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N37 1.0 0.12500 0.29688 0.35587 1.0000 + N N38 1.0 0.12500 0.35937 0.35587 1.0000 + N N39 1.0 0.12500 0.42187 0.35587 1.0000 + N N40 1.0 0.12500 0.48437 0.35587 1.0000 + N N41 1.0 0.12500 0.54688 0.35587 1.0000 + N N42 1.0 0.12500 0.60938 0.35587 1.0000 + N N43 1.0 0.12500 0.67188 0.35587 1.0000 + N N44 1.0 0.12500 0.73438 0.35587 1.0000 + N N45 1.0 0.12500 0.79688 0.35587 1.0000 + N N46 1.0 0.12500 0.85938 0.35587 1.0000 + N N47 1.0 0.12500 0.92188 0.35587 1.0000 + N N48 1.0 0.12500 0.98437 0.35587 1.0000 + N N49 1.0 0.18750 0.04688 0.35587 1.0000 + N N50 1.0 0.18750 0.10938 0.35587 1.0000 + N N51 1.0 0.18750 0.17187 0.35587 1.0000 + N N52 1.0 0.18750 0.23437 0.35587 1.0000 + N N53 1.0 0.18750 0.29688 0.35587 1.0000 + N N54 1.0 0.18750 0.35937 0.35587 1.0000 + N N55 1.0 0.18750 0.42187 0.35587 1.0000 + N N56 1.0 0.18750 0.48437 0.35587 1.0000 + N N57 1.0 0.18750 0.54688 0.35587 1.0000 + N N58 1.0 0.18750 0.60938 0.35587 1.0000 + N N59 1.0 0.18750 0.67188 0.35587 1.0000 + N N60 1.0 0.18750 0.73438 0.35587 1.0000 + N N61 1.0 0.18750 0.79688 0.35587 1.0000 + N N62 1.0 0.18750 0.85938 0.35587 1.0000 + N N63 1.0 0.18750 0.92188 0.35587 1.0000 + N N64 1.0 0.18750 0.98437 0.35587 1.0000 + N N65 1.0 0.25000 0.04688 0.35587 1.0000 + N N66 1.0 0.25000 0.10938 0.35587 1.0000 + N N67 1.0 0.25000 0.17187 0.35587 1.0000 + N N68 1.0 0.25000 0.23437 0.35587 1.0000 + N N69 1.0 0.25000 0.29688 0.35587 1.0000 + N N70 1.0 0.25000 0.35937 0.35587 1.0000 + N N71 1.0 0.25000 0.42187 0.35587 1.0000 + N N72 1.0 0.25000 0.48437 0.35587 1.0000 + N N73 1.0 0.25000 0.54688 0.35587 1.0000 + N N74 1.0 0.25000 0.60938 0.35587 1.0000 + N N75 1.0 0.25000 0.67188 0.35587 1.0000 + N N76 1.0 0.25000 0.73438 0.35587 1.0000 + N N77 1.0 0.25000 0.79688 0.35587 1.0000 + N N78 1.0 0.25000 0.85938 0.35587 1.0000 + N N79 1.0 0.25000 0.92188 0.35587 1.0000 + N N80 1.0 0.25000 0.98437 0.35587 1.0000 + N N81 1.0 0.31250 0.04688 0.35587 1.0000 + N N82 1.0 0.31250 0.10938 0.35587 1.0000 + N N83 1.0 0.31250 0.17187 0.35587 1.0000 + N N84 1.0 0.31250 0.23437 0.35587 1.0000 + N N85 1.0 0.31250 0.29688 0.35587 1.0000 + N N86 1.0 0.31250 0.35937 0.35587 1.0000 + N N87 1.0 0.31250 0.42187 0.35587 1.0000 + N N88 1.0 0.31250 0.48437 0.35587 1.0000 + N N89 1.0 0.31250 0.54688 0.35587 1.0000 + N N90 1.0 0.31250 0.60938 0.35587 1.0000 + N N91 1.0 0.31250 0.67188 0.35587 1.0000 + N N92 1.0 0.31250 0.73438 0.35587 1.0000 + N N93 1.0 0.31250 0.79688 0.35587 1.0000 + N N94 1.0 0.31250 0.85938 0.35587 1.0000 + N N95 1.0 0.31250 0.92188 0.35587 1.0000 + N N96 1.0 0.31250 0.98437 0.35587 1.0000 + N N97 1.0 0.37500 0.04688 0.35587 1.0000 + N N98 1.0 0.37500 0.10938 0.35587 1.0000 + N N99 1.0 0.37500 0.17187 0.35587 1.0000 + N N100 1.0 0.37500 0.23437 0.35587 1.0000 + N N101 1.0 0.37500 0.29688 0.35587 1.0000 + N N102 1.0 0.37500 0.35937 0.35587 1.0000 + N N103 1.0 0.37500 0.42187 0.35587 1.0000 + N N104 1.0 0.37500 0.48437 0.35587 1.0000 + N N105 1.0 0.37500 0.54688 0.35587 1.0000 + N N106 1.0 0.37500 0.60938 0.35587 1.0000 + N N107 1.0 0.37500 0.67188 0.35587 1.0000 + N N108 1.0 0.37500 0.73438 0.35587 1.0000 + N N109 1.0 0.37500 0.79688 0.35587 1.0000 + N N110 1.0 0.37500 0.85938 0.35587 1.0000 + N N111 1.0 0.37500 0.92188 0.35587 1.0000 + N N112 1.0 0.37500 0.98437 0.35587 1.0000 + N N113 1.0 0.43750 0.04688 0.35587 1.0000 + N N114 1.0 0.43750 0.10938 0.35587 1.0000 + N N115 1.0 0.43750 0.17187 0.35587 1.0000 + N N116 1.0 0.43750 0.23437 0.35587 1.0000 + N N117 1.0 0.43750 0.29688 0.35587 1.0000 + N N118 1.0 0.43750 0.35937 0.35587 1.0000 + N N119 1.0 0.43750 0.42187 0.35587 1.0000 + N N120 1.0 0.43750 0.48437 0.35587 1.0000 + N N121 1.0 0.43750 0.54688 0.35587 1.0000 + N N122 1.0 0.43750 0.60938 0.35587 1.0000 + N N123 1.0 0.43750 0.67188 0.35587 1.0000 + N N124 1.0 0.43750 0.73438 0.35587 1.0000 + N N125 1.0 0.43750 0.79688 0.35587 1.0000 + N N126 1.0 0.43750 0.85938 0.35587 1.0000 + N N127 1.0 0.43750 0.92188 0.35587 1.0000 + N N128 1.0 0.43750 0.98437 0.35587 1.0000 + N N129 1.0 0.50000 0.04688 0.35587 1.0000 + N N130 1.0 0.50000 0.10938 0.35587 1.0000 + N N131 1.0 0.50000 0.17187 0.35587 1.0000 + N N132 1.0 0.50000 0.23437 0.35587 1.0000 + N N133 1.0 0.50000 0.29688 0.35587 1.0000 + N N134 1.0 0.50000 0.35937 0.35587 1.0000 + N N135 1.0 0.50000 0.42187 0.35587 1.0000 + N N136 1.0 0.50000 0.48437 0.35587 1.0000 + N N137 1.0 0.50000 0.54688 0.35587 1.0000 + N N138 1.0 0.50000 0.60938 0.35587 1.0000 + N N139 1.0 0.50000 0.67188 0.35587 1.0000 + N N140 1.0 0.50000 0.73438 0.35587 1.0000 + N N141 1.0 0.50000 0.79688 0.35587 1.0000 + N N142 1.0 0.50000 0.85938 0.35587 1.0000 + N N143 1.0 0.50000 0.92188 0.35587 1.0000 + N N144 1.0 0.50000 0.98437 0.35587 1.0000 + N N145 1.0 0.56250 0.04688 0.35587 1.0000 + N N146 1.0 0.56250 0.10938 0.35587 1.0000 + N N147 1.0 0.56250 0.17187 0.35587 1.0000 + N N148 1.0 0.56250 0.23437 0.35587 1.0000 + N N149 1.0 0.56250 0.29688 0.35587 1.0000 + N N150 1.0 0.56250 0.35937 0.35587 1.0000 + N N151 1.0 0.56250 0.42187 0.35587 1.0000 + N N152 1.0 0.56250 0.48437 0.35587 1.0000 + N N153 1.0 0.56250 0.54688 0.35587 1.0000 + N N154 1.0 0.56250 0.60938 0.35587 1.0000 + N N155 1.0 0.56250 0.67188 0.35587 1.0000 + N N156 1.0 0.56250 0.73438 0.35587 1.0000 + N N157 1.0 0.56250 0.79688 0.35587 1.0000 + N N158 1.0 0.56250 0.85938 0.35587 1.0000 + N N159 1.0 0.56250 0.92188 0.35587 1.0000 + N N160 1.0 0.56250 0.98437 0.35587 1.0000 + N N161 1.0 0.62500 0.04688 0.35587 1.0000 + N N162 1.0 0.62500 0.10938 0.35587 1.0000 + N N163 1.0 0.62500 0.17187 0.35587 1.0000 + N N164 1.0 0.62500 0.23437 0.35587 1.0000 + N N165 1.0 0.62500 0.29688 0.35587 1.0000 + N N166 1.0 0.62500 0.35937 0.35587 1.0000 + N N167 1.0 0.62500 0.42187 0.35587 1.0000 + N N168 1.0 0.62500 0.48437 0.35587 1.0000 + N N169 1.0 0.62500 0.54688 0.35587 1.0000 + N N170 1.0 0.62500 0.60938 0.35587 1.0000 + N N171 1.0 0.62500 0.67188 0.35587 1.0000 + N N172 1.0 0.62500 0.73438 0.35587 1.0000 + N N173 1.0 0.62500 0.79688 0.35587 1.0000 + N N174 1.0 0.62500 0.85938 0.35587 1.0000 + N N175 1.0 0.62500 0.92188 0.35587 1.0000 + N N176 1.0 0.62500 0.98437 0.35587 1.0000 + N N177 1.0 0.68750 0.04688 0.35587 1.0000 + N N178 1.0 0.68750 0.10938 0.35587 1.0000 + N N179 1.0 0.68750 0.17187 0.35587 1.0000 + N N180 1.0 0.68750 0.23437 0.35587 1.0000 + N N181 1.0 0.68750 0.29688 0.35587 1.0000 + N N182 1.0 0.68750 0.35937 0.35587 1.0000 + N N183 1.0 0.68750 0.42187 0.35587 1.0000 + N N184 1.0 0.68750 0.48437 0.35587 1.0000 + N N185 1.0 0.68750 0.54688 0.35587 1.0000 + N N186 1.0 0.68750 0.60938 0.35587 1.0000 + N N187 1.0 0.68750 0.67188 0.35587 1.0000 + N N188 1.0 0.68750 0.73438 0.35587 1.0000 + N N189 1.0 0.68750 0.79688 0.35587 1.0000 + N N190 1.0 0.68750 0.85938 0.35587 1.0000 + N N191 1.0 0.68750 0.92188 0.35587 1.0000 + N N192 1.0 0.68750 0.98437 0.35587 1.0000 + N N193 1.0 0.75000 0.04688 0.35587 1.0000 + N N194 1.0 0.75000 0.10938 0.35587 1.0000 + N N195 1.0 0.75000 0.17187 0.35587 1.0000 + N N196 1.0 0.75000 0.23437 0.35587 1.0000 + N N197 1.0 0.75000 0.29688 0.35587 1.0000 + N N198 1.0 0.75000 0.35937 0.35587 1.0000 + N N199 1.0 0.75000 0.42187 0.35587 1.0000 + N N200 1.0 0.75000 0.48437 0.35587 1.0000 + N N201 1.0 0.75000 0.54688 0.35587 1.0000 + N N202 1.0 0.75000 0.60938 0.35587 1.0000 + N N203 1.0 0.75000 0.67188 0.35587 1.0000 + N N204 1.0 0.75000 0.73438 0.35587 1.0000 + N N205 1.0 0.75000 0.79688 0.35587 1.0000 + N N206 1.0 0.75000 0.85938 0.35587 1.0000 + N N207 1.0 0.75000 0.92188 0.35587 1.0000 + N N208 1.0 0.75000 0.98437 0.35587 1.0000 + N N209 1.0 0.81250 0.04688 0.35587 1.0000 + N N210 1.0 0.81250 0.10938 0.35587 1.0000 + N N211 1.0 0.81250 0.17187 0.35587 1.0000 + N N212 1.0 0.81250 0.23437 0.35587 1.0000 + N N213 1.0 0.81250 0.29688 0.35587 1.0000 + N N214 1.0 0.81250 0.35937 0.35587 1.0000 + N N215 1.0 0.81250 0.42187 0.35587 1.0000 + N N216 1.0 0.81250 0.48437 0.35587 1.0000 + N N217 1.0 0.81250 0.54688 0.35587 1.0000 + N N218 1.0 0.81250 0.60938 0.35587 1.0000 + N N219 1.0 0.81250 0.67188 0.35587 1.0000 + N N220 1.0 0.81250 0.73438 0.35587 1.0000 + N N221 1.0 0.81250 0.79688 0.35587 1.0000 + N N222 1.0 0.81250 0.85938 0.35587 1.0000 + N N223 1.0 0.81250 0.92188 0.35587 1.0000 + N N224 1.0 0.81250 0.98437 0.35587 1.0000 + N N225 1.0 0.87500 0.04688 0.35587 1.0000 + N N226 1.0 0.87500 0.10938 0.35587 1.0000 + N N227 1.0 0.87500 0.17187 0.35587 1.0000 + N N228 1.0 0.87500 0.23437 0.35587 1.0000 + N N229 1.0 0.87500 0.29688 0.35587 1.0000 + N N230 1.0 0.87500 0.35937 0.35587 1.0000 + N N231 1.0 0.87500 0.42187 0.35587 1.0000 + N N232 1.0 0.87500 0.48437 0.35587 1.0000 + N N233 1.0 0.87500 0.54688 0.35587 1.0000 + N N234 1.0 0.87500 0.60938 0.35587 1.0000 + N N235 1.0 0.87500 0.67188 0.35587 1.0000 + N N236 1.0 0.87500 0.73438 0.35587 1.0000 + N N237 1.0 0.87500 0.79688 0.35587 1.0000 + N N238 1.0 0.87500 0.85938 0.35587 1.0000 + N N239 1.0 0.87500 0.92188 0.35587 1.0000 + N N240 1.0 0.87500 0.98437 0.35587 1.0000 + N N241 1.0 0.93750 0.04688 0.35587 1.0000 + N N242 1.0 0.93750 0.10938 0.35587 1.0000 + N N243 1.0 0.93750 0.17187 0.35587 1.0000 + N N244 1.0 0.93750 0.23437 0.35587 1.0000 + N N245 1.0 0.93750 0.29688 0.35587 1.0000 + N N246 1.0 0.93750 0.35937 0.35587 1.0000 + N N247 1.0 0.93750 0.42187 0.35587 1.0000 + N N248 1.0 0.93750 0.48437 0.35587 1.0000 + N N249 1.0 0.93750 0.54688 0.35587 1.0000 + N N250 1.0 0.93750 0.60938 0.35587 1.0000 + N N251 1.0 0.93750 0.67188 0.35587 1.0000 + N N252 1.0 0.93750 0.73438 0.35587 1.0000 + N N253 1.0 0.93750 0.79688 0.35587 1.0000 + N N254 1.0 0.93750 0.85938 0.35587 1.0000 + N N255 1.0 0.93750 0.92188 0.35587 1.0000 + N N256 1.0 0.93750 0.98437 0.35587 1.0000 + N N257 1.0 0.00000 0.01562 0.64413 1.0000 + N N258 1.0 0.00000 0.07812 0.64413 1.0000 + N N259 1.0 0.00000 0.14062 0.64413 1.0000 + N N260 1.0 0.00000 0.20312 0.64413 1.0000 + N N261 1.0 0.00000 0.26562 0.64413 1.0000 + N N262 1.0 0.00000 0.32812 0.64413 1.0000 + N N263 1.0 0.00000 0.39062 0.64413 1.0000 + N N264 1.0 0.00000 0.45312 0.64413 1.0000 + N N265 1.0 0.00000 0.51562 0.64413 1.0000 + N N266 1.0 0.00000 0.57812 0.64413 1.0000 + N N267 1.0 0.00000 0.64062 0.64413 1.0000 + N N268 1.0 0.00000 0.70312 0.64413 1.0000 + N N269 1.0 0.00000 0.76562 0.64413 1.0000 + N N270 1.0 0.00000 0.82812 0.64413 1.0000 + N N271 1.0 0.00000 0.89062 0.64413 1.0000 + N N272 1.0 0.00000 0.95312 0.64413 1.0000 + N N273 1.0 0.06250 0.01562 0.64413 1.0000 + N N274 1.0 0.06250 0.07812 0.64413 1.0000 + N N275 1.0 0.06250 0.14062 0.64413 1.0000 + N N276 1.0 0.06250 0.20312 0.64413 1.0000 + N N277 1.0 0.06250 0.26562 0.64413 1.0000 + N N278 1.0 0.06250 0.32812 0.64413 1.0000 + N N279 1.0 0.06250 0.39062 0.64413 1.0000 + N N280 1.0 0.06250 0.45312 0.64413 1.0000 + N N281 1.0 0.06250 0.51562 0.64413 1.0000 + N N282 1.0 0.06250 0.57812 0.64413 1.0000 + N N283 1.0 0.06250 0.64062 0.64413 1.0000 + N N284 1.0 0.06250 0.70312 0.64413 1.0000 + N N285 1.0 0.06250 0.76562 0.64413 1.0000 + N N286 1.0 0.06250 0.82812 0.64413 1.0000 + N N287 1.0 0.06250 0.89062 0.64413 1.0000 + N N288 1.0 0.06250 0.95312 0.64413 1.0000 + N N289 1.0 0.12500 0.01562 0.64413 1.0000 + N N290 1.0 0.12500 0.07812 0.64413 1.0000 + N N291 1.0 0.12500 0.14062 0.64413 1.0000 + N N292 1.0 0.12500 0.20312 0.64413 1.0000 + N N293 1.0 0.12500 0.26562 0.64413 1.0000 + N N294 1.0 0.12500 0.32812 0.64413 1.0000 + N N295 1.0 0.12500 0.39062 0.64413 1.0000 + N N296 1.0 0.12500 0.45312 0.64413 1.0000 + N N297 1.0 0.12500 0.51562 0.64413 1.0000 + N N298 1.0 0.12500 0.57812 0.64413 1.0000 + N N299 1.0 0.12500 0.64062 0.64413 1.0000 + N N300 1.0 0.12500 0.70312 0.64413 1.0000 + N N301 1.0 0.12500 0.76562 0.64413 1.0000 + N N302 1.0 0.12500 0.82812 0.64413 1.0000 + N N303 1.0 0.12500 0.89062 0.64413 1.0000 + N N304 1.0 0.12500 0.95312 0.64413 1.0000 + N N305 1.0 0.18750 0.01562 0.64413 1.0000 + N N306 1.0 0.18750 0.07812 0.64413 1.0000 + N N307 1.0 0.18750 0.14062 0.64413 1.0000 + N N308 1.0 0.18750 0.20312 0.64413 1.0000 + N N309 1.0 0.18750 0.26562 0.64413 1.0000 + N N310 1.0 0.18750 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+_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Mg Mg1 1.0 0.03125 0.03125 0.50000 1.0000 + Mg Mg2 1.0 0.03125 0.09375 0.50000 1.0000 + Mg Mg3 1.0 0.03125 0.15625 0.50000 1.0000 + Mg Mg4 1.0 0.03125 0.21875 0.50000 1.0000 + Mg Mg5 1.0 0.03125 0.28125 0.50000 1.0000 + Mg Mg6 1.0 0.03125 0.34375 0.50000 1.0000 + Mg Mg7 1.0 0.03125 0.40625 0.50000 1.0000 + Mg Mg8 1.0 0.03125 0.46875 0.50000 1.0000 + Mg Mg9 1.0 0.03125 0.53125 0.50000 1.0000 + Mg Mg10 1.0 0.03125 0.59375 0.50000 1.0000 + Mg Mg11 1.0 0.03125 0.65625 0.50000 1.0000 + Mg Mg12 1.0 0.03125 0.71875 0.50000 1.0000 + Mg Mg13 1.0 0.03125 0.78125 0.50000 1.0000 + Mg Mg14 1.0 0.03125 0.84375 0.50000 1.0000 + Mg Mg15 1.0 0.03125 0.90625 0.50000 1.0000 + Mg Mg16 1.0 0.03125 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Br Br486 1.0 0.90625 0.32933 0.70122 1.0000 + Br Br487 1.0 0.90625 0.39183 0.70122 1.0000 + Br Br488 1.0 0.90625 0.45433 0.70122 1.0000 + Br Br489 1.0 0.90625 0.51683 0.70122 1.0000 + Br Br490 1.0 0.90625 0.57933 0.70122 1.0000 + Br Br491 1.0 0.90625 0.64183 0.70122 1.0000 + Br Br492 1.0 0.90625 0.70433 0.70122 1.0000 + Br Br493 1.0 0.90625 0.76683 0.70122 1.0000 + Br Br494 1.0 0.90625 0.82933 0.70122 1.0000 + Br Br495 1.0 0.90625 0.89183 0.70122 1.0000 + Br Br496 1.0 0.90625 0.95433 0.70122 1.0000 + Br Br497 1.0 0.96875 0.01683 0.70122 1.0000 + Br Br498 1.0 0.96875 0.07933 0.70122 1.0000 + Br Br499 1.0 0.96875 0.14183 0.70122 1.0000 + Br Br500 1.0 0.96875 0.20433 0.70122 1.0000 + Br Br501 1.0 0.96875 0.26683 0.70122 1.0000 + Br Br502 1.0 0.96875 0.32933 0.70122 1.0000 + Br Br503 1.0 0.96875 0.39183 0.70122 1.0000 + Br Br504 1.0 0.96875 0.45433 0.70122 1.0000 + Br Br505 1.0 0.96875 0.51683 0.70122 1.0000 + Br Br506 1.0 0.96875 0.57933 0.70122 1.0000 + Br Br507 1.0 0.96875 0.64183 0.70122 1.0000 + Br Br508 1.0 0.96875 0.70433 0.70122 1.0000 + Br Br509 1.0 0.96875 0.76683 0.70122 1.0000 + Br Br510 1.0 0.96875 0.82933 0.70122 1.0000 + Br Br511 1.0 0.96875 0.89183 0.70122 1.0000 + Br Br512 1.0 0.96875 0.95433 0.70122 1.0000 + N N1 1.0 0.00000 0.04505 0.69076 1.0000 + N N2 1.0 0.00000 0.10755 0.69076 1.0000 + N N3 1.0 0.00000 0.17005 0.69076 1.0000 + N N4 1.0 0.00000 0.23255 0.69076 1.0000 + N N5 1.0 0.00000 0.29505 0.69076 1.0000 + N N6 1.0 0.00000 0.35755 0.69076 1.0000 + N N7 1.0 0.00000 0.42005 0.69076 1.0000 + N N8 1.0 0.00000 0.48255 0.69076 1.0000 + N N9 1.0 0.00000 0.54505 0.69076 1.0000 + N N10 1.0 0.00000 0.60755 0.69076 1.0000 + N N11 1.0 0.00000 0.67005 0.69076 1.0000 + N N12 1.0 0.00000 0.73255 0.69076 1.0000 + N N13 1.0 0.00000 0.79505 0.69076 1.0000 + N N14 1.0 0.00000 0.85755 0.69076 1.0000 + N N15 1.0 0.00000 0.92005 0.69076 1.0000 + N N16 1.0 0.00000 0.98255 0.69076 1.0000 + N N17 1.0 0.06250 0.04505 0.69076 1.0000 + N N18 1.0 0.06250 0.10755 0.69076 1.0000 + N N19 1.0 0.06250 0.17005 0.69076 1.0000 + N N20 1.0 0.06250 0.23255 0.69076 1.0000 + N N21 1.0 0.06250 0.29505 0.69076 1.0000 + N N22 1.0 0.06250 0.35755 0.69076 1.0000 + N N23 1.0 0.06250 0.42005 0.69076 1.0000 + N N24 1.0 0.06250 0.48255 0.69076 1.0000 + N N25 1.0 0.06250 0.54505 0.69076 1.0000 + N N26 1.0 0.06250 0.60755 0.69076 1.0000 + N N27 1.0 0.06250 0.67005 0.69076 1.0000 + N N28 1.0 0.06250 0.73255 0.69076 1.0000 + N N29 1.0 0.06250 0.79505 0.69076 1.0000 + N N30 1.0 0.06250 0.85755 0.69076 1.0000 + N N31 1.0 0.06250 0.92005 0.69076 1.0000 + N N32 1.0 0.06250 0.98255 0.69076 1.0000 + N N33 1.0 0.12500 0.04505 0.69076 1.0000 + N N34 1.0 0.12500 0.10755 0.69076 1.0000 + N N35 1.0 0.12500 0.17005 0.69076 1.0000 + N N36 1.0 0.12500 0.23255 0.69076 1.0000 + N N37 1.0 0.12500 0.29505 0.69076 1.0000 + N N38 1.0 0.12500 0.35755 0.69076 1.0000 + N N39 1.0 0.12500 0.42005 0.69076 1.0000 + N N40 1.0 0.12500 0.48255 0.69076 1.0000 + N N41 1.0 0.12500 0.54505 0.69076 1.0000 + N N42 1.0 0.12500 0.60755 0.69076 1.0000 + N N43 1.0 0.12500 0.67005 0.69076 1.0000 + N N44 1.0 0.12500 0.73255 0.69076 1.0000 + N N45 1.0 0.12500 0.79505 0.69076 1.0000 + N N46 1.0 0.12500 0.85755 0.69076 1.0000 + N N47 1.0 0.12500 0.92005 0.69076 1.0000 + N N48 1.0 0.12500 0.98255 0.69076 1.0000 + N N49 1.0 0.18750 0.04505 0.69076 1.0000 + N N50 1.0 0.18750 0.10755 0.69076 1.0000 + N N51 1.0 0.18750 0.17005 0.69076 1.0000 + N N52 1.0 0.18750 0.23255 0.69076 1.0000 + N N53 1.0 0.18750 0.29505 0.69076 1.0000 + N N54 1.0 0.18750 0.35755 0.69076 1.0000 + N N55 1.0 0.18750 0.42005 0.69076 1.0000 + N N56 1.0 0.18750 0.48255 0.69076 1.0000 + N N57 1.0 0.18750 0.54505 0.69076 1.0000 + N N58 1.0 0.18750 0.60755 0.69076 1.0000 + N N59 1.0 0.18750 0.67005 0.69076 1.0000 + N N60 1.0 0.18750 0.73255 0.69076 1.0000 + N N61 1.0 0.18750 0.79505 0.69076 1.0000 + N N62 1.0 0.18750 0.85755 0.69076 1.0000 + N N63 1.0 0.18750 0.92005 0.69076 1.0000 + N N64 1.0 0.18750 0.98255 0.69076 1.0000 + N N65 1.0 0.25000 0.04505 0.69076 1.0000 + N N66 1.0 0.25000 0.10755 0.69076 1.0000 + N N67 1.0 0.25000 0.17005 0.69076 1.0000 + N N68 1.0 0.25000 0.23255 0.69076 1.0000 + N N69 1.0 0.25000 0.29505 0.69076 1.0000 + N N70 1.0 0.25000 0.35755 0.69076 1.0000 + N N71 1.0 0.25000 0.42005 0.69076 1.0000 + N N72 1.0 0.25000 0.48255 0.69076 1.0000 + N N73 1.0 0.25000 0.54505 0.69076 1.0000 + N N74 1.0 0.25000 0.60755 0.69076 1.0000 + N N75 1.0 0.25000 0.67005 0.69076 1.0000 + N N76 1.0 0.25000 0.73255 0.69076 1.0000 + N N77 1.0 0.25000 0.79505 0.69076 1.0000 + N N78 1.0 0.25000 0.85755 0.69076 1.0000 + N N79 1.0 0.25000 0.92005 0.69076 1.0000 + N N80 1.0 0.25000 0.98255 0.69076 1.0000 + N N81 1.0 0.31250 0.04505 0.69076 1.0000 + N N82 1.0 0.31250 0.10755 0.69076 1.0000 + N N83 1.0 0.31250 0.17005 0.69076 1.0000 + N N84 1.0 0.31250 0.23255 0.69076 1.0000 + N N85 1.0 0.31250 0.29505 0.69076 1.0000 + N N86 1.0 0.31250 0.35755 0.69076 1.0000 + N N87 1.0 0.31250 0.42005 0.69076 1.0000 + N N88 1.0 0.31250 0.48255 0.69076 1.0000 + N N89 1.0 0.31250 0.54505 0.69076 1.0000 + N N90 1.0 0.31250 0.60755 0.69076 1.0000 + N N91 1.0 0.31250 0.67005 0.69076 1.0000 + N N92 1.0 0.31250 0.73255 0.69076 1.0000 + N N93 1.0 0.31250 0.79505 0.69076 1.0000 + N N94 1.0 0.31250 0.85755 0.69076 1.0000 + N N95 1.0 0.31250 0.92005 0.69076 1.0000 + N N96 1.0 0.31250 0.98255 0.69076 1.0000 + N N97 1.0 0.37500 0.04505 0.69076 1.0000 + N N98 1.0 0.37500 0.10755 0.69076 1.0000 + N N99 1.0 0.37500 0.17005 0.69076 1.0000 + N N100 1.0 0.37500 0.23255 0.69076 1.0000 + N N101 1.0 0.37500 0.29505 0.69076 1.0000 + N N102 1.0 0.37500 0.35755 0.69076 1.0000 + N N103 1.0 0.37500 0.42005 0.69076 1.0000 + N N104 1.0 0.37500 0.48255 0.69076 1.0000 + N N105 1.0 0.37500 0.54505 0.69076 1.0000 + N N106 1.0 0.37500 0.60755 0.69076 1.0000 + N N107 1.0 0.37500 0.67005 0.69076 1.0000 + N N108 1.0 0.37500 0.73255 0.69076 1.0000 + N N109 1.0 0.37500 0.79505 0.69076 1.0000 + N N110 1.0 0.37500 0.85755 0.69076 1.0000 + N N111 1.0 0.37500 0.92005 0.69076 1.0000 + N N112 1.0 0.37500 0.98255 0.69076 1.0000 + N N113 1.0 0.43750 0.04505 0.69076 1.0000 + N N114 1.0 0.43750 0.10755 0.69076 1.0000 + N N115 1.0 0.43750 0.17005 0.69076 1.0000 + N N116 1.0 0.43750 0.23255 0.69076 1.0000 + N N117 1.0 0.43750 0.29505 0.69076 1.0000 + N N118 1.0 0.43750 0.35755 0.69076 1.0000 + N N119 1.0 0.43750 0.42005 0.69076 1.0000 + N N120 1.0 0.43750 0.48255 0.69076 1.0000 + N N121 1.0 0.43750 0.54505 0.69076 1.0000 + N N122 1.0 0.43750 0.60755 0.69076 1.0000 + N N123 1.0 0.43750 0.67005 0.69076 1.0000 + N N124 1.0 0.43750 0.73255 0.69076 1.0000 + N N125 1.0 0.43750 0.79505 0.69076 1.0000 + N N126 1.0 0.43750 0.85755 0.69076 1.0000 + N N127 1.0 0.43750 0.92005 0.69076 1.0000 + N N128 1.0 0.43750 0.98255 0.69076 1.0000 + N N129 1.0 0.50000 0.04505 0.69076 1.0000 + N N130 1.0 0.50000 0.10755 0.69076 1.0000 + N N131 1.0 0.50000 0.17005 0.69076 1.0000 + N N132 1.0 0.50000 0.23255 0.69076 1.0000 + N N133 1.0 0.50000 0.29505 0.69076 1.0000 + N N134 1.0 0.50000 0.35755 0.69076 1.0000 + N N135 1.0 0.50000 0.42005 0.69076 1.0000 + N N136 1.0 0.50000 0.48255 0.69076 1.0000 + N N137 1.0 0.50000 0.54505 0.69076 1.0000 + N N138 1.0 0.50000 0.60755 0.69076 1.0000 + N N139 1.0 0.50000 0.67005 0.69076 1.0000 + N N140 1.0 0.50000 0.73255 0.69076 1.0000 + N N141 1.0 0.50000 0.79505 0.69076 1.0000 + N N142 1.0 0.50000 0.85755 0.69076 1.0000 + N N143 1.0 0.50000 0.92005 0.69076 1.0000 + N N144 1.0 0.50000 0.98255 0.69076 1.0000 + N N145 1.0 0.56250 0.04505 0.69076 1.0000 + N N146 1.0 0.56250 0.10755 0.69076 1.0000 + N N147 1.0 0.56250 0.17005 0.69076 1.0000 + N N148 1.0 0.56250 0.23255 0.69076 1.0000 + N N149 1.0 0.56250 0.29505 0.69076 1.0000 + N N150 1.0 0.56250 0.35755 0.69076 1.0000 + N N151 1.0 0.56250 0.42005 0.69076 1.0000 + N N152 1.0 0.56250 0.48255 0.69076 1.0000 + N N153 1.0 0.56250 0.54505 0.69076 1.0000 + N N154 1.0 0.56250 0.60755 0.69076 1.0000 + N N155 1.0 0.56250 0.67005 0.69076 1.0000 + N N156 1.0 0.56250 0.73255 0.69076 1.0000 + N N157 1.0 0.56250 0.79505 0.69076 1.0000 + N N158 1.0 0.56250 0.85755 0.69076 1.0000 + N N159 1.0 0.56250 0.92005 0.69076 1.0000 + N N160 1.0 0.56250 0.98255 0.69076 1.0000 + N N161 1.0 0.62500 0.04505 0.69076 1.0000 + N N162 1.0 0.62500 0.10755 0.69076 1.0000 + N N163 1.0 0.62500 0.17005 0.69076 1.0000 + N N164 1.0 0.62500 0.23255 0.69076 1.0000 + N N165 1.0 0.62500 0.29505 0.69076 1.0000 + N N166 1.0 0.62500 0.35755 0.69076 1.0000 + N N167 1.0 0.62500 0.42005 0.69076 1.0000 + N N168 1.0 0.62500 0.48255 0.69076 1.0000 + N N169 1.0 0.62500 0.54505 0.69076 1.0000 + N N170 1.0 0.62500 0.60755 0.69076 1.0000 + N N171 1.0 0.62500 0.67005 0.69076 1.0000 + N N172 1.0 0.62500 0.73255 0.69076 1.0000 + N N173 1.0 0.62500 0.79505 0.69076 1.0000 + N N174 1.0 0.62500 0.85755 0.69076 1.0000 + N N175 1.0 0.62500 0.92005 0.69076 1.0000 + N N176 1.0 0.62500 0.98255 0.69076 1.0000 + N N177 1.0 0.68750 0.04505 0.69076 1.0000 + N N178 1.0 0.68750 0.10755 0.69076 1.0000 + N N179 1.0 0.68750 0.17005 0.69076 1.0000 + N N180 1.0 0.68750 0.23255 0.69076 1.0000 + N N181 1.0 0.68750 0.29505 0.69076 1.0000 + N N182 1.0 0.68750 0.35755 0.69076 1.0000 + N N183 1.0 0.68750 0.42005 0.69076 1.0000 + N N184 1.0 0.68750 0.48255 0.69076 1.0000 + N N185 1.0 0.68750 0.54505 0.69076 1.0000 + N N186 1.0 0.68750 0.60755 0.69076 1.0000 + N N187 1.0 0.68750 0.67005 0.69076 1.0000 + N N188 1.0 0.68750 0.73255 0.69076 1.0000 + N N189 1.0 0.68750 0.79505 0.69076 1.0000 + N N190 1.0 0.68750 0.85755 0.69076 1.0000 + N N191 1.0 0.68750 0.92005 0.69076 1.0000 + N N192 1.0 0.68750 0.98255 0.69076 1.0000 + N N193 1.0 0.75000 0.04505 0.69076 1.0000 + N N194 1.0 0.75000 0.10755 0.69076 1.0000 + N N195 1.0 0.75000 0.17005 0.69076 1.0000 + N N196 1.0 0.75000 0.23255 0.69076 1.0000 + N N197 1.0 0.75000 0.29505 0.69076 1.0000 + N N198 1.0 0.75000 0.35755 0.69076 1.0000 + N N199 1.0 0.75000 0.42005 0.69076 1.0000 + N N200 1.0 0.75000 0.48255 0.69076 1.0000 + N N201 1.0 0.75000 0.54505 0.69076 1.0000 + N N202 1.0 0.75000 0.60755 0.69076 1.0000 + N N203 1.0 0.75000 0.67005 0.69076 1.0000 + N N204 1.0 0.75000 0.73255 0.69076 1.0000 + N N205 1.0 0.75000 0.79505 0.69076 1.0000 + N N206 1.0 0.75000 0.85755 0.69076 1.0000 + N N207 1.0 0.75000 0.92005 0.69076 1.0000 + N N208 1.0 0.75000 0.98255 0.69076 1.0000 + N N209 1.0 0.81250 0.04505 0.69076 1.0000 + N N210 1.0 0.81250 0.10755 0.69076 1.0000 + N N211 1.0 0.81250 0.17005 0.69076 1.0000 + N N212 1.0 0.81250 0.23255 0.69076 1.0000 + N N213 1.0 0.81250 0.29505 0.69076 1.0000 + N N214 1.0 0.81250 0.35755 0.69076 1.0000 + N N215 1.0 0.81250 0.42005 0.69076 1.0000 + N N216 1.0 0.81250 0.48255 0.69076 1.0000 + N N217 1.0 0.81250 0.54505 0.69076 1.0000 + N N218 1.0 0.81250 0.60755 0.69076 1.0000 + N N219 1.0 0.81250 0.67005 0.69076 1.0000 + N N220 1.0 0.81250 0.73255 0.69076 1.0000 + N N221 1.0 0.81250 0.79505 0.69076 1.0000 + N N222 1.0 0.81250 0.85755 0.69076 1.0000 + N N223 1.0 0.81250 0.92005 0.69076 1.0000 + N N224 1.0 0.81250 0.98255 0.69076 1.0000 + N N225 1.0 0.87500 0.04505 0.69076 1.0000 + N N226 1.0 0.87500 0.10755 0.69076 1.0000 + N N227 1.0 0.87500 0.17005 0.69076 1.0000 + N N228 1.0 0.87500 0.23255 0.69076 1.0000 + N N229 1.0 0.87500 0.29505 0.69076 1.0000 + N N230 1.0 0.87500 0.35755 0.69076 1.0000 + N N231 1.0 0.87500 0.42005 0.69076 1.0000 + N N232 1.0 0.87500 0.48255 0.69076 1.0000 + N N233 1.0 0.87500 0.54505 0.69076 1.0000 + N N234 1.0 0.87500 0.60755 0.69076 1.0000 + N N235 1.0 0.87500 0.67005 0.69076 1.0000 + N N236 1.0 0.87500 0.73255 0.69076 1.0000 + N N237 1.0 0.87500 0.79505 0.69076 1.0000 + N N238 1.0 0.87500 0.85755 0.69076 1.0000 + N N239 1.0 0.87500 0.92005 0.69076 1.0000 + N N240 1.0 0.87500 0.98255 0.69076 1.0000 + N N241 1.0 0.93750 0.04505 0.69076 1.0000 + N N242 1.0 0.93750 0.10755 0.69076 1.0000 + N N243 1.0 0.93750 0.17005 0.69076 1.0000 + N N244 1.0 0.93750 0.23255 0.69076 1.0000 + N N245 1.0 0.93750 0.29505 0.69076 1.0000 + N N246 1.0 0.93750 0.35755 0.69076 1.0000 + N N247 1.0 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N N270 1.0 0.00000 0.82995 0.30924 1.0000 + N N271 1.0 0.00000 0.89245 0.30924 1.0000 + N N272 1.0 0.00000 0.95495 0.30924 1.0000 + N N273 1.0 0.06250 0.01745 0.30924 1.0000 + N N274 1.0 0.06250 0.07995 0.30924 1.0000 + N N275 1.0 0.06250 0.14245 0.30924 1.0000 + N N276 1.0 0.06250 0.20495 0.30924 1.0000 + N N277 1.0 0.06250 0.26745 0.30924 1.0000 + N N278 1.0 0.06250 0.32995 0.30924 1.0000 + N N279 1.0 0.06250 0.39245 0.30924 1.0000 + N N280 1.0 0.06250 0.45495 0.30924 1.0000 + N N281 1.0 0.06250 0.51745 0.30924 1.0000 + N N282 1.0 0.06250 0.57995 0.30924 1.0000 + N N283 1.0 0.06250 0.64245 0.30924 1.0000 + N N284 1.0 0.06250 0.70495 0.30924 1.0000 + N N285 1.0 0.06250 0.76745 0.30924 1.0000 + N N286 1.0 0.06250 0.82995 0.30924 1.0000 + N N287 1.0 0.06250 0.89245 0.30924 1.0000 + N N288 1.0 0.06250 0.95495 0.30924 1.0000 + N N289 1.0 0.12500 0.01745 0.30924 1.0000 + N N290 1.0 0.12500 0.07995 0.30924 1.0000 + N N291 1.0 0.12500 0.14245 0.30924 1.0000 + N N292 1.0 0.12500 0.20495 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0.30924 1.0000 + N N497 1.0 0.93750 0.01745 0.30924 1.0000 + N N498 1.0 0.93750 0.07995 0.30924 1.0000 + N N499 1.0 0.93750 0.14245 0.30924 1.0000 + N N500 1.0 0.93750 0.20495 0.30924 1.0000 + N N501 1.0 0.93750 0.26745 0.30924 1.0000 + N N502 1.0 0.93750 0.32995 0.30924 1.0000 + N N503 1.0 0.93750 0.39245 0.30924 1.0000 + N N504 1.0 0.93750 0.45495 0.30924 1.0000 + N N505 1.0 0.93750 0.51745 0.30924 1.0000 + N N506 1.0 0.93750 0.57995 0.30924 1.0000 + N N507 1.0 0.93750 0.64245 0.30924 1.0000 + N N508 1.0 0.93750 0.70495 0.30924 1.0000 + N N509 1.0 0.93750 0.76745 0.30924 1.0000 + N N510 1.0 0.93750 0.82995 0.30924 1.0000 + N N511 1.0 0.93750 0.89245 0.30924 1.0000 + N N512 1.0 0.93750 0.95495 0.30924 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-3234_supercell_12x12x1.cif b/tier3/cif_file/orthogonal_2dm-3234_supercell_12x12x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..46f48b7c495e0243bbca9637b836d8f5bd3fc6d2 --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-3234_supercell_12x12x1.cif @@ -0,0 +1,2041 @@ +data_image0 +_chemical_formula_structural Al288Bi576O1152 +_chemical_formula_sum "Al288 Bi576 O1152" +_cell_length_a 104.713 +_cell_length_b 104.713 +_cell_length_c 4.47706 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Al Al1 1.0 0.00000 0.04167 0.55328 1.0000 + Al Al2 1.0 0.00000 0.12500 0.55328 1.0000 + Al Al3 1.0 0.00000 0.20833 0.55328 1.0000 + Al Al4 1.0 0.00000 0.29167 0.55328 1.0000 + Al Al5 1.0 0.00000 0.37500 0.55328 1.0000 + Al Al6 1.0 0.00000 0.45833 0.55328 1.0000 + Al Al7 1.0 0.00000 0.54167 0.55328 1.0000 + Al Al8 1.0 0.00000 0.62500 0.55328 1.0000 + Al Al9 1.0 0.00000 0.70833 0.55328 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0.45544 1.0000 + O O1151 1.0 0.97427 0.90988 0.45544 1.0000 + O O1152 1.0 0.97427 0.99321 0.45544 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-3271_supercell_16x16x1.cif b/tier3/cif_file/orthogonal_2dm-3271_supercell_16x16x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..ae606e72b8b6c3c4c6f2e1a6565b5668206fdd4c --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-3271_supercell_16x16x1.cif @@ -0,0 +1,1561 @@ +data_image0 +_chemical_formula_structural Hg512S512Br512 +_chemical_formula_sum "Hg512 S512 Br512" +_cell_length_a 75.8261 +_cell_length_b 128.344 +_cell_length_c 6.8718 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Hg Hg1 1.0 0.01562 0.04395 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S S13 1.0 0.01562 0.81219 0.45596 1.0000 + S S14 1.0 0.01562 0.87469 0.45596 1.0000 + S S15 1.0 0.01562 0.93719 0.45596 1.0000 + S S16 1.0 0.01562 0.99969 0.45596 1.0000 + S S17 1.0 0.07812 0.06219 0.45596 1.0000 + S S18 1.0 0.07812 0.12469 0.45596 1.0000 + S S19 1.0 0.07812 0.18719 0.45596 1.0000 + S S20 1.0 0.07812 0.24969 0.45596 1.0000 + S S21 1.0 0.07812 0.31219 0.45596 1.0000 + S S22 1.0 0.07812 0.37469 0.45596 1.0000 + S S23 1.0 0.07812 0.43719 0.45596 1.0000 + S S24 1.0 0.07812 0.49969 0.45596 1.0000 + S S25 1.0 0.07812 0.56219 0.45596 1.0000 + S S26 1.0 0.07812 0.62469 0.45596 1.0000 + S S27 1.0 0.07812 0.68719 0.45596 1.0000 + S S28 1.0 0.07812 0.74969 0.45596 1.0000 + S S29 1.0 0.07812 0.81219 0.45596 1.0000 + S S30 1.0 0.07812 0.87469 0.45596 1.0000 + S S31 1.0 0.07812 0.93719 0.45596 1.0000 + S S32 1.0 0.07812 0.99969 0.45596 1.0000 + S S33 1.0 0.14062 0.06219 0.45596 1.0000 + S S34 1.0 0.14062 0.12469 0.45596 1.0000 + S S35 1.0 0.14062 0.18719 0.45596 1.0000 + S S36 1.0 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0.68719 0.45596 1.0000 + S S60 1.0 0.20312 0.74969 0.45596 1.0000 + S S61 1.0 0.20312 0.81219 0.45596 1.0000 + S S62 1.0 0.20312 0.87469 0.45596 1.0000 + S S63 1.0 0.20312 0.93719 0.45596 1.0000 + S S64 1.0 0.20312 0.99969 0.45596 1.0000 + S S65 1.0 0.26562 0.06219 0.45596 1.0000 + S S66 1.0 0.26562 0.12469 0.45596 1.0000 + S S67 1.0 0.26562 0.18719 0.45596 1.0000 + S S68 1.0 0.26562 0.24969 0.45596 1.0000 + S S69 1.0 0.26562 0.31219 0.45596 1.0000 + S S70 1.0 0.26562 0.37469 0.45596 1.0000 + S S71 1.0 0.26562 0.43719 0.45596 1.0000 + S S72 1.0 0.26562 0.49969 0.45596 1.0000 + S S73 1.0 0.26562 0.56219 0.45596 1.0000 + S S74 1.0 0.26562 0.62469 0.45596 1.0000 + S S75 1.0 0.26562 0.68719 0.45596 1.0000 + S S76 1.0 0.26562 0.74969 0.45596 1.0000 + S S77 1.0 0.26562 0.81219 0.45596 1.0000 + S S78 1.0 0.26562 0.87469 0.45596 1.0000 + S S79 1.0 0.26562 0.93719 0.45596 1.0000 + S S80 1.0 0.26562 0.99969 0.45596 1.0000 + S S81 1.0 0.32812 0.06219 0.45596 1.0000 + S S82 1.0 0.32812 0.12469 0.45596 1.0000 + S S83 1.0 0.32812 0.18719 0.45596 1.0000 + S S84 1.0 0.32812 0.24969 0.45596 1.0000 + S S85 1.0 0.32812 0.31219 0.45596 1.0000 + S S86 1.0 0.32812 0.37469 0.45596 1.0000 + S S87 1.0 0.32812 0.43719 0.45596 1.0000 + S S88 1.0 0.32812 0.49969 0.45596 1.0000 + S S89 1.0 0.32812 0.56219 0.45596 1.0000 + S S90 1.0 0.32812 0.62469 0.45596 1.0000 + S S91 1.0 0.32812 0.68719 0.45596 1.0000 + S S92 1.0 0.32812 0.74969 0.45596 1.0000 + S S93 1.0 0.32812 0.81219 0.45596 1.0000 + S S94 1.0 0.32812 0.87469 0.45596 1.0000 + S S95 1.0 0.32812 0.93719 0.45596 1.0000 + S S96 1.0 0.32812 0.99969 0.45596 1.0000 + S S97 1.0 0.39062 0.06219 0.45596 1.0000 + S S98 1.0 0.39062 0.12469 0.45596 1.0000 + S S99 1.0 0.39062 0.18719 0.45596 1.0000 + S S100 1.0 0.39062 0.24969 0.45596 1.0000 + S S101 1.0 0.39062 0.31219 0.45596 1.0000 + S S102 1.0 0.39062 0.37469 0.45596 1.0000 + S S103 1.0 0.39062 0.43719 0.45596 1.0000 + S S104 1.0 0.39062 0.49969 0.45596 1.0000 + S S105 1.0 0.39062 0.56219 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S S151 1.0 0.57812 0.43719 0.45596 1.0000 + S S152 1.0 0.57812 0.49969 0.45596 1.0000 + S S153 1.0 0.57812 0.56219 0.45596 1.0000 + S S154 1.0 0.57812 0.62469 0.45596 1.0000 + S S155 1.0 0.57812 0.68719 0.45596 1.0000 + S S156 1.0 0.57812 0.74969 0.45596 1.0000 + S S157 1.0 0.57812 0.81219 0.45596 1.0000 + S S158 1.0 0.57812 0.87469 0.45596 1.0000 + S S159 1.0 0.57812 0.93719 0.45596 1.0000 + S S160 1.0 0.57812 0.99969 0.45596 1.0000 + S S161 1.0 0.64062 0.06219 0.45596 1.0000 + S S162 1.0 0.64062 0.12469 0.45596 1.0000 + S S163 1.0 0.64062 0.18719 0.45596 1.0000 + S S164 1.0 0.64062 0.24969 0.45596 1.0000 + S S165 1.0 0.64062 0.31219 0.45596 1.0000 + S S166 1.0 0.64062 0.37469 0.45596 1.0000 + S S167 1.0 0.64062 0.43719 0.45596 1.0000 + S S168 1.0 0.64062 0.49969 0.45596 1.0000 + S S169 1.0 0.64062 0.56219 0.45596 1.0000 + S S170 1.0 0.64062 0.62469 0.45596 1.0000 + S S171 1.0 0.64062 0.68719 0.45596 1.0000 + S S172 1.0 0.64062 0.74969 0.45596 1.0000 + S S173 1.0 0.64062 0.81219 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S S287 1.0 0.10937 0.87531 0.54404 1.0000 + S S288 1.0 0.10937 0.93781 0.54404 1.0000 + S S289 1.0 0.17188 0.00031 0.54404 1.0000 + S S290 1.0 0.17188 0.06281 0.54404 1.0000 + S S291 1.0 0.17188 0.12531 0.54404 1.0000 + S S292 1.0 0.17188 0.18781 0.54404 1.0000 + S S293 1.0 0.17188 0.25031 0.54404 1.0000 + S S294 1.0 0.17188 0.31281 0.54404 1.0000 + S S295 1.0 0.17188 0.37531 0.54404 1.0000 + S S296 1.0 0.17188 0.43781 0.54404 1.0000 + S S297 1.0 0.17188 0.50031 0.54404 1.0000 + S S298 1.0 0.17188 0.56281 0.54404 1.0000 + S S299 1.0 0.17188 0.62531 0.54404 1.0000 + S S300 1.0 0.17188 0.68781 0.54404 1.0000 + S S301 1.0 0.17188 0.75031 0.54404 1.0000 + S S302 1.0 0.17188 0.81281 0.54404 1.0000 + S S303 1.0 0.17188 0.87531 0.54404 1.0000 + S S304 1.0 0.17188 0.93781 0.54404 1.0000 + S S305 1.0 0.23438 0.00031 0.54404 1.0000 + S S306 1.0 0.23438 0.06281 0.54404 1.0000 + S S307 1.0 0.23438 0.12531 0.54404 1.0000 + S S308 1.0 0.23438 0.18781 0.54404 1.0000 + S S309 1.0 0.23438 0.25031 0.54404 1.0000 + S S310 1.0 0.23438 0.31281 0.54404 1.0000 + S S311 1.0 0.23438 0.37531 0.54404 1.0000 + S S312 1.0 0.23438 0.43781 0.54404 1.0000 + S S313 1.0 0.23438 0.50031 0.54404 1.0000 + S S314 1.0 0.23438 0.56281 0.54404 1.0000 + S S315 1.0 0.23438 0.62531 0.54404 1.0000 + S S316 1.0 0.23438 0.68781 0.54404 1.0000 + S S317 1.0 0.23438 0.75031 0.54404 1.0000 + S S318 1.0 0.23438 0.81281 0.54404 1.0000 + S S319 1.0 0.23438 0.87531 0.54404 1.0000 + S S320 1.0 0.23438 0.93781 0.54404 1.0000 + S S321 1.0 0.29688 0.00031 0.54404 1.0000 + S S322 1.0 0.29688 0.06281 0.54404 1.0000 + S S323 1.0 0.29688 0.12531 0.54404 1.0000 + S S324 1.0 0.29688 0.18781 0.54404 1.0000 + S S325 1.0 0.29688 0.25031 0.54404 1.0000 + S S326 1.0 0.29688 0.31281 0.54404 1.0000 + S S327 1.0 0.29688 0.37531 0.54404 1.0000 + S S328 1.0 0.29688 0.43781 0.54404 1.0000 + S S329 1.0 0.29688 0.50031 0.54404 1.0000 + S S330 1.0 0.29688 0.56281 0.54404 1.0000 + S S331 1.0 0.29688 0.62531 0.54404 1.0000 + S S332 1.0 0.29688 0.68781 0.54404 1.0000 + S S333 1.0 0.29688 0.75031 0.54404 1.0000 + S S334 1.0 0.29688 0.81281 0.54404 1.0000 + S S335 1.0 0.29688 0.87531 0.54404 1.0000 + S S336 1.0 0.29688 0.93781 0.54404 1.0000 + S S337 1.0 0.35938 0.00031 0.54404 1.0000 + S S338 1.0 0.35938 0.06281 0.54404 1.0000 + S S339 1.0 0.35938 0.12531 0.54404 1.0000 + S S340 1.0 0.35938 0.18781 0.54404 1.0000 + S S341 1.0 0.35938 0.25031 0.54404 1.0000 + S S342 1.0 0.35938 0.31281 0.54404 1.0000 + S S343 1.0 0.35938 0.37531 0.54404 1.0000 + S S344 1.0 0.35938 0.43781 0.54404 1.0000 + S S345 1.0 0.35938 0.50031 0.54404 1.0000 + S S346 1.0 0.35938 0.56281 0.54404 1.0000 + S S347 1.0 0.35938 0.62531 0.54404 1.0000 + S S348 1.0 0.35938 0.68781 0.54404 1.0000 + S S349 1.0 0.35938 0.75031 0.54404 1.0000 + S S350 1.0 0.35938 0.81281 0.54404 1.0000 + S S351 1.0 0.35938 0.87531 0.54404 1.0000 + S S352 1.0 0.35938 0.93781 0.54404 1.0000 + S S353 1.0 0.42188 0.00031 0.54404 1.0000 + S S354 1.0 0.42188 0.06281 0.54404 1.0000 + S S355 1.0 0.42188 0.12531 0.54404 1.0000 + S S356 1.0 0.42188 0.18781 0.54404 1.0000 + S S357 1.0 0.42188 0.25031 0.54404 1.0000 + S S358 1.0 0.42188 0.31281 0.54404 1.0000 + S S359 1.0 0.42188 0.37531 0.54404 1.0000 + S S360 1.0 0.42188 0.43781 0.54404 1.0000 + S S361 1.0 0.42188 0.50031 0.54404 1.0000 + S S362 1.0 0.42188 0.56281 0.54404 1.0000 + S S363 1.0 0.42188 0.62531 0.54404 1.0000 + S S364 1.0 0.42188 0.68781 0.54404 1.0000 + S S365 1.0 0.42188 0.75031 0.54404 1.0000 + S S366 1.0 0.42188 0.81281 0.54404 1.0000 + S S367 1.0 0.42188 0.87531 0.54404 1.0000 + S S368 1.0 0.42188 0.93781 0.54404 1.0000 + S S369 1.0 0.48438 0.00031 0.54404 1.0000 + S S370 1.0 0.48438 0.06281 0.54404 1.0000 + S S371 1.0 0.48438 0.12531 0.54404 1.0000 + S S372 1.0 0.48438 0.18781 0.54404 1.0000 + S S373 1.0 0.48438 0.25031 0.54404 1.0000 + S S374 1.0 0.48438 0.31281 0.54404 1.0000 + S S375 1.0 0.48438 0.37531 0.54404 1.0000 + S S376 1.0 0.48438 0.43781 0.54404 1.0000 + S S377 1.0 0.48438 0.50031 0.54404 1.0000 + S S378 1.0 0.48438 0.56281 0.54404 1.0000 + S S379 1.0 0.48438 0.62531 0.54404 1.0000 + S S380 1.0 0.48438 0.68781 0.54404 1.0000 + S S381 1.0 0.48438 0.75031 0.54404 1.0000 + S S382 1.0 0.48438 0.81281 0.54404 1.0000 + S S383 1.0 0.48438 0.87531 0.54404 1.0000 + S S384 1.0 0.48438 0.93781 0.54404 1.0000 + S S385 1.0 0.54688 0.00031 0.54404 1.0000 + S S386 1.0 0.54688 0.06281 0.54404 1.0000 + S S387 1.0 0.54688 0.12531 0.54404 1.0000 + S S388 1.0 0.54688 0.18781 0.54404 1.0000 + S S389 1.0 0.54688 0.25031 0.54404 1.0000 + S S390 1.0 0.54688 0.31281 0.54404 1.0000 + S S391 1.0 0.54688 0.37531 0.54404 1.0000 + S S392 1.0 0.54688 0.43781 0.54404 1.0000 + S S393 1.0 0.54688 0.50031 0.54404 1.0000 + S S394 1.0 0.54688 0.56281 0.54404 1.0000 + S S395 1.0 0.54688 0.62531 0.54404 1.0000 + S S396 1.0 0.54688 0.68781 0.54404 1.0000 + S S397 1.0 0.54688 0.75031 0.54404 1.0000 + S S398 1.0 0.54688 0.81281 0.54404 1.0000 + S S399 1.0 0.54688 0.87531 0.54404 1.0000 + S S400 1.0 0.54688 0.93781 0.54404 1.0000 + S S401 1.0 0.60938 0.00031 0.54404 1.0000 + S S402 1.0 0.60938 0.06281 0.54404 1.0000 + S S403 1.0 0.60938 0.12531 0.54404 1.0000 + S S404 1.0 0.60938 0.18781 0.54404 1.0000 + S S405 1.0 0.60938 0.25031 0.54404 1.0000 + S S406 1.0 0.60938 0.31281 0.54404 1.0000 + S S407 1.0 0.60938 0.37531 0.54404 1.0000 + S S408 1.0 0.60938 0.43781 0.54404 1.0000 + S S409 1.0 0.60938 0.50031 0.54404 1.0000 + S S410 1.0 0.60938 0.56281 0.54404 1.0000 + S S411 1.0 0.60938 0.62531 0.54404 1.0000 + S S412 1.0 0.60938 0.68781 0.54404 1.0000 + S S413 1.0 0.60938 0.75031 0.54404 1.0000 + S S414 1.0 0.60938 0.81281 0.54404 1.0000 + S S415 1.0 0.60938 0.87531 0.54404 1.0000 + S S416 1.0 0.60938 0.93781 0.54404 1.0000 + S S417 1.0 0.67188 0.00031 0.54404 1.0000 + S S418 1.0 0.67188 0.06281 0.54404 1.0000 + S S419 1.0 0.67188 0.12531 0.54404 1.0000 + S S420 1.0 0.67188 0.18781 0.54404 1.0000 + S S421 1.0 0.67188 0.25031 0.54404 1.0000 + S S422 1.0 0.67188 0.31281 0.54404 1.0000 + S S423 1.0 0.67188 0.37531 0.54404 1.0000 + S S424 1.0 0.67188 0.43781 0.54404 1.0000 + S S425 1.0 0.67188 0.50031 0.54404 1.0000 + S S426 1.0 0.67188 0.56281 0.54404 1.0000 + S S427 1.0 0.67188 0.62531 0.54404 1.0000 + S S428 1.0 0.67188 0.68781 0.54404 1.0000 + S S429 1.0 0.67188 0.75031 0.54404 1.0000 + S S430 1.0 0.67188 0.81281 0.54404 1.0000 + S S431 1.0 0.67188 0.87531 0.54404 1.0000 + S S432 1.0 0.67188 0.93781 0.54404 1.0000 + S S433 1.0 0.73438 0.00031 0.54404 1.0000 + S S434 1.0 0.73438 0.06281 0.54404 1.0000 + S S435 1.0 0.73438 0.12531 0.54404 1.0000 + S S436 1.0 0.73438 0.18781 0.54404 1.0000 + S S437 1.0 0.73438 0.25031 0.54404 1.0000 + S S438 1.0 0.73438 0.31281 0.54404 1.0000 + S S439 1.0 0.73438 0.37531 0.54404 1.0000 + S S440 1.0 0.73438 0.43781 0.54404 1.0000 + S S441 1.0 0.73438 0.50031 0.54404 1.0000 + S S442 1.0 0.73438 0.56281 0.54404 1.0000 + S S443 1.0 0.73438 0.62531 0.54404 1.0000 + S S444 1.0 0.73438 0.68781 0.54404 1.0000 + S S445 1.0 0.73438 0.75031 0.54404 1.0000 + S S446 1.0 0.73438 0.81281 0.54404 1.0000 + S S447 1.0 0.73438 0.87531 0.54404 1.0000 + S S448 1.0 0.73438 0.93781 0.54404 1.0000 + S S449 1.0 0.79688 0.00031 0.54404 1.0000 + S S450 1.0 0.79688 0.06281 0.54404 1.0000 + S S451 1.0 0.79688 0.12531 0.54404 1.0000 + S S452 1.0 0.79688 0.18781 0.54404 1.0000 + S S453 1.0 0.79688 0.25031 0.54404 1.0000 + S S454 1.0 0.79688 0.31281 0.54404 1.0000 + S S455 1.0 0.79688 0.37531 0.54404 1.0000 + S S456 1.0 0.79688 0.43781 0.54404 1.0000 + S S457 1.0 0.79688 0.50031 0.54404 1.0000 + S S458 1.0 0.79688 0.56281 0.54404 1.0000 + S S459 1.0 0.79688 0.62531 0.54404 1.0000 + S S460 1.0 0.79688 0.68781 0.54404 1.0000 + S S461 1.0 0.79688 0.75031 0.54404 1.0000 + S S462 1.0 0.79688 0.81281 0.54404 1.0000 + S S463 1.0 0.79688 0.87531 0.54404 1.0000 + S S464 1.0 0.79688 0.93781 0.54404 1.0000 + S S465 1.0 0.85938 0.00031 0.54404 1.0000 + S S466 1.0 0.85938 0.06281 0.54404 1.0000 + S S467 1.0 0.85938 0.12531 0.54404 1.0000 + S S468 1.0 0.85938 0.18781 0.54404 1.0000 + S S469 1.0 0.85938 0.25031 0.54404 1.0000 + S S470 1.0 0.85938 0.31281 0.54404 1.0000 + S S471 1.0 0.85938 0.37531 0.54404 1.0000 + S S472 1.0 0.85938 0.43781 0.54404 1.0000 + S S473 1.0 0.85938 0.50031 0.54404 1.0000 + S S474 1.0 0.85938 0.56281 0.54404 1.0000 + S S475 1.0 0.85938 0.62531 0.54404 1.0000 + S S476 1.0 0.85938 0.68781 0.54404 1.0000 + S S477 1.0 0.85938 0.75031 0.54404 1.0000 + S S478 1.0 0.85938 0.81281 0.54404 1.0000 + S S479 1.0 0.85938 0.87531 0.54404 1.0000 + S S480 1.0 0.85938 0.93781 0.54404 1.0000 + S S481 1.0 0.92187 0.00031 0.54404 1.0000 + S S482 1.0 0.92187 0.06281 0.54404 1.0000 + S S483 1.0 0.92187 0.12531 0.54404 1.0000 + S S484 1.0 0.92187 0.18781 0.54404 1.0000 + S S485 1.0 0.92187 0.25031 0.54404 1.0000 + S S486 1.0 0.92187 0.31281 0.54404 1.0000 + S S487 1.0 0.92187 0.37531 0.54404 1.0000 + S S488 1.0 0.92187 0.43781 0.54404 1.0000 + S S489 1.0 0.92187 0.50031 0.54404 1.0000 + S S490 1.0 0.92187 0.56281 0.54404 1.0000 + S S491 1.0 0.92187 0.62531 0.54404 1.0000 + S S492 1.0 0.92187 0.68781 0.54404 1.0000 + S S493 1.0 0.92187 0.75031 0.54404 1.0000 + S S494 1.0 0.92187 0.81281 0.54404 1.0000 + S S495 1.0 0.92187 0.87531 0.54404 1.0000 + S S496 1.0 0.92187 0.93781 0.54404 1.0000 + S S497 1.0 0.98438 0.00031 0.54404 1.0000 + S S498 1.0 0.98438 0.06281 0.54404 1.0000 + S S499 1.0 0.98438 0.12531 0.54404 1.0000 + S S500 1.0 0.98438 0.18781 0.54404 1.0000 + S S501 1.0 0.98438 0.25031 0.54404 1.0000 + S S502 1.0 0.98438 0.31281 0.54404 1.0000 + S S503 1.0 0.98438 0.37531 0.54404 1.0000 + S S504 1.0 0.98438 0.43781 0.54404 1.0000 + S S505 1.0 0.98438 0.50031 0.54404 1.0000 + S S506 1.0 0.98438 0.56281 0.54404 1.0000 + S S507 1.0 0.98438 0.62531 0.54404 1.0000 + S S508 1.0 0.98438 0.68781 0.54404 1.0000 + S S509 1.0 0.98438 0.75031 0.54404 1.0000 + S S510 1.0 0.98438 0.81281 0.54404 1.0000 + S S511 1.0 0.98438 0.87531 0.54404 1.0000 + S S512 1.0 0.98438 0.93781 0.54404 1.0000 + Br Br1 1.0 0.01562 0.02544 0.29104 1.0000 + Br Br2 1.0 0.01562 0.08794 0.29104 1.0000 + Br Br3 1.0 0.01562 0.15044 0.29104 1.0000 + Br Br4 1.0 0.01562 0.21294 0.29104 1.0000 + Br Br5 1.0 0.01562 0.27544 0.29104 1.0000 + Br Br6 1.0 0.01562 0.33794 0.29104 1.0000 + Br Br7 1.0 0.01562 0.40044 0.29104 1.0000 + Br Br8 1.0 0.01562 0.46294 0.29104 1.0000 + Br Br9 1.0 0.01562 0.52544 0.29104 1.0000 + Br Br10 1.0 0.01562 0.58794 0.29104 1.0000 + Br Br11 1.0 0.01562 0.65044 0.29104 1.0000 + Br Br12 1.0 0.01562 0.71294 0.29104 1.0000 + Br Br13 1.0 0.01562 0.77544 0.29104 1.0000 + Br Br14 1.0 0.01562 0.83794 0.29104 1.0000 + Br Br15 1.0 0.01562 0.90044 0.29104 1.0000 + Br Br16 1.0 0.01562 0.96294 0.29104 1.0000 + Br Br17 1.0 0.07812 0.02544 0.29104 1.0000 + Br Br18 1.0 0.07812 0.08794 0.29104 1.0000 + Br Br19 1.0 0.07812 0.15044 0.29104 1.0000 + Br Br20 1.0 0.07812 0.21294 0.29104 1.0000 + Br Br21 1.0 0.07812 0.27544 0.29104 1.0000 + Br Br22 1.0 0.07812 0.33794 0.29104 1.0000 + Br Br23 1.0 0.07812 0.40044 0.29104 1.0000 + Br Br24 1.0 0.07812 0.46294 0.29104 1.0000 + Br Br25 1.0 0.07812 0.52544 0.29104 1.0000 + Br Br26 1.0 0.07812 0.58794 0.29104 1.0000 + Br Br27 1.0 0.07812 0.65044 0.29104 1.0000 + Br Br28 1.0 0.07812 0.71294 0.29104 1.0000 + Br Br29 1.0 0.07812 0.77544 0.29104 1.0000 + Br Br30 1.0 0.07812 0.83794 0.29104 1.0000 + Br Br31 1.0 0.07812 0.90044 0.29104 1.0000 + Br Br32 1.0 0.07812 0.96294 0.29104 1.0000 + Br Br33 1.0 0.14062 0.02544 0.29104 1.0000 + Br Br34 1.0 0.14062 0.08794 0.29104 1.0000 + Br Br35 1.0 0.14062 0.15044 0.29104 1.0000 + Br Br36 1.0 0.14062 0.21294 0.29104 1.0000 + Br Br37 1.0 0.14062 0.27544 0.29104 1.0000 + Br Br38 1.0 0.14062 0.33794 0.29104 1.0000 + Br Br39 1.0 0.14062 0.40044 0.29104 1.0000 + Br Br40 1.0 0.14062 0.46294 0.29104 1.0000 + Br Br41 1.0 0.14062 0.52544 0.29104 1.0000 + Br Br42 1.0 0.14062 0.58794 0.29104 1.0000 + Br Br43 1.0 0.14062 0.65044 0.29104 1.0000 + Br Br44 1.0 0.14062 0.71294 0.29104 1.0000 + Br Br45 1.0 0.14062 0.77544 0.29104 1.0000 + Br Br46 1.0 0.14062 0.83794 0.29104 1.0000 + Br Br47 1.0 0.14062 0.90044 0.29104 1.0000 + Br Br48 1.0 0.14062 0.96294 0.29104 1.0000 + Br Br49 1.0 0.20312 0.02544 0.29104 1.0000 + Br Br50 1.0 0.20312 0.08794 0.29104 1.0000 + Br Br51 1.0 0.20312 0.15044 0.29104 1.0000 + Br Br52 1.0 0.20312 0.21294 0.29104 1.0000 + Br Br53 1.0 0.20312 0.27544 0.29104 1.0000 + Br Br54 1.0 0.20312 0.33794 0.29104 1.0000 + Br Br55 1.0 0.20312 0.40044 0.29104 1.0000 + Br Br56 1.0 0.20312 0.46294 0.29104 1.0000 + Br Br57 1.0 0.20312 0.52544 0.29104 1.0000 + Br Br58 1.0 0.20312 0.58794 0.29104 1.0000 + Br Br59 1.0 0.20312 0.65044 0.29104 1.0000 + Br Br60 1.0 0.20312 0.71294 0.29104 1.0000 + Br Br61 1.0 0.20312 0.77544 0.29104 1.0000 + Br Br62 1.0 0.20312 0.83794 0.29104 1.0000 + Br Br63 1.0 0.20312 0.90044 0.29104 1.0000 + Br Br64 1.0 0.20312 0.96294 0.29104 1.0000 + Br Br65 1.0 0.26562 0.02544 0.29104 1.0000 + Br Br66 1.0 0.26562 0.08794 0.29104 1.0000 + Br Br67 1.0 0.26562 0.15044 0.29104 1.0000 + Br Br68 1.0 0.26562 0.21294 0.29104 1.0000 + Br Br69 1.0 0.26562 0.27544 0.29104 1.0000 + Br Br70 1.0 0.26562 0.33794 0.29104 1.0000 + Br Br71 1.0 0.26562 0.40044 0.29104 1.0000 + Br Br72 1.0 0.26562 0.46294 0.29104 1.0000 + Br Br73 1.0 0.26562 0.52544 0.29104 1.0000 + Br Br74 1.0 0.26562 0.58794 0.29104 1.0000 + Br Br75 1.0 0.26562 0.65044 0.29104 1.0000 + Br Br76 1.0 0.26562 0.71294 0.29104 1.0000 + Br Br77 1.0 0.26562 0.77544 0.29104 1.0000 + Br Br78 1.0 0.26562 0.83794 0.29104 1.0000 + Br Br79 1.0 0.26562 0.90044 0.29104 1.0000 + Br Br80 1.0 0.26562 0.96294 0.29104 1.0000 + Br Br81 1.0 0.32812 0.02544 0.29104 1.0000 + Br Br82 1.0 0.32812 0.08794 0.29104 1.0000 + Br Br83 1.0 0.32812 0.15044 0.29104 1.0000 + Br Br84 1.0 0.32812 0.21294 0.29104 1.0000 + Br Br85 1.0 0.32812 0.27544 0.29104 1.0000 + Br Br86 1.0 0.32812 0.33794 0.29104 1.0000 + Br Br87 1.0 0.32812 0.40044 0.29104 1.0000 + Br Br88 1.0 0.32812 0.46294 0.29104 1.0000 + Br Br89 1.0 0.32812 0.52544 0.29104 1.0000 + Br Br90 1.0 0.32812 0.58794 0.29104 1.0000 + Br Br91 1.0 0.32812 0.65044 0.29104 1.0000 + Br Br92 1.0 0.32812 0.71294 0.29104 1.0000 + Br Br93 1.0 0.32812 0.77544 0.29104 1.0000 + Br Br94 1.0 0.32812 0.83794 0.29104 1.0000 + Br Br95 1.0 0.32812 0.90044 0.29104 1.0000 + Br Br96 1.0 0.32812 0.96294 0.29104 1.0000 + Br Br97 1.0 0.39062 0.02544 0.29104 1.0000 + Br Br98 1.0 0.39062 0.08794 0.29104 1.0000 + Br Br99 1.0 0.39062 0.15044 0.29104 1.0000 + Br Br100 1.0 0.39062 0.21294 0.29104 1.0000 + Br Br101 1.0 0.39062 0.27544 0.29104 1.0000 + Br Br102 1.0 0.39062 0.33794 0.29104 1.0000 + Br Br103 1.0 0.39062 0.40044 0.29104 1.0000 + Br Br104 1.0 0.39062 0.46294 0.29104 1.0000 + Br Br105 1.0 0.39062 0.52544 0.29104 1.0000 + Br Br106 1.0 0.39062 0.58794 0.29104 1.0000 + Br Br107 1.0 0.39062 0.65044 0.29104 1.0000 + Br Br108 1.0 0.39062 0.71294 0.29104 1.0000 + Br Br109 1.0 0.39062 0.77544 0.29104 1.0000 + Br Br110 1.0 0.39062 0.83794 0.29104 1.0000 + Br Br111 1.0 0.39062 0.90044 0.29104 1.0000 + Br Br112 1.0 0.39062 0.96294 0.29104 1.0000 + Br Br113 1.0 0.45312 0.02544 0.29104 1.0000 + Br Br114 1.0 0.45312 0.08794 0.29104 1.0000 + Br Br115 1.0 0.45312 0.15044 0.29104 1.0000 + Br Br116 1.0 0.45312 0.21294 0.29104 1.0000 + Br Br117 1.0 0.45312 0.27544 0.29104 1.0000 + Br Br118 1.0 0.45312 0.33794 0.29104 1.0000 + Br Br119 1.0 0.45312 0.40044 0.29104 1.0000 + Br Br120 1.0 0.45312 0.46294 0.29104 1.0000 + Br Br121 1.0 0.45312 0.52544 0.29104 1.0000 + Br Br122 1.0 0.45312 0.58794 0.29104 1.0000 + Br Br123 1.0 0.45312 0.65044 0.29104 1.0000 + Br Br124 1.0 0.45312 0.71294 0.29104 1.0000 + Br Br125 1.0 0.45312 0.77544 0.29104 1.0000 + Br Br126 1.0 0.45312 0.83794 0.29104 1.0000 + Br Br127 1.0 0.45312 0.90044 0.29104 1.0000 + Br Br128 1.0 0.45312 0.96294 0.29104 1.0000 + Br Br129 1.0 0.51562 0.02544 0.29104 1.0000 + Br Br130 1.0 0.51562 0.08794 0.29104 1.0000 + Br Br131 1.0 0.51562 0.15044 0.29104 1.0000 + Br Br132 1.0 0.51562 0.21294 0.29104 1.0000 + Br Br133 1.0 0.51562 0.27544 0.29104 1.0000 + Br Br134 1.0 0.51562 0.33794 0.29104 1.0000 + Br Br135 1.0 0.51562 0.40044 0.29104 1.0000 + Br Br136 1.0 0.51562 0.46294 0.29104 1.0000 + Br Br137 1.0 0.51562 0.52544 0.29104 1.0000 + Br Br138 1.0 0.51562 0.58794 0.29104 1.0000 + Br Br139 1.0 0.51562 0.65044 0.29104 1.0000 + Br Br140 1.0 0.51562 0.71294 0.29104 1.0000 + Br Br141 1.0 0.51562 0.77544 0.29104 1.0000 + Br Br142 1.0 0.51562 0.83794 0.29104 1.0000 + Br Br143 1.0 0.51562 0.90044 0.29104 1.0000 + Br Br144 1.0 0.51562 0.96294 0.29104 1.0000 + Br Br145 1.0 0.57812 0.02544 0.29104 1.0000 + Br Br146 1.0 0.57812 0.08794 0.29104 1.0000 + Br Br147 1.0 0.57812 0.15044 0.29104 1.0000 + Br Br148 1.0 0.57812 0.21294 0.29104 1.0000 + Br Br149 1.0 0.57812 0.27544 0.29104 1.0000 + Br Br150 1.0 0.57812 0.33794 0.29104 1.0000 + Br Br151 1.0 0.57812 0.40044 0.29104 1.0000 + Br Br152 1.0 0.57812 0.46294 0.29104 1.0000 + Br Br153 1.0 0.57812 0.52544 0.29104 1.0000 + Br Br154 1.0 0.57812 0.58794 0.29104 1.0000 + Br Br155 1.0 0.57812 0.65044 0.29104 1.0000 + Br Br156 1.0 0.57812 0.71294 0.29104 1.0000 + Br Br157 1.0 0.57812 0.77544 0.29104 1.0000 + Br Br158 1.0 0.57812 0.83794 0.29104 1.0000 + Br Br159 1.0 0.57812 0.90044 0.29104 1.0000 + Br Br160 1.0 0.57812 0.96294 0.29104 1.0000 + Br Br161 1.0 0.64062 0.02544 0.29104 1.0000 + Br Br162 1.0 0.64062 0.08794 0.29104 1.0000 + Br Br163 1.0 0.64062 0.15044 0.29104 1.0000 + Br Br164 1.0 0.64062 0.21294 0.29104 1.0000 + Br Br165 1.0 0.64062 0.27544 0.29104 1.0000 + Br Br166 1.0 0.64062 0.33794 0.29104 1.0000 + Br Br167 1.0 0.64062 0.40044 0.29104 1.0000 + Br Br168 1.0 0.64062 0.46294 0.29104 1.0000 + Br Br169 1.0 0.64062 0.52544 0.29104 1.0000 + Br Br170 1.0 0.64062 0.58794 0.29104 1.0000 + Br Br171 1.0 0.64062 0.65044 0.29104 1.0000 + Br Br172 1.0 0.64062 0.71294 0.29104 1.0000 + Br Br173 1.0 0.64062 0.77544 0.29104 1.0000 + Br Br174 1.0 0.64062 0.83794 0.29104 1.0000 + Br Br175 1.0 0.64062 0.90044 0.29104 1.0000 + Br Br176 1.0 0.64062 0.96294 0.29104 1.0000 + Br Br177 1.0 0.70312 0.02544 0.29104 1.0000 + Br Br178 1.0 0.70312 0.08794 0.29104 1.0000 + Br Br179 1.0 0.70312 0.15044 0.29104 1.0000 + Br Br180 1.0 0.70312 0.21294 0.29104 1.0000 + Br Br181 1.0 0.70312 0.27544 0.29104 1.0000 + Br Br182 1.0 0.70312 0.33794 0.29104 1.0000 + Br Br183 1.0 0.70312 0.40044 0.29104 1.0000 + Br Br184 1.0 0.70312 0.46294 0.29104 1.0000 + Br Br185 1.0 0.70312 0.52544 0.29104 1.0000 + Br Br186 1.0 0.70312 0.58794 0.29104 1.0000 + Br Br187 1.0 0.70312 0.65044 0.29104 1.0000 + Br Br188 1.0 0.70312 0.71294 0.29104 1.0000 + Br Br189 1.0 0.70312 0.77544 0.29104 1.0000 + Br Br190 1.0 0.70312 0.83794 0.29104 1.0000 + Br Br191 1.0 0.70312 0.90044 0.29104 1.0000 + Br Br192 1.0 0.70312 0.96294 0.29104 1.0000 + Br Br193 1.0 0.76562 0.02544 0.29104 1.0000 + Br Br194 1.0 0.76562 0.08794 0.29104 1.0000 + Br Br195 1.0 0.76562 0.15044 0.29104 1.0000 + Br Br196 1.0 0.76562 0.21294 0.29104 1.0000 + Br Br197 1.0 0.76562 0.27544 0.29104 1.0000 + Br Br198 1.0 0.76562 0.33794 0.29104 1.0000 + Br Br199 1.0 0.76562 0.40044 0.29104 1.0000 + Br Br200 1.0 0.76562 0.46294 0.29104 1.0000 + Br Br201 1.0 0.76562 0.52544 0.29104 1.0000 + Br Br202 1.0 0.76562 0.58794 0.29104 1.0000 + Br Br203 1.0 0.76562 0.65044 0.29104 1.0000 + Br Br204 1.0 0.76562 0.71294 0.29104 1.0000 + Br Br205 1.0 0.76562 0.77544 0.29104 1.0000 + Br Br206 1.0 0.76562 0.83794 0.29104 1.0000 + Br Br207 1.0 0.76562 0.90044 0.29104 1.0000 + Br Br208 1.0 0.76562 0.96294 0.29104 1.0000 + Br Br209 1.0 0.82812 0.02544 0.29104 1.0000 + Br Br210 1.0 0.82812 0.08794 0.29104 1.0000 + Br Br211 1.0 0.82812 0.15044 0.29104 1.0000 + Br Br212 1.0 0.82812 0.21294 0.29104 1.0000 + Br Br213 1.0 0.82812 0.27544 0.29104 1.0000 + Br Br214 1.0 0.82812 0.33794 0.29104 1.0000 + Br Br215 1.0 0.82812 0.40044 0.29104 1.0000 + Br Br216 1.0 0.82812 0.46294 0.29104 1.0000 + Br Br217 1.0 0.82812 0.52544 0.29104 1.0000 + Br Br218 1.0 0.82812 0.58794 0.29104 1.0000 + Br Br219 1.0 0.82812 0.65044 0.29104 1.0000 + Br Br220 1.0 0.82812 0.71294 0.29104 1.0000 + Br Br221 1.0 0.82812 0.77544 0.29104 1.0000 + Br Br222 1.0 0.82812 0.83794 0.29104 1.0000 + Br Br223 1.0 0.82812 0.90044 0.29104 1.0000 + Br Br224 1.0 0.82812 0.96294 0.29104 1.0000 + Br Br225 1.0 0.89062 0.02544 0.29104 1.0000 + Br Br226 1.0 0.89062 0.08794 0.29104 1.0000 + Br Br227 1.0 0.89062 0.15044 0.29104 1.0000 + Br Br228 1.0 0.89062 0.21294 0.29104 1.0000 + Br Br229 1.0 0.89062 0.27544 0.29104 1.0000 + Br Br230 1.0 0.89062 0.33794 0.29104 1.0000 + Br Br231 1.0 0.89062 0.40044 0.29104 1.0000 + Br Br232 1.0 0.89062 0.46294 0.29104 1.0000 + Br Br233 1.0 0.89062 0.52544 0.29104 1.0000 + Br Br234 1.0 0.89062 0.58794 0.29104 1.0000 + Br Br235 1.0 0.89062 0.65044 0.29104 1.0000 + Br Br236 1.0 0.89062 0.71294 0.29104 1.0000 + Br Br237 1.0 0.89062 0.77544 0.29104 1.0000 + Br Br238 1.0 0.89062 0.83794 0.29104 1.0000 + Br Br239 1.0 0.89062 0.90044 0.29104 1.0000 + Br Br240 1.0 0.89062 0.96294 0.29104 1.0000 + Br Br241 1.0 0.95312 0.02544 0.29104 1.0000 + Br Br242 1.0 0.95312 0.08794 0.29104 1.0000 + Br Br243 1.0 0.95312 0.15044 0.29104 1.0000 + Br Br244 1.0 0.95312 0.21294 0.29104 1.0000 + Br Br245 1.0 0.95312 0.27544 0.29104 1.0000 + Br Br246 1.0 0.95312 0.33794 0.29104 1.0000 + Br Br247 1.0 0.95312 0.40044 0.29104 1.0000 + Br Br248 1.0 0.95312 0.46294 0.29104 1.0000 + Br Br249 1.0 0.95312 0.52544 0.29104 1.0000 + Br Br250 1.0 0.95312 0.58794 0.29104 1.0000 + Br Br251 1.0 0.95312 0.65044 0.29104 1.0000 + Br Br252 1.0 0.95312 0.71294 0.29104 1.0000 + Br Br253 1.0 0.95312 0.77544 0.29104 1.0000 + Br Br254 1.0 0.95312 0.83794 0.29104 1.0000 + Br Br255 1.0 0.95312 0.90044 0.29104 1.0000 + Br Br256 1.0 0.95312 0.96294 0.29104 1.0000 + Br Br257 1.0 0.04688 0.03706 0.70896 1.0000 + Br Br258 1.0 0.04688 0.09956 0.70896 1.0000 + Br Br259 1.0 0.04688 0.16206 0.70896 1.0000 + Br Br260 1.0 0.04688 0.22456 0.70896 1.0000 + Br Br261 1.0 0.04688 0.28706 0.70896 1.0000 + Br Br262 1.0 0.04688 0.34956 0.70896 1.0000 + Br Br263 1.0 0.04688 0.41206 0.70896 1.0000 + Br Br264 1.0 0.04688 0.47456 0.70896 1.0000 + Br Br265 1.0 0.04688 0.53706 0.70896 1.0000 + Br Br266 1.0 0.04688 0.59956 0.70896 1.0000 + Br Br267 1.0 0.04688 0.66206 0.70896 1.0000 + Br Br268 1.0 0.04688 0.72456 0.70896 1.0000 + Br Br269 1.0 0.04688 0.78706 0.70896 1.0000 + Br Br270 1.0 0.04688 0.84956 0.70896 1.0000 + Br Br271 1.0 0.04688 0.91206 0.70896 1.0000 + Br Br272 1.0 0.04688 0.97456 0.70896 1.0000 + Br Br273 1.0 0.10937 0.03706 0.70896 1.0000 + Br Br274 1.0 0.10937 0.09956 0.70896 1.0000 + Br Br275 1.0 0.10937 0.16206 0.70896 1.0000 + Br Br276 1.0 0.10937 0.22456 0.70896 1.0000 + Br Br277 1.0 0.10937 0.28706 0.70896 1.0000 + Br Br278 1.0 0.10937 0.34956 0.70896 1.0000 + Br Br279 1.0 0.10937 0.41206 0.70896 1.0000 + Br Br280 1.0 0.10937 0.47456 0.70896 1.0000 + Br Br281 1.0 0.10937 0.53706 0.70896 1.0000 + Br Br282 1.0 0.10937 0.59956 0.70896 1.0000 + Br Br283 1.0 0.10937 0.66206 0.70896 1.0000 + Br Br284 1.0 0.10937 0.72456 0.70896 1.0000 + Br Br285 1.0 0.10937 0.78706 0.70896 1.0000 + Br Br286 1.0 0.10937 0.84956 0.70896 1.0000 + Br Br287 1.0 0.10937 0.91206 0.70896 1.0000 + Br Br288 1.0 0.10937 0.97456 0.70896 1.0000 + Br Br289 1.0 0.17188 0.03706 0.70896 1.0000 + Br Br290 1.0 0.17188 0.09956 0.70896 1.0000 + Br Br291 1.0 0.17188 0.16206 0.70896 1.0000 + Br Br292 1.0 0.17188 0.22456 0.70896 1.0000 + Br Br293 1.0 0.17188 0.28706 0.70896 1.0000 + Br Br294 1.0 0.17188 0.34956 0.70896 1.0000 + Br Br295 1.0 0.17188 0.41206 0.70896 1.0000 + Br Br296 1.0 0.17188 0.47456 0.70896 1.0000 + Br Br297 1.0 0.17188 0.53706 0.70896 1.0000 + Br Br298 1.0 0.17188 0.59956 0.70896 1.0000 + Br Br299 1.0 0.17188 0.66206 0.70896 1.0000 + Br Br300 1.0 0.17188 0.72456 0.70896 1.0000 + Br Br301 1.0 0.17188 0.78706 0.70896 1.0000 + Br Br302 1.0 0.17188 0.84956 0.70896 1.0000 + Br Br303 1.0 0.17188 0.91206 0.70896 1.0000 + Br Br304 1.0 0.17188 0.97456 0.70896 1.0000 + Br Br305 1.0 0.23438 0.03706 0.70896 1.0000 + Br Br306 1.0 0.23438 0.09956 0.70896 1.0000 + Br Br307 1.0 0.23438 0.16206 0.70896 1.0000 + Br Br308 1.0 0.23438 0.22456 0.70896 1.0000 + Br Br309 1.0 0.23438 0.28706 0.70896 1.0000 + Br Br310 1.0 0.23438 0.34956 0.70896 1.0000 + Br Br311 1.0 0.23438 0.41206 0.70896 1.0000 + Br Br312 1.0 0.23438 0.47456 0.70896 1.0000 + Br Br313 1.0 0.23438 0.53706 0.70896 1.0000 + Br Br314 1.0 0.23438 0.59956 0.70896 1.0000 + Br Br315 1.0 0.23438 0.66206 0.70896 1.0000 + Br Br316 1.0 0.23438 0.72456 0.70896 1.0000 + Br Br317 1.0 0.23438 0.78706 0.70896 1.0000 + Br Br318 1.0 0.23438 0.84956 0.70896 1.0000 + Br Br319 1.0 0.23438 0.91206 0.70896 1.0000 + Br Br320 1.0 0.23438 0.97456 0.70896 1.0000 + Br Br321 1.0 0.29688 0.03706 0.70896 1.0000 + Br Br322 1.0 0.29688 0.09956 0.70896 1.0000 + Br Br323 1.0 0.29688 0.16206 0.70896 1.0000 + Br Br324 1.0 0.29688 0.22456 0.70896 1.0000 + Br Br325 1.0 0.29688 0.28706 0.70896 1.0000 + Br Br326 1.0 0.29688 0.34956 0.70896 1.0000 + Br Br327 1.0 0.29688 0.41206 0.70896 1.0000 + Br Br328 1.0 0.29688 0.47456 0.70896 1.0000 + Br Br329 1.0 0.29688 0.53706 0.70896 1.0000 + Br Br330 1.0 0.29688 0.59956 0.70896 1.0000 + Br Br331 1.0 0.29688 0.66206 0.70896 1.0000 + Br Br332 1.0 0.29688 0.72456 0.70896 1.0000 + Br Br333 1.0 0.29688 0.78706 0.70896 1.0000 + Br Br334 1.0 0.29688 0.84956 0.70896 1.0000 + Br Br335 1.0 0.29688 0.91206 0.70896 1.0000 + Br Br336 1.0 0.29688 0.97456 0.70896 1.0000 + Br Br337 1.0 0.35938 0.03706 0.70896 1.0000 + Br Br338 1.0 0.35938 0.09956 0.70896 1.0000 + Br Br339 1.0 0.35938 0.16206 0.70896 1.0000 + Br Br340 1.0 0.35938 0.22456 0.70896 1.0000 + Br Br341 1.0 0.35938 0.28706 0.70896 1.0000 + Br Br342 1.0 0.35938 0.34956 0.70896 1.0000 + Br Br343 1.0 0.35938 0.41206 0.70896 1.0000 + Br Br344 1.0 0.35938 0.47456 0.70896 1.0000 + Br Br345 1.0 0.35938 0.53706 0.70896 1.0000 + Br Br346 1.0 0.35938 0.59956 0.70896 1.0000 + Br Br347 1.0 0.35938 0.66206 0.70896 1.0000 + Br Br348 1.0 0.35938 0.72456 0.70896 1.0000 + Br Br349 1.0 0.35938 0.78706 0.70896 1.0000 + Br Br350 1.0 0.35938 0.84956 0.70896 1.0000 + Br Br351 1.0 0.35938 0.91206 0.70896 1.0000 + Br Br352 1.0 0.35938 0.97456 0.70896 1.0000 + Br Br353 1.0 0.42188 0.03706 0.70896 1.0000 + Br Br354 1.0 0.42188 0.09956 0.70896 1.0000 + Br Br355 1.0 0.42188 0.16206 0.70896 1.0000 + Br Br356 1.0 0.42188 0.22456 0.70896 1.0000 + Br Br357 1.0 0.42188 0.28706 0.70896 1.0000 + Br Br358 1.0 0.42188 0.34956 0.70896 1.0000 + Br Br359 1.0 0.42188 0.41206 0.70896 1.0000 + Br Br360 1.0 0.42188 0.47456 0.70896 1.0000 + Br Br361 1.0 0.42188 0.53706 0.70896 1.0000 + Br Br362 1.0 0.42188 0.59956 0.70896 1.0000 + Br Br363 1.0 0.42188 0.66206 0.70896 1.0000 + Br Br364 1.0 0.42188 0.72456 0.70896 1.0000 + Br Br365 1.0 0.42188 0.78706 0.70896 1.0000 + Br Br366 1.0 0.42188 0.84956 0.70896 1.0000 + Br Br367 1.0 0.42188 0.91206 0.70896 1.0000 + Br Br368 1.0 0.42188 0.97456 0.70896 1.0000 + Br Br369 1.0 0.48438 0.03706 0.70896 1.0000 + Br Br370 1.0 0.48438 0.09956 0.70896 1.0000 + Br Br371 1.0 0.48438 0.16206 0.70896 1.0000 + Br Br372 1.0 0.48438 0.22456 0.70896 1.0000 + Br Br373 1.0 0.48438 0.28706 0.70896 1.0000 + Br Br374 1.0 0.48438 0.34956 0.70896 1.0000 + Br Br375 1.0 0.48438 0.41206 0.70896 1.0000 + Br Br376 1.0 0.48438 0.47456 0.70896 1.0000 + Br Br377 1.0 0.48438 0.53706 0.70896 1.0000 + Br Br378 1.0 0.48438 0.59956 0.70896 1.0000 + Br Br379 1.0 0.48438 0.66206 0.70896 1.0000 + Br Br380 1.0 0.48438 0.72456 0.70896 1.0000 + Br Br381 1.0 0.48438 0.78706 0.70896 1.0000 + Br Br382 1.0 0.48438 0.84956 0.70896 1.0000 + Br Br383 1.0 0.48438 0.91206 0.70896 1.0000 + Br Br384 1.0 0.48438 0.97456 0.70896 1.0000 + Br Br385 1.0 0.54688 0.03706 0.70896 1.0000 + Br Br386 1.0 0.54688 0.09956 0.70896 1.0000 + Br Br387 1.0 0.54688 0.16206 0.70896 1.0000 + Br Br388 1.0 0.54688 0.22456 0.70896 1.0000 + Br Br389 1.0 0.54688 0.28706 0.70896 1.0000 + Br Br390 1.0 0.54688 0.34956 0.70896 1.0000 + Br Br391 1.0 0.54688 0.41206 0.70896 1.0000 + Br Br392 1.0 0.54688 0.47456 0.70896 1.0000 + Br Br393 1.0 0.54688 0.53706 0.70896 1.0000 + Br Br394 1.0 0.54688 0.59956 0.70896 1.0000 + Br Br395 1.0 0.54688 0.66206 0.70896 1.0000 + Br Br396 1.0 0.54688 0.72456 0.70896 1.0000 + Br Br397 1.0 0.54688 0.78706 0.70896 1.0000 + Br Br398 1.0 0.54688 0.84956 0.70896 1.0000 + Br Br399 1.0 0.54688 0.91206 0.70896 1.0000 + Br Br400 1.0 0.54688 0.97456 0.70896 1.0000 + Br Br401 1.0 0.60938 0.03706 0.70896 1.0000 + Br Br402 1.0 0.60938 0.09956 0.70896 1.0000 + Br Br403 1.0 0.60938 0.16206 0.70896 1.0000 + Br Br404 1.0 0.60938 0.22456 0.70896 1.0000 + Br Br405 1.0 0.60938 0.28706 0.70896 1.0000 + Br Br406 1.0 0.60938 0.34956 0.70896 1.0000 + Br Br407 1.0 0.60938 0.41206 0.70896 1.0000 + Br Br408 1.0 0.60938 0.47456 0.70896 1.0000 + Br Br409 1.0 0.60938 0.53706 0.70896 1.0000 + Br Br410 1.0 0.60938 0.59956 0.70896 1.0000 + Br Br411 1.0 0.60938 0.66206 0.70896 1.0000 + Br Br412 1.0 0.60938 0.72456 0.70896 1.0000 + Br Br413 1.0 0.60938 0.78706 0.70896 1.0000 + Br Br414 1.0 0.60938 0.84956 0.70896 1.0000 + Br Br415 1.0 0.60938 0.91206 0.70896 1.0000 + Br Br416 1.0 0.60938 0.97456 0.70896 1.0000 + Br Br417 1.0 0.67188 0.03706 0.70896 1.0000 + Br Br418 1.0 0.67188 0.09956 0.70896 1.0000 + Br Br419 1.0 0.67188 0.16206 0.70896 1.0000 + Br Br420 1.0 0.67188 0.22456 0.70896 1.0000 + Br Br421 1.0 0.67188 0.28706 0.70896 1.0000 + Br Br422 1.0 0.67188 0.34956 0.70896 1.0000 + Br Br423 1.0 0.67188 0.41206 0.70896 1.0000 + Br Br424 1.0 0.67188 0.47456 0.70896 1.0000 + Br Br425 1.0 0.67188 0.53706 0.70896 1.0000 + Br Br426 1.0 0.67188 0.59956 0.70896 1.0000 + Br Br427 1.0 0.67188 0.66206 0.70896 1.0000 + Br Br428 1.0 0.67188 0.72456 0.70896 1.0000 + Br Br429 1.0 0.67188 0.78706 0.70896 1.0000 + Br Br430 1.0 0.67188 0.84956 0.70896 1.0000 + Br Br431 1.0 0.67188 0.91206 0.70896 1.0000 + Br Br432 1.0 0.67188 0.97456 0.70896 1.0000 + Br Br433 1.0 0.73438 0.03706 0.70896 1.0000 + Br Br434 1.0 0.73438 0.09956 0.70896 1.0000 + Br Br435 1.0 0.73438 0.16206 0.70896 1.0000 + Br Br436 1.0 0.73438 0.22456 0.70896 1.0000 + Br Br437 1.0 0.73438 0.28706 0.70896 1.0000 + Br Br438 1.0 0.73438 0.34956 0.70896 1.0000 + Br Br439 1.0 0.73438 0.41206 0.70896 1.0000 + Br Br440 1.0 0.73438 0.47456 0.70896 1.0000 + Br Br441 1.0 0.73438 0.53706 0.70896 1.0000 + Br Br442 1.0 0.73438 0.59956 0.70896 1.0000 + Br Br443 1.0 0.73438 0.66206 0.70896 1.0000 + Br Br444 1.0 0.73438 0.72456 0.70896 1.0000 + Br Br445 1.0 0.73438 0.78706 0.70896 1.0000 + Br Br446 1.0 0.73438 0.84956 0.70896 1.0000 + Br Br447 1.0 0.73438 0.91206 0.70896 1.0000 + Br Br448 1.0 0.73438 0.97456 0.70896 1.0000 + Br Br449 1.0 0.79688 0.03706 0.70896 1.0000 + Br Br450 1.0 0.79688 0.09956 0.70896 1.0000 + Br Br451 1.0 0.79688 0.16206 0.70896 1.0000 + Br Br452 1.0 0.79688 0.22456 0.70896 1.0000 + Br Br453 1.0 0.79688 0.28706 0.70896 1.0000 + Br Br454 1.0 0.79688 0.34956 0.70896 1.0000 + Br Br455 1.0 0.79688 0.41206 0.70896 1.0000 + Br Br456 1.0 0.79688 0.47456 0.70896 1.0000 + Br Br457 1.0 0.79688 0.53706 0.70896 1.0000 + Br Br458 1.0 0.79688 0.59956 0.70896 1.0000 + Br Br459 1.0 0.79688 0.66206 0.70896 1.0000 + Br Br460 1.0 0.79688 0.72456 0.70896 1.0000 + Br Br461 1.0 0.79688 0.78706 0.70896 1.0000 + Br Br462 1.0 0.79688 0.84956 0.70896 1.0000 + Br Br463 1.0 0.79688 0.91206 0.70896 1.0000 + Br Br464 1.0 0.79688 0.97456 0.70896 1.0000 + Br Br465 1.0 0.85938 0.03706 0.70896 1.0000 + Br Br466 1.0 0.85938 0.09956 0.70896 1.0000 + Br Br467 1.0 0.85938 0.16206 0.70896 1.0000 + Br Br468 1.0 0.85938 0.22456 0.70896 1.0000 + Br Br469 1.0 0.85938 0.28706 0.70896 1.0000 + Br Br470 1.0 0.85938 0.34956 0.70896 1.0000 + Br Br471 1.0 0.85938 0.41206 0.70896 1.0000 + Br Br472 1.0 0.85938 0.47456 0.70896 1.0000 + Br Br473 1.0 0.85938 0.53706 0.70896 1.0000 + Br Br474 1.0 0.85938 0.59956 0.70896 1.0000 + Br Br475 1.0 0.85938 0.66206 0.70896 1.0000 + Br Br476 1.0 0.85938 0.72456 0.70896 1.0000 + Br Br477 1.0 0.85938 0.78706 0.70896 1.0000 + Br Br478 1.0 0.85938 0.84956 0.70896 1.0000 + Br Br479 1.0 0.85938 0.91206 0.70896 1.0000 + Br Br480 1.0 0.85938 0.97456 0.70896 1.0000 + Br Br481 1.0 0.92187 0.03706 0.70896 1.0000 + Br Br482 1.0 0.92187 0.09956 0.70896 1.0000 + Br Br483 1.0 0.92187 0.16206 0.70896 1.0000 + Br Br484 1.0 0.92187 0.22456 0.70896 1.0000 + Br Br485 1.0 0.92187 0.28706 0.70896 1.0000 + Br Br486 1.0 0.92187 0.34956 0.70896 1.0000 + Br Br487 1.0 0.92187 0.41206 0.70896 1.0000 + Br Br488 1.0 0.92187 0.47456 0.70896 1.0000 + Br Br489 1.0 0.92187 0.53706 0.70896 1.0000 + Br Br490 1.0 0.92187 0.59956 0.70896 1.0000 + Br Br491 1.0 0.92187 0.66206 0.70896 1.0000 + Br Br492 1.0 0.92187 0.72456 0.70896 1.0000 + Br Br493 1.0 0.92187 0.78706 0.70896 1.0000 + Br Br494 1.0 0.92187 0.84956 0.70896 1.0000 + Br Br495 1.0 0.92187 0.91206 0.70896 1.0000 + Br Br496 1.0 0.92187 0.97456 0.70896 1.0000 + Br Br497 1.0 0.98438 0.03706 0.70896 1.0000 + Br Br498 1.0 0.98438 0.09956 0.70896 1.0000 + Br Br499 1.0 0.98438 0.16206 0.70896 1.0000 + Br Br500 1.0 0.98438 0.22456 0.70896 1.0000 + Br Br501 1.0 0.98438 0.28706 0.70896 1.0000 + Br Br502 1.0 0.98438 0.34956 0.70896 1.0000 + Br Br503 1.0 0.98438 0.41206 0.70896 1.0000 + Br Br504 1.0 0.98438 0.47456 0.70896 1.0000 + Br Br505 1.0 0.98438 0.53706 0.70896 1.0000 + Br Br506 1.0 0.98438 0.59956 0.70896 1.0000 + Br Br507 1.0 0.98438 0.66206 0.70896 1.0000 + Br Br508 1.0 0.98438 0.72456 0.70896 1.0000 + Br Br509 1.0 0.98438 0.78706 0.70896 1.0000 + Br Br510 1.0 0.98438 0.84956 0.70896 1.0000 + Br Br511 1.0 0.98438 0.91206 0.70896 1.0000 + Br Br512 1.0 0.98438 0.97456 0.70896 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-3357_supercell_16x16x1.cif b/tier3/cif_file/orthogonal_2dm-3357_supercell_16x16x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..902f6d76f17d115a11adaf9896e030bd2f5157df --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-3357_supercell_16x16x1.cif @@ -0,0 +1,3609 @@ +data_image0 +_chemical_formula_structural Hg512Ge256O1024Hg512Ge256O1024 +_chemical_formula_sum "Hg1024 Ge512 O2048" +_cell_length_a 180.448 +_cell_length_b 104.313 +_cell_length_c 6.27286 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Hg Hg1 1.0 0.01562 0.01562 0.64950 1.0000 + Hg Hg2 1.0 0.98438 0.04687 0.64950 1.0000 + Hg Hg3 1.0 0.95312 0.07812 0.64950 1.0000 + Hg Hg4 1.0 0.92187 0.10937 0.64950 1.0000 + Hg Hg5 1.0 0.89062 0.14062 0.64950 1.0000 + Hg Hg6 1.0 0.85938 0.17188 0.64950 1.0000 + Hg Hg7 1.0 0.82813 0.20313 0.64950 1.0000 + Hg Hg8 1.0 0.79688 0.23438 0.64950 1.0000 + Hg Hg9 1.0 0.76563 0.26563 0.64950 1.0000 + Hg Hg10 1.0 0.73438 0.29688 0.64950 1.0000 + Hg Hg11 1.0 0.70313 0.32812 0.64950 1.0000 + Hg Hg12 1.0 0.67188 0.35938 0.64950 1.0000 + Hg Hg13 1.0 0.64063 0.39062 0.64950 1.0000 + Hg Hg14 1.0 0.60938 0.42187 0.64950 1.0000 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1.0 0.95312 0.20312 0.64950 1.0000 + Hg Hg38 1.0 0.92187 0.23438 0.64950 1.0000 + Hg Hg39 1.0 0.89062 0.26562 0.64950 1.0000 + Hg Hg40 1.0 0.85938 0.29687 0.64950 1.0000 + Hg Hg41 1.0 0.82813 0.32813 0.64950 1.0000 + Hg Hg42 1.0 0.79688 0.35938 0.64950 1.0000 + Hg Hg43 1.0 0.76562 0.39063 0.64950 1.0000 + Hg Hg44 1.0 0.73438 0.42188 0.64950 1.0000 + Hg Hg45 1.0 0.70313 0.45312 0.64950 1.0000 + Hg Hg46 1.0 0.67188 0.48437 0.64950 1.0000 + Hg Hg47 1.0 0.64063 0.51562 0.64950 1.0000 + Hg Hg48 1.0 0.60938 0.54688 0.64950 1.0000 + Hg Hg49 1.0 0.10937 0.10938 0.64950 1.0000 + Hg Hg50 1.0 0.07812 0.14062 0.64950 1.0000 + Hg Hg51 1.0 0.04687 0.17188 0.64950 1.0000 + Hg Hg52 1.0 0.01562 0.20312 0.64950 1.0000 + Hg Hg53 1.0 0.98438 0.23437 0.64950 1.0000 + Hg Hg54 1.0 0.95312 0.26562 0.64950 1.0000 + Hg Hg55 1.0 0.92187 0.29687 0.64950 1.0000 + Hg Hg56 1.0 0.89062 0.32813 0.64950 1.0000 + Hg Hg57 1.0 0.85938 0.35938 0.64950 1.0000 + Hg Hg58 1.0 0.82813 0.39063 0.64950 1.0000 + Hg Hg59 1.0 0.79688 0.42188 0.64950 1.0000 + Hg Hg60 1.0 0.76562 0.45312 0.64950 1.0000 + Hg Hg61 1.0 0.73438 0.48437 0.64950 1.0000 + Hg Hg62 1.0 0.70312 0.51562 0.64950 1.0000 + Hg Hg63 1.0 0.67188 0.54688 0.64950 1.0000 + Hg Hg64 1.0 0.64062 0.57812 0.64950 1.0000 + Hg Hg65 1.0 0.14062 0.14063 0.64950 1.0000 + Hg Hg66 1.0 0.10938 0.17188 0.64950 1.0000 + Hg Hg67 1.0 0.07813 0.20312 0.64950 1.0000 + Hg Hg68 1.0 0.04688 0.23438 0.64950 1.0000 + Hg Hg69 1.0 0.01563 0.26563 0.64950 1.0000 + Hg Hg70 1.0 0.98438 0.29688 0.64950 1.0000 + Hg Hg71 1.0 0.95312 0.32813 0.64950 1.0000 + Hg Hg72 1.0 0.92187 0.35937 0.64950 1.0000 + Hg Hg73 1.0 0.89062 0.39062 0.64950 1.0000 + Hg Hg74 1.0 0.85938 0.42188 0.64950 1.0000 + Hg Hg75 1.0 0.82813 0.45313 0.64950 1.0000 + Hg Hg76 1.0 0.79688 0.48438 0.64950 1.0000 + Hg Hg77 1.0 0.76562 0.51562 0.64950 1.0000 + Hg Hg78 1.0 0.73438 0.54688 0.64950 1.0000 + Hg Hg79 1.0 0.70313 0.57812 0.64950 1.0000 + Hg Hg80 1.0 0.67188 0.60938 0.64950 1.0000 + Hg Hg81 1.0 0.17187 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0.82338 0.76088 0.34928 1.0000 + O O990 1.0 0.82338 0.82338 0.34928 1.0000 + O O991 1.0 0.82338 0.88588 0.34928 1.0000 + O O992 1.0 0.82338 0.94838 0.34928 1.0000 + O O993 1.0 0.88588 0.01088 0.34928 1.0000 + O O994 1.0 0.88588 0.07338 0.34928 1.0000 + O O995 1.0 0.88588 0.13588 0.34928 1.0000 + O O996 1.0 0.88588 0.19838 0.34928 1.0000 + O O997 1.0 0.88588 0.26088 0.34928 1.0000 + O O998 1.0 0.88588 0.32338 0.34928 1.0000 + O O999 1.0 0.88588 0.38588 0.34928 1.0000 + O O1000 1.0 0.88588 0.44838 0.34928 1.0000 + O O1001 1.0 0.88588 0.51088 0.34928 1.0000 + O O1002 1.0 0.88588 0.57338 0.34928 1.0000 + O O1003 1.0 0.88588 0.63588 0.34928 1.0000 + O O1004 1.0 0.88588 0.69838 0.34928 1.0000 + O O1005 1.0 0.88588 0.76088 0.34928 1.0000 + O O1006 1.0 0.88588 0.82338 0.34928 1.0000 + O O1007 1.0 0.88588 0.88588 0.34928 1.0000 + O O1008 1.0 0.88588 0.94838 0.34928 1.0000 + O O1009 1.0 0.94838 0.01088 0.34928 1.0000 + O O1010 1.0 0.94838 0.07338 0.34928 1.0000 + O O1011 1.0 0.94838 0.13588 0.34928 1.0000 + O O1012 1.0 0.94838 0.19838 0.34928 1.0000 + O O1013 1.0 0.94838 0.26088 0.34928 1.0000 + O O1014 1.0 0.94838 0.32338 0.34928 1.0000 + O O1015 1.0 0.94838 0.38588 0.34928 1.0000 + O O1016 1.0 0.94838 0.44838 0.34928 1.0000 + O O1017 1.0 0.94838 0.51088 0.34928 1.0000 + O O1018 1.0 0.94838 0.57338 0.34928 1.0000 + O O1019 1.0 0.94838 0.63588 0.34928 1.0000 + O O1020 1.0 0.94838 0.69838 0.34928 1.0000 + O O1021 1.0 0.94838 0.76088 0.34928 1.0000 + O O1022 1.0 0.94838 0.82338 0.34928 1.0000 + O O1023 1.0 0.94838 0.88588 0.34928 1.0000 + O O1024 1.0 0.94838 0.94838 0.34928 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-3467_supercell_16x16x1.cif b/tier3/cif_file/orthogonal_2dm-3467_supercell_16x16x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..542f60273da87f308b6a26b6089d903ad926e698 --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-3467_supercell_16x16x1.cif @@ -0,0 +1,1561 @@ +data_image0 +_chemical_formula_structural Te512Rh512Cl512 +_chemical_formula_sum "Te512 Rh512 Cl512" +_cell_length_a 59.161 +_cell_length_b 106.463 +_cell_length_c 6.77212 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Te Te1 1.0 0.04688 0.02648 0.29795 1.0000 + Te Te2 1.0 0.04688 0.08898 0.29795 1.0000 + Te Te3 1.0 0.04688 0.15148 0.29795 1.0000 + Te Te4 1.0 0.04688 0.21398 0.29795 1.0000 + Te Te5 1.0 0.04688 0.27648 0.29795 1.0000 + Te Te6 1.0 0.04688 0.33898 0.29795 1.0000 + Te Te7 1.0 0.04688 0.40148 0.29795 1.0000 + Te Te8 1.0 0.04688 0.46398 0.29795 1.0000 + Te Te9 1.0 0.04688 0.52648 0.29795 1.0000 + Te Te10 1.0 0.04688 0.58898 0.29795 1.0000 + Te Te11 1.0 0.04688 0.65148 0.29795 1.0000 + Te Te12 1.0 0.04688 0.71398 0.29795 1.0000 + Te Te13 1.0 0.04688 0.77648 0.29795 1.0000 + Te Te14 1.0 0.04688 0.83898 0.29795 1.0000 + Te Te15 1.0 0.04688 0.90148 0.29795 1.0000 + Te Te16 1.0 0.04688 0.96398 0.29795 1.0000 + Te Te17 1.0 0.10938 0.02648 0.29795 1.0000 + Te Te18 1.0 0.10938 0.08898 0.29795 1.0000 + Te Te19 1.0 0.10938 0.15148 0.29795 1.0000 + Te Te20 1.0 0.10938 0.21398 0.29795 1.0000 + Te Te21 1.0 0.10938 0.27648 0.29795 1.0000 + Te Te22 1.0 0.10938 0.33898 0.29795 1.0000 + Te Te23 1.0 0.10938 0.40148 0.29795 1.0000 + Te Te24 1.0 0.10938 0.46398 0.29795 1.0000 + Te Te25 1.0 0.10938 0.52648 0.29795 1.0000 + Te Te26 1.0 0.10938 0.58898 0.29795 1.0000 + Te Te27 1.0 0.10938 0.65148 0.29795 1.0000 + Te Te28 1.0 0.10938 0.71398 0.29795 1.0000 + Te Te29 1.0 0.10938 0.77648 0.29795 1.0000 + Te Te30 1.0 0.10938 0.83898 0.29795 1.0000 + Te Te31 1.0 0.10938 0.90148 0.29795 1.0000 + Te Te32 1.0 0.10938 0.96398 0.29795 1.0000 + Te Te33 1.0 0.17188 0.02648 0.29795 1.0000 + Te Te34 1.0 0.17188 0.08898 0.29795 1.0000 + Te Te35 1.0 0.17188 0.15148 0.29795 1.0000 + Te Te36 1.0 0.17188 0.21398 0.29795 1.0000 + Te Te37 1.0 0.17188 0.27648 0.29795 1.0000 + Te Te38 1.0 0.17188 0.33898 0.29795 1.0000 + Te Te39 1.0 0.17188 0.40148 0.29795 1.0000 + Te Te40 1.0 0.17188 0.46398 0.29795 1.0000 + Te Te41 1.0 0.17188 0.52648 0.29795 1.0000 + Te Te42 1.0 0.17188 0.58898 0.29795 1.0000 + Te Te43 1.0 0.17188 0.65148 0.29795 1.0000 + Te Te44 1.0 0.17188 0.71398 0.29795 1.0000 + Te Te45 1.0 0.17188 0.77648 0.29795 1.0000 + Te Te46 1.0 0.17188 0.83898 0.29795 1.0000 + Te Te47 1.0 0.17188 0.90148 0.29795 1.0000 + Te Te48 1.0 0.17188 0.96398 0.29795 1.0000 + Te Te49 1.0 0.23438 0.02648 0.29795 1.0000 + Te Te50 1.0 0.23438 0.08898 0.29795 1.0000 + Te Te51 1.0 0.23438 0.15148 0.29795 1.0000 + Te Te52 1.0 0.23438 0.21398 0.29795 1.0000 + Te Te53 1.0 0.23438 0.27648 0.29795 1.0000 + Te Te54 1.0 0.23438 0.33898 0.29795 1.0000 + Te Te55 1.0 0.23438 0.40148 0.29795 1.0000 + Te Te56 1.0 0.23438 0.46398 0.29795 1.0000 + Te Te57 1.0 0.23438 0.52648 0.29795 1.0000 + Te Te58 1.0 0.23438 0.58898 0.29795 1.0000 + Te Te59 1.0 0.23438 0.65148 0.29795 1.0000 + Te Te60 1.0 0.23438 0.71398 0.29795 1.0000 + Te Te61 1.0 0.23438 0.77648 0.29795 1.0000 + Te Te62 1.0 0.23438 0.83898 0.29795 1.0000 + Te Te63 1.0 0.23438 0.90148 0.29795 1.0000 + Te Te64 1.0 0.23438 0.96398 0.29795 1.0000 + Te Te65 1.0 0.29688 0.02648 0.29795 1.0000 + Te Te66 1.0 0.29688 0.08898 0.29795 1.0000 + Te Te67 1.0 0.29688 0.15148 0.29795 1.0000 + Te Te68 1.0 0.29688 0.21398 0.29795 1.0000 + Te Te69 1.0 0.29688 0.27648 0.29795 1.0000 + Te Te70 1.0 0.29688 0.33898 0.29795 1.0000 + Te Te71 1.0 0.29688 0.40148 0.29795 1.0000 + Te Te72 1.0 0.29688 0.46398 0.29795 1.0000 + Te Te73 1.0 0.29688 0.52648 0.29795 1.0000 + Te Te74 1.0 0.29688 0.58898 0.29795 1.0000 + Te Te75 1.0 0.29688 0.65148 0.29795 1.0000 + Te Te76 1.0 0.29688 0.71398 0.29795 1.0000 + Te Te77 1.0 0.29688 0.77648 0.29795 1.0000 + Te Te78 1.0 0.29688 0.83898 0.29795 1.0000 + Te Te79 1.0 0.29688 0.90148 0.29795 1.0000 + Te Te80 1.0 0.29688 0.96398 0.29795 1.0000 + Te Te81 1.0 0.35938 0.02648 0.29795 1.0000 + Te Te82 1.0 0.35938 0.08898 0.29795 1.0000 + Te Te83 1.0 0.35938 0.15148 0.29795 1.0000 + Te Te84 1.0 0.35938 0.21398 0.29795 1.0000 + Te Te85 1.0 0.35938 0.27648 0.29795 1.0000 + Te Te86 1.0 0.35938 0.33898 0.29795 1.0000 + Te Te87 1.0 0.35938 0.40148 0.29795 1.0000 + Te Te88 1.0 0.35938 0.46398 0.29795 1.0000 + Te Te89 1.0 0.35938 0.52648 0.29795 1.0000 + Te Te90 1.0 0.35938 0.58898 0.29795 1.0000 + Te Te91 1.0 0.35938 0.65148 0.29795 1.0000 + Te Te92 1.0 0.35938 0.71398 0.29795 1.0000 + Te Te93 1.0 0.35938 0.77648 0.29795 1.0000 + Te Te94 1.0 0.35938 0.83898 0.29795 1.0000 + Te Te95 1.0 0.35938 0.90148 0.29795 1.0000 + Te Te96 1.0 0.35938 0.96398 0.29795 1.0000 + Te Te97 1.0 0.42188 0.02648 0.29795 1.0000 + Te Te98 1.0 0.42188 0.08898 0.29795 1.0000 + Te Te99 1.0 0.42188 0.15148 0.29795 1.0000 + Te Te100 1.0 0.42188 0.21398 0.29795 1.0000 + Te Te101 1.0 0.42188 0.27648 0.29795 1.0000 + Te Te102 1.0 0.42188 0.33898 0.29795 1.0000 + Te Te103 1.0 0.42188 0.40148 0.29795 1.0000 + Te Te104 1.0 0.42188 0.46398 0.29795 1.0000 + Te Te105 1.0 0.42188 0.52648 0.29795 1.0000 + Te Te106 1.0 0.42188 0.58898 0.29795 1.0000 + Te Te107 1.0 0.42188 0.65148 0.29795 1.0000 + Te Te108 1.0 0.42188 0.71398 0.29795 1.0000 + Te Te109 1.0 0.42188 0.77648 0.29795 1.0000 + Te Te110 1.0 0.42188 0.83898 0.29795 1.0000 + Te Te111 1.0 0.42188 0.90148 0.29795 1.0000 + Te Te112 1.0 0.42188 0.96398 0.29795 1.0000 + Te Te113 1.0 0.48438 0.02648 0.29795 1.0000 + Te Te114 1.0 0.48438 0.08898 0.29795 1.0000 + Te Te115 1.0 0.48438 0.15148 0.29795 1.0000 + Te Te116 1.0 0.48438 0.21398 0.29795 1.0000 + Te Te117 1.0 0.48438 0.27648 0.29795 1.0000 + Te Te118 1.0 0.48438 0.33898 0.29795 1.0000 + Te Te119 1.0 0.48438 0.40148 0.29795 1.0000 + Te Te120 1.0 0.48438 0.46398 0.29795 1.0000 + Te Te121 1.0 0.48438 0.52648 0.29795 1.0000 + Te Te122 1.0 0.48438 0.58898 0.29795 1.0000 + Te Te123 1.0 0.48438 0.65148 0.29795 1.0000 + Te Te124 1.0 0.48438 0.71398 0.29795 1.0000 + Te Te125 1.0 0.48438 0.77648 0.29795 1.0000 + Te Te126 1.0 0.48438 0.83898 0.29795 1.0000 + Te Te127 1.0 0.48438 0.90148 0.29795 1.0000 + Te Te128 1.0 0.48438 0.96398 0.29795 1.0000 + Te Te129 1.0 0.54688 0.02648 0.29795 1.0000 + Te Te130 1.0 0.54688 0.08898 0.29795 1.0000 + Te Te131 1.0 0.54688 0.15148 0.29795 1.0000 + Te Te132 1.0 0.54688 0.21398 0.29795 1.0000 + Te Te133 1.0 0.54688 0.27648 0.29795 1.0000 + Te Te134 1.0 0.54688 0.33898 0.29795 1.0000 + Te Te135 1.0 0.54688 0.40148 0.29795 1.0000 + Te Te136 1.0 0.54688 0.46398 0.29795 1.0000 + Te Te137 1.0 0.54688 0.52648 0.29795 1.0000 + Te Te138 1.0 0.54688 0.58898 0.29795 1.0000 + Te Te139 1.0 0.54688 0.65148 0.29795 1.0000 + Te Te140 1.0 0.54688 0.71398 0.29795 1.0000 + Te Te141 1.0 0.54688 0.77648 0.29795 1.0000 + Te Te142 1.0 0.54688 0.83898 0.29795 1.0000 + Te Te143 1.0 0.54688 0.90148 0.29795 1.0000 + Te Te144 1.0 0.54688 0.96398 0.29795 1.0000 + Te Te145 1.0 0.60938 0.02648 0.29795 1.0000 + Te Te146 1.0 0.60938 0.08898 0.29795 1.0000 + Te Te147 1.0 0.60938 0.15148 0.29795 1.0000 + Te Te148 1.0 0.60938 0.21398 0.29795 1.0000 + Te Te149 1.0 0.60938 0.27648 0.29795 1.0000 + Te Te150 1.0 0.60938 0.33898 0.29795 1.0000 + Te Te151 1.0 0.60938 0.40148 0.29795 1.0000 + Te Te152 1.0 0.60938 0.46398 0.29795 1.0000 + Te Te153 1.0 0.60938 0.52648 0.29795 1.0000 + Te Te154 1.0 0.60938 0.58898 0.29795 1.0000 + Te Te155 1.0 0.60938 0.65148 0.29795 1.0000 + Te Te156 1.0 0.60938 0.71398 0.29795 1.0000 + Te Te157 1.0 0.60938 0.77648 0.29795 1.0000 + Te Te158 1.0 0.60938 0.83898 0.29795 1.0000 + Te Te159 1.0 0.60938 0.90148 0.29795 1.0000 + Te Te160 1.0 0.60938 0.96398 0.29795 1.0000 + Te Te161 1.0 0.67188 0.02648 0.29795 1.0000 + Te Te162 1.0 0.67188 0.08898 0.29795 1.0000 + Te Te163 1.0 0.67188 0.15148 0.29795 1.0000 + Te Te164 1.0 0.67188 0.21398 0.29795 1.0000 + Te Te165 1.0 0.67188 0.27648 0.29795 1.0000 + Te Te166 1.0 0.67188 0.33898 0.29795 1.0000 + Te Te167 1.0 0.67188 0.40148 0.29795 1.0000 + Te Te168 1.0 0.67188 0.46398 0.29795 1.0000 + Te Te169 1.0 0.67188 0.52648 0.29795 1.0000 + Te Te170 1.0 0.67188 0.58898 0.29795 1.0000 + Te Te171 1.0 0.67188 0.65148 0.29795 1.0000 + Te Te172 1.0 0.67188 0.71398 0.29795 1.0000 + Te Te173 1.0 0.67188 0.77648 0.29795 1.0000 + Te Te174 1.0 0.67188 0.83898 0.29795 1.0000 + Te Te175 1.0 0.67188 0.90148 0.29795 1.0000 + Te Te176 1.0 0.67188 0.96398 0.29795 1.0000 + Te Te177 1.0 0.73438 0.02648 0.29795 1.0000 + Te Te178 1.0 0.73438 0.08898 0.29795 1.0000 + Te Te179 1.0 0.73438 0.15148 0.29795 1.0000 + Te Te180 1.0 0.73438 0.21398 0.29795 1.0000 + Te Te181 1.0 0.73438 0.27648 0.29795 1.0000 + Te Te182 1.0 0.73438 0.33898 0.29795 1.0000 + Te Te183 1.0 0.73438 0.40148 0.29795 1.0000 + Te Te184 1.0 0.73438 0.46398 0.29795 1.0000 + Te Te185 1.0 0.73438 0.52648 0.29795 1.0000 + Te Te186 1.0 0.73438 0.58898 0.29795 1.0000 + Te Te187 1.0 0.73438 0.65148 0.29795 1.0000 + Te Te188 1.0 0.73438 0.71398 0.29795 1.0000 + Te Te189 1.0 0.73438 0.77648 0.29795 1.0000 + Te Te190 1.0 0.73438 0.83898 0.29795 1.0000 + Te Te191 1.0 0.73438 0.90148 0.29795 1.0000 + Te Te192 1.0 0.73438 0.96398 0.29795 1.0000 + Te Te193 1.0 0.79688 0.02648 0.29795 1.0000 + Te Te194 1.0 0.79688 0.08898 0.29795 1.0000 + Te Te195 1.0 0.79688 0.15148 0.29795 1.0000 + Te Te196 1.0 0.79688 0.21398 0.29795 1.0000 + Te Te197 1.0 0.79688 0.27648 0.29795 1.0000 + Te Te198 1.0 0.79688 0.33898 0.29795 1.0000 + Te Te199 1.0 0.79688 0.40148 0.29795 1.0000 + Te Te200 1.0 0.79688 0.46398 0.29795 1.0000 + Te Te201 1.0 0.79688 0.52648 0.29795 1.0000 + Te Te202 1.0 0.79688 0.58898 0.29795 1.0000 + Te Te203 1.0 0.79688 0.65148 0.29795 1.0000 + Te Te204 1.0 0.79688 0.71398 0.29795 1.0000 + Te Te205 1.0 0.79688 0.77648 0.29795 1.0000 + Te Te206 1.0 0.79688 0.83898 0.29795 1.0000 + Te Te207 1.0 0.79688 0.90148 0.29795 1.0000 + Te Te208 1.0 0.79688 0.96398 0.29795 1.0000 + Te Te209 1.0 0.85938 0.02648 0.29795 1.0000 + Te Te210 1.0 0.85938 0.08898 0.29795 1.0000 + Te Te211 1.0 0.85938 0.15148 0.29795 1.0000 + Te Te212 1.0 0.85938 0.21398 0.29795 1.0000 + Te Te213 1.0 0.85938 0.27648 0.29795 1.0000 + Te Te214 1.0 0.85938 0.33898 0.29795 1.0000 + Te Te215 1.0 0.85938 0.40148 0.29795 1.0000 + Te Te216 1.0 0.85938 0.46398 0.29795 1.0000 + Te Te217 1.0 0.85938 0.52648 0.29795 1.0000 + Te Te218 1.0 0.85938 0.58898 0.29795 1.0000 + Te Te219 1.0 0.85938 0.65148 0.29795 1.0000 + Te Te220 1.0 0.85938 0.71398 0.29795 1.0000 + Te Te221 1.0 0.85938 0.77648 0.29795 1.0000 + Te Te222 1.0 0.85938 0.83898 0.29795 1.0000 + Te Te223 1.0 0.85938 0.90148 0.29795 1.0000 + Te Te224 1.0 0.85938 0.96398 0.29795 1.0000 + Te Te225 1.0 0.92188 0.02648 0.29795 1.0000 + Te Te226 1.0 0.92188 0.08898 0.29795 1.0000 + Te Te227 1.0 0.92188 0.15148 0.29795 1.0000 + Te Te228 1.0 0.92188 0.21398 0.29795 1.0000 + Te Te229 1.0 0.92188 0.27648 0.29795 1.0000 + Te Te230 1.0 0.92188 0.33898 0.29795 1.0000 + Te Te231 1.0 0.92188 0.40148 0.29795 1.0000 + Te Te232 1.0 0.92188 0.46398 0.29795 1.0000 + Te Te233 1.0 0.92188 0.52648 0.29795 1.0000 + Te Te234 1.0 0.92188 0.58898 0.29795 1.0000 + Te Te235 1.0 0.92188 0.65148 0.29795 1.0000 + Te Te236 1.0 0.92188 0.71398 0.29795 1.0000 + Te Te237 1.0 0.92188 0.77648 0.29795 1.0000 + Te Te238 1.0 0.92188 0.83898 0.29795 1.0000 + Te Te239 1.0 0.92188 0.90148 0.29795 1.0000 + Te Te240 1.0 0.92188 0.96398 0.29795 1.0000 + Te Te241 1.0 0.98438 0.02648 0.29795 1.0000 + Te Te242 1.0 0.98438 0.08898 0.29795 1.0000 + Te Te243 1.0 0.98438 0.15148 0.29795 1.0000 + Te Te244 1.0 0.98438 0.21398 0.29795 1.0000 + Te Te245 1.0 0.98438 0.27648 0.29795 1.0000 + Te Te246 1.0 0.98438 0.33898 0.29795 1.0000 + Te Te247 1.0 0.98438 0.40148 0.29795 1.0000 + Te Te248 1.0 0.98438 0.46398 0.29795 1.0000 + Te Te249 1.0 0.98438 0.52648 0.29795 1.0000 + Te Te250 1.0 0.98438 0.58898 0.29795 1.0000 + Te Te251 1.0 0.98438 0.65148 0.29795 1.0000 + Te Te252 1.0 0.98438 0.71398 0.29795 1.0000 + Te Te253 1.0 0.98438 0.77648 0.29795 1.0000 + Te Te254 1.0 0.98438 0.83898 0.29795 1.0000 + Te Te255 1.0 0.98438 0.90148 0.29795 1.0000 + Te Te256 1.0 0.98438 0.96398 0.29795 1.0000 + Te Te257 1.0 0.01562 0.03602 0.70205 1.0000 + Te Te258 1.0 0.01562 0.09852 0.70205 1.0000 + Te Te259 1.0 0.01562 0.16102 0.70205 1.0000 + Te Te260 1.0 0.01562 0.22352 0.70205 1.0000 + Te Te261 1.0 0.01562 0.28602 0.70205 1.0000 + Te Te262 1.0 0.01562 0.34852 0.70205 1.0000 + Te Te263 1.0 0.01562 0.41102 0.70205 1.0000 + Te Te264 1.0 0.01562 0.47352 0.70205 1.0000 + Te Te265 1.0 0.01562 0.53602 0.70205 1.0000 + Te Te266 1.0 0.01562 0.59852 0.70205 1.0000 + Te Te267 1.0 0.01562 0.66102 0.70205 1.0000 + Te Te268 1.0 0.01562 0.72352 0.70205 1.0000 + Te Te269 1.0 0.01562 0.78602 0.70205 1.0000 + Te Te270 1.0 0.01562 0.84852 0.70205 1.0000 + Te Te271 1.0 0.01562 0.91102 0.70205 1.0000 + Te Te272 1.0 0.01562 0.97352 0.70205 1.0000 + Te Te273 1.0 0.07813 0.03602 0.70205 1.0000 + Te Te274 1.0 0.07813 0.09852 0.70205 1.0000 + Te Te275 1.0 0.07813 0.16102 0.70205 1.0000 + Te Te276 1.0 0.07813 0.22352 0.70205 1.0000 + Te Te277 1.0 0.07813 0.28602 0.70205 1.0000 + Te Te278 1.0 0.07813 0.34852 0.70205 1.0000 + Te Te279 1.0 0.07813 0.41102 0.70205 1.0000 + Te Te280 1.0 0.07813 0.47352 0.70205 1.0000 + Te Te281 1.0 0.07813 0.53602 0.70205 1.0000 + Te Te282 1.0 0.07813 0.59852 0.70205 1.0000 + Te Te283 1.0 0.07813 0.66102 0.70205 1.0000 + Te Te284 1.0 0.07813 0.72352 0.70205 1.0000 + Te Te285 1.0 0.07813 0.78602 0.70205 1.0000 + Te Te286 1.0 0.07813 0.84852 0.70205 1.0000 + Te Te287 1.0 0.07813 0.91102 0.70205 1.0000 + Te Te288 1.0 0.07813 0.97352 0.70205 1.0000 + Te Te289 1.0 0.14062 0.03602 0.70205 1.0000 + Te Te290 1.0 0.14062 0.09852 0.70205 1.0000 + Te Te291 1.0 0.14062 0.16102 0.70205 1.0000 + Te Te292 1.0 0.14062 0.22352 0.70205 1.0000 + Te Te293 1.0 0.14062 0.28602 0.70205 1.0000 + Te Te294 1.0 0.14062 0.34852 0.70205 1.0000 + Te Te295 1.0 0.14062 0.41102 0.70205 1.0000 + Te Te296 1.0 0.14062 0.47352 0.70205 1.0000 + Te Te297 1.0 0.14062 0.53602 0.70205 1.0000 + Te Te298 1.0 0.14062 0.59852 0.70205 1.0000 + Te Te299 1.0 0.14062 0.66102 0.70205 1.0000 + Te Te300 1.0 0.14062 0.72352 0.70205 1.0000 + Te Te301 1.0 0.14062 0.78602 0.70205 1.0000 + Te Te302 1.0 0.14062 0.84852 0.70205 1.0000 + Te Te303 1.0 0.14062 0.91102 0.70205 1.0000 + Te Te304 1.0 0.14062 0.97352 0.70205 1.0000 + Te Te305 1.0 0.20312 0.03602 0.70205 1.0000 + Te Te306 1.0 0.20312 0.09852 0.70205 1.0000 + Te Te307 1.0 0.20312 0.16102 0.70205 1.0000 + Te Te308 1.0 0.20312 0.22352 0.70205 1.0000 + Te Te309 1.0 0.20312 0.28602 0.70205 1.0000 + Te Te310 1.0 0.20312 0.34852 0.70205 1.0000 + Te Te311 1.0 0.20312 0.41102 0.70205 1.0000 + Te Te312 1.0 0.20312 0.47352 0.70205 1.0000 + Te Te313 1.0 0.20312 0.53602 0.70205 1.0000 + Te Te314 1.0 0.20312 0.59852 0.70205 1.0000 + Te Te315 1.0 0.20312 0.66102 0.70205 1.0000 + Te Te316 1.0 0.20312 0.72352 0.70205 1.0000 + Te Te317 1.0 0.20312 0.78602 0.70205 1.0000 + Te Te318 1.0 0.20312 0.84852 0.70205 1.0000 + Te Te319 1.0 0.20312 0.91102 0.70205 1.0000 + Te Te320 1.0 0.20312 0.97352 0.70205 1.0000 + Te Te321 1.0 0.26563 0.03602 0.70205 1.0000 + Te Te322 1.0 0.26563 0.09852 0.70205 1.0000 + Te Te323 1.0 0.26563 0.16102 0.70205 1.0000 + Te Te324 1.0 0.26563 0.22352 0.70205 1.0000 + Te Te325 1.0 0.26563 0.28602 0.70205 1.0000 + Te Te326 1.0 0.26563 0.34852 0.70205 1.0000 + Te Te327 1.0 0.26563 0.41102 0.70205 1.0000 + Te Te328 1.0 0.26563 0.47352 0.70205 1.0000 + Te Te329 1.0 0.26563 0.53602 0.70205 1.0000 + Te Te330 1.0 0.26563 0.59852 0.70205 1.0000 + Te Te331 1.0 0.26563 0.66102 0.70205 1.0000 + Te Te332 1.0 0.26563 0.72352 0.70205 1.0000 + Te Te333 1.0 0.26563 0.78602 0.70205 1.0000 + Te Te334 1.0 0.26563 0.84852 0.70205 1.0000 + Te Te335 1.0 0.26563 0.91102 0.70205 1.0000 + Te Te336 1.0 0.26563 0.97352 0.70205 1.0000 + Te Te337 1.0 0.32813 0.03602 0.70205 1.0000 + Te Te338 1.0 0.32813 0.09852 0.70205 1.0000 + Te Te339 1.0 0.32813 0.16102 0.70205 1.0000 + Te Te340 1.0 0.32813 0.22352 0.70205 1.0000 + Te Te341 1.0 0.32813 0.28602 0.70205 1.0000 + Te Te342 1.0 0.32813 0.34852 0.70205 1.0000 + Te Te343 1.0 0.32813 0.41102 0.70205 1.0000 + Te Te344 1.0 0.32813 0.47352 0.70205 1.0000 + Te Te345 1.0 0.32813 0.53602 0.70205 1.0000 + Te Te346 1.0 0.32813 0.59852 0.70205 1.0000 + Te Te347 1.0 0.32813 0.66102 0.70205 1.0000 + Te Te348 1.0 0.32813 0.72352 0.70205 1.0000 + Te Te349 1.0 0.32813 0.78602 0.70205 1.0000 + Te Te350 1.0 0.32813 0.84852 0.70205 1.0000 + Te Te351 1.0 0.32813 0.91102 0.70205 1.0000 + Te Te352 1.0 0.32813 0.97352 0.70205 1.0000 + Te Te353 1.0 0.39063 0.03602 0.70205 1.0000 + Te Te354 1.0 0.39063 0.09852 0.70205 1.0000 + Te Te355 1.0 0.39063 0.16102 0.70205 1.0000 + Te Te356 1.0 0.39063 0.22352 0.70205 1.0000 + Te Te357 1.0 0.39063 0.28602 0.70205 1.0000 + Te Te358 1.0 0.39063 0.34852 0.70205 1.0000 + Te Te359 1.0 0.39063 0.41102 0.70205 1.0000 + Te Te360 1.0 0.39063 0.47352 0.70205 1.0000 + Te Te361 1.0 0.39063 0.53602 0.70205 1.0000 + Te Te362 1.0 0.39063 0.59852 0.70205 1.0000 + Te Te363 1.0 0.39063 0.66102 0.70205 1.0000 + Te Te364 1.0 0.39063 0.72352 0.70205 1.0000 + Te Te365 1.0 0.39063 0.78602 0.70205 1.0000 + Te Te366 1.0 0.39063 0.84852 0.70205 1.0000 + Te Te367 1.0 0.39063 0.91102 0.70205 1.0000 + Te Te368 1.0 0.39063 0.97352 0.70205 1.0000 + Te Te369 1.0 0.45313 0.03602 0.70205 1.0000 + Te Te370 1.0 0.45313 0.09852 0.70205 1.0000 + Te Te371 1.0 0.45313 0.16102 0.70205 1.0000 + Te Te372 1.0 0.45313 0.22352 0.70205 1.0000 + Te Te373 1.0 0.45313 0.28602 0.70205 1.0000 + Te Te374 1.0 0.45313 0.34852 0.70205 1.0000 + Te Te375 1.0 0.45313 0.41102 0.70205 1.0000 + Te Te376 1.0 0.45313 0.47352 0.70205 1.0000 + Te Te377 1.0 0.45313 0.53602 0.70205 1.0000 + Te Te378 1.0 0.45313 0.59852 0.70205 1.0000 + Te Te379 1.0 0.45313 0.66102 0.70205 1.0000 + Te Te380 1.0 0.45313 0.72352 0.70205 1.0000 + Te Te381 1.0 0.45313 0.78602 0.70205 1.0000 + Te Te382 1.0 0.45313 0.84852 0.70205 1.0000 + Te Te383 1.0 0.45313 0.91102 0.70205 1.0000 + Te Te384 1.0 0.45313 0.97352 0.70205 1.0000 + Te Te385 1.0 0.51562 0.03602 0.70205 1.0000 + Te Te386 1.0 0.51562 0.09852 0.70205 1.0000 + Te Te387 1.0 0.51562 0.16102 0.70205 1.0000 + Te Te388 1.0 0.51562 0.22352 0.70205 1.0000 + Te Te389 1.0 0.51562 0.28602 0.70205 1.0000 + Te Te390 1.0 0.51562 0.34852 0.70205 1.0000 + Te Te391 1.0 0.51562 0.41102 0.70205 1.0000 + Te Te392 1.0 0.51562 0.47352 0.70205 1.0000 + Te Te393 1.0 0.51562 0.53602 0.70205 1.0000 + Te Te394 1.0 0.51562 0.59852 0.70205 1.0000 + Te Te395 1.0 0.51562 0.66102 0.70205 1.0000 + Te Te396 1.0 0.51562 0.72352 0.70205 1.0000 + Te Te397 1.0 0.51562 0.78602 0.70205 1.0000 + Te Te398 1.0 0.51562 0.84852 0.70205 1.0000 + Te Te399 1.0 0.51562 0.91102 0.70205 1.0000 + Te Te400 1.0 0.51562 0.97352 0.70205 1.0000 + Te Te401 1.0 0.57813 0.03602 0.70205 1.0000 + Te Te402 1.0 0.57813 0.09852 0.70205 1.0000 + Te Te403 1.0 0.57813 0.16102 0.70205 1.0000 + Te Te404 1.0 0.57813 0.22352 0.70205 1.0000 + Te Te405 1.0 0.57813 0.28602 0.70205 1.0000 + Te Te406 1.0 0.57813 0.34852 0.70205 1.0000 + Te Te407 1.0 0.57813 0.41102 0.70205 1.0000 + Te Te408 1.0 0.57813 0.47352 0.70205 1.0000 + Te Te409 1.0 0.57813 0.53602 0.70205 1.0000 + Te Te410 1.0 0.57813 0.59852 0.70205 1.0000 + Te Te411 1.0 0.57813 0.66102 0.70205 1.0000 + Te Te412 1.0 0.57813 0.72352 0.70205 1.0000 + Te Te413 1.0 0.57813 0.78602 0.70205 1.0000 + Te Te414 1.0 0.57813 0.84852 0.70205 1.0000 + Te Te415 1.0 0.57813 0.91102 0.70205 1.0000 + Te Te416 1.0 0.57813 0.97352 0.70205 1.0000 + Te Te417 1.0 0.64062 0.03602 0.70205 1.0000 + Te Te418 1.0 0.64062 0.09852 0.70205 1.0000 + Te Te419 1.0 0.64062 0.16102 0.70205 1.0000 + Te Te420 1.0 0.64062 0.22352 0.70205 1.0000 + Te Te421 1.0 0.64062 0.28602 0.70205 1.0000 + Te Te422 1.0 0.64062 0.34852 0.70205 1.0000 + Te Te423 1.0 0.64062 0.41102 0.70205 1.0000 + Te Te424 1.0 0.64062 0.47352 0.70205 1.0000 + Te Te425 1.0 0.64062 0.53602 0.70205 1.0000 + Te Te426 1.0 0.64062 0.59852 0.70205 1.0000 + Te Te427 1.0 0.64062 0.66102 0.70205 1.0000 + Te Te428 1.0 0.64062 0.72352 0.70205 1.0000 + Te Te429 1.0 0.64062 0.78602 0.70205 1.0000 + Te Te430 1.0 0.64062 0.84852 0.70205 1.0000 + Te Te431 1.0 0.64062 0.91102 0.70205 1.0000 + Te Te432 1.0 0.64062 0.97352 0.70205 1.0000 + Te Te433 1.0 0.70313 0.03602 0.70205 1.0000 + Te Te434 1.0 0.70313 0.09852 0.70205 1.0000 + Te Te435 1.0 0.70313 0.16102 0.70205 1.0000 + Te Te436 1.0 0.70313 0.22352 0.70205 1.0000 + Te Te437 1.0 0.70313 0.28602 0.70205 1.0000 + Te Te438 1.0 0.70313 0.34852 0.70205 1.0000 + Te Te439 1.0 0.70313 0.41102 0.70205 1.0000 + Te Te440 1.0 0.70313 0.47352 0.70205 1.0000 + Te Te441 1.0 0.70313 0.53602 0.70205 1.0000 + Te Te442 1.0 0.70313 0.59852 0.70205 1.0000 + Te Te443 1.0 0.70313 0.66102 0.70205 1.0000 + Te Te444 1.0 0.70313 0.72352 0.70205 1.0000 + Te Te445 1.0 0.70313 0.78602 0.70205 1.0000 + Te Te446 1.0 0.70313 0.84852 0.70205 1.0000 + Te Te447 1.0 0.70313 0.91102 0.70205 1.0000 + Te Te448 1.0 0.70313 0.97352 0.70205 1.0000 + Te Te449 1.0 0.76562 0.03602 0.70205 1.0000 + Te Te450 1.0 0.76562 0.09852 0.70205 1.0000 + Te Te451 1.0 0.76562 0.16102 0.70205 1.0000 + Te Te452 1.0 0.76562 0.22352 0.70205 1.0000 + Te Te453 1.0 0.76562 0.28602 0.70205 1.0000 + Te Te454 1.0 0.76562 0.34852 0.70205 1.0000 + Te Te455 1.0 0.76562 0.41102 0.70205 1.0000 + Te Te456 1.0 0.76562 0.47352 0.70205 1.0000 + Te Te457 1.0 0.76562 0.53602 0.70205 1.0000 + Te Te458 1.0 0.76562 0.59852 0.70205 1.0000 + Te Te459 1.0 0.76562 0.66102 0.70205 1.0000 + Te Te460 1.0 0.76562 0.72352 0.70205 1.0000 + Te Te461 1.0 0.76562 0.78602 0.70205 1.0000 + Te Te462 1.0 0.76562 0.84852 0.70205 1.0000 + Te Te463 1.0 0.76562 0.91102 0.70205 1.0000 + Te Te464 1.0 0.76562 0.97352 0.70205 1.0000 + Te Te465 1.0 0.82813 0.03602 0.70205 1.0000 + Te Te466 1.0 0.82813 0.09852 0.70205 1.0000 + Te Te467 1.0 0.82813 0.16102 0.70205 1.0000 + Te Te468 1.0 0.82813 0.22352 0.70205 1.0000 + Te Te469 1.0 0.82813 0.28602 0.70205 1.0000 + Te Te470 1.0 0.82813 0.34852 0.70205 1.0000 + Te Te471 1.0 0.82813 0.41102 0.70205 1.0000 + Te Te472 1.0 0.82813 0.47352 0.70205 1.0000 + Te Te473 1.0 0.82813 0.53602 0.70205 1.0000 + Te Te474 1.0 0.82813 0.59852 0.70205 1.0000 + Te Te475 1.0 0.82813 0.66102 0.70205 1.0000 + Te Te476 1.0 0.82813 0.72352 0.70205 1.0000 + Te Te477 1.0 0.82813 0.78602 0.70205 1.0000 + Te Te478 1.0 0.82813 0.84852 0.70205 1.0000 + Te Te479 1.0 0.82813 0.91102 0.70205 1.0000 + Te Te480 1.0 0.82813 0.97352 0.70205 1.0000 + Te Te481 1.0 0.89063 0.03602 0.70205 1.0000 + Te Te482 1.0 0.89063 0.09852 0.70205 1.0000 + Te Te483 1.0 0.89063 0.16102 0.70205 1.0000 + Te Te484 1.0 0.89063 0.22352 0.70205 1.0000 + Te Te485 1.0 0.89063 0.28602 0.70205 1.0000 + Te Te486 1.0 0.89063 0.34852 0.70205 1.0000 + Te Te487 1.0 0.89063 0.41102 0.70205 1.0000 + Te Te488 1.0 0.89063 0.47352 0.70205 1.0000 + Te Te489 1.0 0.89063 0.53602 0.70205 1.0000 + Te Te490 1.0 0.89063 0.59852 0.70205 1.0000 + Te Te491 1.0 0.89063 0.66102 0.70205 1.0000 + Te Te492 1.0 0.89063 0.72352 0.70205 1.0000 + Te Te493 1.0 0.89063 0.78602 0.70205 1.0000 + Te Te494 1.0 0.89063 0.84852 0.70205 1.0000 + Te Te495 1.0 0.89063 0.91102 0.70205 1.0000 + Te Te496 1.0 0.89063 0.97352 0.70205 1.0000 + Te Te497 1.0 0.95313 0.03602 0.70205 1.0000 + Te Te498 1.0 0.95313 0.09852 0.70205 1.0000 + Te Te499 1.0 0.95313 0.16102 0.70205 1.0000 + Te Te500 1.0 0.95313 0.22352 0.70205 1.0000 + Te Te501 1.0 0.95313 0.28602 0.70205 1.0000 + Te Te502 1.0 0.95313 0.34852 0.70205 1.0000 + Te Te503 1.0 0.95313 0.41102 0.70205 1.0000 + Te Te504 1.0 0.95313 0.47352 0.70205 1.0000 + Te Te505 1.0 0.95313 0.53602 0.70205 1.0000 + Te Te506 1.0 0.95313 0.59852 0.70205 1.0000 + Te Te507 1.0 0.95313 0.66102 0.70205 1.0000 + Te Te508 1.0 0.95313 0.72352 0.70205 1.0000 + Te Te509 1.0 0.95313 0.78602 0.70205 1.0000 + Te Te510 1.0 0.95313 0.84852 0.70205 1.0000 + Te Te511 1.0 0.95313 0.91102 0.70205 1.0000 + Te Te512 1.0 0.95313 0.97352 0.70205 1.0000 + Rh Rh1 1.0 0.01562 0.01532 0.49857 1.0000 + Rh Rh2 1.0 0.01562 0.07782 0.49857 1.0000 + Rh Rh3 1.0 0.01562 0.14032 0.49857 1.0000 + Rh Rh4 1.0 0.01562 0.20282 0.49857 1.0000 + Rh Rh5 1.0 0.01562 0.26532 0.49857 1.0000 + Rh Rh6 1.0 0.01562 0.32782 0.49857 1.0000 + Rh Rh7 1.0 0.01562 0.39032 0.49857 1.0000 + Rh Rh8 1.0 0.01562 0.45282 0.49857 1.0000 + Rh Rh9 1.0 0.01562 0.51532 0.49857 1.0000 + Rh Rh10 1.0 0.01562 0.57782 0.49857 1.0000 + Rh Rh11 1.0 0.01562 0.64032 0.49857 1.0000 + Rh Rh12 1.0 0.01562 0.70282 0.49857 1.0000 + Rh Rh13 1.0 0.01562 0.76532 0.49857 1.0000 + Rh Rh14 1.0 0.01562 0.82782 0.49857 1.0000 + Rh Rh15 1.0 0.01562 0.89032 0.49857 1.0000 + Rh Rh16 1.0 0.01562 0.95282 0.49857 1.0000 + Rh Rh17 1.0 0.07813 0.01532 0.49857 1.0000 + Rh Rh18 1.0 0.07813 0.07782 0.49857 1.0000 + Rh Rh19 1.0 0.07813 0.14032 0.49857 1.0000 + Rh Rh20 1.0 0.07813 0.20282 0.49857 1.0000 + Rh Rh21 1.0 0.07813 0.26532 0.49857 1.0000 + Rh Rh22 1.0 0.07813 0.32782 0.49857 1.0000 + Rh Rh23 1.0 0.07813 0.39032 0.49857 1.0000 + Rh Rh24 1.0 0.07813 0.45282 0.49857 1.0000 + Rh Rh25 1.0 0.07813 0.51532 0.49857 1.0000 + Rh Rh26 1.0 0.07813 0.57782 0.49857 1.0000 + Rh Rh27 1.0 0.07813 0.64032 0.49857 1.0000 + Rh Rh28 1.0 0.07813 0.70282 0.49857 1.0000 + Rh Rh29 1.0 0.07813 0.76532 0.49857 1.0000 + Rh Rh30 1.0 0.07813 0.82782 0.49857 1.0000 + Rh Rh31 1.0 0.07813 0.89032 0.49857 1.0000 + Rh Rh32 1.0 0.07813 0.95282 0.49857 1.0000 + Rh Rh33 1.0 0.14062 0.01532 0.49857 1.0000 + Rh Rh34 1.0 0.14062 0.07782 0.49857 1.0000 + Rh Rh35 1.0 0.14062 0.14032 0.49857 1.0000 + Rh Rh36 1.0 0.14062 0.20282 0.49857 1.0000 + Rh Rh37 1.0 0.14062 0.26532 0.49857 1.0000 + Rh Rh38 1.0 0.14062 0.32782 0.49857 1.0000 + Rh Rh39 1.0 0.14062 0.39032 0.49857 1.0000 + Rh Rh40 1.0 0.14062 0.45282 0.49857 1.0000 + Rh Rh41 1.0 0.14062 0.51532 0.49857 1.0000 + Rh Rh42 1.0 0.14062 0.57782 0.49857 1.0000 + Rh Rh43 1.0 0.14062 0.64032 0.49857 1.0000 + Rh Rh44 1.0 0.14062 0.70282 0.49857 1.0000 + Rh Rh45 1.0 0.14062 0.76532 0.49857 1.0000 + Rh Rh46 1.0 0.14062 0.82782 0.49857 1.0000 + Rh Rh47 1.0 0.14062 0.89032 0.49857 1.0000 + Rh Rh48 1.0 0.14062 0.95282 0.49857 1.0000 + Rh Rh49 1.0 0.20312 0.01532 0.49857 1.0000 + Rh Rh50 1.0 0.20312 0.07782 0.49857 1.0000 + Rh Rh51 1.0 0.20312 0.14032 0.49857 1.0000 + Rh Rh52 1.0 0.20312 0.20282 0.49857 1.0000 + Rh Rh53 1.0 0.20312 0.26532 0.49857 1.0000 + Rh Rh54 1.0 0.20312 0.32782 0.49857 1.0000 + Rh Rh55 1.0 0.20312 0.39032 0.49857 1.0000 + Rh Rh56 1.0 0.20312 0.45282 0.49857 1.0000 + Rh Rh57 1.0 0.20312 0.51532 0.49857 1.0000 + Rh Rh58 1.0 0.20312 0.57782 0.49857 1.0000 + Rh Rh59 1.0 0.20312 0.64032 0.49857 1.0000 + Rh Rh60 1.0 0.20312 0.70282 0.49857 1.0000 + Rh Rh61 1.0 0.20312 0.76532 0.49857 1.0000 + Rh Rh62 1.0 0.20312 0.82782 0.49857 1.0000 + Rh Rh63 1.0 0.20312 0.89032 0.49857 1.0000 + Rh Rh64 1.0 0.20312 0.95282 0.49857 1.0000 + Rh Rh65 1.0 0.26563 0.01532 0.49857 1.0000 + Rh Rh66 1.0 0.26563 0.07782 0.49857 1.0000 + Rh Rh67 1.0 0.26563 0.14032 0.49857 1.0000 + Rh Rh68 1.0 0.26563 0.20282 0.49857 1.0000 + Rh Rh69 1.0 0.26563 0.26532 0.49857 1.0000 + Rh Rh70 1.0 0.26563 0.32782 0.49857 1.0000 + Rh Rh71 1.0 0.26563 0.39032 0.49857 1.0000 + Rh Rh72 1.0 0.26563 0.45282 0.49857 1.0000 + Rh Rh73 1.0 0.26563 0.51532 0.49857 1.0000 + Rh Rh74 1.0 0.26563 0.57782 0.49857 1.0000 + Rh Rh75 1.0 0.26563 0.64032 0.49857 1.0000 + Rh Rh76 1.0 0.26563 0.70282 0.49857 1.0000 + Rh Rh77 1.0 0.26563 0.76532 0.49857 1.0000 + Rh Rh78 1.0 0.26563 0.82782 0.49857 1.0000 + Rh Rh79 1.0 0.26563 0.89032 0.49857 1.0000 + Rh Rh80 1.0 0.26563 0.95282 0.49857 1.0000 + Rh Rh81 1.0 0.32813 0.01532 0.49857 1.0000 + Rh Rh82 1.0 0.32813 0.07782 0.49857 1.0000 + Rh Rh83 1.0 0.32813 0.14032 0.49857 1.0000 + Rh Rh84 1.0 0.32813 0.20282 0.49857 1.0000 + Rh Rh85 1.0 0.32813 0.26532 0.49857 1.0000 + Rh Rh86 1.0 0.32813 0.32782 0.49857 1.0000 + Rh Rh87 1.0 0.32813 0.39032 0.49857 1.0000 + Rh Rh88 1.0 0.32813 0.45282 0.49857 1.0000 + Rh Rh89 1.0 0.32813 0.51532 0.49857 1.0000 + Rh Rh90 1.0 0.32813 0.57782 0.49857 1.0000 + Rh Rh91 1.0 0.32813 0.64032 0.49857 1.0000 + Rh Rh92 1.0 0.32813 0.70282 0.49857 1.0000 + Rh Rh93 1.0 0.32813 0.76532 0.49857 1.0000 + Rh Rh94 1.0 0.32813 0.82782 0.49857 1.0000 + Rh Rh95 1.0 0.32813 0.89032 0.49857 1.0000 + Rh Rh96 1.0 0.32813 0.95282 0.49857 1.0000 + Rh Rh97 1.0 0.39063 0.01532 0.49857 1.0000 + Rh Rh98 1.0 0.39063 0.07782 0.49857 1.0000 + Rh Rh99 1.0 0.39063 0.14032 0.49857 1.0000 + Rh Rh100 1.0 0.39063 0.20282 0.49857 1.0000 + Rh Rh101 1.0 0.39063 0.26532 0.49857 1.0000 + Rh Rh102 1.0 0.39063 0.32782 0.49857 1.0000 + Rh Rh103 1.0 0.39063 0.39032 0.49857 1.0000 + Rh Rh104 1.0 0.39063 0.45282 0.49857 1.0000 + Rh Rh105 1.0 0.39063 0.51532 0.49857 1.0000 + Rh Rh106 1.0 0.39063 0.57782 0.49857 1.0000 + Rh Rh107 1.0 0.39063 0.64032 0.49857 1.0000 + Rh Rh108 1.0 0.39063 0.70282 0.49857 1.0000 + Rh Rh109 1.0 0.39063 0.76532 0.49857 1.0000 + Rh Rh110 1.0 0.39063 0.82782 0.49857 1.0000 + Rh Rh111 1.0 0.39063 0.89032 0.49857 1.0000 + Rh Rh112 1.0 0.39063 0.95282 0.49857 1.0000 + Rh Rh113 1.0 0.45313 0.01532 0.49857 1.0000 + Rh Rh114 1.0 0.45313 0.07782 0.49857 1.0000 + Rh Rh115 1.0 0.45313 0.14032 0.49857 1.0000 + Rh Rh116 1.0 0.45313 0.20282 0.49857 1.0000 + Rh Rh117 1.0 0.45313 0.26532 0.49857 1.0000 + Rh Rh118 1.0 0.45313 0.32782 0.49857 1.0000 + Rh Rh119 1.0 0.45313 0.39032 0.49857 1.0000 + Rh Rh120 1.0 0.45313 0.45282 0.49857 1.0000 + Rh Rh121 1.0 0.45313 0.51532 0.49857 1.0000 + Rh Rh122 1.0 0.45313 0.57782 0.49857 1.0000 + Rh Rh123 1.0 0.45313 0.64032 0.49857 1.0000 + Rh Rh124 1.0 0.45313 0.70282 0.49857 1.0000 + Rh Rh125 1.0 0.45313 0.76532 0.49857 1.0000 + Rh Rh126 1.0 0.45313 0.82782 0.49857 1.0000 + Rh Rh127 1.0 0.45313 0.89032 0.49857 1.0000 + Rh Rh128 1.0 0.45313 0.95282 0.49857 1.0000 + Rh Rh129 1.0 0.51562 0.01532 0.49857 1.0000 + Rh Rh130 1.0 0.51562 0.07782 0.49857 1.0000 + Rh Rh131 1.0 0.51562 0.14032 0.49857 1.0000 + Rh Rh132 1.0 0.51562 0.20282 0.49857 1.0000 + Rh Rh133 1.0 0.51562 0.26532 0.49857 1.0000 + Rh Rh134 1.0 0.51562 0.32782 0.49857 1.0000 + Rh Rh135 1.0 0.51562 0.39032 0.49857 1.0000 + Rh Rh136 1.0 0.51562 0.45282 0.49857 1.0000 + Rh Rh137 1.0 0.51562 0.51532 0.49857 1.0000 + Rh Rh138 1.0 0.51562 0.57782 0.49857 1.0000 + Rh Rh139 1.0 0.51562 0.64032 0.49857 1.0000 + Rh Rh140 1.0 0.51562 0.70282 0.49857 1.0000 + Rh Rh141 1.0 0.51562 0.76532 0.49857 1.0000 + Rh Rh142 1.0 0.51562 0.82782 0.49857 1.0000 + Rh Rh143 1.0 0.51562 0.89032 0.49857 1.0000 + Rh Rh144 1.0 0.51562 0.95282 0.49857 1.0000 + Rh Rh145 1.0 0.57813 0.01532 0.49857 1.0000 + Rh Rh146 1.0 0.57813 0.07782 0.49857 1.0000 + Rh Rh147 1.0 0.57813 0.14032 0.49857 1.0000 + Rh Rh148 1.0 0.57813 0.20282 0.49857 1.0000 + Rh Rh149 1.0 0.57813 0.26532 0.49857 1.0000 + Rh Rh150 1.0 0.57813 0.32782 0.49857 1.0000 + Rh Rh151 1.0 0.57813 0.39032 0.49857 1.0000 + Rh Rh152 1.0 0.57813 0.45282 0.49857 1.0000 + Rh Rh153 1.0 0.57813 0.51532 0.49857 1.0000 + Rh Rh154 1.0 0.57813 0.57782 0.49857 1.0000 + Rh Rh155 1.0 0.57813 0.64032 0.49857 1.0000 + Rh Rh156 1.0 0.57813 0.70282 0.49857 1.0000 + Rh Rh157 1.0 0.57813 0.76532 0.49857 1.0000 + Rh Rh158 1.0 0.57813 0.82782 0.49857 1.0000 + Rh Rh159 1.0 0.57813 0.89032 0.49857 1.0000 + Rh Rh160 1.0 0.57813 0.95282 0.49857 1.0000 + Rh Rh161 1.0 0.64062 0.01532 0.49857 1.0000 + Rh Rh162 1.0 0.64062 0.07782 0.49857 1.0000 + Rh Rh163 1.0 0.64062 0.14032 0.49857 1.0000 + Rh Rh164 1.0 0.64062 0.20282 0.49857 1.0000 + Rh Rh165 1.0 0.64062 0.26532 0.49857 1.0000 + Rh Rh166 1.0 0.64062 0.32782 0.49857 1.0000 + Rh Rh167 1.0 0.64062 0.39032 0.49857 1.0000 + Rh Rh168 1.0 0.64062 0.45282 0.49857 1.0000 + Rh Rh169 1.0 0.64062 0.51532 0.49857 1.0000 + Rh Rh170 1.0 0.64062 0.57782 0.49857 1.0000 + Rh Rh171 1.0 0.64062 0.64032 0.49857 1.0000 + Rh Rh172 1.0 0.64062 0.70282 0.49857 1.0000 + Rh Rh173 1.0 0.64062 0.76532 0.49857 1.0000 + Rh Rh174 1.0 0.64062 0.82782 0.49857 1.0000 + Rh Rh175 1.0 0.64062 0.89032 0.49857 1.0000 + Rh Rh176 1.0 0.64062 0.95282 0.49857 1.0000 + Rh Rh177 1.0 0.70313 0.01532 0.49857 1.0000 + Rh Rh178 1.0 0.70313 0.07782 0.49857 1.0000 + Rh Rh179 1.0 0.70313 0.14032 0.49857 1.0000 + Rh Rh180 1.0 0.70313 0.20282 0.49857 1.0000 + Rh Rh181 1.0 0.70313 0.26532 0.49857 1.0000 + Rh Rh182 1.0 0.70313 0.32782 0.49857 1.0000 + Rh Rh183 1.0 0.70313 0.39032 0.49857 1.0000 + Rh Rh184 1.0 0.70313 0.45282 0.49857 1.0000 + Rh Rh185 1.0 0.70313 0.51532 0.49857 1.0000 + Rh Rh186 1.0 0.70313 0.57782 0.49857 1.0000 + Rh Rh187 1.0 0.70313 0.64032 0.49857 1.0000 + Rh Rh188 1.0 0.70313 0.70282 0.49857 1.0000 + Rh Rh189 1.0 0.70313 0.76532 0.49857 1.0000 + Rh Rh190 1.0 0.70313 0.82782 0.49857 1.0000 + Rh Rh191 1.0 0.70313 0.89032 0.49857 1.0000 + Rh Rh192 1.0 0.70313 0.95282 0.49857 1.0000 + Rh Rh193 1.0 0.76562 0.01532 0.49857 1.0000 + Rh Rh194 1.0 0.76562 0.07782 0.49857 1.0000 + Rh Rh195 1.0 0.76562 0.14032 0.49857 1.0000 + Rh Rh196 1.0 0.76562 0.20282 0.49857 1.0000 + Rh Rh197 1.0 0.76562 0.26532 0.49857 1.0000 + Rh Rh198 1.0 0.76562 0.32782 0.49857 1.0000 + Rh Rh199 1.0 0.76562 0.39032 0.49857 1.0000 + Rh Rh200 1.0 0.76562 0.45282 0.49857 1.0000 + Rh Rh201 1.0 0.76562 0.51532 0.49857 1.0000 + Rh Rh202 1.0 0.76562 0.57782 0.49857 1.0000 + Rh Rh203 1.0 0.76562 0.64032 0.49857 1.0000 + Rh Rh204 1.0 0.76562 0.70282 0.49857 1.0000 + Rh Rh205 1.0 0.76562 0.76532 0.49857 1.0000 + Rh Rh206 1.0 0.76562 0.82782 0.49857 1.0000 + Rh Rh207 1.0 0.76562 0.89032 0.49857 1.0000 + Rh Rh208 1.0 0.76562 0.95282 0.49857 1.0000 + Rh Rh209 1.0 0.82813 0.01532 0.49857 1.0000 + Rh Rh210 1.0 0.82813 0.07782 0.49857 1.0000 + Rh Rh211 1.0 0.82813 0.14032 0.49857 1.0000 + Rh Rh212 1.0 0.82813 0.20282 0.49857 1.0000 + Rh Rh213 1.0 0.82813 0.26532 0.49857 1.0000 + Rh Rh214 1.0 0.82813 0.32782 0.49857 1.0000 + Rh Rh215 1.0 0.82813 0.39032 0.49857 1.0000 + Rh Rh216 1.0 0.82813 0.45282 0.49857 1.0000 + Rh Rh217 1.0 0.82813 0.51532 0.49857 1.0000 + Rh Rh218 1.0 0.82813 0.57782 0.49857 1.0000 + Rh Rh219 1.0 0.82813 0.64032 0.49857 1.0000 + Rh Rh220 1.0 0.82813 0.70282 0.49857 1.0000 + Rh Rh221 1.0 0.82813 0.76532 0.49857 1.0000 + Rh Rh222 1.0 0.82813 0.82782 0.49857 1.0000 + Rh Rh223 1.0 0.82813 0.89032 0.49857 1.0000 + Rh Rh224 1.0 0.82813 0.95282 0.49857 1.0000 + Rh Rh225 1.0 0.89063 0.01532 0.49857 1.0000 + Rh Rh226 1.0 0.89063 0.07782 0.49857 1.0000 + Rh Rh227 1.0 0.89063 0.14032 0.49857 1.0000 + Rh Rh228 1.0 0.89063 0.20282 0.49857 1.0000 + Rh Rh229 1.0 0.89063 0.26532 0.49857 1.0000 + Rh Rh230 1.0 0.89063 0.32782 0.49857 1.0000 + Rh Rh231 1.0 0.89063 0.39032 0.49857 1.0000 + Rh Rh232 1.0 0.89063 0.45282 0.49857 1.0000 + Rh Rh233 1.0 0.89063 0.51532 0.49857 1.0000 + Rh Rh234 1.0 0.89063 0.57782 0.49857 1.0000 + Rh Rh235 1.0 0.89063 0.64032 0.49857 1.0000 + Rh Rh236 1.0 0.89063 0.70282 0.49857 1.0000 + Rh Rh237 1.0 0.89063 0.76532 0.49857 1.0000 + Rh Rh238 1.0 0.89063 0.82782 0.49857 1.0000 + Rh Rh239 1.0 0.89063 0.89032 0.49857 1.0000 + Rh Rh240 1.0 0.89063 0.95282 0.49857 1.0000 + Rh Rh241 1.0 0.95313 0.01532 0.49857 1.0000 + Rh Rh242 1.0 0.95313 0.07782 0.49857 1.0000 + Rh Rh243 1.0 0.95313 0.14032 0.49857 1.0000 + Rh Rh244 1.0 0.95313 0.20282 0.49857 1.0000 + Rh Rh245 1.0 0.95313 0.26532 0.49857 1.0000 + Rh Rh246 1.0 0.95313 0.32782 0.49857 1.0000 + Rh Rh247 1.0 0.95313 0.39032 0.49857 1.0000 + Rh Rh248 1.0 0.95313 0.45282 0.49857 1.0000 + Rh Rh249 1.0 0.95313 0.51532 0.49857 1.0000 + Rh Rh250 1.0 0.95313 0.57782 0.49857 1.0000 + Rh Rh251 1.0 0.95313 0.64032 0.49857 1.0000 + Rh Rh252 1.0 0.95313 0.70282 0.49857 1.0000 + Rh Rh253 1.0 0.95313 0.76532 0.49857 1.0000 + Rh Rh254 1.0 0.95313 0.82782 0.49857 1.0000 + Rh Rh255 1.0 0.95313 0.89032 0.49857 1.0000 + Rh Rh256 1.0 0.95313 0.95282 0.49857 1.0000 + Rh Rh257 1.0 0.04688 0.04718 0.50143 1.0000 + Rh Rh258 1.0 0.04688 0.10968 0.50143 1.0000 + Rh Rh259 1.0 0.04688 0.17218 0.50143 1.0000 + Rh Rh260 1.0 0.04688 0.23468 0.50143 1.0000 + Rh Rh261 1.0 0.04688 0.29718 0.50143 1.0000 + Rh Rh262 1.0 0.04688 0.35968 0.50143 1.0000 + Rh Rh263 1.0 0.04688 0.42218 0.50143 1.0000 + Rh Rh264 1.0 0.04688 0.48468 0.50143 1.0000 + Rh Rh265 1.0 0.04688 0.54718 0.50143 1.0000 + Rh Rh266 1.0 0.04688 0.60968 0.50143 1.0000 + Rh Rh267 1.0 0.04688 0.67218 0.50143 1.0000 + Rh Rh268 1.0 0.04688 0.73468 0.50143 1.0000 + Rh Rh269 1.0 0.04688 0.79718 0.50143 1.0000 + Rh Rh270 1.0 0.04688 0.85968 0.50143 1.0000 + Rh Rh271 1.0 0.04688 0.92218 0.50143 1.0000 + Rh Rh272 1.0 0.04688 0.98468 0.50143 1.0000 + Rh Rh273 1.0 0.10938 0.04718 0.50143 1.0000 + Rh Rh274 1.0 0.10938 0.10968 0.50143 1.0000 + Rh Rh275 1.0 0.10938 0.17218 0.50143 1.0000 + Rh Rh276 1.0 0.10938 0.23468 0.50143 1.0000 + Rh Rh277 1.0 0.10938 0.29718 0.50143 1.0000 + Rh Rh278 1.0 0.10938 0.35968 0.50143 1.0000 + Rh Rh279 1.0 0.10938 0.42218 0.50143 1.0000 + Rh Rh280 1.0 0.10938 0.48468 0.50143 1.0000 + Rh Rh281 1.0 0.10938 0.54718 0.50143 1.0000 + Rh Rh282 1.0 0.10938 0.60968 0.50143 1.0000 + Rh Rh283 1.0 0.10938 0.67218 0.50143 1.0000 + Rh Rh284 1.0 0.10938 0.73468 0.50143 1.0000 + Rh Rh285 1.0 0.10938 0.79718 0.50143 1.0000 + Rh Rh286 1.0 0.10938 0.85968 0.50143 1.0000 + Rh Rh287 1.0 0.10938 0.92218 0.50143 1.0000 + Rh Rh288 1.0 0.10938 0.98468 0.50143 1.0000 + Rh Rh289 1.0 0.17188 0.04718 0.50143 1.0000 + Rh Rh290 1.0 0.17188 0.10968 0.50143 1.0000 + Rh Rh291 1.0 0.17188 0.17218 0.50143 1.0000 + Rh Rh292 1.0 0.17188 0.23468 0.50143 1.0000 + Rh Rh293 1.0 0.17188 0.29718 0.50143 1.0000 + Rh Rh294 1.0 0.17188 0.35968 0.50143 1.0000 + Rh Rh295 1.0 0.17188 0.42218 0.50143 1.0000 + Rh Rh296 1.0 0.17188 0.48468 0.50143 1.0000 + Rh Rh297 1.0 0.17188 0.54718 0.50143 1.0000 + Rh Rh298 1.0 0.17188 0.60968 0.50143 1.0000 + Rh Rh299 1.0 0.17188 0.67218 0.50143 1.0000 + Rh Rh300 1.0 0.17188 0.73468 0.50143 1.0000 + Rh Rh301 1.0 0.17188 0.79718 0.50143 1.0000 + Rh Rh302 1.0 0.17188 0.85968 0.50143 1.0000 + Rh Rh303 1.0 0.17188 0.92218 0.50143 1.0000 + Rh Rh304 1.0 0.17188 0.98468 0.50143 1.0000 + Rh Rh305 1.0 0.23438 0.04718 0.50143 1.0000 + Rh Rh306 1.0 0.23438 0.10968 0.50143 1.0000 + Rh Rh307 1.0 0.23438 0.17218 0.50143 1.0000 + Rh Rh308 1.0 0.23438 0.23468 0.50143 1.0000 + Rh Rh309 1.0 0.23438 0.29718 0.50143 1.0000 + Rh Rh310 1.0 0.23438 0.35968 0.50143 1.0000 + Rh Rh311 1.0 0.23438 0.42218 0.50143 1.0000 + Rh Rh312 1.0 0.23438 0.48468 0.50143 1.0000 + Rh Rh313 1.0 0.23438 0.54718 0.50143 1.0000 + Rh Rh314 1.0 0.23438 0.60968 0.50143 1.0000 + Rh Rh315 1.0 0.23438 0.67218 0.50143 1.0000 + Rh Rh316 1.0 0.23438 0.73468 0.50143 1.0000 + Rh Rh317 1.0 0.23438 0.79718 0.50143 1.0000 + Rh Rh318 1.0 0.23438 0.85968 0.50143 1.0000 + Rh Rh319 1.0 0.23438 0.92218 0.50143 1.0000 + Rh Rh320 1.0 0.23438 0.98468 0.50143 1.0000 + Rh Rh321 1.0 0.29688 0.04718 0.50143 1.0000 + Rh Rh322 1.0 0.29688 0.10968 0.50143 1.0000 + Rh Rh323 1.0 0.29688 0.17218 0.50143 1.0000 + Rh Rh324 1.0 0.29688 0.23468 0.50143 1.0000 + Rh Rh325 1.0 0.29688 0.29718 0.50143 1.0000 + Rh Rh326 1.0 0.29688 0.35968 0.50143 1.0000 + Rh Rh327 1.0 0.29688 0.42218 0.50143 1.0000 + Rh Rh328 1.0 0.29688 0.48468 0.50143 1.0000 + Rh Rh329 1.0 0.29688 0.54718 0.50143 1.0000 + Rh Rh330 1.0 0.29688 0.60968 0.50143 1.0000 + Rh Rh331 1.0 0.29688 0.67218 0.50143 1.0000 + Rh Rh332 1.0 0.29688 0.73468 0.50143 1.0000 + Rh Rh333 1.0 0.29688 0.79718 0.50143 1.0000 + Rh Rh334 1.0 0.29688 0.85968 0.50143 1.0000 + Rh Rh335 1.0 0.29688 0.92218 0.50143 1.0000 + Rh Rh336 1.0 0.29688 0.98468 0.50143 1.0000 + Rh Rh337 1.0 0.35938 0.04718 0.50143 1.0000 + Rh Rh338 1.0 0.35938 0.10968 0.50143 1.0000 + Rh Rh339 1.0 0.35938 0.17218 0.50143 1.0000 + Rh Rh340 1.0 0.35938 0.23468 0.50143 1.0000 + Rh Rh341 1.0 0.35938 0.29718 0.50143 1.0000 + Rh Rh342 1.0 0.35938 0.35968 0.50143 1.0000 + Rh Rh343 1.0 0.35938 0.42218 0.50143 1.0000 + Rh Rh344 1.0 0.35938 0.48468 0.50143 1.0000 + Rh Rh345 1.0 0.35938 0.54718 0.50143 1.0000 + Rh Rh346 1.0 0.35938 0.60968 0.50143 1.0000 + Rh Rh347 1.0 0.35938 0.67218 0.50143 1.0000 + Rh Rh348 1.0 0.35938 0.73468 0.50143 1.0000 + Rh Rh349 1.0 0.35938 0.79718 0.50143 1.0000 + Rh Rh350 1.0 0.35938 0.85968 0.50143 1.0000 + Rh Rh351 1.0 0.35938 0.92218 0.50143 1.0000 + Rh Rh352 1.0 0.35938 0.98468 0.50143 1.0000 + Rh Rh353 1.0 0.42188 0.04718 0.50143 1.0000 + Rh Rh354 1.0 0.42188 0.10968 0.50143 1.0000 + Rh Rh355 1.0 0.42188 0.17218 0.50143 1.0000 + Rh Rh356 1.0 0.42188 0.23468 0.50143 1.0000 + Rh Rh357 1.0 0.42188 0.29718 0.50143 1.0000 + Rh Rh358 1.0 0.42188 0.35968 0.50143 1.0000 + Rh Rh359 1.0 0.42188 0.42218 0.50143 1.0000 + Rh Rh360 1.0 0.42188 0.48468 0.50143 1.0000 + Rh Rh361 1.0 0.42188 0.54718 0.50143 1.0000 + Rh Rh362 1.0 0.42188 0.60968 0.50143 1.0000 + Rh Rh363 1.0 0.42188 0.67218 0.50143 1.0000 + Rh Rh364 1.0 0.42188 0.73468 0.50143 1.0000 + Rh Rh365 1.0 0.42188 0.79718 0.50143 1.0000 + Rh Rh366 1.0 0.42188 0.85968 0.50143 1.0000 + Rh Rh367 1.0 0.42188 0.92218 0.50143 1.0000 + Rh Rh368 1.0 0.42188 0.98468 0.50143 1.0000 + Rh Rh369 1.0 0.48438 0.04718 0.50143 1.0000 + Rh Rh370 1.0 0.48438 0.10968 0.50143 1.0000 + Rh Rh371 1.0 0.48438 0.17218 0.50143 1.0000 + Rh Rh372 1.0 0.48438 0.23468 0.50143 1.0000 + Rh Rh373 1.0 0.48438 0.29718 0.50143 1.0000 + Rh Rh374 1.0 0.48438 0.35968 0.50143 1.0000 + Rh Rh375 1.0 0.48438 0.42218 0.50143 1.0000 + Rh Rh376 1.0 0.48438 0.48468 0.50143 1.0000 + Rh Rh377 1.0 0.48438 0.54718 0.50143 1.0000 + Rh Rh378 1.0 0.48438 0.60968 0.50143 1.0000 + Rh Rh379 1.0 0.48438 0.67218 0.50143 1.0000 + Rh Rh380 1.0 0.48438 0.73468 0.50143 1.0000 + Rh Rh381 1.0 0.48438 0.79718 0.50143 1.0000 + Rh Rh382 1.0 0.48438 0.85968 0.50143 1.0000 + Rh Rh383 1.0 0.48438 0.92218 0.50143 1.0000 + Rh Rh384 1.0 0.48438 0.98468 0.50143 1.0000 + Rh Rh385 1.0 0.54688 0.04718 0.50143 1.0000 + Rh Rh386 1.0 0.54688 0.10968 0.50143 1.0000 + Rh Rh387 1.0 0.54688 0.17218 0.50143 1.0000 + Rh Rh388 1.0 0.54688 0.23468 0.50143 1.0000 + Rh Rh389 1.0 0.54688 0.29718 0.50143 1.0000 + Rh Rh390 1.0 0.54688 0.35968 0.50143 1.0000 + Rh Rh391 1.0 0.54688 0.42218 0.50143 1.0000 + Rh Rh392 1.0 0.54688 0.48468 0.50143 1.0000 + Rh Rh393 1.0 0.54688 0.54718 0.50143 1.0000 + Rh Rh394 1.0 0.54688 0.60968 0.50143 1.0000 + Rh Rh395 1.0 0.54688 0.67218 0.50143 1.0000 + Rh Rh396 1.0 0.54688 0.73468 0.50143 1.0000 + Rh Rh397 1.0 0.54688 0.79718 0.50143 1.0000 + Rh Rh398 1.0 0.54688 0.85968 0.50143 1.0000 + Rh Rh399 1.0 0.54688 0.92218 0.50143 1.0000 + Rh Rh400 1.0 0.54688 0.98468 0.50143 1.0000 + Rh Rh401 1.0 0.60938 0.04718 0.50143 1.0000 + Rh Rh402 1.0 0.60938 0.10968 0.50143 1.0000 + Rh Rh403 1.0 0.60938 0.17218 0.50143 1.0000 + Rh Rh404 1.0 0.60938 0.23468 0.50143 1.0000 + Rh Rh405 1.0 0.60938 0.29718 0.50143 1.0000 + Rh Rh406 1.0 0.60938 0.35968 0.50143 1.0000 + Rh Rh407 1.0 0.60938 0.42218 0.50143 1.0000 + Rh Rh408 1.0 0.60938 0.48468 0.50143 1.0000 + Rh Rh409 1.0 0.60938 0.54718 0.50143 1.0000 + Rh Rh410 1.0 0.60938 0.60968 0.50143 1.0000 + Rh Rh411 1.0 0.60938 0.67218 0.50143 1.0000 + Rh Rh412 1.0 0.60938 0.73468 0.50143 1.0000 + Rh Rh413 1.0 0.60938 0.79718 0.50143 1.0000 + Rh Rh414 1.0 0.60938 0.85968 0.50143 1.0000 + Rh Rh415 1.0 0.60938 0.92218 0.50143 1.0000 + Rh Rh416 1.0 0.60938 0.98468 0.50143 1.0000 + Rh Rh417 1.0 0.67188 0.04718 0.50143 1.0000 + Rh Rh418 1.0 0.67188 0.10968 0.50143 1.0000 + Rh Rh419 1.0 0.67188 0.17218 0.50143 1.0000 + Rh Rh420 1.0 0.67188 0.23468 0.50143 1.0000 + Rh Rh421 1.0 0.67188 0.29718 0.50143 1.0000 + Rh Rh422 1.0 0.67188 0.35968 0.50143 1.0000 + Rh Rh423 1.0 0.67188 0.42218 0.50143 1.0000 + Rh Rh424 1.0 0.67188 0.48468 0.50143 1.0000 + Rh Rh425 1.0 0.67188 0.54718 0.50143 1.0000 + Rh Rh426 1.0 0.67188 0.60968 0.50143 1.0000 + Rh Rh427 1.0 0.67188 0.67218 0.50143 1.0000 + Rh Rh428 1.0 0.67188 0.73468 0.50143 1.0000 + Rh Rh429 1.0 0.67188 0.79718 0.50143 1.0000 + Rh Rh430 1.0 0.67188 0.85968 0.50143 1.0000 + Rh Rh431 1.0 0.67188 0.92218 0.50143 1.0000 + Rh Rh432 1.0 0.67188 0.98468 0.50143 1.0000 + Rh Rh433 1.0 0.73438 0.04718 0.50143 1.0000 + Rh Rh434 1.0 0.73438 0.10968 0.50143 1.0000 + Rh Rh435 1.0 0.73438 0.17218 0.50143 1.0000 + Rh Rh436 1.0 0.73438 0.23468 0.50143 1.0000 + Rh Rh437 1.0 0.73438 0.29718 0.50143 1.0000 + Rh Rh438 1.0 0.73438 0.35968 0.50143 1.0000 + Rh Rh439 1.0 0.73438 0.42218 0.50143 1.0000 + Rh Rh440 1.0 0.73438 0.48468 0.50143 1.0000 + Rh Rh441 1.0 0.73438 0.54718 0.50143 1.0000 + Rh Rh442 1.0 0.73438 0.60968 0.50143 1.0000 + Rh Rh443 1.0 0.73438 0.67218 0.50143 1.0000 + Rh Rh444 1.0 0.73438 0.73468 0.50143 1.0000 + Rh Rh445 1.0 0.73438 0.79718 0.50143 1.0000 + Rh Rh446 1.0 0.73438 0.85968 0.50143 1.0000 + Rh Rh447 1.0 0.73438 0.92218 0.50143 1.0000 + Rh Rh448 1.0 0.73438 0.98468 0.50143 1.0000 + Rh Rh449 1.0 0.79688 0.04718 0.50143 1.0000 + Rh Rh450 1.0 0.79688 0.10968 0.50143 1.0000 + Rh Rh451 1.0 0.79688 0.17218 0.50143 1.0000 + Rh Rh452 1.0 0.79688 0.23468 0.50143 1.0000 + Rh Rh453 1.0 0.79688 0.29718 0.50143 1.0000 + Rh Rh454 1.0 0.79688 0.35968 0.50143 1.0000 + Rh Rh455 1.0 0.79688 0.42218 0.50143 1.0000 + Rh Rh456 1.0 0.79688 0.48468 0.50143 1.0000 + Rh Rh457 1.0 0.79688 0.54718 0.50143 1.0000 + Rh Rh458 1.0 0.79688 0.60968 0.50143 1.0000 + Rh Rh459 1.0 0.79688 0.67218 0.50143 1.0000 + Rh Rh460 1.0 0.79688 0.73468 0.50143 1.0000 + Rh Rh461 1.0 0.79688 0.79718 0.50143 1.0000 + Rh Rh462 1.0 0.79688 0.85968 0.50143 1.0000 + Rh Rh463 1.0 0.79688 0.92218 0.50143 1.0000 + Rh Rh464 1.0 0.79688 0.98468 0.50143 1.0000 + Rh Rh465 1.0 0.85938 0.04718 0.50143 1.0000 + Rh Rh466 1.0 0.85938 0.10968 0.50143 1.0000 + Rh Rh467 1.0 0.85938 0.17218 0.50143 1.0000 + Rh Rh468 1.0 0.85938 0.23468 0.50143 1.0000 + Rh Rh469 1.0 0.85938 0.29718 0.50143 1.0000 + Rh Rh470 1.0 0.85938 0.35968 0.50143 1.0000 + Rh Rh471 1.0 0.85938 0.42218 0.50143 1.0000 + Rh Rh472 1.0 0.85938 0.48468 0.50143 1.0000 + Rh Rh473 1.0 0.85938 0.54718 0.50143 1.0000 + Rh Rh474 1.0 0.85938 0.60968 0.50143 1.0000 + Rh Rh475 1.0 0.85938 0.67218 0.50143 1.0000 + Rh Rh476 1.0 0.85938 0.73468 0.50143 1.0000 + Rh Rh477 1.0 0.85938 0.79718 0.50143 1.0000 + Rh Rh478 1.0 0.85938 0.85968 0.50143 1.0000 + Rh Rh479 1.0 0.85938 0.92218 0.50143 1.0000 + Rh Rh480 1.0 0.85938 0.98468 0.50143 1.0000 + Rh Rh481 1.0 0.92188 0.04718 0.50143 1.0000 + Rh Rh482 1.0 0.92188 0.10968 0.50143 1.0000 + Rh Rh483 1.0 0.92188 0.17218 0.50143 1.0000 + Rh Rh484 1.0 0.92188 0.23468 0.50143 1.0000 + Rh Rh485 1.0 0.92188 0.29718 0.50143 1.0000 + Rh Rh486 1.0 0.92188 0.35968 0.50143 1.0000 + Rh Rh487 1.0 0.92188 0.42218 0.50143 1.0000 + Rh Rh488 1.0 0.92188 0.48468 0.50143 1.0000 + Rh Rh489 1.0 0.92188 0.54718 0.50143 1.0000 + Rh Rh490 1.0 0.92188 0.60968 0.50143 1.0000 + Rh Rh491 1.0 0.92188 0.67218 0.50143 1.0000 + Rh Rh492 1.0 0.92188 0.73468 0.50143 1.0000 + Rh Rh493 1.0 0.92188 0.79718 0.50143 1.0000 + Rh Rh494 1.0 0.92188 0.85968 0.50143 1.0000 + Rh Rh495 1.0 0.92188 0.92218 0.50143 1.0000 + Rh Rh496 1.0 0.92188 0.98468 0.50143 1.0000 + Rh Rh497 1.0 0.98438 0.04718 0.50143 1.0000 + Rh Rh498 1.0 0.98438 0.10968 0.50143 1.0000 + Rh Rh499 1.0 0.98438 0.17218 0.50143 1.0000 + Rh Rh500 1.0 0.98438 0.23468 0.50143 1.0000 + Rh Rh501 1.0 0.98438 0.29718 0.50143 1.0000 + Rh Rh502 1.0 0.98438 0.35968 0.50143 1.0000 + Rh Rh503 1.0 0.98438 0.42218 0.50143 1.0000 + Rh Rh504 1.0 0.98438 0.48468 0.50143 1.0000 + Rh Rh505 1.0 0.98438 0.54718 0.50143 1.0000 + Rh Rh506 1.0 0.98438 0.60968 0.50143 1.0000 + Rh Rh507 1.0 0.98438 0.67218 0.50143 1.0000 + Rh Rh508 1.0 0.98438 0.73468 0.50143 1.0000 + Rh Rh509 1.0 0.98438 0.79718 0.50143 1.0000 + Rh Rh510 1.0 0.98438 0.85968 0.50143 1.0000 + Rh Rh511 1.0 0.98438 0.92218 0.50143 1.0000 + Rh Rh512 1.0 0.98438 0.98468 0.50143 1.0000 + Cl Cl1 1.0 0.01562 0.05785 0.29533 1.0000 + Cl Cl2 1.0 0.01562 0.12035 0.29533 1.0000 + Cl Cl3 1.0 0.01562 0.18285 0.29533 1.0000 + Cl Cl4 1.0 0.01562 0.24535 0.29533 1.0000 + Cl Cl5 1.0 0.01562 0.30785 0.29533 1.0000 + Cl Cl6 1.0 0.01562 0.37035 0.29533 1.0000 + Cl Cl7 1.0 0.01562 0.43285 0.29533 1.0000 + Cl Cl8 1.0 0.01562 0.49535 0.29533 1.0000 + Cl Cl9 1.0 0.01562 0.55785 0.29533 1.0000 + Cl Cl10 1.0 0.01562 0.62035 0.29533 1.0000 + Cl Cl11 1.0 0.01562 0.68285 0.29533 1.0000 + Cl Cl12 1.0 0.01562 0.74535 0.29533 1.0000 + Cl Cl13 1.0 0.01562 0.80785 0.29533 1.0000 + Cl Cl14 1.0 0.01562 0.87035 0.29533 1.0000 + Cl Cl15 1.0 0.01562 0.93285 0.29533 1.0000 + Cl Cl16 1.0 0.01562 0.99535 0.29533 1.0000 + Cl Cl17 1.0 0.07813 0.05785 0.29533 1.0000 + Cl Cl18 1.0 0.07813 0.12035 0.29533 1.0000 + Cl Cl19 1.0 0.07813 0.18285 0.29533 1.0000 + Cl Cl20 1.0 0.07813 0.24535 0.29533 1.0000 + Cl Cl21 1.0 0.07813 0.30785 0.29533 1.0000 + Cl Cl22 1.0 0.07813 0.37035 0.29533 1.0000 + Cl Cl23 1.0 0.07813 0.43285 0.29533 1.0000 + Cl Cl24 1.0 0.07813 0.49535 0.29533 1.0000 + Cl Cl25 1.0 0.07813 0.55785 0.29533 1.0000 + Cl Cl26 1.0 0.07813 0.62035 0.29533 1.0000 + Cl Cl27 1.0 0.07813 0.68285 0.29533 1.0000 + Cl Cl28 1.0 0.07813 0.74535 0.29533 1.0000 + Cl Cl29 1.0 0.07813 0.80785 0.29533 1.0000 + Cl Cl30 1.0 0.07813 0.87035 0.29533 1.0000 + Cl Cl31 1.0 0.07813 0.93285 0.29533 1.0000 + Cl Cl32 1.0 0.07813 0.99535 0.29533 1.0000 + Cl Cl33 1.0 0.14062 0.05785 0.29533 1.0000 + Cl Cl34 1.0 0.14062 0.12035 0.29533 1.0000 + Cl Cl35 1.0 0.14062 0.18285 0.29533 1.0000 + Cl Cl36 1.0 0.14062 0.24535 0.29533 1.0000 + Cl Cl37 1.0 0.14062 0.30785 0.29533 1.0000 + Cl Cl38 1.0 0.14062 0.37035 0.29533 1.0000 + Cl Cl39 1.0 0.14062 0.43285 0.29533 1.0000 + Cl Cl40 1.0 0.14062 0.49535 0.29533 1.0000 + Cl Cl41 1.0 0.14062 0.55785 0.29533 1.0000 + Cl Cl42 1.0 0.14062 0.62035 0.29533 1.0000 + Cl Cl43 1.0 0.14062 0.68285 0.29533 1.0000 + Cl Cl44 1.0 0.14062 0.74535 0.29533 1.0000 + Cl Cl45 1.0 0.14062 0.80785 0.29533 1.0000 + Cl Cl46 1.0 0.14062 0.87035 0.29533 1.0000 + Cl Cl47 1.0 0.14062 0.93285 0.29533 1.0000 + Cl Cl48 1.0 0.14062 0.99535 0.29533 1.0000 + Cl Cl49 1.0 0.20312 0.05785 0.29533 1.0000 + Cl Cl50 1.0 0.20312 0.12035 0.29533 1.0000 + Cl Cl51 1.0 0.20312 0.18285 0.29533 1.0000 + Cl Cl52 1.0 0.20312 0.24535 0.29533 1.0000 + Cl Cl53 1.0 0.20312 0.30785 0.29533 1.0000 + Cl Cl54 1.0 0.20312 0.37035 0.29533 1.0000 + Cl Cl55 1.0 0.20312 0.43285 0.29533 1.0000 + Cl Cl56 1.0 0.20312 0.49535 0.29533 1.0000 + Cl Cl57 1.0 0.20312 0.55785 0.29533 1.0000 + Cl Cl58 1.0 0.20312 0.62035 0.29533 1.0000 + Cl Cl59 1.0 0.20312 0.68285 0.29533 1.0000 + Cl Cl60 1.0 0.20312 0.74535 0.29533 1.0000 + Cl Cl61 1.0 0.20312 0.80785 0.29533 1.0000 + Cl Cl62 1.0 0.20312 0.87035 0.29533 1.0000 + Cl Cl63 1.0 0.20312 0.93285 0.29533 1.0000 + Cl Cl64 1.0 0.20312 0.99535 0.29533 1.0000 + Cl Cl65 1.0 0.26563 0.05785 0.29533 1.0000 + Cl Cl66 1.0 0.26563 0.12035 0.29533 1.0000 + Cl Cl67 1.0 0.26563 0.18285 0.29533 1.0000 + Cl Cl68 1.0 0.26563 0.24535 0.29533 1.0000 + Cl Cl69 1.0 0.26563 0.30785 0.29533 1.0000 + Cl Cl70 1.0 0.26563 0.37035 0.29533 1.0000 + Cl Cl71 1.0 0.26563 0.43285 0.29533 1.0000 + Cl Cl72 1.0 0.26563 0.49535 0.29533 1.0000 + Cl Cl73 1.0 0.26563 0.55785 0.29533 1.0000 + Cl Cl74 1.0 0.26563 0.62035 0.29533 1.0000 + Cl Cl75 1.0 0.26563 0.68285 0.29533 1.0000 + Cl Cl76 1.0 0.26563 0.74535 0.29533 1.0000 + Cl Cl77 1.0 0.26563 0.80785 0.29533 1.0000 + Cl Cl78 1.0 0.26563 0.87035 0.29533 1.0000 + Cl Cl79 1.0 0.26563 0.93285 0.29533 1.0000 + Cl Cl80 1.0 0.26563 0.99535 0.29533 1.0000 + Cl Cl81 1.0 0.32813 0.05785 0.29533 1.0000 + Cl Cl82 1.0 0.32813 0.12035 0.29533 1.0000 + Cl Cl83 1.0 0.32813 0.18285 0.29533 1.0000 + Cl Cl84 1.0 0.32813 0.24535 0.29533 1.0000 + Cl Cl85 1.0 0.32813 0.30785 0.29533 1.0000 + Cl Cl86 1.0 0.32813 0.37035 0.29533 1.0000 + Cl Cl87 1.0 0.32813 0.43285 0.29533 1.0000 + Cl Cl88 1.0 0.32813 0.49535 0.29533 1.0000 + Cl Cl89 1.0 0.32813 0.55785 0.29533 1.0000 + Cl Cl90 1.0 0.32813 0.62035 0.29533 1.0000 + Cl Cl91 1.0 0.32813 0.68285 0.29533 1.0000 + Cl Cl92 1.0 0.32813 0.74535 0.29533 1.0000 + Cl Cl93 1.0 0.32813 0.80785 0.29533 1.0000 + Cl Cl94 1.0 0.32813 0.87035 0.29533 1.0000 + Cl Cl95 1.0 0.32813 0.93285 0.29533 1.0000 + Cl Cl96 1.0 0.32813 0.99535 0.29533 1.0000 + Cl Cl97 1.0 0.39063 0.05785 0.29533 1.0000 + Cl Cl98 1.0 0.39063 0.12035 0.29533 1.0000 + Cl Cl99 1.0 0.39063 0.18285 0.29533 1.0000 + Cl Cl100 1.0 0.39063 0.24535 0.29533 1.0000 + Cl Cl101 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Cl Cl448 1.0 0.73438 0.94215 0.70467 1.0000 + Cl Cl449 1.0 0.79688 0.00465 0.70467 1.0000 + Cl Cl450 1.0 0.79688 0.06715 0.70467 1.0000 + Cl Cl451 1.0 0.79688 0.12965 0.70467 1.0000 + Cl Cl452 1.0 0.79688 0.19215 0.70467 1.0000 + Cl Cl453 1.0 0.79688 0.25465 0.70467 1.0000 + Cl Cl454 1.0 0.79688 0.31715 0.70467 1.0000 + Cl Cl455 1.0 0.79688 0.37965 0.70467 1.0000 + Cl Cl456 1.0 0.79688 0.44215 0.70467 1.0000 + Cl Cl457 1.0 0.79688 0.50465 0.70467 1.0000 + Cl Cl458 1.0 0.79688 0.56715 0.70467 1.0000 + Cl Cl459 1.0 0.79688 0.62965 0.70467 1.0000 + Cl Cl460 1.0 0.79688 0.69215 0.70467 1.0000 + Cl Cl461 1.0 0.79688 0.75465 0.70467 1.0000 + Cl Cl462 1.0 0.79688 0.81715 0.70467 1.0000 + Cl Cl463 1.0 0.79688 0.87965 0.70467 1.0000 + Cl Cl464 1.0 0.79688 0.94215 0.70467 1.0000 + Cl Cl465 1.0 0.85938 0.00465 0.70467 1.0000 + Cl Cl466 1.0 0.85938 0.06715 0.70467 1.0000 + Cl Cl467 1.0 0.85938 0.12965 0.70467 1.0000 + Cl Cl468 1.0 0.85938 0.19215 0.70467 1.0000 + Cl Cl469 1.0 0.85938 0.25465 0.70467 1.0000 + Cl Cl470 1.0 0.85938 0.31715 0.70467 1.0000 + Cl Cl471 1.0 0.85938 0.37965 0.70467 1.0000 + Cl Cl472 1.0 0.85938 0.44215 0.70467 1.0000 + Cl Cl473 1.0 0.85938 0.50465 0.70467 1.0000 + Cl Cl474 1.0 0.85938 0.56715 0.70467 1.0000 + Cl Cl475 1.0 0.85938 0.62965 0.70467 1.0000 + Cl Cl476 1.0 0.85938 0.69215 0.70467 1.0000 + Cl Cl477 1.0 0.85938 0.75465 0.70467 1.0000 + Cl Cl478 1.0 0.85938 0.81715 0.70467 1.0000 + Cl Cl479 1.0 0.85938 0.87965 0.70467 1.0000 + Cl Cl480 1.0 0.85938 0.94215 0.70467 1.0000 + Cl Cl481 1.0 0.92188 0.00465 0.70467 1.0000 + Cl Cl482 1.0 0.92188 0.06715 0.70467 1.0000 + Cl Cl483 1.0 0.92188 0.12965 0.70467 1.0000 + Cl Cl484 1.0 0.92188 0.19215 0.70467 1.0000 + Cl Cl485 1.0 0.92188 0.25465 0.70467 1.0000 + Cl Cl486 1.0 0.92188 0.31715 0.70467 1.0000 + Cl Cl487 1.0 0.92188 0.37965 0.70467 1.0000 + Cl Cl488 1.0 0.92188 0.44215 0.70467 1.0000 + Cl Cl489 1.0 0.92188 0.50465 0.70467 1.0000 + Cl Cl490 1.0 0.92188 0.56715 0.70467 1.0000 + Cl Cl491 1.0 0.92188 0.62965 0.70467 1.0000 + Cl Cl492 1.0 0.92188 0.69215 0.70467 1.0000 + Cl Cl493 1.0 0.92188 0.75465 0.70467 1.0000 + Cl Cl494 1.0 0.92188 0.81715 0.70467 1.0000 + Cl Cl495 1.0 0.92188 0.87965 0.70467 1.0000 + Cl Cl496 1.0 0.92188 0.94215 0.70467 1.0000 + Cl Cl497 1.0 0.98438 0.00465 0.70467 1.0000 + Cl Cl498 1.0 0.98438 0.06715 0.70467 1.0000 + Cl Cl499 1.0 0.98438 0.12965 0.70467 1.0000 + Cl Cl500 1.0 0.98438 0.19215 0.70467 1.0000 + Cl Cl501 1.0 0.98438 0.25465 0.70467 1.0000 + Cl Cl502 1.0 0.98438 0.31715 0.70467 1.0000 + Cl Cl503 1.0 0.98438 0.37965 0.70467 1.0000 + Cl Cl504 1.0 0.98438 0.44215 0.70467 1.0000 + Cl Cl505 1.0 0.98438 0.50465 0.70467 1.0000 + Cl Cl506 1.0 0.98438 0.56715 0.70467 1.0000 + Cl Cl507 1.0 0.98438 0.62965 0.70467 1.0000 + Cl Cl508 1.0 0.98438 0.69215 0.70467 1.0000 + Cl Cl509 1.0 0.98438 0.75465 0.70467 1.0000 + Cl Cl510 1.0 0.98438 0.81715 0.70467 1.0000 + Cl Cl511 1.0 0.98438 0.87965 0.70467 1.0000 + Cl Cl512 1.0 0.98438 0.94215 0.70467 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-3491_supercell_12x12x1.cif b/tier3/cif_file/orthogonal_2dm-3491_supercell_12x12x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..7cd3035a057c06dbc0f6aefdbcedc2f9997e34bc --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-3491_supercell_12x12x1.cif @@ -0,0 +1,3193 @@ +data_image0 +_chemical_formula_structural Au576Se576O2016 +_chemical_formula_sum "Au576 Se576 O2016" +_cell_length_a 85.531 +_cell_length_b 136.514 +_cell_length_c 6.6898 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Au Au1 1.0 0.01626 0.03654 0.51844 1.0000 + Au Au2 1.0 0.01626 0.11987 0.51844 1.0000 + Au Au3 1.0 0.01626 0.20321 0.51844 1.0000 + Au Au4 1.0 0.01626 0.28654 0.51844 1.0000 + Au Au5 1.0 0.01626 0.36987 0.51844 1.0000 + Au Au6 1.0 0.01626 0.45321 0.51844 1.0000 + Au Au7 1.0 0.01626 0.53654 0.51844 1.0000 + Au Au8 1.0 0.01626 0.61987 0.51844 1.0000 + Au Au9 1.0 0.01626 0.70321 0.51844 1.0000 + Au Au10 1.0 0.01626 0.78654 0.51844 1.0000 + Au Au11 1.0 0.01626 0.86987 0.51844 1.0000 + Au Au12 1.0 0.01626 0.95321 0.51844 1.0000 + Au Au13 1.0 0.09959 0.03654 0.51844 1.0000 + Au Au14 1.0 0.09959 0.11987 0.51844 1.0000 + Au Au15 1.0 0.09959 0.20321 0.51844 1.0000 + Au Au16 1.0 0.09959 0.28654 0.51844 1.0000 + Au Au17 1.0 0.09959 0.36987 0.51844 1.0000 + Au Au18 1.0 0.09959 0.45321 0.51844 1.0000 + Au Au19 1.0 0.09959 0.53654 0.51844 1.0000 + Au Au20 1.0 0.09959 0.61987 0.51844 1.0000 + Au Au21 1.0 0.09959 0.70321 0.51844 1.0000 + Au Au22 1.0 0.09959 0.78654 0.51844 1.0000 + Au Au23 1.0 0.09959 0.86987 0.51844 1.0000 + Au Au24 1.0 0.09959 0.95321 0.51844 1.0000 + Au Au25 1.0 0.18293 0.03654 0.51844 1.0000 + Au Au26 1.0 0.18293 0.11987 0.51844 1.0000 + Au Au27 1.0 0.18293 0.20321 0.51844 1.0000 + Au Au28 1.0 0.18293 0.28654 0.51844 1.0000 + Au Au29 1.0 0.18293 0.36987 0.51844 1.0000 + Au Au30 1.0 0.18293 0.45321 0.51844 1.0000 + Au Au31 1.0 0.18293 0.53654 0.51844 1.0000 + Au Au32 1.0 0.18293 0.61987 0.51844 1.0000 + Au Au33 1.0 0.18293 0.70321 0.51844 1.0000 + Au Au34 1.0 0.18293 0.78654 0.51844 1.0000 + Au Au35 1.0 0.18293 0.86987 0.51844 1.0000 + Au Au36 1.0 0.18293 0.95321 0.51844 1.0000 + Au Au37 1.0 0.26626 0.03654 0.51844 1.0000 + Au Au38 1.0 0.26626 0.11987 0.51844 1.0000 + Au Au39 1.0 0.26626 0.20321 0.51844 1.0000 + Au Au40 1.0 0.26626 0.28654 0.51844 1.0000 + Au Au41 1.0 0.26626 0.36987 0.51844 1.0000 + Au Au42 1.0 0.26626 0.45321 0.51844 1.0000 + Au Au43 1.0 0.26626 0.53654 0.51844 1.0000 + Au Au44 1.0 0.26626 0.61987 0.51844 1.0000 + Au Au45 1.0 0.26626 0.70321 0.51844 1.0000 + Au Au46 1.0 0.26626 0.78654 0.51844 1.0000 + Au Au47 1.0 0.26626 0.86987 0.51844 1.0000 + Au Au48 1.0 0.26626 0.95321 0.51844 1.0000 + Au Au49 1.0 0.34959 0.03654 0.51844 1.0000 + Au Au50 1.0 0.34959 0.11987 0.51844 1.0000 + Au Au51 1.0 0.34959 0.20321 0.51844 1.0000 + Au Au52 1.0 0.34959 0.28654 0.51844 1.0000 + Au Au53 1.0 0.34959 0.36987 0.51844 1.0000 + Au Au54 1.0 0.34959 0.45321 0.51844 1.0000 + Au Au55 1.0 0.34959 0.53654 0.51844 1.0000 + Au Au56 1.0 0.34959 0.61987 0.51844 1.0000 + Au Au57 1.0 0.34959 0.70321 0.51844 1.0000 + Au Au58 1.0 0.34959 0.78654 0.51844 1.0000 + Au Au59 1.0 0.34959 0.86987 0.51844 1.0000 + Au Au60 1.0 0.34959 0.95321 0.51844 1.0000 + Au Au61 1.0 0.43293 0.03654 0.51844 1.0000 + Au Au62 1.0 0.43293 0.11987 0.51844 1.0000 + Au Au63 1.0 0.43293 0.20321 0.51844 1.0000 + Au Au64 1.0 0.43293 0.28654 0.51844 1.0000 + Au Au65 1.0 0.43293 0.36987 0.51844 1.0000 + Au Au66 1.0 0.43293 0.45321 0.51844 1.0000 + Au Au67 1.0 0.43293 0.53654 0.51844 1.0000 + Au Au68 1.0 0.43293 0.61987 0.51844 1.0000 + Au Au69 1.0 0.43293 0.70321 0.51844 1.0000 + Au Au70 1.0 0.43293 0.78654 0.51844 1.0000 + Au Au71 1.0 0.43293 0.86987 0.51844 1.0000 + Au Au72 1.0 0.43293 0.95321 0.51844 1.0000 + Au Au73 1.0 0.51626 0.03654 0.51844 1.0000 + Au Au74 1.0 0.51626 0.11987 0.51844 1.0000 + Au Au75 1.0 0.51626 0.20321 0.51844 1.0000 + Au Au76 1.0 0.51626 0.28654 0.51844 1.0000 + Au Au77 1.0 0.51626 0.36987 0.51844 1.0000 + Au Au78 1.0 0.51626 0.45321 0.51844 1.0000 + Au Au79 1.0 0.51626 0.53654 0.51844 1.0000 + Au Au80 1.0 0.51626 0.61987 0.51844 1.0000 + Au Au81 1.0 0.51626 0.70321 0.51844 1.0000 + Au Au82 1.0 0.51626 0.78654 0.51844 1.0000 + Au Au83 1.0 0.51626 0.86987 0.51844 1.0000 + Au Au84 1.0 0.51626 0.95321 0.51844 1.0000 + Au Au85 1.0 0.59959 0.03654 0.51844 1.0000 + Au Au86 1.0 0.59959 0.11987 0.51844 1.0000 + Au Au87 1.0 0.59959 0.20321 0.51844 1.0000 + Au Au88 1.0 0.59959 0.28654 0.51844 1.0000 + Au Au89 1.0 0.59959 0.36987 0.51844 1.0000 + Au Au90 1.0 0.59959 0.45321 0.51844 1.0000 + Au Au91 1.0 0.59959 0.53654 0.51844 1.0000 + Au Au92 1.0 0.59959 0.61987 0.51844 1.0000 + Au Au93 1.0 0.59959 0.70321 0.51844 1.0000 + Au Au94 1.0 0.59959 0.78654 0.51844 1.0000 + Au Au95 1.0 0.59959 0.86987 0.51844 1.0000 + Au Au96 1.0 0.59959 0.95321 0.51844 1.0000 + Au Au97 1.0 0.68293 0.03654 0.51844 1.0000 + Au Au98 1.0 0.68293 0.11987 0.51844 1.0000 + Au Au99 1.0 0.68293 0.20321 0.51844 1.0000 + Au Au100 1.0 0.68293 0.28654 0.51844 1.0000 + Au Au101 1.0 0.68293 0.36987 0.51844 1.0000 + Au Au102 1.0 0.68293 0.45321 0.51844 1.0000 + Au Au103 1.0 0.68293 0.53654 0.51844 1.0000 + Au Au104 1.0 0.68293 0.61987 0.51844 1.0000 + Au Au105 1.0 0.68293 0.70321 0.51844 1.0000 + Au Au106 1.0 0.68293 0.78654 0.51844 1.0000 + Au Au107 1.0 0.68293 0.86987 0.51844 1.0000 + Au Au108 1.0 0.68293 0.95321 0.51844 1.0000 + Au Au109 1.0 0.76626 0.03654 0.51844 1.0000 + Au Au110 1.0 0.76626 0.11987 0.51844 1.0000 + Au Au111 1.0 0.76626 0.20321 0.51844 1.0000 + Au Au112 1.0 0.76626 0.28654 0.51844 1.0000 + Au Au113 1.0 0.76626 0.36987 0.51844 1.0000 + Au Au114 1.0 0.76626 0.45321 0.51844 1.0000 + Au Au115 1.0 0.76626 0.53654 0.51844 1.0000 + Au Au116 1.0 0.76626 0.61987 0.51844 1.0000 + Au Au117 1.0 0.76626 0.70321 0.51844 1.0000 + Au Au118 1.0 0.76626 0.78654 0.51844 1.0000 + Au Au119 1.0 0.76626 0.86987 0.51844 1.0000 + Au Au120 1.0 0.76626 0.95321 0.51844 1.0000 + Au Au121 1.0 0.84959 0.03654 0.51844 1.0000 + Au Au122 1.0 0.84959 0.11987 0.51844 1.0000 + Au Au123 1.0 0.84959 0.20321 0.51844 1.0000 + Au Au124 1.0 0.84959 0.28654 0.51844 1.0000 + Au Au125 1.0 0.84959 0.36987 0.51844 1.0000 + Au Au126 1.0 0.84959 0.45321 0.51844 1.0000 + Au Au127 1.0 0.84959 0.53654 0.51844 1.0000 + Au Au128 1.0 0.84959 0.61987 0.51844 1.0000 + Au Au129 1.0 0.84959 0.70321 0.51844 1.0000 + Au Au130 1.0 0.84959 0.78654 0.51844 1.0000 + Au Au131 1.0 0.84959 0.86987 0.51844 1.0000 + Au Au132 1.0 0.84959 0.95321 0.51844 1.0000 + Au Au133 1.0 0.93293 0.03654 0.51844 1.0000 + Au Au134 1.0 0.93293 0.11987 0.51844 1.0000 + Au Au135 1.0 0.93293 0.20321 0.51844 1.0000 + Au Au136 1.0 0.93293 0.28654 0.51844 1.0000 + Au Au137 1.0 0.93293 0.36987 0.51844 1.0000 + Au Au138 1.0 0.93293 0.45321 0.51844 1.0000 + Au Au139 1.0 0.93293 0.53654 0.51844 1.0000 + Au Au140 1.0 0.93293 0.61987 0.51844 1.0000 + Au Au141 1.0 0.93293 0.70321 0.51844 1.0000 + Au Au142 1.0 0.93293 0.78654 0.51844 1.0000 + Au Au143 1.0 0.93293 0.86987 0.51844 1.0000 + Au Au144 1.0 0.93293 0.95321 0.51844 1.0000 + Au Au145 1.0 0.06707 0.04679 0.51844 1.0000 + Au Au146 1.0 0.06707 0.13013 0.51844 1.0000 + Au Au147 1.0 0.06707 0.21346 0.51844 1.0000 + Au Au148 1.0 0.06707 0.29679 0.51844 1.0000 + Au Au149 1.0 0.06707 0.38013 0.51844 1.0000 + Au Au150 1.0 0.06707 0.46346 0.51844 1.0000 + Au Au151 1.0 0.06707 0.54679 0.51844 1.0000 + Au Au152 1.0 0.06707 0.63013 0.51844 1.0000 + Au Au153 1.0 0.06707 0.71346 0.51844 1.0000 + Au Au154 1.0 0.06707 0.79679 0.51844 1.0000 + Au Au155 1.0 0.06707 0.88013 0.51844 1.0000 + Au Au156 1.0 0.06707 0.96346 0.51844 1.0000 + Au Au157 1.0 0.15041 0.04679 0.51844 1.0000 + Au Au158 1.0 0.15041 0.13013 0.51844 1.0000 + Au Au159 1.0 0.15041 0.21346 0.51844 1.0000 + Au Au160 1.0 0.15041 0.29679 0.51844 1.0000 + Au Au161 1.0 0.15041 0.38013 0.51844 1.0000 + Au Au162 1.0 0.15041 0.46346 0.51844 1.0000 + Au Au163 1.0 0.15041 0.54679 0.51844 1.0000 + Au Au164 1.0 0.15041 0.63013 0.51844 1.0000 + Au Au165 1.0 0.15041 0.71346 0.51844 1.0000 + Au Au166 1.0 0.15041 0.79679 0.51844 1.0000 + Au Au167 1.0 0.15041 0.88013 0.51844 1.0000 + Au Au168 1.0 0.15041 0.96346 0.51844 1.0000 + Au Au169 1.0 0.23374 0.04679 0.51844 1.0000 + Au Au170 1.0 0.23374 0.13013 0.51844 1.0000 + Au Au171 1.0 0.23374 0.21346 0.51844 1.0000 + Au Au172 1.0 0.23374 0.29679 0.51844 1.0000 + Au Au173 1.0 0.23374 0.38013 0.51844 1.0000 + Au Au174 1.0 0.23374 0.46346 0.51844 1.0000 + Au Au175 1.0 0.23374 0.54679 0.51844 1.0000 + Au Au176 1.0 0.23374 0.63013 0.51844 1.0000 + Au Au177 1.0 0.23374 0.71346 0.51844 1.0000 + Au Au178 1.0 0.23374 0.79679 0.51844 1.0000 + Au Au179 1.0 0.23374 0.88013 0.51844 1.0000 + Au Au180 1.0 0.23374 0.96346 0.51844 1.0000 + Au Au181 1.0 0.31707 0.04679 0.51844 1.0000 + Au Au182 1.0 0.31707 0.13013 0.51844 1.0000 + Au Au183 1.0 0.31707 0.21346 0.51844 1.0000 + Au Au184 1.0 0.31707 0.29679 0.51844 1.0000 + Au Au185 1.0 0.31707 0.38013 0.51844 1.0000 + Au Au186 1.0 0.31707 0.46346 0.51844 1.0000 + Au Au187 1.0 0.31707 0.54679 0.51844 1.0000 + Au Au188 1.0 0.31707 0.63013 0.51844 1.0000 + Au Au189 1.0 0.31707 0.71346 0.51844 1.0000 + Au Au190 1.0 0.31707 0.79679 0.51844 1.0000 + Au Au191 1.0 0.31707 0.88013 0.51844 1.0000 + Au Au192 1.0 0.31707 0.96346 0.51844 1.0000 + Au Au193 1.0 0.40041 0.04679 0.51844 1.0000 + Au Au194 1.0 0.40041 0.13013 0.51844 1.0000 + Au Au195 1.0 0.40041 0.21346 0.51844 1.0000 + Au Au196 1.0 0.40041 0.29679 0.51844 1.0000 + Au Au197 1.0 0.40041 0.38013 0.51844 1.0000 + Au Au198 1.0 0.40041 0.46346 0.51844 1.0000 + Au Au199 1.0 0.40041 0.54679 0.51844 1.0000 + Au Au200 1.0 0.40041 0.63013 0.51844 1.0000 + Au Au201 1.0 0.40041 0.71346 0.51844 1.0000 + Au Au202 1.0 0.40041 0.79679 0.51844 1.0000 + Au Au203 1.0 0.40041 0.88013 0.51844 1.0000 + Au Au204 1.0 0.40041 0.96346 0.51844 1.0000 + Au Au205 1.0 0.48374 0.04679 0.51844 1.0000 + Au Au206 1.0 0.48374 0.13013 0.51844 1.0000 + Au Au207 1.0 0.48374 0.21346 0.51844 1.0000 + Au Au208 1.0 0.48374 0.29679 0.51844 1.0000 + Au Au209 1.0 0.48374 0.38013 0.51844 1.0000 + Au Au210 1.0 0.48374 0.46346 0.51844 1.0000 + Au Au211 1.0 0.48374 0.54679 0.51844 1.0000 + Au Au212 1.0 0.48374 0.63013 0.51844 1.0000 + Au Au213 1.0 0.48374 0.71346 0.51844 1.0000 + Au Au214 1.0 0.48374 0.79679 0.51844 1.0000 + Au Au215 1.0 0.48374 0.88013 0.51844 1.0000 + Au Au216 1.0 0.48374 0.96346 0.51844 1.0000 + Au Au217 1.0 0.56707 0.04679 0.51844 1.0000 + Au Au218 1.0 0.56707 0.13013 0.51844 1.0000 + Au Au219 1.0 0.56707 0.21346 0.51844 1.0000 + Au Au220 1.0 0.56707 0.29679 0.51844 1.0000 + Au Au221 1.0 0.56707 0.38013 0.51844 1.0000 + Au Au222 1.0 0.56707 0.46346 0.51844 1.0000 + Au Au223 1.0 0.56707 0.54679 0.51844 1.0000 + Au Au224 1.0 0.56707 0.63013 0.51844 1.0000 + Au Au225 1.0 0.56707 0.71346 0.51844 1.0000 + Au Au226 1.0 0.56707 0.79679 0.51844 1.0000 + Au Au227 1.0 0.56707 0.88013 0.51844 1.0000 + Au Au228 1.0 0.56707 0.96346 0.51844 1.0000 + Au Au229 1.0 0.65041 0.04679 0.51844 1.0000 + Au Au230 1.0 0.65041 0.13013 0.51844 1.0000 + Au Au231 1.0 0.65041 0.21346 0.51844 1.0000 + Au Au232 1.0 0.65041 0.29679 0.51844 1.0000 + Au Au233 1.0 0.65041 0.38013 0.51844 1.0000 + Au Au234 1.0 0.65041 0.46346 0.51844 1.0000 + Au Au235 1.0 0.65041 0.54679 0.51844 1.0000 + Au Au236 1.0 0.65041 0.63013 0.51844 1.0000 + Au Au237 1.0 0.65041 0.71346 0.51844 1.0000 + Au Au238 1.0 0.65041 0.79679 0.51844 1.0000 + Au Au239 1.0 0.65041 0.88013 0.51844 1.0000 + Au Au240 1.0 0.65041 0.96346 0.51844 1.0000 + Au Au241 1.0 0.73374 0.04679 0.51844 1.0000 + Au Au242 1.0 0.73374 0.13013 0.51844 1.0000 + Au Au243 1.0 0.73374 0.21346 0.51844 1.0000 + Au Au244 1.0 0.73374 0.29679 0.51844 1.0000 + Au Au245 1.0 0.73374 0.38013 0.51844 1.0000 + Au Au246 1.0 0.73374 0.46346 0.51844 1.0000 + Au Au247 1.0 0.73374 0.54679 0.51844 1.0000 + Au Au248 1.0 0.73374 0.63013 0.51844 1.0000 + Au Au249 1.0 0.73374 0.71346 0.51844 1.0000 + Au Au250 1.0 0.73374 0.79679 0.51844 1.0000 + Au Au251 1.0 0.73374 0.88013 0.51844 1.0000 + Au Au252 1.0 0.73374 0.96346 0.51844 1.0000 + Au Au253 1.0 0.81707 0.04679 0.51844 1.0000 + Au Au254 1.0 0.81707 0.13013 0.51844 1.0000 + Au Au255 1.0 0.81707 0.21346 0.51844 1.0000 + Au Au256 1.0 0.81707 0.29679 0.51844 1.0000 + Au Au257 1.0 0.81707 0.38013 0.51844 1.0000 + Au Au258 1.0 0.81707 0.46346 0.51844 1.0000 + Au Au259 1.0 0.81707 0.54679 0.51844 1.0000 + Au Au260 1.0 0.81707 0.63013 0.51844 1.0000 + Au Au261 1.0 0.81707 0.71346 0.51844 1.0000 + Au Au262 1.0 0.81707 0.79679 0.51844 1.0000 + Au Au263 1.0 0.81707 0.88013 0.51844 1.0000 + Au Au264 1.0 0.81707 0.96346 0.51844 1.0000 + Au Au265 1.0 0.90041 0.04679 0.51844 1.0000 + Au Au266 1.0 0.90041 0.13013 0.51844 1.0000 + Au Au267 1.0 0.90041 0.21346 0.51844 1.0000 + Au Au268 1.0 0.90041 0.29679 0.51844 1.0000 + Au Au269 1.0 0.90041 0.38013 0.51844 1.0000 + Au Au270 1.0 0.90041 0.46346 0.51844 1.0000 + Au Au271 1.0 0.90041 0.54679 0.51844 1.0000 + Au Au272 1.0 0.90041 0.63013 0.51844 1.0000 + Au Au273 1.0 0.90041 0.71346 0.51844 1.0000 + Au Au274 1.0 0.90041 0.79679 0.51844 1.0000 + Au Au275 1.0 0.90041 0.88013 0.51844 1.0000 + Au Au276 1.0 0.90041 0.96346 0.51844 1.0000 + Au Au277 1.0 0.98374 0.04679 0.51844 1.0000 + Au Au278 1.0 0.98374 0.13013 0.51844 1.0000 + Au Au279 1.0 0.98374 0.21346 0.51844 1.0000 + Au Au280 1.0 0.98374 0.29679 0.51844 1.0000 + Au Au281 1.0 0.98374 0.38013 0.51844 1.0000 + Au Au282 1.0 0.98374 0.46346 0.51844 1.0000 + Au Au283 1.0 0.98374 0.54679 0.51844 1.0000 + Au Au284 1.0 0.98374 0.63013 0.51844 1.0000 + Au Au285 1.0 0.98374 0.71346 0.51844 1.0000 + Au Au286 1.0 0.98374 0.79679 0.51844 1.0000 + Au Au287 1.0 0.98374 0.88013 0.51844 1.0000 + Au Au288 1.0 0.98374 0.96346 0.51844 1.0000 + Au Au289 1.0 0.02541 0.07821 0.51844 1.0000 + Au Au290 1.0 0.02541 0.16154 0.51844 1.0000 + Au Au291 1.0 0.02541 0.24487 0.51844 1.0000 + Au Au292 1.0 0.02541 0.32821 0.51844 1.0000 + Au Au293 1.0 0.02541 0.41154 0.51844 1.0000 + Au Au294 1.0 0.02541 0.49487 0.51844 1.0000 + Au Au295 1.0 0.02541 0.57821 0.51844 1.0000 + Au Au296 1.0 0.02541 0.66154 0.51844 1.0000 + Au Au297 1.0 0.02541 0.74487 0.51844 1.0000 + Au Au298 1.0 0.02541 0.82821 0.51844 1.0000 + Au Au299 1.0 0.02541 0.91154 0.51844 1.0000 + Au Au300 1.0 0.02541 0.99487 0.51844 1.0000 + Au Au301 1.0 0.10874 0.07821 0.51844 1.0000 + Au Au302 1.0 0.10874 0.16154 0.51844 1.0000 + Au Au303 1.0 0.10874 0.24487 0.51844 1.0000 + Au Au304 1.0 0.10874 0.32821 0.51844 1.0000 + Au Au305 1.0 0.10874 0.41154 0.51844 1.0000 + Au Au306 1.0 0.10874 0.49487 0.51844 1.0000 + Au Au307 1.0 0.10874 0.57821 0.51844 1.0000 + Au Au308 1.0 0.10874 0.66154 0.51844 1.0000 + Au Au309 1.0 0.10874 0.74487 0.51844 1.0000 + Au Au310 1.0 0.10874 0.82821 0.51844 1.0000 + Au Au311 1.0 0.10874 0.91154 0.51844 1.0000 + Au Au312 1.0 0.10874 0.99487 0.51844 1.0000 + Au Au313 1.0 0.19207 0.07821 0.51844 1.0000 + Au Au314 1.0 0.19207 0.16154 0.51844 1.0000 + Au Au315 1.0 0.19207 0.24487 0.51844 1.0000 + Au Au316 1.0 0.19207 0.32821 0.51844 1.0000 + Au Au317 1.0 0.19207 0.41154 0.51844 1.0000 + Au Au318 1.0 0.19207 0.49487 0.51844 1.0000 + Au Au319 1.0 0.19207 0.57821 0.51844 1.0000 + Au Au320 1.0 0.19207 0.66154 0.51844 1.0000 + Au Au321 1.0 0.19207 0.74487 0.51844 1.0000 + Au Au322 1.0 0.19207 0.82821 0.51844 1.0000 + Au Au323 1.0 0.19207 0.91154 0.51844 1.0000 + Au Au324 1.0 0.19207 0.99487 0.51844 1.0000 + Au Au325 1.0 0.27541 0.07821 0.51844 1.0000 + Au Au326 1.0 0.27541 0.16154 0.51844 1.0000 + Au Au327 1.0 0.27541 0.24487 0.51844 1.0000 + Au Au328 1.0 0.27541 0.32821 0.51844 1.0000 + Au Au329 1.0 0.27541 0.41154 0.51844 1.0000 + Au Au330 1.0 0.27541 0.49487 0.51844 1.0000 + Au Au331 1.0 0.27541 0.57821 0.51844 1.0000 + Au Au332 1.0 0.27541 0.66154 0.51844 1.0000 + Au Au333 1.0 0.27541 0.74487 0.51844 1.0000 + Au Au334 1.0 0.27541 0.82821 0.51844 1.0000 + Au Au335 1.0 0.27541 0.91154 0.51844 1.0000 + Au Au336 1.0 0.27541 0.99487 0.51844 1.0000 + Au Au337 1.0 0.35874 0.07821 0.51844 1.0000 + Au Au338 1.0 0.35874 0.16154 0.51844 1.0000 + Au Au339 1.0 0.35874 0.24487 0.51844 1.0000 + Au Au340 1.0 0.35874 0.32821 0.51844 1.0000 + Au Au341 1.0 0.35874 0.41154 0.51844 1.0000 + Au Au342 1.0 0.35874 0.49487 0.51844 1.0000 + Au Au343 1.0 0.35874 0.57821 0.51844 1.0000 + Au Au344 1.0 0.35874 0.66154 0.51844 1.0000 + Au Au345 1.0 0.35874 0.74487 0.51844 1.0000 + Au Au346 1.0 0.35874 0.82821 0.51844 1.0000 + Au Au347 1.0 0.35874 0.91154 0.51844 1.0000 + Au Au348 1.0 0.35874 0.99487 0.51844 1.0000 + Au Au349 1.0 0.44207 0.07821 0.51844 1.0000 + Au Au350 1.0 0.44207 0.16154 0.51844 1.0000 + Au Au351 1.0 0.44207 0.24487 0.51844 1.0000 + Au Au352 1.0 0.44207 0.32821 0.51844 1.0000 + Au Au353 1.0 0.44207 0.41154 0.51844 1.0000 + Au Au354 1.0 0.44207 0.49487 0.51844 1.0000 + Au Au355 1.0 0.44207 0.57821 0.51844 1.0000 + Au Au356 1.0 0.44207 0.66154 0.51844 1.0000 + Au Au357 1.0 0.44207 0.74487 0.51844 1.0000 + Au Au358 1.0 0.44207 0.82821 0.51844 1.0000 + Au Au359 1.0 0.44207 0.91154 0.51844 1.0000 + Au Au360 1.0 0.44207 0.99487 0.51844 1.0000 + Au Au361 1.0 0.52541 0.07821 0.51844 1.0000 + Au Au362 1.0 0.52541 0.16154 0.51844 1.0000 + Au Au363 1.0 0.52541 0.24487 0.51844 1.0000 + Au Au364 1.0 0.52541 0.32821 0.51844 1.0000 + Au Au365 1.0 0.52541 0.41154 0.51844 1.0000 + Au Au366 1.0 0.52541 0.49487 0.51844 1.0000 + Au Au367 1.0 0.52541 0.57821 0.51844 1.0000 + Au Au368 1.0 0.52541 0.66154 0.51844 1.0000 + Au Au369 1.0 0.52541 0.74487 0.51844 1.0000 + Au Au370 1.0 0.52541 0.82821 0.51844 1.0000 + Au Au371 1.0 0.52541 0.91154 0.51844 1.0000 + Au Au372 1.0 0.52541 0.99487 0.51844 1.0000 + Au Au373 1.0 0.60874 0.07821 0.51844 1.0000 + Au Au374 1.0 0.60874 0.16154 0.51844 1.0000 + Au Au375 1.0 0.60874 0.24487 0.51844 1.0000 + Au Au376 1.0 0.60874 0.32821 0.51844 1.0000 + Au Au377 1.0 0.60874 0.41154 0.51844 1.0000 + Au Au378 1.0 0.60874 0.49487 0.51844 1.0000 + Au Au379 1.0 0.60874 0.57821 0.51844 1.0000 + Au Au380 1.0 0.60874 0.66154 0.51844 1.0000 + Au Au381 1.0 0.60874 0.74487 0.51844 1.0000 + Au Au382 1.0 0.60874 0.82821 0.51844 1.0000 + Au Au383 1.0 0.60874 0.91154 0.51844 1.0000 + Au Au384 1.0 0.60874 0.99487 0.51844 1.0000 + Au Au385 1.0 0.69207 0.07821 0.51844 1.0000 + Au Au386 1.0 0.69207 0.16154 0.51844 1.0000 + Au Au387 1.0 0.69207 0.24487 0.51844 1.0000 + Au Au388 1.0 0.69207 0.32821 0.51844 1.0000 + Au Au389 1.0 0.69207 0.41154 0.51844 1.0000 + Au Au390 1.0 0.69207 0.49487 0.51844 1.0000 + Au Au391 1.0 0.69207 0.57821 0.51844 1.0000 + Au Au392 1.0 0.69207 0.66154 0.51844 1.0000 + Au Au393 1.0 0.69207 0.74487 0.51844 1.0000 + Au Au394 1.0 0.69207 0.82821 0.51844 1.0000 + Au Au395 1.0 0.69207 0.91154 0.51844 1.0000 + Au Au396 1.0 0.69207 0.99487 0.51844 1.0000 + Au Au397 1.0 0.77541 0.07821 0.51844 1.0000 + Au Au398 1.0 0.77541 0.16154 0.51844 1.0000 + Au Au399 1.0 0.77541 0.24487 0.51844 1.0000 + Au Au400 1.0 0.77541 0.32821 0.51844 1.0000 + Au Au401 1.0 0.77541 0.41154 0.51844 1.0000 + Au Au402 1.0 0.77541 0.49487 0.51844 1.0000 + Au Au403 1.0 0.77541 0.57821 0.51844 1.0000 + Au Au404 1.0 0.77541 0.66154 0.51844 1.0000 + Au Au405 1.0 0.77541 0.74487 0.51844 1.0000 + Au Au406 1.0 0.77541 0.82821 0.51844 1.0000 + Au Au407 1.0 0.77541 0.91154 0.51844 1.0000 + Au Au408 1.0 0.77541 0.99487 0.51844 1.0000 + Au Au409 1.0 0.85874 0.07821 0.51844 1.0000 + Au Au410 1.0 0.85874 0.16154 0.51844 1.0000 + Au Au411 1.0 0.85874 0.24487 0.51844 1.0000 + Au Au412 1.0 0.85874 0.32821 0.51844 1.0000 + Au Au413 1.0 0.85874 0.41154 0.51844 1.0000 + Au Au414 1.0 0.85874 0.49487 0.51844 1.0000 + Au Au415 1.0 0.85874 0.57821 0.51844 1.0000 + Au Au416 1.0 0.85874 0.66154 0.51844 1.0000 + Au Au417 1.0 0.85874 0.74487 0.51844 1.0000 + Au Au418 1.0 0.85874 0.82821 0.51844 1.0000 + Au Au419 1.0 0.85874 0.91154 0.51844 1.0000 + Au Au420 1.0 0.85874 0.99487 0.51844 1.0000 + Au Au421 1.0 0.94207 0.07821 0.51844 1.0000 + Au Au422 1.0 0.94207 0.16154 0.51844 1.0000 + Au Au423 1.0 0.94207 0.24487 0.51844 1.0000 + Au Au424 1.0 0.94207 0.32821 0.51844 1.0000 + Au Au425 1.0 0.94207 0.41154 0.51844 1.0000 + Au Au426 1.0 0.94207 0.49487 0.51844 1.0000 + Au Au427 1.0 0.94207 0.57821 0.51844 1.0000 + Au Au428 1.0 0.94207 0.66154 0.51844 1.0000 + Au Au429 1.0 0.94207 0.74487 0.51844 1.0000 + Au Au430 1.0 0.94207 0.82821 0.51844 1.0000 + Au Au431 1.0 0.94207 0.91154 0.51844 1.0000 + Au Au432 1.0 0.94207 0.99487 0.51844 1.0000 + Au Au433 1.0 0.05793 0.00513 0.51844 1.0000 + Au Au434 1.0 0.05793 0.08846 0.51844 1.0000 + Au Au435 1.0 0.05793 0.17179 0.51844 1.0000 + Au Au436 1.0 0.05793 0.25513 0.51844 1.0000 + Au Au437 1.0 0.05793 0.33846 0.51844 1.0000 + Au Au438 1.0 0.05793 0.42179 0.51844 1.0000 + Au Au439 1.0 0.05793 0.50513 0.51844 1.0000 + Au Au440 1.0 0.05793 0.58846 0.51844 1.0000 + Au Au441 1.0 0.05793 0.67179 0.51844 1.0000 + Au Au442 1.0 0.05793 0.75513 0.51844 1.0000 + Au Au443 1.0 0.05793 0.83846 0.51844 1.0000 + Au Au444 1.0 0.05793 0.92179 0.51844 1.0000 + Au Au445 1.0 0.14126 0.00513 0.51844 1.0000 + Au Au446 1.0 0.14126 0.08846 0.51844 1.0000 + Au Au447 1.0 0.14126 0.17179 0.51844 1.0000 + Au Au448 1.0 0.14126 0.25513 0.51844 1.0000 + Au Au449 1.0 0.14126 0.33846 0.51844 1.0000 + Au Au450 1.0 0.14126 0.42179 0.51844 1.0000 + Au Au451 1.0 0.14126 0.50513 0.51844 1.0000 + Au Au452 1.0 0.14126 0.58846 0.51844 1.0000 + Au Au453 1.0 0.14126 0.67179 0.51844 1.0000 + Au Au454 1.0 0.14126 0.75513 0.51844 1.0000 + Au Au455 1.0 0.14126 0.83846 0.51844 1.0000 + Au Au456 1.0 0.14126 0.92179 0.51844 1.0000 + Au Au457 1.0 0.22459 0.00513 0.51844 1.0000 + Au Au458 1.0 0.22459 0.08846 0.51844 1.0000 + Au Au459 1.0 0.22459 0.17179 0.51844 1.0000 + Au Au460 1.0 0.22459 0.25513 0.51844 1.0000 + Au Au461 1.0 0.22459 0.33846 0.51844 1.0000 + Au Au462 1.0 0.22459 0.42179 0.51844 1.0000 + Au Au463 1.0 0.22459 0.50513 0.51844 1.0000 + Au Au464 1.0 0.22459 0.58846 0.51844 1.0000 + Au Au465 1.0 0.22459 0.67179 0.51844 1.0000 + Au Au466 1.0 0.22459 0.75513 0.51844 1.0000 + Au Au467 1.0 0.22459 0.83846 0.51844 1.0000 + Au Au468 1.0 0.22459 0.92179 0.51844 1.0000 + Au Au469 1.0 0.30793 0.00513 0.51844 1.0000 + Au Au470 1.0 0.30793 0.08846 0.51844 1.0000 + Au Au471 1.0 0.30793 0.17179 0.51844 1.0000 + Au Au472 1.0 0.30793 0.25513 0.51844 1.0000 + Au Au473 1.0 0.30793 0.33846 0.51844 1.0000 + Au Au474 1.0 0.30793 0.42179 0.51844 1.0000 + Au Au475 1.0 0.30793 0.50513 0.51844 1.0000 + Au Au476 1.0 0.30793 0.58846 0.51844 1.0000 + Au Au477 1.0 0.30793 0.67179 0.51844 1.0000 + Au Au478 1.0 0.30793 0.75513 0.51844 1.0000 + Au Au479 1.0 0.30793 0.83846 0.51844 1.0000 + Au Au480 1.0 0.30793 0.92179 0.51844 1.0000 + Au Au481 1.0 0.39126 0.00513 0.51844 1.0000 + Au Au482 1.0 0.39126 0.08846 0.51844 1.0000 + Au Au483 1.0 0.39126 0.17179 0.51844 1.0000 + Au Au484 1.0 0.39126 0.25513 0.51844 1.0000 + Au Au485 1.0 0.39126 0.33846 0.51844 1.0000 + Au Au486 1.0 0.39126 0.42179 0.51844 1.0000 + Au Au487 1.0 0.39126 0.50513 0.51844 1.0000 + Au Au488 1.0 0.39126 0.58846 0.51844 1.0000 + Au Au489 1.0 0.39126 0.67179 0.51844 1.0000 + Au Au490 1.0 0.39126 0.75513 0.51844 1.0000 + Au Au491 1.0 0.39126 0.83846 0.51844 1.0000 + Au Au492 1.0 0.39126 0.92179 0.51844 1.0000 + Au Au493 1.0 0.47459 0.00513 0.51844 1.0000 + Au Au494 1.0 0.47459 0.08846 0.51844 1.0000 + Au Au495 1.0 0.47459 0.17179 0.51844 1.0000 + Au Au496 1.0 0.47459 0.25513 0.51844 1.0000 + Au Au497 1.0 0.47459 0.33846 0.51844 1.0000 + Au Au498 1.0 0.47459 0.42179 0.51844 1.0000 + Au Au499 1.0 0.47459 0.50513 0.51844 1.0000 + Au Au500 1.0 0.47459 0.58846 0.51844 1.0000 + Au Au501 1.0 0.47459 0.67179 0.51844 1.0000 + Au Au502 1.0 0.47459 0.75513 0.51844 1.0000 + Au Au503 1.0 0.47459 0.83846 0.51844 1.0000 + Au Au504 1.0 0.47459 0.92179 0.51844 1.0000 + Au Au505 1.0 0.55793 0.00513 0.51844 1.0000 + Au Au506 1.0 0.55793 0.08846 0.51844 1.0000 + Au Au507 1.0 0.55793 0.17179 0.51844 1.0000 + Au Au508 1.0 0.55793 0.25513 0.51844 1.0000 + Au Au509 1.0 0.55793 0.33846 0.51844 1.0000 + Au Au510 1.0 0.55793 0.42179 0.51844 1.0000 + Au Au511 1.0 0.55793 0.50513 0.51844 1.0000 + Au Au512 1.0 0.55793 0.58846 0.51844 1.0000 + Au Au513 1.0 0.55793 0.67179 0.51844 1.0000 + Au Au514 1.0 0.55793 0.75513 0.51844 1.0000 + Au Au515 1.0 0.55793 0.83846 0.51844 1.0000 + Au Au516 1.0 0.55793 0.92179 0.51844 1.0000 + Au Au517 1.0 0.64126 0.00513 0.51844 1.0000 + Au Au518 1.0 0.64126 0.08846 0.51844 1.0000 + Au Au519 1.0 0.64126 0.17179 0.51844 1.0000 + Au Au520 1.0 0.64126 0.25513 0.51844 1.0000 + Au Au521 1.0 0.64126 0.33846 0.51844 1.0000 + Au Au522 1.0 0.64126 0.42179 0.51844 1.0000 + Au Au523 1.0 0.64126 0.50513 0.51844 1.0000 + Au Au524 1.0 0.64126 0.58846 0.51844 1.0000 + Au Au525 1.0 0.64126 0.67179 0.51844 1.0000 + Au Au526 1.0 0.64126 0.75513 0.51844 1.0000 + Au Au527 1.0 0.64126 0.83846 0.51844 1.0000 + Au Au528 1.0 0.64126 0.92179 0.51844 1.0000 + Au Au529 1.0 0.72459 0.00513 0.51844 1.0000 + Au Au530 1.0 0.72459 0.08846 0.51844 1.0000 + Au Au531 1.0 0.72459 0.17179 0.51844 1.0000 + Au Au532 1.0 0.72459 0.25513 0.51844 1.0000 + Au Au533 1.0 0.72459 0.33846 0.51844 1.0000 + Au Au534 1.0 0.72459 0.42179 0.51844 1.0000 + Au Au535 1.0 0.72459 0.50513 0.51844 1.0000 + Au Au536 1.0 0.72459 0.58846 0.51844 1.0000 + Au Au537 1.0 0.72459 0.67179 0.51844 1.0000 + Au Au538 1.0 0.72459 0.75513 0.51844 1.0000 + Au Au539 1.0 0.72459 0.83846 0.51844 1.0000 + Au Au540 1.0 0.72459 0.92179 0.51844 1.0000 + Au Au541 1.0 0.80793 0.00513 0.51844 1.0000 + Au Au542 1.0 0.80793 0.08846 0.51844 1.0000 + Au Au543 1.0 0.80793 0.17179 0.51844 1.0000 + Au Au544 1.0 0.80793 0.25513 0.51844 1.0000 + Au Au545 1.0 0.80793 0.33846 0.51844 1.0000 + Au Au546 1.0 0.80793 0.42179 0.51844 1.0000 + Au Au547 1.0 0.80793 0.50513 0.51844 1.0000 + Au Au548 1.0 0.80793 0.58846 0.51844 1.0000 + Au Au549 1.0 0.80793 0.67179 0.51844 1.0000 + Au Au550 1.0 0.80793 0.75513 0.51844 1.0000 + Au Au551 1.0 0.80793 0.83846 0.51844 1.0000 + Au Au552 1.0 0.80793 0.92179 0.51844 1.0000 + Au Au553 1.0 0.89126 0.00513 0.51844 1.0000 + Au Au554 1.0 0.89126 0.08846 0.51844 1.0000 + Au Au555 1.0 0.89126 0.17179 0.51844 1.0000 + Au Au556 1.0 0.89126 0.25513 0.51844 1.0000 + Au Au557 1.0 0.89126 0.33846 0.51844 1.0000 + Au Au558 1.0 0.89126 0.42179 0.51844 1.0000 + Au Au559 1.0 0.89126 0.50513 0.51844 1.0000 + Au Au560 1.0 0.89126 0.58846 0.51844 1.0000 + Au Au561 1.0 0.89126 0.67179 0.51844 1.0000 + Au Au562 1.0 0.89126 0.75513 0.51844 1.0000 + Au Au563 1.0 0.89126 0.83846 0.51844 1.0000 + Au Au564 1.0 0.89126 0.92179 0.51844 1.0000 + Au Au565 1.0 0.97459 0.00513 0.51844 1.0000 + Au Au566 1.0 0.97459 0.08846 0.51844 1.0000 + Au Au567 1.0 0.97459 0.17179 0.51844 1.0000 + Au Au568 1.0 0.97459 0.25513 0.51844 1.0000 + Au Au569 1.0 0.97459 0.33846 0.51844 1.0000 + Au Au570 1.0 0.97459 0.42179 0.51844 1.0000 + Au Au571 1.0 0.97459 0.50513 0.51844 1.0000 + Au Au572 1.0 0.97459 0.58846 0.51844 1.0000 + Au Au573 1.0 0.97459 0.67179 0.51844 1.0000 + Au Au574 1.0 0.97459 0.75513 0.51844 1.0000 + Au Au575 1.0 0.97459 0.83846 0.51844 1.0000 + Au Au576 1.0 0.97459 0.92179 0.51844 1.0000 + Se Se1 1.0 0.00875 0.01407 0.35955 1.0000 + Se Se2 1.0 0.00875 0.09741 0.35955 1.0000 + Se Se3 1.0 0.00875 0.18074 0.35955 1.0000 + Se Se4 1.0 0.00875 0.26407 0.35955 1.0000 + Se Se5 1.0 0.00875 0.34741 0.35955 1.0000 + Se Se6 1.0 0.00875 0.43074 0.35955 1.0000 + Se Se7 1.0 0.00875 0.51407 0.35955 1.0000 + Se Se8 1.0 0.00875 0.59741 0.35955 1.0000 + Se Se9 1.0 0.00875 0.68074 0.35955 1.0000 + Se Se10 1.0 0.00875 0.76407 0.35955 1.0000 + Se Se11 1.0 0.00875 0.84741 0.35955 1.0000 + Se Se12 1.0 0.00875 0.93074 0.35955 1.0000 + Se Se13 1.0 0.09208 0.01407 0.35955 1.0000 + Se Se14 1.0 0.09208 0.09741 0.35955 1.0000 + Se Se15 1.0 0.09208 0.18074 0.35955 1.0000 + Se Se16 1.0 0.09208 0.26407 0.35955 1.0000 + Se Se17 1.0 0.09208 0.34741 0.35955 1.0000 + Se Se18 1.0 0.09208 0.43074 0.35955 1.0000 + Se Se19 1.0 0.09208 0.51407 0.35955 1.0000 + Se Se20 1.0 0.09208 0.59741 0.35955 1.0000 + Se Se21 1.0 0.09208 0.68074 0.35955 1.0000 + Se Se22 1.0 0.09208 0.76407 0.35955 1.0000 + Se Se23 1.0 0.09208 0.84741 0.35955 1.0000 + Se Se24 1.0 0.09208 0.93074 0.35955 1.0000 + Se Se25 1.0 0.17541 0.01407 0.35955 1.0000 + Se Se26 1.0 0.17541 0.09741 0.35955 1.0000 + Se Se27 1.0 0.17541 0.18074 0.35955 1.0000 + Se Se28 1.0 0.17541 0.26407 0.35955 1.0000 + Se Se29 1.0 0.17541 0.34741 0.35955 1.0000 + Se Se30 1.0 0.17541 0.43074 0.35955 1.0000 + Se Se31 1.0 0.17541 0.51407 0.35955 1.0000 + Se Se32 1.0 0.17541 0.59741 0.35955 1.0000 + Se Se33 1.0 0.17541 0.68074 0.35955 1.0000 + Se Se34 1.0 0.17541 0.76407 0.35955 1.0000 + Se Se35 1.0 0.17541 0.84741 0.35955 1.0000 + Se Se36 1.0 0.17541 0.93074 0.35955 1.0000 + Se Se37 1.0 0.25875 0.01407 0.35955 1.0000 + Se Se38 1.0 0.25875 0.09741 0.35955 1.0000 + Se Se39 1.0 0.25875 0.18074 0.35955 1.0000 + Se Se40 1.0 0.25875 0.26407 0.35955 1.0000 + Se Se41 1.0 0.25875 0.34741 0.35955 1.0000 + Se Se42 1.0 0.25875 0.43074 0.35955 1.0000 + Se Se43 1.0 0.25875 0.51407 0.35955 1.0000 + Se Se44 1.0 0.25875 0.59741 0.35955 1.0000 + Se Se45 1.0 0.25875 0.68074 0.35955 1.0000 + Se Se46 1.0 0.25875 0.76407 0.35955 1.0000 + Se Se47 1.0 0.25875 0.84741 0.35955 1.0000 + Se Se48 1.0 0.25875 0.93074 0.35955 1.0000 + Se Se49 1.0 0.34208 0.01407 0.35955 1.0000 + Se Se50 1.0 0.34208 0.09741 0.35955 1.0000 + Se Se51 1.0 0.34208 0.18074 0.35955 1.0000 + Se Se52 1.0 0.34208 0.26407 0.35955 1.0000 + Se Se53 1.0 0.34208 0.34741 0.35955 1.0000 + Se Se54 1.0 0.34208 0.43074 0.35955 1.0000 + Se Se55 1.0 0.34208 0.51407 0.35955 1.0000 + Se Se56 1.0 0.34208 0.59741 0.35955 1.0000 + Se Se57 1.0 0.34208 0.68074 0.35955 1.0000 + Se Se58 1.0 0.34208 0.76407 0.35955 1.0000 + Se Se59 1.0 0.34208 0.84741 0.35955 1.0000 + Se Se60 1.0 0.34208 0.93074 0.35955 1.0000 + Se Se61 1.0 0.42541 0.01407 0.35955 1.0000 + Se Se62 1.0 0.42541 0.09741 0.35955 1.0000 + Se Se63 1.0 0.42541 0.18074 0.35955 1.0000 + Se Se64 1.0 0.42541 0.26407 0.35955 1.0000 + Se Se65 1.0 0.42541 0.34741 0.35955 1.0000 + Se Se66 1.0 0.42541 0.43074 0.35955 1.0000 + Se Se67 1.0 0.42541 0.51407 0.35955 1.0000 + Se Se68 1.0 0.42541 0.59741 0.35955 1.0000 + Se Se69 1.0 0.42541 0.68074 0.35955 1.0000 + Se Se70 1.0 0.42541 0.76407 0.35955 1.0000 + Se Se71 1.0 0.42541 0.84741 0.35955 1.0000 + Se Se72 1.0 0.42541 0.93074 0.35955 1.0000 + Se Se73 1.0 0.50875 0.01407 0.35955 1.0000 + Se Se74 1.0 0.50875 0.09741 0.35955 1.0000 + Se Se75 1.0 0.50875 0.18074 0.35955 1.0000 + Se Se76 1.0 0.50875 0.26407 0.35955 1.0000 + Se Se77 1.0 0.50875 0.34741 0.35955 1.0000 + Se Se78 1.0 0.50875 0.43074 0.35955 1.0000 + Se Se79 1.0 0.50875 0.51407 0.35955 1.0000 + Se Se80 1.0 0.50875 0.59741 0.35955 1.0000 + Se Se81 1.0 0.50875 0.68074 0.35955 1.0000 + Se Se82 1.0 0.50875 0.76407 0.35955 1.0000 + Se Se83 1.0 0.50875 0.84741 0.35955 1.0000 + Se Se84 1.0 0.50875 0.93074 0.35955 1.0000 + Se Se85 1.0 0.59208 0.01407 0.35955 1.0000 + Se Se86 1.0 0.59208 0.09741 0.35955 1.0000 + Se Se87 1.0 0.59208 0.18074 0.35955 1.0000 + Se Se88 1.0 0.59208 0.26407 0.35955 1.0000 + Se Se89 1.0 0.59208 0.34741 0.35955 1.0000 + Se Se90 1.0 0.59208 0.43074 0.35955 1.0000 + Se Se91 1.0 0.59208 0.51407 0.35955 1.0000 + Se Se92 1.0 0.59208 0.59741 0.35955 1.0000 + Se Se93 1.0 0.59208 0.68074 0.35955 1.0000 + Se Se94 1.0 0.59208 0.76407 0.35955 1.0000 + Se Se95 1.0 0.59208 0.84741 0.35955 1.0000 + Se Se96 1.0 0.59208 0.93074 0.35955 1.0000 + Se Se97 1.0 0.67541 0.01407 0.35955 1.0000 + Se Se98 1.0 0.67541 0.09741 0.35955 1.0000 + Se Se99 1.0 0.67541 0.18074 0.35955 1.0000 + Se Se100 1.0 0.67541 0.26407 0.35955 1.0000 + Se Se101 1.0 0.67541 0.34741 0.35955 1.0000 + Se Se102 1.0 0.67541 0.43074 0.35955 1.0000 + Se Se103 1.0 0.67541 0.51407 0.35955 1.0000 + Se Se104 1.0 0.67541 0.59741 0.35955 1.0000 + Se Se105 1.0 0.67541 0.68074 0.35955 1.0000 + Se Se106 1.0 0.67541 0.76407 0.35955 1.0000 + Se Se107 1.0 0.67541 0.84741 0.35955 1.0000 + Se Se108 1.0 0.67541 0.93074 0.35955 1.0000 + Se Se109 1.0 0.75875 0.01407 0.35955 1.0000 + Se Se110 1.0 0.75875 0.09741 0.35955 1.0000 + Se Se111 1.0 0.75875 0.18074 0.35955 1.0000 + Se Se112 1.0 0.75875 0.26407 0.35955 1.0000 + Se Se113 1.0 0.75875 0.34741 0.35955 1.0000 + Se Se114 1.0 0.75875 0.43074 0.35955 1.0000 + Se Se115 1.0 0.75875 0.51407 0.35955 1.0000 + Se Se116 1.0 0.75875 0.59741 0.35955 1.0000 + Se Se117 1.0 0.75875 0.68074 0.35955 1.0000 + Se Se118 1.0 0.75875 0.76407 0.35955 1.0000 + Se Se119 1.0 0.75875 0.84741 0.35955 1.0000 + Se Se120 1.0 0.75875 0.93074 0.35955 1.0000 + Se Se121 1.0 0.84208 0.01407 0.35955 1.0000 + Se Se122 1.0 0.84208 0.09741 0.35955 1.0000 + Se Se123 1.0 0.84208 0.18074 0.35955 1.0000 + Se Se124 1.0 0.84208 0.26407 0.35955 1.0000 + Se Se125 1.0 0.84208 0.34741 0.35955 1.0000 + Se Se126 1.0 0.84208 0.43074 0.35955 1.0000 + Se Se127 1.0 0.84208 0.51407 0.35955 1.0000 + Se Se128 1.0 0.84208 0.59741 0.35955 1.0000 + Se Se129 1.0 0.84208 0.68074 0.35955 1.0000 + Se Se130 1.0 0.84208 0.76407 0.35955 1.0000 + Se Se131 1.0 0.84208 0.84741 0.35955 1.0000 + Se Se132 1.0 0.84208 0.93074 0.35955 1.0000 + Se Se133 1.0 0.92541 0.01407 0.35955 1.0000 + Se Se134 1.0 0.92541 0.09741 0.35955 1.0000 + Se Se135 1.0 0.92541 0.18074 0.35955 1.0000 + Se Se136 1.0 0.92541 0.26407 0.35955 1.0000 + Se Se137 1.0 0.92541 0.34741 0.35955 1.0000 + Se Se138 1.0 0.92541 0.43074 0.35955 1.0000 + Se Se139 1.0 0.92541 0.51407 0.35955 1.0000 + Se Se140 1.0 0.92541 0.59741 0.35955 1.0000 + Se Se141 1.0 0.92541 0.68074 0.35955 1.0000 + Se Se142 1.0 0.92541 0.76407 0.35955 1.0000 + Se Se143 1.0 0.92541 0.84741 0.35955 1.0000 + Se Se144 1.0 0.92541 0.93074 0.35955 1.0000 + Se Se145 1.0 0.07459 0.06926 0.35955 1.0000 + Se Se146 1.0 0.07459 0.15259 0.35955 1.0000 + Se Se147 1.0 0.07459 0.23593 0.35955 1.0000 + Se Se148 1.0 0.07459 0.31926 0.35955 1.0000 + Se Se149 1.0 0.07459 0.40259 0.35955 1.0000 + Se Se150 1.0 0.07459 0.48593 0.35955 1.0000 + Se Se151 1.0 0.07459 0.56926 0.35955 1.0000 + Se Se152 1.0 0.07459 0.65259 0.35955 1.0000 + Se Se153 1.0 0.07459 0.73593 0.35955 1.0000 + Se Se154 1.0 0.07459 0.81926 0.35955 1.0000 + Se Se155 1.0 0.07459 0.90259 0.35955 1.0000 + Se Se156 1.0 0.07459 0.98593 0.35955 1.0000 + Se Se157 1.0 0.15792 0.06926 0.35955 1.0000 + Se Se158 1.0 0.15792 0.15259 0.35955 1.0000 + Se Se159 1.0 0.15792 0.23593 0.35955 1.0000 + Se Se160 1.0 0.15792 0.31926 0.35955 1.0000 + Se Se161 1.0 0.15792 0.40259 0.35955 1.0000 + Se Se162 1.0 0.15792 0.48593 0.35955 1.0000 + Se Se163 1.0 0.15792 0.56926 0.35955 1.0000 + Se Se164 1.0 0.15792 0.65259 0.35955 1.0000 + Se Se165 1.0 0.15792 0.73593 0.35955 1.0000 + Se Se166 1.0 0.15792 0.81926 0.35955 1.0000 + Se Se167 1.0 0.15792 0.90259 0.35955 1.0000 + Se Se168 1.0 0.15792 0.98593 0.35955 1.0000 + Se Se169 1.0 0.24125 0.06926 0.35955 1.0000 + Se Se170 1.0 0.24125 0.15259 0.35955 1.0000 + Se Se171 1.0 0.24125 0.23593 0.35955 1.0000 + Se Se172 1.0 0.24125 0.31926 0.35955 1.0000 + Se Se173 1.0 0.24125 0.40259 0.35955 1.0000 + Se Se174 1.0 0.24125 0.48593 0.35955 1.0000 + Se Se175 1.0 0.24125 0.56926 0.35955 1.0000 + Se Se176 1.0 0.24125 0.65259 0.35955 1.0000 + Se Se177 1.0 0.24125 0.73593 0.35955 1.0000 + Se Se178 1.0 0.24125 0.81926 0.35955 1.0000 + Se Se179 1.0 0.24125 0.90259 0.35955 1.0000 + Se Se180 1.0 0.24125 0.98593 0.35955 1.0000 + Se Se181 1.0 0.32459 0.06926 0.35955 1.0000 + Se Se182 1.0 0.32459 0.15259 0.35955 1.0000 + Se Se183 1.0 0.32459 0.23593 0.35955 1.0000 + Se Se184 1.0 0.32459 0.31926 0.35955 1.0000 + Se Se185 1.0 0.32459 0.40259 0.35955 1.0000 + Se Se186 1.0 0.32459 0.48593 0.35955 1.0000 + Se Se187 1.0 0.32459 0.56926 0.35955 1.0000 + Se Se188 1.0 0.32459 0.65259 0.35955 1.0000 + Se Se189 1.0 0.32459 0.73593 0.35955 1.0000 + Se Se190 1.0 0.32459 0.81926 0.35955 1.0000 + Se Se191 1.0 0.32459 0.90259 0.35955 1.0000 + Se Se192 1.0 0.32459 0.98593 0.35955 1.0000 + Se Se193 1.0 0.40792 0.06926 0.35955 1.0000 + Se Se194 1.0 0.40792 0.15259 0.35955 1.0000 + Se Se195 1.0 0.40792 0.23593 0.35955 1.0000 + Se Se196 1.0 0.40792 0.31926 0.35955 1.0000 + Se Se197 1.0 0.40792 0.40259 0.35955 1.0000 + Se Se198 1.0 0.40792 0.48593 0.35955 1.0000 + Se Se199 1.0 0.40792 0.56926 0.35955 1.0000 + Se Se200 1.0 0.40792 0.65259 0.35955 1.0000 + Se Se201 1.0 0.40792 0.73593 0.35955 1.0000 + Se Se202 1.0 0.40792 0.81926 0.35955 1.0000 + Se Se203 1.0 0.40792 0.90259 0.35955 1.0000 + Se Se204 1.0 0.40792 0.98593 0.35955 1.0000 + Se Se205 1.0 0.49125 0.06926 0.35955 1.0000 + Se Se206 1.0 0.49125 0.15259 0.35955 1.0000 + Se Se207 1.0 0.49125 0.23593 0.35955 1.0000 + Se Se208 1.0 0.49125 0.31926 0.35955 1.0000 + Se Se209 1.0 0.49125 0.40259 0.35955 1.0000 + Se Se210 1.0 0.49125 0.48593 0.35955 1.0000 + Se Se211 1.0 0.49125 0.56926 0.35955 1.0000 + Se Se212 1.0 0.49125 0.65259 0.35955 1.0000 + Se Se213 1.0 0.49125 0.73593 0.35955 1.0000 + Se Se214 1.0 0.49125 0.81926 0.35955 1.0000 + Se Se215 1.0 0.49125 0.90259 0.35955 1.0000 + Se Se216 1.0 0.49125 0.98593 0.35955 1.0000 + Se Se217 1.0 0.57459 0.06926 0.35955 1.0000 + Se Se218 1.0 0.57459 0.15259 0.35955 1.0000 + Se Se219 1.0 0.57459 0.23593 0.35955 1.0000 + Se Se220 1.0 0.57459 0.31926 0.35955 1.0000 + Se Se221 1.0 0.57459 0.40259 0.35955 1.0000 + Se Se222 1.0 0.57459 0.48593 0.35955 1.0000 + Se Se223 1.0 0.57459 0.56926 0.35955 1.0000 + Se Se224 1.0 0.57459 0.65259 0.35955 1.0000 + Se Se225 1.0 0.57459 0.73593 0.35955 1.0000 + Se Se226 1.0 0.57459 0.81926 0.35955 1.0000 + Se Se227 1.0 0.57459 0.90259 0.35955 1.0000 + Se Se228 1.0 0.57459 0.98593 0.35955 1.0000 + Se Se229 1.0 0.65792 0.06926 0.35955 1.0000 + Se Se230 1.0 0.65792 0.15259 0.35955 1.0000 + Se Se231 1.0 0.65792 0.23593 0.35955 1.0000 + Se Se232 1.0 0.65792 0.31926 0.35955 1.0000 + Se Se233 1.0 0.65792 0.40259 0.35955 1.0000 + Se Se234 1.0 0.65792 0.48593 0.35955 1.0000 + 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O1827 1.0 0.71066 0.18371 0.48278 1.0000 + O O1828 1.0 0.71066 0.26704 0.48278 1.0000 + O O1829 1.0 0.71066 0.35038 0.48278 1.0000 + O O1830 1.0 0.71066 0.43371 0.48278 1.0000 + O O1831 1.0 0.71066 0.51704 0.48278 1.0000 + O O1832 1.0 0.71066 0.60038 0.48278 1.0000 + O O1833 1.0 0.71066 0.68371 0.48278 1.0000 + O O1834 1.0 0.71066 0.76704 0.48278 1.0000 + O O1835 1.0 0.71066 0.85038 0.48278 1.0000 + O O1836 1.0 0.71066 0.93371 0.48278 1.0000 + O O1837 1.0 0.79399 0.01704 0.48278 1.0000 + O O1838 1.0 0.79399 0.10038 0.48278 1.0000 + O O1839 1.0 0.79399 0.18371 0.48278 1.0000 + O O1840 1.0 0.79399 0.26704 0.48278 1.0000 + O O1841 1.0 0.79399 0.35038 0.48278 1.0000 + O O1842 1.0 0.79399 0.43371 0.48278 1.0000 + O O1843 1.0 0.79399 0.51704 0.48278 1.0000 + O O1844 1.0 0.79399 0.60038 0.48278 1.0000 + O O1845 1.0 0.79399 0.68371 0.48278 1.0000 + O O1846 1.0 0.79399 0.76704 0.48278 1.0000 + O O1847 1.0 0.79399 0.85038 0.48278 1.0000 + O O1848 1.0 0.79399 0.93371 0.48278 1.0000 + O O1849 1.0 0.87733 0.01704 0.48278 1.0000 + O O1850 1.0 0.87733 0.10038 0.48278 1.0000 + O O1851 1.0 0.87733 0.18371 0.48278 1.0000 + O O1852 1.0 0.87733 0.26704 0.48278 1.0000 + O O1853 1.0 0.87733 0.35038 0.48278 1.0000 + O O1854 1.0 0.87733 0.43371 0.48278 1.0000 + O O1855 1.0 0.87733 0.51704 0.48278 1.0000 + O O1856 1.0 0.87733 0.60038 0.48278 1.0000 + O O1857 1.0 0.87733 0.68371 0.48278 1.0000 + O O1858 1.0 0.87733 0.76704 0.48278 1.0000 + O O1859 1.0 0.87733 0.85038 0.48278 1.0000 + O O1860 1.0 0.87733 0.93371 0.48278 1.0000 + O O1861 1.0 0.96066 0.01704 0.48278 1.0000 + O O1862 1.0 0.96066 0.10038 0.48278 1.0000 + O O1863 1.0 0.96066 0.18371 0.48278 1.0000 + O O1864 1.0 0.96066 0.26704 0.48278 1.0000 + O O1865 1.0 0.96066 0.35038 0.48278 1.0000 + O O1866 1.0 0.96066 0.43371 0.48278 1.0000 + O O1867 1.0 0.96066 0.51704 0.48278 1.0000 + O O1868 1.0 0.96066 0.60038 0.48278 1.0000 + O O1869 1.0 0.96066 0.68371 0.48278 1.0000 + O O1870 1.0 0.96066 0.76704 0.48278 1.0000 + O O1871 1.0 0.96066 0.85038 0.48278 1.0000 + O O1872 1.0 0.96066 0.93371 0.48278 1.0000 + O O1873 1.0 0.03934 0.06629 0.48278 1.0000 + O O1874 1.0 0.03934 0.14962 0.48278 1.0000 + O O1875 1.0 0.03934 0.23296 0.48278 1.0000 + O O1876 1.0 0.03934 0.31629 0.48278 1.0000 + O O1877 1.0 0.03934 0.39962 0.48278 1.0000 + O O1878 1.0 0.03934 0.48296 0.48278 1.0000 + O O1879 1.0 0.03934 0.56629 0.48278 1.0000 + O O1880 1.0 0.03934 0.64962 0.48278 1.0000 + O O1881 1.0 0.03934 0.73296 0.48278 1.0000 + O O1882 1.0 0.03934 0.81629 0.48278 1.0000 + O O1883 1.0 0.03934 0.89962 0.48278 1.0000 + O O1884 1.0 0.03934 0.98296 0.48278 1.0000 + O O1885 1.0 0.12267 0.06629 0.48278 1.0000 + O O1886 1.0 0.12267 0.14962 0.48278 1.0000 + O O1887 1.0 0.12267 0.23296 0.48278 1.0000 + O O1888 1.0 0.12267 0.31629 0.48278 1.0000 + O O1889 1.0 0.12267 0.39962 0.48278 1.0000 + O O1890 1.0 0.12267 0.48296 0.48278 1.0000 + O O1891 1.0 0.12267 0.56629 0.48278 1.0000 + O O1892 1.0 0.12267 0.64962 0.48278 1.0000 + O O1893 1.0 0.12267 0.73296 0.48278 1.0000 + O O1894 1.0 0.12267 0.81629 0.48278 1.0000 + O O1895 1.0 0.12267 0.89962 0.48278 1.0000 + O O1896 1.0 0.12267 0.98296 0.48278 1.0000 + O O1897 1.0 0.20601 0.06629 0.48278 1.0000 + O O1898 1.0 0.20601 0.14962 0.48278 1.0000 + O O1899 1.0 0.20601 0.23296 0.48278 1.0000 + O O1900 1.0 0.20601 0.31629 0.48278 1.0000 + O O1901 1.0 0.20601 0.39962 0.48278 1.0000 + O O1902 1.0 0.20601 0.48296 0.48278 1.0000 + O O1903 1.0 0.20601 0.56629 0.48278 1.0000 + O O1904 1.0 0.20601 0.64962 0.48278 1.0000 + O O1905 1.0 0.20601 0.73296 0.48278 1.0000 + O O1906 1.0 0.20601 0.81629 0.48278 1.0000 + O O1907 1.0 0.20601 0.89962 0.48278 1.0000 + O O1908 1.0 0.20601 0.98296 0.48278 1.0000 + O O1909 1.0 0.28934 0.06629 0.48278 1.0000 + O O1910 1.0 0.28934 0.14962 0.48278 1.0000 + O O1911 1.0 0.28934 0.23296 0.48278 1.0000 + O O1912 1.0 0.28934 0.31629 0.48278 1.0000 + O O1913 1.0 0.28934 0.39962 0.48278 1.0000 + O O1914 1.0 0.28934 0.48296 0.48278 1.0000 + O O1915 1.0 0.28934 0.56629 0.48278 1.0000 + O O1916 1.0 0.28934 0.64962 0.48278 1.0000 + O O1917 1.0 0.28934 0.73296 0.48278 1.0000 + O O1918 1.0 0.28934 0.81629 0.48278 1.0000 + O O1919 1.0 0.28934 0.89962 0.48278 1.0000 + O O1920 1.0 0.28934 0.98296 0.48278 1.0000 + O O1921 1.0 0.37267 0.06629 0.48278 1.0000 + O O1922 1.0 0.37267 0.14962 0.48278 1.0000 + O O1923 1.0 0.37267 0.23296 0.48278 1.0000 + O O1924 1.0 0.37267 0.31629 0.48278 1.0000 + O O1925 1.0 0.37267 0.39962 0.48278 1.0000 + O O1926 1.0 0.37267 0.48296 0.48278 1.0000 + O O1927 1.0 0.37267 0.56629 0.48278 1.0000 + O O1928 1.0 0.37267 0.64962 0.48278 1.0000 + O O1929 1.0 0.37267 0.73296 0.48278 1.0000 + O O1930 1.0 0.37267 0.81629 0.48278 1.0000 + O O1931 1.0 0.37267 0.89962 0.48278 1.0000 + O O1932 1.0 0.37267 0.98296 0.48278 1.0000 + O O1933 1.0 0.45601 0.06629 0.48278 1.0000 + O O1934 1.0 0.45601 0.14962 0.48278 1.0000 + O O1935 1.0 0.45601 0.23296 0.48278 1.0000 + O O1936 1.0 0.45601 0.31629 0.48278 1.0000 + O O1937 1.0 0.45601 0.39962 0.48278 1.0000 + O O1938 1.0 0.45601 0.48296 0.48278 1.0000 + O O1939 1.0 0.45601 0.56629 0.48278 1.0000 + O O1940 1.0 0.45601 0.64962 0.48278 1.0000 + O O1941 1.0 0.45601 0.73296 0.48278 1.0000 + O O1942 1.0 0.45601 0.81629 0.48278 1.0000 + O O1943 1.0 0.45601 0.89962 0.48278 1.0000 + O O1944 1.0 0.45601 0.98296 0.48278 1.0000 + O O1945 1.0 0.53934 0.06629 0.48278 1.0000 + O O1946 1.0 0.53934 0.14962 0.48278 1.0000 + O O1947 1.0 0.53934 0.23296 0.48278 1.0000 + O O1948 1.0 0.53934 0.31629 0.48278 1.0000 + O O1949 1.0 0.53934 0.39962 0.48278 1.0000 + O O1950 1.0 0.53934 0.48296 0.48278 1.0000 + O O1951 1.0 0.53934 0.56629 0.48278 1.0000 + O O1952 1.0 0.53934 0.64962 0.48278 1.0000 + O O1953 1.0 0.53934 0.73296 0.48278 1.0000 + O O1954 1.0 0.53934 0.81629 0.48278 1.0000 + O O1955 1.0 0.53934 0.89962 0.48278 1.0000 + O O1956 1.0 0.53934 0.98296 0.48278 1.0000 + O O1957 1.0 0.62267 0.06629 0.48278 1.0000 + O O1958 1.0 0.62267 0.14962 0.48278 1.0000 + O O1959 1.0 0.62267 0.23296 0.48278 1.0000 + O O1960 1.0 0.62267 0.31629 0.48278 1.0000 + O O1961 1.0 0.62267 0.39962 0.48278 1.0000 + O O1962 1.0 0.62267 0.48296 0.48278 1.0000 + O O1963 1.0 0.62267 0.56629 0.48278 1.0000 + O O1964 1.0 0.62267 0.64962 0.48278 1.0000 + O O1965 1.0 0.62267 0.73296 0.48278 1.0000 + O O1966 1.0 0.62267 0.81629 0.48278 1.0000 + O O1967 1.0 0.62267 0.89962 0.48278 1.0000 + O O1968 1.0 0.62267 0.98296 0.48278 1.0000 + O O1969 1.0 0.70601 0.06629 0.48278 1.0000 + O O1970 1.0 0.70601 0.14962 0.48278 1.0000 + O O1971 1.0 0.70601 0.23296 0.48278 1.0000 + O O1972 1.0 0.70601 0.31629 0.48278 1.0000 + O O1973 1.0 0.70601 0.39962 0.48278 1.0000 + O O1974 1.0 0.70601 0.48296 0.48278 1.0000 + O O1975 1.0 0.70601 0.56629 0.48278 1.0000 + O O1976 1.0 0.70601 0.64962 0.48278 1.0000 + O O1977 1.0 0.70601 0.73296 0.48278 1.0000 + O O1978 1.0 0.70601 0.81629 0.48278 1.0000 + O O1979 1.0 0.70601 0.89962 0.48278 1.0000 + O O1980 1.0 0.70601 0.98296 0.48278 1.0000 + O O1981 1.0 0.78934 0.06629 0.48278 1.0000 + O O1982 1.0 0.78934 0.14962 0.48278 1.0000 + O O1983 1.0 0.78934 0.23296 0.48278 1.0000 + O O1984 1.0 0.78934 0.31629 0.48278 1.0000 + O O1985 1.0 0.78934 0.39962 0.48278 1.0000 + O O1986 1.0 0.78934 0.48296 0.48278 1.0000 + O O1987 1.0 0.78934 0.56629 0.48278 1.0000 + O O1988 1.0 0.78934 0.64962 0.48278 1.0000 + O O1989 1.0 0.78934 0.73296 0.48278 1.0000 + O O1990 1.0 0.78934 0.81629 0.48278 1.0000 + O O1991 1.0 0.78934 0.89962 0.48278 1.0000 + O O1992 1.0 0.78934 0.98296 0.48278 1.0000 + O O1993 1.0 0.87267 0.06629 0.48278 1.0000 + O O1994 1.0 0.87267 0.14962 0.48278 1.0000 + O O1995 1.0 0.87267 0.23296 0.48278 1.0000 + O O1996 1.0 0.87267 0.31629 0.48278 1.0000 + O O1997 1.0 0.87267 0.39962 0.48278 1.0000 + O O1998 1.0 0.87267 0.48296 0.48278 1.0000 + O O1999 1.0 0.87267 0.56629 0.48278 1.0000 + O O2000 1.0 0.87267 0.64962 0.48278 1.0000 + O O2001 1.0 0.87267 0.73296 0.48278 1.0000 + O O2002 1.0 0.87267 0.81629 0.48278 1.0000 + O O2003 1.0 0.87267 0.89962 0.48278 1.0000 + O O2004 1.0 0.87267 0.98296 0.48278 1.0000 + O O2005 1.0 0.95601 0.06629 0.48278 1.0000 + O O2006 1.0 0.95601 0.14962 0.48278 1.0000 + O O2007 1.0 0.95601 0.23296 0.48278 1.0000 + O O2008 1.0 0.95601 0.31629 0.48278 1.0000 + O O2009 1.0 0.95601 0.39962 0.48278 1.0000 + O O2010 1.0 0.95601 0.48296 0.48278 1.0000 + O O2011 1.0 0.95601 0.56629 0.48278 1.0000 + O O2012 1.0 0.95601 0.64962 0.48278 1.0000 + O O2013 1.0 0.95601 0.73296 0.48278 1.0000 + O O2014 1.0 0.95601 0.81629 0.48278 1.0000 + O O2015 1.0 0.95601 0.89962 0.48278 1.0000 + O O2016 1.0 0.95601 0.98296 0.48278 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-3505_supercell_12x12x1.cif b/tier3/cif_file/orthogonal_2dm-3505_supercell_12x12x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..b553b9129ae3b88a0173c910b247bcc2254dff3a --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-3505_supercell_12x12x1.cif @@ -0,0 +1,2617 @@ +data_image0 +_chemical_formula_structural Mn288Ni144O864Mn288Ni144O864 +_chemical_formula_sum "Mn576 Ni288 O1728" +_cell_length_a 103.558 +_cell_length_b 59.8031 +_cell_length_c 5.92107 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Mn Mn1 1.0 0.00695 0.06249 0.50000 1.0000 + Mn Mn2 1.0 0.96528 0.10416 0.50000 1.0000 + Mn Mn3 1.0 0.92361 0.14583 0.50000 1.0000 + Mn Mn4 1.0 0.88195 0.18749 0.50000 1.0000 + Mn Mn5 1.0 0.84028 0.22916 0.50000 1.0000 + Mn Mn6 1.0 0.79861 0.27083 0.50000 1.0000 + Mn Mn7 1.0 0.75695 0.31249 0.50000 1.0000 + Mn Mn8 1.0 0.71528 0.35416 0.50000 1.0000 + Mn Mn9 1.0 0.67361 0.39583 0.50000 1.0000 + Mn Mn10 1.0 0.63195 0.43749 0.50000 1.0000 + Mn Mn11 1.0 0.59028 0.47916 0.50000 1.0000 + Mn Mn12 1.0 0.54861 0.52083 0.50000 1.0000 + Mn Mn13 1.0 0.04861 0.10416 0.50000 1.0000 + Mn Mn14 1.0 0.00695 0.14583 0.50000 1.0000 + Mn Mn15 1.0 0.96528 0.18749 0.50000 1.0000 + Mn Mn16 1.0 0.92361 0.22916 0.50000 1.0000 + Mn Mn17 1.0 0.88195 0.27083 0.50000 1.0000 + Mn Mn18 1.0 0.84028 0.31249 0.50000 1.0000 + Mn Mn19 1.0 0.79861 0.35416 0.50000 1.0000 + Mn Mn20 1.0 0.75695 0.39583 0.50000 1.0000 + Mn Mn21 1.0 0.71528 0.43749 0.50000 1.0000 + Mn Mn22 1.0 0.67361 0.47916 0.50000 1.0000 + Mn Mn23 1.0 0.63195 0.52083 0.50000 1.0000 + Mn Mn24 1.0 0.59028 0.56249 0.50000 1.0000 + Mn Mn25 1.0 0.09028 0.14583 0.50000 1.0000 + Mn Mn26 1.0 0.04861 0.18749 0.50000 1.0000 + Mn Mn27 1.0 0.00695 0.22916 0.50000 1.0000 + Mn Mn28 1.0 0.96528 0.27083 0.50000 1.0000 + Mn Mn29 1.0 0.92361 0.31249 0.50000 1.0000 + Mn Mn30 1.0 0.88195 0.35416 0.50000 1.0000 + Mn Mn31 1.0 0.84028 0.39583 0.50000 1.0000 + Mn Mn32 1.0 0.79861 0.43749 0.50000 1.0000 + Mn Mn33 1.0 0.75695 0.47916 0.50000 1.0000 + Mn Mn34 1.0 0.71528 0.52083 0.50000 1.0000 + Mn Mn35 1.0 0.67361 0.56249 0.50000 1.0000 + Mn Mn36 1.0 0.63195 0.60416 0.50000 1.0000 + Mn Mn37 1.0 0.13195 0.18749 0.50000 1.0000 + Mn Mn38 1.0 0.09028 0.22916 0.50000 1.0000 + Mn Mn39 1.0 0.04861 0.27083 0.50000 1.0000 + Mn Mn40 1.0 0.00695 0.31249 0.50000 1.0000 + Mn Mn41 1.0 0.96528 0.35416 0.50000 1.0000 + Mn Mn42 1.0 0.92361 0.39583 0.50000 1.0000 + Mn Mn43 1.0 0.88195 0.43749 0.50000 1.0000 + Mn Mn44 1.0 0.84028 0.47916 0.50000 1.0000 + Mn Mn45 1.0 0.79861 0.52083 0.50000 1.0000 + Mn Mn46 1.0 0.75695 0.56249 0.50000 1.0000 + Mn Mn47 1.0 0.71528 0.60416 0.50000 1.0000 + Mn Mn48 1.0 0.67361 0.64583 0.50000 1.0000 + Mn Mn49 1.0 0.17361 0.22916 0.50000 1.0000 + Mn Mn50 1.0 0.13195 0.27083 0.50000 1.0000 + Mn Mn51 1.0 0.09028 0.31249 0.50000 1.0000 + Mn Mn52 1.0 0.04861 0.35416 0.50000 1.0000 + Mn Mn53 1.0 0.00695 0.39583 0.50000 1.0000 + Mn Mn54 1.0 0.96528 0.43749 0.50000 1.0000 + Mn Mn55 1.0 0.92361 0.47916 0.50000 1.0000 + Mn Mn56 1.0 0.88195 0.52083 0.50000 1.0000 + Mn Mn57 1.0 0.84028 0.56249 0.50000 1.0000 + Mn Mn58 1.0 0.79861 0.60416 0.50000 1.0000 + Mn Mn59 1.0 0.75695 0.64583 0.50000 1.0000 + Mn Mn60 1.0 0.71528 0.68749 0.50000 1.0000 + Mn Mn61 1.0 0.21528 0.27083 0.50000 1.0000 + Mn Mn62 1.0 0.17361 0.31249 0.50000 1.0000 + Mn Mn63 1.0 0.13195 0.35416 0.50000 1.0000 + Mn Mn64 1.0 0.09028 0.39583 0.50000 1.0000 + Mn Mn65 1.0 0.04861 0.43749 0.50000 1.0000 + Mn Mn66 1.0 0.00695 0.47916 0.50000 1.0000 + Mn Mn67 1.0 0.96528 0.52083 0.50000 1.0000 + Mn Mn68 1.0 0.92361 0.56249 0.50000 1.0000 + Mn Mn69 1.0 0.88195 0.60416 0.50000 1.0000 + Mn Mn70 1.0 0.84028 0.64583 0.50000 1.0000 + Mn Mn71 1.0 0.79861 0.68749 0.50000 1.0000 + Mn Mn72 1.0 0.75695 0.72916 0.50000 1.0000 + Mn Mn73 1.0 0.25695 0.31249 0.50000 1.0000 + Mn Mn74 1.0 0.21528 0.35416 0.50000 1.0000 + Mn Mn75 1.0 0.17361 0.39583 0.50000 1.0000 + Mn Mn76 1.0 0.13195 0.43749 0.50000 1.0000 + Mn Mn77 1.0 0.09028 0.47916 0.50000 1.0000 + Mn Mn78 1.0 0.04861 0.52083 0.50000 1.0000 + Mn Mn79 1.0 0.00695 0.56249 0.50000 1.0000 + Mn Mn80 1.0 0.96528 0.60416 0.50000 1.0000 + Mn Mn81 1.0 0.92361 0.64583 0.50000 1.0000 + Mn Mn82 1.0 0.88195 0.68749 0.50000 1.0000 + Mn Mn83 1.0 0.84028 0.72916 0.50000 1.0000 + Mn Mn84 1.0 0.79861 0.77083 0.50000 1.0000 + Mn Mn85 1.0 0.29861 0.35416 0.50000 1.0000 + Mn Mn86 1.0 0.25695 0.39583 0.50000 1.0000 + Mn Mn87 1.0 0.21528 0.43749 0.50000 1.0000 + Mn Mn88 1.0 0.17361 0.47916 0.50000 1.0000 + Mn Mn89 1.0 0.13195 0.52083 0.50000 1.0000 + Mn Mn90 1.0 0.09028 0.56249 0.50000 1.0000 + Mn Mn91 1.0 0.04861 0.60416 0.50000 1.0000 + Mn Mn92 1.0 0.00695 0.64583 0.50000 1.0000 + Mn Mn93 1.0 0.96528 0.68749 0.50000 1.0000 + Mn Mn94 1.0 0.92361 0.72916 0.50000 1.0000 + Mn Mn95 1.0 0.88195 0.77083 0.50000 1.0000 + Mn Mn96 1.0 0.84028 0.81249 0.50000 1.0000 + Mn Mn97 1.0 0.34028 0.39583 0.50000 1.0000 + Mn Mn98 1.0 0.29861 0.43749 0.50000 1.0000 + Mn Mn99 1.0 0.25695 0.47916 0.50000 1.0000 + Mn Mn100 1.0 0.21528 0.52083 0.50000 1.0000 + Mn Mn101 1.0 0.17361 0.56249 0.50000 1.0000 + Mn Mn102 1.0 0.13195 0.60416 0.50000 1.0000 + Mn Mn103 1.0 0.09028 0.64583 0.50000 1.0000 + Mn Mn104 1.0 0.04861 0.68749 0.50000 1.0000 + Mn Mn105 1.0 0.00695 0.72916 0.50000 1.0000 + Mn Mn106 1.0 0.96528 0.77083 0.50000 1.0000 + Mn Mn107 1.0 0.92361 0.81249 0.50000 1.0000 + Mn Mn108 1.0 0.88195 0.85416 0.50000 1.0000 + Mn Mn109 1.0 0.38195 0.43749 0.50000 1.0000 + Mn Mn110 1.0 0.34028 0.47916 0.50000 1.0000 + Mn Mn111 1.0 0.29861 0.52083 0.50000 1.0000 + Mn Mn112 1.0 0.25695 0.56249 0.50000 1.0000 + Mn Mn113 1.0 0.21528 0.60416 0.50000 1.0000 + Mn Mn114 1.0 0.17361 0.64583 0.50000 1.0000 + Mn Mn115 1.0 0.13195 0.68749 0.50000 1.0000 + Mn Mn116 1.0 0.09028 0.72916 0.50000 1.0000 + Mn Mn117 1.0 0.04861 0.77083 0.50000 1.0000 + Mn Mn118 1.0 0.00695 0.81249 0.50000 1.0000 + Mn Mn119 1.0 0.96528 0.85416 0.50000 1.0000 + Mn Mn120 1.0 0.92361 0.89583 0.50000 1.0000 + Mn Mn121 1.0 0.42361 0.47916 0.50000 1.0000 + Mn Mn122 1.0 0.38195 0.52083 0.50000 1.0000 + Mn Mn123 1.0 0.34028 0.56249 0.50000 1.0000 + Mn Mn124 1.0 0.29861 0.60416 0.50000 1.0000 + Mn Mn125 1.0 0.25695 0.64583 0.50000 1.0000 + Mn Mn126 1.0 0.21528 0.68749 0.50000 1.0000 + Mn Mn127 1.0 0.17361 0.72916 0.50000 1.0000 + Mn Mn128 1.0 0.13195 0.77083 0.50000 1.0000 + Mn Mn129 1.0 0.09028 0.81249 0.50000 1.0000 + Mn Mn130 1.0 0.04861 0.85416 0.50000 1.0000 + Mn Mn131 1.0 0.00695 0.89583 0.50000 1.0000 + Mn Mn132 1.0 0.96528 0.93749 0.50000 1.0000 + Mn Mn133 1.0 0.46528 0.52083 0.50000 1.0000 + Mn Mn134 1.0 0.42361 0.56249 0.50000 1.0000 + Mn Mn135 1.0 0.38195 0.60416 0.50000 1.0000 + Mn Mn136 1.0 0.34028 0.64583 0.50000 1.0000 + Mn Mn137 1.0 0.29861 0.68749 0.50000 1.0000 + Mn Mn138 1.0 0.25695 0.72916 0.50000 1.0000 + Mn Mn139 1.0 0.21528 0.77083 0.50000 1.0000 + Mn Mn140 1.0 0.17361 0.81249 0.50000 1.0000 + Mn Mn141 1.0 0.13195 0.85416 0.50000 1.0000 + Mn Mn142 1.0 0.09028 0.89583 0.50000 1.0000 + Mn Mn143 1.0 0.04861 0.93749 0.50000 1.0000 + Mn Mn144 1.0 0.00695 0.97916 0.50000 1.0000 + Mn Mn145 1.0 0.99305 0.02084 0.50000 1.0000 + Mn Mn146 1.0 0.95139 0.06251 0.50000 1.0000 + Mn Mn147 1.0 0.90972 0.10417 0.50000 1.0000 + Mn Mn148 1.0 0.86805 0.14584 0.50000 1.0000 + Mn Mn149 1.0 0.82639 0.18751 0.50000 1.0000 + Mn Mn150 1.0 0.78472 0.22917 0.50000 1.0000 + Mn Mn151 1.0 0.74305 0.27084 0.50000 1.0000 + Mn Mn152 1.0 0.70139 0.31251 0.50000 1.0000 + Mn Mn153 1.0 0.65972 0.35417 0.50000 1.0000 + Mn Mn154 1.0 0.61805 0.39584 0.50000 1.0000 + Mn Mn155 1.0 0.57639 0.43751 0.50000 1.0000 + Mn Mn156 1.0 0.53472 0.47917 0.50000 1.0000 + Mn Mn157 1.0 0.03472 0.06251 0.50000 1.0000 + Mn Mn158 1.0 0.99305 0.10417 0.50000 1.0000 + Mn Mn159 1.0 0.95139 0.14584 0.50000 1.0000 + Mn Mn160 1.0 0.90972 0.18751 0.50000 1.0000 + Mn Mn161 1.0 0.86805 0.22917 0.50000 1.0000 + Mn Mn162 1.0 0.82639 0.27084 0.50000 1.0000 + Mn Mn163 1.0 0.78472 0.31251 0.50000 1.0000 + Mn Mn164 1.0 0.74305 0.35417 0.50000 1.0000 + Mn Mn165 1.0 0.70139 0.39584 0.50000 1.0000 + Mn Mn166 1.0 0.65972 0.43751 0.50000 1.0000 + Mn Mn167 1.0 0.61805 0.47917 0.50000 1.0000 + Mn Mn168 1.0 0.57639 0.52084 0.50000 1.0000 + Mn Mn169 1.0 0.07639 0.10417 0.50000 1.0000 + Mn Mn170 1.0 0.03472 0.14584 0.50000 1.0000 + Mn Mn171 1.0 0.99305 0.18751 0.50000 1.0000 + Mn Mn172 1.0 0.95139 0.22917 0.50000 1.0000 + Mn Mn173 1.0 0.90972 0.27084 0.50000 1.0000 + Mn Mn174 1.0 0.86805 0.31251 0.50000 1.0000 + Mn Mn175 1.0 0.82639 0.35417 0.50000 1.0000 + Mn Mn176 1.0 0.78472 0.39584 0.50000 1.0000 + Mn Mn177 1.0 0.74305 0.43751 0.50000 1.0000 + Mn Mn178 1.0 0.70139 0.47917 0.50000 1.0000 + Mn Mn179 1.0 0.65972 0.52084 0.50000 1.0000 + Mn Mn180 1.0 0.61805 0.56251 0.50000 1.0000 + Mn Mn181 1.0 0.11805 0.14584 0.50000 1.0000 + Mn Mn182 1.0 0.07639 0.18751 0.50000 1.0000 + Mn Mn183 1.0 0.03472 0.22917 0.50000 1.0000 + Mn Mn184 1.0 0.99305 0.27084 0.50000 1.0000 + Mn Mn185 1.0 0.95139 0.31251 0.50000 1.0000 + Mn Mn186 1.0 0.90972 0.35417 0.50000 1.0000 + Mn Mn187 1.0 0.86805 0.39584 0.50000 1.0000 + Mn Mn188 1.0 0.82639 0.43751 0.50000 1.0000 + Mn Mn189 1.0 0.78472 0.47917 0.50000 1.0000 + Mn Mn190 1.0 0.74305 0.52084 0.50000 1.0000 + Mn Mn191 1.0 0.70139 0.56251 0.50000 1.0000 + Mn Mn192 1.0 0.65972 0.60417 0.50000 1.0000 + Mn Mn193 1.0 0.15972 0.18751 0.50000 1.0000 + Mn Mn194 1.0 0.11805 0.22917 0.50000 1.0000 + Mn Mn195 1.0 0.07639 0.27084 0.50000 1.0000 + Mn Mn196 1.0 0.03472 0.31251 0.50000 1.0000 + Mn Mn197 1.0 0.99305 0.35417 0.50000 1.0000 + Mn Mn198 1.0 0.95139 0.39584 0.50000 1.0000 + Mn Mn199 1.0 0.90972 0.43751 0.50000 1.0000 + Mn Mn200 1.0 0.86805 0.47917 0.50000 1.0000 + Mn Mn201 1.0 0.82639 0.52084 0.50000 1.0000 + Mn Mn202 1.0 0.78472 0.56251 0.50000 1.0000 + Mn Mn203 1.0 0.74305 0.60417 0.50000 1.0000 + Mn Mn204 1.0 0.70139 0.64584 0.50000 1.0000 + Mn Mn205 1.0 0.20139 0.22917 0.50000 1.0000 + Mn Mn206 1.0 0.15972 0.27084 0.50000 1.0000 + Mn Mn207 1.0 0.11805 0.31251 0.50000 1.0000 + Mn Mn208 1.0 0.07639 0.35417 0.50000 1.0000 + Mn Mn209 1.0 0.03472 0.39584 0.50000 1.0000 + Mn Mn210 1.0 0.99305 0.43751 0.50000 1.0000 + Mn Mn211 1.0 0.95139 0.47917 0.50000 1.0000 + Mn Mn212 1.0 0.90972 0.52084 0.50000 1.0000 + Mn Mn213 1.0 0.86805 0.56251 0.50000 1.0000 + Mn Mn214 1.0 0.82639 0.60417 0.50000 1.0000 + Mn Mn215 1.0 0.78472 0.64584 0.50000 1.0000 + Mn Mn216 1.0 0.74305 0.68751 0.50000 1.0000 + Mn Mn217 1.0 0.24305 0.27084 0.50000 1.0000 + Mn Mn218 1.0 0.20139 0.31251 0.50000 1.0000 + Mn Mn219 1.0 0.15972 0.35417 0.50000 1.0000 + Mn Mn220 1.0 0.11805 0.39584 0.50000 1.0000 + Mn Mn221 1.0 0.07639 0.43751 0.50000 1.0000 + Mn Mn222 1.0 0.03472 0.47917 0.50000 1.0000 + Mn Mn223 1.0 0.99305 0.52084 0.50000 1.0000 + Mn Mn224 1.0 0.95139 0.56251 0.50000 1.0000 + Mn Mn225 1.0 0.90972 0.60417 0.50000 1.0000 + Mn Mn226 1.0 0.86805 0.64584 0.50000 1.0000 + Mn Mn227 1.0 0.82639 0.68751 0.50000 1.0000 + Mn Mn228 1.0 0.78472 0.72917 0.50000 1.0000 + Mn Mn229 1.0 0.28472 0.31251 0.50000 1.0000 + Mn Mn230 1.0 0.24305 0.35417 0.50000 1.0000 + Mn Mn231 1.0 0.20139 0.39584 0.50000 1.0000 + Mn Mn232 1.0 0.15972 0.43751 0.50000 1.0000 + Mn Mn233 1.0 0.11805 0.47917 0.50000 1.0000 + Mn Mn234 1.0 0.07639 0.52084 0.50000 1.0000 + Mn Mn235 1.0 0.03472 0.56251 0.50000 1.0000 + Mn Mn236 1.0 0.99305 0.60417 0.50000 1.0000 + Mn Mn237 1.0 0.95139 0.64584 0.50000 1.0000 + Mn Mn238 1.0 0.90972 0.68751 0.50000 1.0000 + Mn Mn239 1.0 0.86805 0.72917 0.50000 1.0000 + Mn Mn240 1.0 0.82639 0.77084 0.50000 1.0000 + Mn Mn241 1.0 0.32639 0.35417 0.50000 1.0000 + Mn Mn242 1.0 0.28472 0.39584 0.50000 1.0000 + Mn Mn243 1.0 0.24305 0.43751 0.50000 1.0000 + Mn Mn244 1.0 0.20139 0.47917 0.50000 1.0000 + Mn Mn245 1.0 0.15972 0.52084 0.50000 1.0000 + Mn Mn246 1.0 0.11805 0.56251 0.50000 1.0000 + Mn Mn247 1.0 0.07639 0.60417 0.50000 1.0000 + Mn Mn248 1.0 0.03472 0.64584 0.50000 1.0000 + Mn Mn249 1.0 0.99305 0.68751 0.50000 1.0000 + Mn Mn250 1.0 0.95139 0.72917 0.50000 1.0000 + Mn Mn251 1.0 0.90972 0.77084 0.50000 1.0000 + Mn Mn252 1.0 0.86805 0.81251 0.50000 1.0000 + Mn Mn253 1.0 0.36805 0.39584 0.50000 1.0000 + Mn Mn254 1.0 0.32639 0.43751 0.50000 1.0000 + Mn Mn255 1.0 0.28472 0.47917 0.50000 1.0000 + Mn Mn256 1.0 0.24305 0.52084 0.50000 1.0000 + Mn Mn257 1.0 0.20139 0.56251 0.50000 1.0000 + Mn Mn258 1.0 0.15972 0.60417 0.50000 1.0000 + Mn Mn259 1.0 0.11805 0.64584 0.50000 1.0000 + Mn Mn260 1.0 0.07639 0.68751 0.50000 1.0000 + Mn Mn261 1.0 0.03472 0.72917 0.50000 1.0000 + Mn Mn262 1.0 0.99305 0.77084 0.50000 1.0000 + Mn Mn263 1.0 0.95139 0.81251 0.50000 1.0000 + Mn Mn264 1.0 0.90972 0.85417 0.50000 1.0000 + Mn Mn265 1.0 0.40972 0.43751 0.50000 1.0000 + Mn Mn266 1.0 0.36805 0.47917 0.50000 1.0000 + Mn Mn267 1.0 0.32639 0.52084 0.50000 1.0000 + Mn Mn268 1.0 0.28472 0.56251 0.50000 1.0000 + Mn Mn269 1.0 0.24305 0.60417 0.50000 1.0000 + Mn Mn270 1.0 0.20139 0.64584 0.50000 1.0000 + Mn Mn271 1.0 0.15972 0.68751 0.50000 1.0000 + Mn Mn272 1.0 0.11805 0.72917 0.50000 1.0000 + Mn Mn273 1.0 0.07639 0.77084 0.50000 1.0000 + Mn Mn274 1.0 0.03472 0.81251 0.50000 1.0000 + Mn Mn275 1.0 0.99305 0.85417 0.50000 1.0000 + Mn Mn276 1.0 0.95139 0.89584 0.50000 1.0000 + Mn Mn277 1.0 0.45139 0.47917 0.50000 1.0000 + Mn Mn278 1.0 0.40972 0.52084 0.50000 1.0000 + Mn Mn279 1.0 0.36805 0.56251 0.50000 1.0000 + Mn Mn280 1.0 0.32639 0.60417 0.50000 1.0000 + Mn Mn281 1.0 0.28472 0.64584 0.50000 1.0000 + Mn Mn282 1.0 0.24305 0.68751 0.50000 1.0000 + Mn Mn283 1.0 0.20139 0.72917 0.50000 1.0000 + Mn Mn284 1.0 0.15972 0.77084 0.50000 1.0000 + Mn Mn285 1.0 0.11805 0.81251 0.50000 1.0000 + Mn Mn286 1.0 0.07639 0.85417 0.50000 1.0000 + Mn Mn287 1.0 0.03472 0.89584 0.50000 1.0000 + Mn Mn288 1.0 0.99305 0.93751 0.50000 1.0000 + Ni Ni1 1.0 0.02083 0.02083 0.50000 1.0000 + Ni Ni2 1.0 0.97917 0.06250 0.50000 1.0000 + Ni Ni3 1.0 0.93750 0.10417 0.50000 1.0000 + Ni Ni4 1.0 0.89583 0.14583 0.50000 1.0000 + Ni Ni5 1.0 0.85417 0.18750 0.50000 1.0000 + Ni Ni6 1.0 0.81250 0.22917 0.50000 1.0000 + Ni Ni7 1.0 0.77083 0.27083 0.50000 1.0000 + Ni Ni8 1.0 0.72917 0.31250 0.50000 1.0000 + Ni Ni9 1.0 0.68750 0.35417 0.50000 1.0000 + Ni Ni10 1.0 0.64583 0.39583 0.50000 1.0000 + Ni Ni11 1.0 0.60417 0.43750 0.50000 1.0000 + Ni Ni12 1.0 0.56250 0.47917 0.50000 1.0000 + Ni Ni13 1.0 0.06250 0.06250 0.50000 1.0000 + Ni Ni14 1.0 0.02083 0.10417 0.50000 1.0000 + Ni Ni15 1.0 0.97917 0.14583 0.50000 1.0000 + Ni Ni16 1.0 0.93750 0.18750 0.50000 1.0000 + Ni Ni17 1.0 0.89583 0.22917 0.50000 1.0000 + Ni Ni18 1.0 0.85417 0.27083 0.50000 1.0000 + Ni Ni19 1.0 0.81250 0.31250 0.50000 1.0000 + Ni Ni20 1.0 0.77083 0.35417 0.50000 1.0000 + Ni Ni21 1.0 0.72917 0.39583 0.50000 1.0000 + Ni Ni22 1.0 0.68750 0.43750 0.50000 1.0000 + Ni Ni23 1.0 0.64583 0.47917 0.50000 1.0000 + Ni Ni24 1.0 0.60417 0.52083 0.50000 1.0000 + Ni Ni25 1.0 0.10417 0.10417 0.50000 1.0000 + Ni Ni26 1.0 0.06250 0.14583 0.50000 1.0000 + Ni Ni27 1.0 0.02083 0.18750 0.50000 1.0000 + Ni Ni28 1.0 0.97917 0.22917 0.50000 1.0000 + Ni Ni29 1.0 0.93750 0.27083 0.50000 1.0000 + Ni Ni30 1.0 0.89583 0.31250 0.50000 1.0000 + Ni Ni31 1.0 0.85417 0.35417 0.50000 1.0000 + Ni Ni32 1.0 0.81250 0.39583 0.50000 1.0000 + Ni Ni33 1.0 0.77083 0.43750 0.50000 1.0000 + Ni Ni34 1.0 0.72917 0.47917 0.50000 1.0000 + Ni Ni35 1.0 0.68750 0.52083 0.50000 1.0000 + Ni Ni36 1.0 0.64583 0.56250 0.50000 1.0000 + Ni Ni37 1.0 0.14583 0.14583 0.50000 1.0000 + Ni Ni38 1.0 0.10417 0.18750 0.50000 1.0000 + Ni Ni39 1.0 0.06250 0.22917 0.50000 1.0000 + Ni Ni40 1.0 0.02083 0.27083 0.50000 1.0000 + Ni Ni41 1.0 0.97917 0.31250 0.50000 1.0000 + Ni Ni42 1.0 0.93750 0.35417 0.50000 1.0000 + Ni Ni43 1.0 0.89583 0.39583 0.50000 1.0000 + Ni Ni44 1.0 0.85417 0.43750 0.50000 1.0000 + Ni Ni45 1.0 0.81250 0.47917 0.50000 1.0000 + Ni Ni46 1.0 0.77083 0.52083 0.50000 1.0000 + Ni Ni47 1.0 0.72917 0.56250 0.50000 1.0000 + Ni Ni48 1.0 0.68750 0.60417 0.50000 1.0000 + Ni Ni49 1.0 0.18750 0.18750 0.50000 1.0000 + Ni Ni50 1.0 0.14583 0.22917 0.50000 1.0000 + Ni Ni51 1.0 0.10417 0.27083 0.50000 1.0000 + Ni Ni52 1.0 0.06250 0.31250 0.50000 1.0000 + Ni Ni53 1.0 0.02083 0.35417 0.50000 1.0000 + Ni Ni54 1.0 0.97917 0.39583 0.50000 1.0000 + Ni Ni55 1.0 0.93750 0.43750 0.50000 1.0000 + Ni Ni56 1.0 0.89583 0.47917 0.50000 1.0000 + Ni Ni57 1.0 0.85417 0.52083 0.50000 1.0000 + Ni Ni58 1.0 0.81250 0.56250 0.50000 1.0000 + Ni Ni59 1.0 0.77083 0.60417 0.50000 1.0000 + Ni Ni60 1.0 0.72917 0.64583 0.50000 1.0000 + Ni Ni61 1.0 0.22917 0.22917 0.50000 1.0000 + Ni Ni62 1.0 0.18750 0.27083 0.50000 1.0000 + Ni Ni63 1.0 0.14583 0.31250 0.50000 1.0000 + Ni Ni64 1.0 0.10417 0.35417 0.50000 1.0000 + Ni Ni65 1.0 0.06250 0.39583 0.50000 1.0000 + Ni Ni66 1.0 0.02083 0.43750 0.50000 1.0000 + Ni Ni67 1.0 0.97917 0.47917 0.50000 1.0000 + Ni Ni68 1.0 0.93750 0.52083 0.50000 1.0000 + Ni Ni69 1.0 0.89583 0.56250 0.50000 1.0000 + Ni Ni70 1.0 0.85417 0.60417 0.50000 1.0000 + Ni Ni71 1.0 0.81250 0.64583 0.50000 1.0000 + Ni Ni72 1.0 0.77083 0.68750 0.50000 1.0000 + Ni Ni73 1.0 0.27083 0.27083 0.50000 1.0000 + Ni Ni74 1.0 0.22917 0.31250 0.50000 1.0000 + Ni Ni75 1.0 0.18750 0.35417 0.50000 1.0000 + Ni Ni76 1.0 0.14583 0.39583 0.50000 1.0000 + Ni Ni77 1.0 0.10417 0.43750 0.50000 1.0000 + Ni Ni78 1.0 0.06250 0.47917 0.50000 1.0000 + Ni Ni79 1.0 0.02083 0.52083 0.50000 1.0000 + Ni Ni80 1.0 0.97917 0.56250 0.50000 1.0000 + Ni Ni81 1.0 0.93750 0.60417 0.50000 1.0000 + Ni Ni82 1.0 0.89583 0.64583 0.50000 1.0000 + Ni Ni83 1.0 0.85417 0.68750 0.50000 1.0000 + Ni Ni84 1.0 0.81250 0.72917 0.50000 1.0000 + Ni Ni85 1.0 0.31250 0.31250 0.50000 1.0000 + Ni Ni86 1.0 0.27083 0.35417 0.50000 1.0000 + Ni Ni87 1.0 0.22917 0.39583 0.50000 1.0000 + Ni Ni88 1.0 0.18750 0.43750 0.50000 1.0000 + Ni Ni89 1.0 0.14583 0.47917 0.50000 1.0000 + Ni Ni90 1.0 0.10417 0.52083 0.50000 1.0000 + Ni Ni91 1.0 0.06250 0.56250 0.50000 1.0000 + Ni Ni92 1.0 0.02083 0.60417 0.50000 1.0000 + Ni Ni93 1.0 0.97917 0.64583 0.50000 1.0000 + Ni Ni94 1.0 0.93750 0.68750 0.50000 1.0000 + Ni Ni95 1.0 0.89583 0.72917 0.50000 1.0000 + Ni Ni96 1.0 0.85417 0.77083 0.50000 1.0000 + Ni Ni97 1.0 0.35417 0.35417 0.50000 1.0000 + Ni Ni98 1.0 0.31250 0.39583 0.50000 1.0000 + Ni Ni99 1.0 0.27083 0.43750 0.50000 1.0000 + Ni Ni100 1.0 0.22917 0.47917 0.50000 1.0000 + Ni Ni101 1.0 0.18750 0.52083 0.50000 1.0000 + Ni Ni102 1.0 0.14583 0.56250 0.50000 1.0000 + Ni Ni103 1.0 0.10417 0.60417 0.50000 1.0000 + Ni Ni104 1.0 0.06250 0.64583 0.50000 1.0000 + Ni Ni105 1.0 0.02083 0.68750 0.50000 1.0000 + Ni Ni106 1.0 0.97917 0.72917 0.50000 1.0000 + Ni Ni107 1.0 0.93750 0.77083 0.50000 1.0000 + Ni Ni108 1.0 0.89583 0.81250 0.50000 1.0000 + Ni Ni109 1.0 0.39583 0.39583 0.50000 1.0000 + Ni Ni110 1.0 0.35417 0.43750 0.50000 1.0000 + Ni Ni111 1.0 0.31250 0.47917 0.50000 1.0000 + Ni Ni112 1.0 0.27083 0.52083 0.50000 1.0000 + Ni Ni113 1.0 0.22917 0.56250 0.50000 1.0000 + Ni Ni114 1.0 0.18750 0.60417 0.50000 1.0000 + Ni Ni115 1.0 0.14583 0.64583 0.50000 1.0000 + Ni Ni116 1.0 0.10417 0.68750 0.50000 1.0000 + Ni Ni117 1.0 0.06250 0.72917 0.50000 1.0000 + Ni Ni118 1.0 0.02083 0.77083 0.50000 1.0000 + Ni Ni119 1.0 0.97917 0.81250 0.50000 1.0000 + Ni Ni120 1.0 0.93750 0.85417 0.50000 1.0000 + Ni Ni121 1.0 0.43750 0.43750 0.50000 1.0000 + Ni Ni122 1.0 0.39583 0.47917 0.50000 1.0000 + Ni Ni123 1.0 0.35417 0.52083 0.50000 1.0000 + Ni Ni124 1.0 0.31250 0.56250 0.50000 1.0000 + Ni Ni125 1.0 0.27083 0.60417 0.50000 1.0000 + Ni Ni126 1.0 0.22917 0.64583 0.50000 1.0000 + Ni Ni127 1.0 0.18750 0.68750 0.50000 1.0000 + Ni Ni128 1.0 0.14583 0.72917 0.50000 1.0000 + Ni Ni129 1.0 0.10417 0.77083 0.50000 1.0000 + Ni Ni130 1.0 0.06250 0.81250 0.50000 1.0000 + Ni Ni131 1.0 0.02083 0.85417 0.50000 1.0000 + Ni Ni132 1.0 0.97917 0.89583 0.50000 1.0000 + Ni Ni133 1.0 0.47917 0.47917 0.50000 1.0000 + Ni Ni134 1.0 0.43750 0.52083 0.50000 1.0000 + Ni Ni135 1.0 0.39583 0.56250 0.50000 1.0000 + Ni Ni136 1.0 0.35417 0.60417 0.50000 1.0000 + Ni Ni137 1.0 0.31250 0.64583 0.50000 1.0000 + Ni Ni138 1.0 0.27083 0.68750 0.50000 1.0000 + Ni Ni139 1.0 0.22917 0.72917 0.50000 1.0000 + Ni Ni140 1.0 0.18750 0.77083 0.50000 1.0000 + Ni Ni141 1.0 0.14583 0.81250 0.50000 1.0000 + Ni Ni142 1.0 0.10417 0.85417 0.50000 1.0000 + Ni Ni143 1.0 0.06250 0.89583 0.50000 1.0000 + Ni Ni144 1.0 0.02083 0.93750 0.50000 1.0000 + O O1 1.0 0.97917 0.03523 0.33810 1.0000 + O O2 1.0 0.93750 0.07689 0.33810 1.0000 + O O3 1.0 0.89584 0.11856 0.33810 1.0000 + O O4 1.0 0.85417 0.16023 0.33810 1.0000 + O O5 1.0 0.81250 0.20189 0.33810 1.0000 + O O6 1.0 0.77084 0.24356 0.33810 1.0000 + O O7 1.0 0.72917 0.28523 0.33810 1.0000 + O O8 1.0 0.68750 0.32689 0.33810 1.0000 + O O9 1.0 0.64584 0.36856 0.33810 1.0000 + O O10 1.0 0.60417 0.41023 0.33810 1.0000 + O O11 1.0 0.56250 0.45189 0.33810 1.0000 + O O12 1.0 0.52084 0.49356 0.33810 1.0000 + O O13 1.0 0.02084 0.07689 0.33810 1.0000 + O O14 1.0 0.97917 0.11856 0.33810 1.0000 + O O15 1.0 0.93750 0.16023 0.33810 1.0000 + O O16 1.0 0.89584 0.20189 0.33810 1.0000 + O O17 1.0 0.85417 0.24356 0.33810 1.0000 + O O18 1.0 0.81250 0.28523 0.33810 1.0000 + O O19 1.0 0.77084 0.32689 0.33810 1.0000 + O O20 1.0 0.72917 0.36856 0.33810 1.0000 + O O21 1.0 0.68750 0.41023 0.33810 1.0000 + O O22 1.0 0.64584 0.45189 0.33810 1.0000 + O O23 1.0 0.60417 0.49356 0.33810 1.0000 + O O24 1.0 0.56250 0.53523 0.33810 1.0000 + O O25 1.0 0.06250 0.11856 0.33810 1.0000 + O O26 1.0 0.02084 0.16023 0.33810 1.0000 + O O27 1.0 0.97917 0.20189 0.33810 1.0000 + O O28 1.0 0.93750 0.24356 0.33810 1.0000 + O O29 1.0 0.89584 0.28523 0.33810 1.0000 + O O30 1.0 0.85417 0.32689 0.33810 1.0000 + O O31 1.0 0.81250 0.36856 0.33810 1.0000 + O O32 1.0 0.77084 0.41023 0.33810 1.0000 + O O33 1.0 0.72917 0.45189 0.33810 1.0000 + O O34 1.0 0.68750 0.49356 0.33810 1.0000 + O O35 1.0 0.64584 0.53523 0.33810 1.0000 + O O36 1.0 0.60417 0.57689 0.33810 1.0000 + O O37 1.0 0.10417 0.16023 0.33810 1.0000 + O O38 1.0 0.06250 0.20189 0.33810 1.0000 + O O39 1.0 0.02084 0.24356 0.33810 1.0000 + O O40 1.0 0.97917 0.28523 0.33810 1.0000 + O O41 1.0 0.93750 0.32689 0.33810 1.0000 + O O42 1.0 0.89584 0.36856 0.33810 1.0000 + O O43 1.0 0.85417 0.41023 0.33810 1.0000 + O O44 1.0 0.81250 0.45189 0.33810 1.0000 + O O45 1.0 0.77084 0.49356 0.33810 1.0000 + O O46 1.0 0.72917 0.53523 0.33810 1.0000 + O O47 1.0 0.68750 0.57689 0.33810 1.0000 + O O48 1.0 0.64584 0.61856 0.33810 1.0000 + O O49 1.0 0.14584 0.20189 0.33810 1.0000 + O O50 1.0 0.10417 0.24356 0.33810 1.0000 + O O51 1.0 0.06250 0.28523 0.33810 1.0000 + O O52 1.0 0.02084 0.32689 0.33810 1.0000 + O O53 1.0 0.97917 0.36856 0.33810 1.0000 + O O54 1.0 0.93750 0.41023 0.33810 1.0000 + O O55 1.0 0.89584 0.45189 0.33810 1.0000 + O O56 1.0 0.85417 0.49356 0.33810 1.0000 + O O57 1.0 0.81250 0.53523 0.33810 1.0000 + O O58 1.0 0.77084 0.57689 0.33810 1.0000 + O O59 1.0 0.72917 0.61856 0.33810 1.0000 + O O60 1.0 0.68750 0.66023 0.33810 1.0000 + O O61 1.0 0.18750 0.24356 0.33810 1.0000 + O O62 1.0 0.14584 0.28523 0.33810 1.0000 + O O63 1.0 0.10417 0.32689 0.33810 1.0000 + O O64 1.0 0.06250 0.36856 0.33810 1.0000 + O O65 1.0 0.02084 0.41023 0.33810 1.0000 + O O66 1.0 0.97917 0.45189 0.33810 1.0000 + O O67 1.0 0.93750 0.49356 0.33810 1.0000 + O O68 1.0 0.89584 0.53523 0.33810 1.0000 + O O69 1.0 0.85417 0.57689 0.33810 1.0000 + O O70 1.0 0.81250 0.61856 0.33810 1.0000 + O O71 1.0 0.77084 0.66023 0.33810 1.0000 + O O72 1.0 0.72917 0.70189 0.33810 1.0000 + O O73 1.0 0.22917 0.28523 0.33810 1.0000 + O O74 1.0 0.18750 0.32689 0.33810 1.0000 + O O75 1.0 0.14584 0.36856 0.33810 1.0000 + O O76 1.0 0.10417 0.41023 0.33810 1.0000 + O O77 1.0 0.06250 0.45189 0.33810 1.0000 + O O78 1.0 0.02084 0.49356 0.33810 1.0000 + O O79 1.0 0.97917 0.53523 0.33810 1.0000 + O O80 1.0 0.93750 0.57689 0.33810 1.0000 + O O81 1.0 0.89584 0.61856 0.33810 1.0000 + O O82 1.0 0.85417 0.66023 0.33810 1.0000 + O O83 1.0 0.81250 0.70189 0.33810 1.0000 + O O84 1.0 0.77084 0.74356 0.33810 1.0000 + O O85 1.0 0.27084 0.32689 0.33810 1.0000 + O O86 1.0 0.22917 0.36856 0.33810 1.0000 + O O87 1.0 0.18750 0.41023 0.33810 1.0000 + O O88 1.0 0.14584 0.45189 0.33810 1.0000 + O O89 1.0 0.10417 0.49356 0.33810 1.0000 + O O90 1.0 0.06250 0.53523 0.33810 1.0000 + O O91 1.0 0.02084 0.57689 0.33810 1.0000 + O O92 1.0 0.97917 0.61856 0.33810 1.0000 + O O93 1.0 0.93750 0.66023 0.33810 1.0000 + O O94 1.0 0.89584 0.70189 0.33810 1.0000 + O O95 1.0 0.85417 0.74356 0.33810 1.0000 + O O96 1.0 0.81250 0.78523 0.33810 1.0000 + O O97 1.0 0.31250 0.36856 0.33810 1.0000 + O O98 1.0 0.27084 0.41023 0.33810 1.0000 + O O99 1.0 0.22917 0.45189 0.33810 1.0000 + O O100 1.0 0.18750 0.49356 0.33810 1.0000 + O O101 1.0 0.14584 0.53523 0.33810 1.0000 + O O102 1.0 0.10417 0.57689 0.33810 1.0000 + O O103 1.0 0.06250 0.61856 0.33810 1.0000 + O O104 1.0 0.02084 0.66023 0.33810 1.0000 + O O105 1.0 0.97917 0.70189 0.33810 1.0000 + O O106 1.0 0.93750 0.74356 0.33810 1.0000 + O O107 1.0 0.89584 0.78523 0.33810 1.0000 + O O108 1.0 0.85417 0.82689 0.33810 1.0000 + O O109 1.0 0.35417 0.41023 0.33810 1.0000 + O O110 1.0 0.31250 0.45189 0.33810 1.0000 + O O111 1.0 0.27084 0.49356 0.33810 1.0000 + O O112 1.0 0.22917 0.53523 0.33810 1.0000 + O O113 1.0 0.18750 0.57689 0.33810 1.0000 + O O114 1.0 0.14584 0.61856 0.33810 1.0000 + O O115 1.0 0.10417 0.66023 0.33810 1.0000 + O O116 1.0 0.06250 0.70189 0.33810 1.0000 + O O117 1.0 0.02084 0.74356 0.33810 1.0000 + O O118 1.0 0.97917 0.78523 0.33810 1.0000 + O O119 1.0 0.93750 0.82689 0.33810 1.0000 + O O120 1.0 0.89584 0.86856 0.33810 1.0000 + O O121 1.0 0.39584 0.45189 0.33810 1.0000 + O O122 1.0 0.35417 0.49356 0.33810 1.0000 + O O123 1.0 0.31250 0.53523 0.33810 1.0000 + O O124 1.0 0.27084 0.57689 0.33810 1.0000 + O O125 1.0 0.22917 0.61856 0.33810 1.0000 + O O126 1.0 0.18750 0.66023 0.33810 1.0000 + O O127 1.0 0.14584 0.70189 0.33810 1.0000 + O O128 1.0 0.10417 0.74356 0.33810 1.0000 + O O129 1.0 0.06250 0.78523 0.33810 1.0000 + O O130 1.0 0.02084 0.82689 0.33810 1.0000 + O O131 1.0 0.97917 0.86856 0.33810 1.0000 + O O132 1.0 0.93750 0.91023 0.33810 1.0000 + O O133 1.0 0.43750 0.49356 0.33810 1.0000 + O O134 1.0 0.39584 0.53523 0.33810 1.0000 + O O135 1.0 0.35417 0.57689 0.33810 1.0000 + O O136 1.0 0.31250 0.61856 0.33810 1.0000 + O O137 1.0 0.27084 0.66023 0.33810 1.0000 + O O138 1.0 0.22917 0.70189 0.33810 1.0000 + O O139 1.0 0.18750 0.74356 0.33810 1.0000 + O O140 1.0 0.14584 0.78523 0.33810 1.0000 + O O141 1.0 0.10417 0.82689 0.33810 1.0000 + O O142 1.0 0.06250 0.86856 0.33810 1.0000 + O O143 1.0 0.02084 0.91023 0.33810 1.0000 + O O144 1.0 0.97917 0.95189 0.33810 1.0000 + O O145 1.0 0.99280 0.04886 0.66190 1.0000 + O O146 1.0 0.95113 0.09052 0.66190 1.0000 + O O147 1.0 0.90947 0.13219 0.66190 1.0000 + O O148 1.0 0.86780 0.17386 0.66190 1.0000 + O O149 1.0 0.82613 0.21552 0.66190 1.0000 + O O150 1.0 0.78447 0.25719 0.66190 1.0000 + O O151 1.0 0.74280 0.29886 0.66190 1.0000 + O O152 1.0 0.70113 0.34052 0.66190 1.0000 + O O153 1.0 0.65947 0.38219 0.66190 1.0000 + O O154 1.0 0.61780 0.42386 0.66190 1.0000 + O O155 1.0 0.57613 0.46552 0.66190 1.0000 + O O156 1.0 0.53447 0.50719 0.66190 1.0000 + O O157 1.0 0.03447 0.09052 0.66190 1.0000 + O O158 1.0 0.99280 0.13219 0.66190 1.0000 + O O159 1.0 0.95113 0.17386 0.66190 1.0000 + O O160 1.0 0.90947 0.21552 0.66190 1.0000 + O O161 1.0 0.86780 0.25719 0.66190 1.0000 + O O162 1.0 0.82613 0.29886 0.66190 1.0000 + O O163 1.0 0.78447 0.34052 0.66190 1.0000 + O O164 1.0 0.74280 0.38219 0.66190 1.0000 + O O165 1.0 0.70113 0.42386 0.66190 1.0000 + O O166 1.0 0.65947 0.46552 0.66190 1.0000 + O O167 1.0 0.61780 0.50719 0.66190 1.0000 + O O168 1.0 0.57613 0.54886 0.66190 1.0000 + O O169 1.0 0.07613 0.13219 0.66190 1.0000 + O O170 1.0 0.03447 0.17386 0.66190 1.0000 + O O171 1.0 0.99280 0.21552 0.66190 1.0000 + O O172 1.0 0.95113 0.25719 0.66190 1.0000 + O O173 1.0 0.90947 0.29886 0.66190 1.0000 + O O174 1.0 0.86780 0.34052 0.66190 1.0000 + O O175 1.0 0.82613 0.38219 0.66190 1.0000 + O O176 1.0 0.78447 0.42386 0.66190 1.0000 + O O177 1.0 0.74280 0.46552 0.66190 1.0000 + O O178 1.0 0.70113 0.50719 0.66190 1.0000 + O O179 1.0 0.65947 0.54886 0.66190 1.0000 + O O180 1.0 0.61780 0.59052 0.66190 1.0000 + O O181 1.0 0.11780 0.17386 0.66190 1.0000 + O O182 1.0 0.07613 0.21552 0.66190 1.0000 + O O183 1.0 0.03447 0.25719 0.66190 1.0000 + O O184 1.0 0.99280 0.29886 0.66190 1.0000 + O O185 1.0 0.95113 0.34052 0.66190 1.0000 + O O186 1.0 0.90947 0.38219 0.66190 1.0000 + O O187 1.0 0.86780 0.42386 0.66190 1.0000 + O O188 1.0 0.82613 0.46552 0.66190 1.0000 + O O189 1.0 0.78447 0.50719 0.66190 1.0000 + O O190 1.0 0.74280 0.54886 0.66190 1.0000 + O O191 1.0 0.70113 0.59052 0.66190 1.0000 + O O192 1.0 0.65947 0.63219 0.66190 1.0000 + O O193 1.0 0.15947 0.21552 0.66190 1.0000 + O O194 1.0 0.11780 0.25719 0.66190 1.0000 + O O195 1.0 0.07613 0.29886 0.66190 1.0000 + O O196 1.0 0.03447 0.34052 0.66190 1.0000 + O O197 1.0 0.99280 0.38219 0.66190 1.0000 + O O198 1.0 0.95113 0.42386 0.66190 1.0000 + O O199 1.0 0.90947 0.46552 0.66190 1.0000 + O O200 1.0 0.86780 0.50719 0.66190 1.0000 + O O201 1.0 0.82613 0.54886 0.66190 1.0000 + O O202 1.0 0.78447 0.59052 0.66190 1.0000 + O O203 1.0 0.74280 0.63219 0.66190 1.0000 + O O204 1.0 0.70113 0.67386 0.66190 1.0000 + O O205 1.0 0.20113 0.25719 0.66190 1.0000 + O O206 1.0 0.15947 0.29886 0.66190 1.0000 + O O207 1.0 0.11780 0.34052 0.66190 1.0000 + O O208 1.0 0.07613 0.38219 0.66190 1.0000 + O O209 1.0 0.03447 0.42386 0.66190 1.0000 + O O210 1.0 0.99280 0.46552 0.66190 1.0000 + O O211 1.0 0.95113 0.50719 0.66190 1.0000 + O O212 1.0 0.90947 0.54886 0.66190 1.0000 + O O213 1.0 0.86780 0.59052 0.66190 1.0000 + O O214 1.0 0.82613 0.63219 0.66190 1.0000 + O O215 1.0 0.78447 0.67386 0.66190 1.0000 + O O216 1.0 0.74280 0.71552 0.66190 1.0000 + O O217 1.0 0.24280 0.29886 0.66190 1.0000 + O O218 1.0 0.20113 0.34052 0.66190 1.0000 + O O219 1.0 0.15947 0.38219 0.66190 1.0000 + O O220 1.0 0.11780 0.42386 0.66190 1.0000 + O O221 1.0 0.07613 0.46552 0.66190 1.0000 + O O222 1.0 0.03447 0.50719 0.66190 1.0000 + O O223 1.0 0.99280 0.54886 0.66190 1.0000 + O O224 1.0 0.95113 0.59052 0.66190 1.0000 + O O225 1.0 0.90947 0.63219 0.66190 1.0000 + O O226 1.0 0.86780 0.67386 0.66190 1.0000 + O O227 1.0 0.82613 0.71552 0.66190 1.0000 + O O228 1.0 0.78447 0.75719 0.66190 1.0000 + O O229 1.0 0.28447 0.34052 0.66190 1.0000 + O O230 1.0 0.24280 0.38219 0.66190 1.0000 + O O231 1.0 0.20113 0.42386 0.66190 1.0000 + O O232 1.0 0.15947 0.46552 0.66190 1.0000 + O O233 1.0 0.11780 0.50719 0.66190 1.0000 + O O234 1.0 0.07613 0.54886 0.66190 1.0000 + O O235 1.0 0.03447 0.59052 0.66190 1.0000 + O O236 1.0 0.99280 0.63219 0.66190 1.0000 + O O237 1.0 0.95113 0.67386 0.66190 1.0000 + O O238 1.0 0.90947 0.71552 0.66190 1.0000 + O O239 1.0 0.86780 0.75719 0.66190 1.0000 + O O240 1.0 0.82613 0.79886 0.66190 1.0000 + O O241 1.0 0.32613 0.38219 0.66190 1.0000 + O O242 1.0 0.28447 0.42386 0.66190 1.0000 + O O243 1.0 0.24280 0.46552 0.66190 1.0000 + O O244 1.0 0.20113 0.50719 0.66190 1.0000 + O O245 1.0 0.15947 0.54886 0.66190 1.0000 + O O246 1.0 0.11780 0.59052 0.66190 1.0000 + O O247 1.0 0.07613 0.63219 0.66190 1.0000 + O O248 1.0 0.03447 0.67386 0.66190 1.0000 + O O249 1.0 0.99280 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1.0000 + O O635 1.0 0.78449 0.61782 0.33778 1.0000 + O O636 1.0 0.74282 0.65949 0.33778 1.0000 + O O637 1.0 0.24282 0.24282 0.33778 1.0000 + O O638 1.0 0.20115 0.28449 0.33778 1.0000 + O O639 1.0 0.15949 0.32615 0.33778 1.0000 + O O640 1.0 0.11782 0.36782 0.33778 1.0000 + O O641 1.0 0.07615 0.40949 0.33778 1.0000 + O O642 1.0 0.03449 0.45115 0.33778 1.0000 + O O643 1.0 0.99282 0.49282 0.33778 1.0000 + O O644 1.0 0.95115 0.53449 0.33778 1.0000 + O O645 1.0 0.90949 0.57615 0.33778 1.0000 + O O646 1.0 0.86782 0.61782 0.33778 1.0000 + O O647 1.0 0.82615 0.65949 0.33778 1.0000 + O O648 1.0 0.78449 0.70115 0.33778 1.0000 + O O649 1.0 0.28449 0.28449 0.33778 1.0000 + O O650 1.0 0.24282 0.32615 0.33778 1.0000 + O O651 1.0 0.20115 0.36782 0.33778 1.0000 + O O652 1.0 0.15949 0.40949 0.33778 1.0000 + O O653 1.0 0.11782 0.45115 0.33778 1.0000 + O O654 1.0 0.07615 0.49282 0.33778 1.0000 + O O655 1.0 0.03449 0.53449 0.33778 1.0000 + O O656 1.0 0.99282 0.57615 0.33778 1.0000 + O O657 1.0 0.95115 0.61782 0.33778 1.0000 + O O658 1.0 0.90949 0.65949 0.33778 1.0000 + O O659 1.0 0.86782 0.70115 0.33778 1.0000 + O O660 1.0 0.82615 0.74282 0.33778 1.0000 + O O661 1.0 0.32615 0.32615 0.33778 1.0000 + O O662 1.0 0.28449 0.36782 0.33778 1.0000 + O O663 1.0 0.24282 0.40949 0.33778 1.0000 + O O664 1.0 0.20115 0.45115 0.33778 1.0000 + O O665 1.0 0.15949 0.49282 0.33778 1.0000 + O O666 1.0 0.11782 0.53449 0.33778 1.0000 + O O667 1.0 0.07615 0.57615 0.33778 1.0000 + O O668 1.0 0.03449 0.61782 0.33778 1.0000 + O O669 1.0 0.99282 0.65949 0.33778 1.0000 + O O670 1.0 0.95115 0.70115 0.33778 1.0000 + O O671 1.0 0.90949 0.74282 0.33778 1.0000 + O O672 1.0 0.86782 0.78449 0.33778 1.0000 + O O673 1.0 0.36782 0.36782 0.33778 1.0000 + O O674 1.0 0.32615 0.40949 0.33778 1.0000 + O O675 1.0 0.28449 0.45115 0.33778 1.0000 + O O676 1.0 0.24282 0.49282 0.33778 1.0000 + O O677 1.0 0.20115 0.53449 0.33778 1.0000 + O O678 1.0 0.15949 0.57615 0.33778 1.0000 + O O679 1.0 0.11782 0.61782 0.33778 1.0000 + O O680 1.0 0.07615 0.65949 0.33778 1.0000 + O O681 1.0 0.03449 0.70115 0.33778 1.0000 + O O682 1.0 0.99282 0.74282 0.33778 1.0000 + O O683 1.0 0.95115 0.78449 0.33778 1.0000 + O O684 1.0 0.90949 0.82615 0.33778 1.0000 + O O685 1.0 0.40949 0.40949 0.33778 1.0000 + O O686 1.0 0.36782 0.45115 0.33778 1.0000 + O O687 1.0 0.32615 0.49282 0.33778 1.0000 + O O688 1.0 0.28449 0.53449 0.33778 1.0000 + O O689 1.0 0.24282 0.57615 0.33778 1.0000 + O O690 1.0 0.20115 0.61782 0.33778 1.0000 + O O691 1.0 0.15949 0.65949 0.33778 1.0000 + O O692 1.0 0.11782 0.70115 0.33778 1.0000 + O O693 1.0 0.07615 0.74282 0.33778 1.0000 + O O694 1.0 0.03449 0.78449 0.33778 1.0000 + O O695 1.0 0.99282 0.82615 0.33778 1.0000 + O O696 1.0 0.95115 0.86782 0.33778 1.0000 + O O697 1.0 0.45115 0.45115 0.33778 1.0000 + O O698 1.0 0.40949 0.49282 0.33778 1.0000 + O O699 1.0 0.36782 0.53449 0.33778 1.0000 + O O700 1.0 0.32615 0.57615 0.33778 1.0000 + O O701 1.0 0.28449 0.61782 0.33778 1.0000 + O O702 1.0 0.24282 0.65949 0.33778 1.0000 + O O703 1.0 0.20115 0.70115 0.33778 1.0000 + O O704 1.0 0.15949 0.74282 0.33778 1.0000 + O O705 1.0 0.11782 0.78449 0.33778 1.0000 + O O706 1.0 0.07615 0.82615 0.33778 1.0000 + O O707 1.0 0.03449 0.86782 0.33778 1.0000 + O O708 1.0 0.99282 0.90949 0.33778 1.0000 + O O709 1.0 0.49282 0.49282 0.33778 1.0000 + O O710 1.0 0.45115 0.53449 0.33778 1.0000 + O O711 1.0 0.40949 0.57615 0.33778 1.0000 + O O712 1.0 0.36782 0.61782 0.33778 1.0000 + O O713 1.0 0.32615 0.65949 0.33778 1.0000 + O O714 1.0 0.28449 0.70115 0.33778 1.0000 + O O715 1.0 0.24282 0.74282 0.33778 1.0000 + O O716 1.0 0.20115 0.78449 0.33778 1.0000 + O O717 1.0 0.15949 0.82615 0.33778 1.0000 + O O718 1.0 0.11782 0.86782 0.33778 1.0000 + O O719 1.0 0.07615 0.90949 0.33778 1.0000 + O O720 1.0 0.03449 0.95115 0.33778 1.0000 + O O721 1.0 0.02083 0.04811 0.66190 1.0000 + O O722 1.0 0.97916 0.08977 0.66190 1.0000 + O O723 1.0 0.93750 0.13144 0.66190 1.0000 + O O724 1.0 0.89583 0.17311 0.66190 1.0000 + O O725 1.0 0.85416 0.21477 0.66190 1.0000 + O O726 1.0 0.81250 0.25644 0.66190 1.0000 + O O727 1.0 0.77083 0.29811 0.66190 1.0000 + O O728 1.0 0.72916 0.33977 0.66190 1.0000 + O O729 1.0 0.68750 0.38144 0.66190 1.0000 + O O730 1.0 0.64583 0.42311 0.66190 1.0000 + O O731 1.0 0.60416 0.46477 0.66190 1.0000 + O O732 1.0 0.56250 0.50644 0.66190 1.0000 + O O733 1.0 0.06250 0.08977 0.66190 1.0000 + O O734 1.0 0.02083 0.13144 0.66190 1.0000 + O O735 1.0 0.97916 0.17311 0.66190 1.0000 + O O736 1.0 0.93750 0.21477 0.66190 1.0000 + O O737 1.0 0.89583 0.25644 0.66190 1.0000 + O O738 1.0 0.85416 0.29811 0.66190 1.0000 + O O739 1.0 0.81250 0.33977 0.66190 1.0000 + O O740 1.0 0.77083 0.38144 0.66190 1.0000 + O O741 1.0 0.72916 0.42311 0.66190 1.0000 + O O742 1.0 0.68750 0.46477 0.66190 1.0000 + O O743 1.0 0.64583 0.50644 0.66190 1.0000 + O O744 1.0 0.60416 0.54811 0.66190 1.0000 + O O745 1.0 0.10416 0.13144 0.66190 1.0000 + O O746 1.0 0.06250 0.17311 0.66190 1.0000 + O O747 1.0 0.02083 0.21477 0.66190 1.0000 + O O748 1.0 0.97916 0.25644 0.66190 1.0000 + O O749 1.0 0.93750 0.29811 0.66190 1.0000 + O O750 1.0 0.89583 0.33977 0.66190 1.0000 + O O751 1.0 0.85416 0.38144 0.66190 1.0000 + O O752 1.0 0.81250 0.42311 0.66190 1.0000 + O O753 1.0 0.77083 0.46477 0.66190 1.0000 + O O754 1.0 0.72916 0.50644 0.66190 1.0000 + O O755 1.0 0.68750 0.54811 0.66190 1.0000 + O O756 1.0 0.64583 0.58977 0.66190 1.0000 + O O757 1.0 0.14583 0.17311 0.66190 1.0000 + O O758 1.0 0.10416 0.21477 0.66190 1.0000 + O O759 1.0 0.06250 0.25644 0.66190 1.0000 + O O760 1.0 0.02083 0.29811 0.66190 1.0000 + O O761 1.0 0.97916 0.33977 0.66190 1.0000 + O O762 1.0 0.93750 0.38144 0.66190 1.0000 + O O763 1.0 0.89583 0.42311 0.66190 1.0000 + O O764 1.0 0.85416 0.46477 0.66190 1.0000 + O O765 1.0 0.81250 0.50644 0.66190 1.0000 + O O766 1.0 0.77083 0.54811 0.66190 1.0000 + O O767 1.0 0.72916 0.58977 0.66190 1.0000 + O O768 1.0 0.68750 0.63144 0.66190 1.0000 + O O769 1.0 0.18750 0.21477 0.66190 1.0000 + O O770 1.0 0.14583 0.25644 0.66190 1.0000 + O O771 1.0 0.10416 0.29811 0.66190 1.0000 + O O772 1.0 0.06250 0.33977 0.66190 1.0000 + O O773 1.0 0.02083 0.38144 0.66190 1.0000 + O O774 1.0 0.97916 0.42311 0.66190 1.0000 + O O775 1.0 0.93750 0.46477 0.66190 1.0000 + O O776 1.0 0.89583 0.50644 0.66190 1.0000 + O O777 1.0 0.85416 0.54811 0.66190 1.0000 + O O778 1.0 0.81250 0.58977 0.66190 1.0000 + O O779 1.0 0.77083 0.63144 0.66190 1.0000 + O O780 1.0 0.72916 0.67311 0.66190 1.0000 + O O781 1.0 0.22916 0.25644 0.66190 1.0000 + O O782 1.0 0.18750 0.29811 0.66190 1.0000 + O O783 1.0 0.14583 0.33977 0.66190 1.0000 + O O784 1.0 0.10416 0.38144 0.66190 1.0000 + O O785 1.0 0.06250 0.42311 0.66190 1.0000 + O O786 1.0 0.02083 0.46477 0.66190 1.0000 + O O787 1.0 0.97916 0.50644 0.66190 1.0000 + O O788 1.0 0.93750 0.54811 0.66190 1.0000 + O O789 1.0 0.89583 0.58977 0.66190 1.0000 + O O790 1.0 0.85416 0.63144 0.66190 1.0000 + O O791 1.0 0.81250 0.67311 0.66190 1.0000 + O O792 1.0 0.77083 0.71477 0.66190 1.0000 + O O793 1.0 0.27083 0.29811 0.66190 1.0000 + O O794 1.0 0.22916 0.33977 0.66190 1.0000 + O O795 1.0 0.18750 0.38144 0.66190 1.0000 + O O796 1.0 0.14583 0.42311 0.66190 1.0000 + O O797 1.0 0.10416 0.46477 0.66190 1.0000 + O O798 1.0 0.06250 0.50644 0.66190 1.0000 + O O799 1.0 0.02083 0.54811 0.66190 1.0000 + O O800 1.0 0.97916 0.58977 0.66190 1.0000 + O O801 1.0 0.93750 0.63144 0.66190 1.0000 + O O802 1.0 0.89583 0.67311 0.66190 1.0000 + O O803 1.0 0.85416 0.71477 0.66190 1.0000 + O O804 1.0 0.81250 0.75644 0.66190 1.0000 + O O805 1.0 0.31250 0.33977 0.66190 1.0000 + O O806 1.0 0.27083 0.38144 0.66190 1.0000 + O O807 1.0 0.22916 0.42311 0.66190 1.0000 + O O808 1.0 0.18750 0.46477 0.66190 1.0000 + O O809 1.0 0.14583 0.50644 0.66190 1.0000 + O O810 1.0 0.10416 0.54811 0.66190 1.0000 + O O811 1.0 0.06250 0.58977 0.66190 1.0000 + O O812 1.0 0.02083 0.63144 0.66190 1.0000 + O O813 1.0 0.97916 0.67311 0.66190 1.0000 + O O814 1.0 0.93750 0.71477 0.66190 1.0000 + O O815 1.0 0.89583 0.75644 0.66190 1.0000 + O O816 1.0 0.85416 0.79811 0.66190 1.0000 + O O817 1.0 0.35416 0.38144 0.66190 1.0000 + O O818 1.0 0.31250 0.42311 0.66190 1.0000 + O O819 1.0 0.27083 0.46477 0.66190 1.0000 + O O820 1.0 0.22916 0.50644 0.66190 1.0000 + O O821 1.0 0.18750 0.54811 0.66190 1.0000 + O O822 1.0 0.14583 0.58977 0.66190 1.0000 + O O823 1.0 0.10416 0.63144 0.66190 1.0000 + O O824 1.0 0.06250 0.67311 0.66190 1.0000 + O O825 1.0 0.02083 0.71477 0.66190 1.0000 + O O826 1.0 0.97916 0.75644 0.66190 1.0000 + O O827 1.0 0.93750 0.79811 0.66190 1.0000 + O O828 1.0 0.89583 0.83977 0.66190 1.0000 + O O829 1.0 0.39583 0.42311 0.66190 1.0000 + O O830 1.0 0.35416 0.46477 0.66190 1.0000 + O O831 1.0 0.31250 0.50644 0.66190 1.0000 + O O832 1.0 0.27083 0.54811 0.66190 1.0000 + O O833 1.0 0.22916 0.58977 0.66190 1.0000 + O O834 1.0 0.18750 0.63144 0.66190 1.0000 + O O835 1.0 0.14583 0.67311 0.66190 1.0000 + O O836 1.0 0.10416 0.71477 0.66190 1.0000 + O O837 1.0 0.06250 0.75644 0.66190 1.0000 + O O838 1.0 0.02083 0.79811 0.66190 1.0000 + O O839 1.0 0.97916 0.83977 0.66190 1.0000 + O O840 1.0 0.93750 0.88144 0.66190 1.0000 + O O841 1.0 0.43750 0.46477 0.66190 1.0000 + O O842 1.0 0.39583 0.50644 0.66190 1.0000 + O O843 1.0 0.35416 0.54811 0.66190 1.0000 + O O844 1.0 0.31250 0.58977 0.66190 1.0000 + O O845 1.0 0.27083 0.63144 0.66190 1.0000 + O O846 1.0 0.22916 0.67311 0.66190 1.0000 + O O847 1.0 0.18750 0.71477 0.66190 1.0000 + O O848 1.0 0.14583 0.75644 0.66190 1.0000 + O O849 1.0 0.10416 0.79811 0.66190 1.0000 + O O850 1.0 0.06250 0.83977 0.66190 1.0000 + O O851 1.0 0.02083 0.88144 0.66190 1.0000 + O O852 1.0 0.97916 0.92311 0.66190 1.0000 + O O853 1.0 0.47916 0.50644 0.66190 1.0000 + O O854 1.0 0.43750 0.54811 0.66190 1.0000 + O O855 1.0 0.39583 0.58977 0.66190 1.0000 + O O856 1.0 0.35416 0.63144 0.66190 1.0000 + O O857 1.0 0.31250 0.67311 0.66190 1.0000 + O O858 1.0 0.27083 0.71477 0.66190 1.0000 + O O859 1.0 0.22916 0.75644 0.66190 1.0000 + O O860 1.0 0.18750 0.79811 0.66190 1.0000 + O O861 1.0 0.14583 0.83977 0.66190 1.0000 + O O862 1.0 0.10416 0.88144 0.66190 1.0000 + O O863 1.0 0.06250 0.92311 0.66190 1.0000 + O O864 1.0 0.02083 0.96477 0.66190 1.0000 + Mn Mn289 1.0 0.50695 0.56249 0.50000 1.0000 + Mn Mn290 1.0 0.46528 0.60416 0.50000 1.0000 + Mn Mn291 1.0 0.42361 0.64583 0.50000 1.0000 + Mn Mn292 1.0 0.38195 0.68749 0.50000 1.0000 + Mn Mn293 1.0 0.34028 0.72916 0.50000 1.0000 + Mn Mn294 1.0 0.29861 0.77083 0.50000 1.0000 + Mn Mn295 1.0 0.25695 0.81249 0.50000 1.0000 + Mn Mn296 1.0 0.21528 0.85416 0.50000 1.0000 + Mn Mn297 1.0 0.17361 0.89583 0.50000 1.0000 + Mn Mn298 1.0 0.13195 0.93749 0.50000 1.0000 + Mn Mn299 1.0 0.09028 0.97916 0.50000 1.0000 + Mn Mn300 1.0 0.04861 0.02083 0.50000 1.0000 + Mn Mn301 1.0 0.54861 0.60416 0.50000 1.0000 + Mn Mn302 1.0 0.50695 0.64583 0.50000 1.0000 + Mn Mn303 1.0 0.46528 0.68749 0.50000 1.0000 + Mn Mn304 1.0 0.42361 0.72916 0.50000 1.0000 + Mn Mn305 1.0 0.38195 0.77083 0.50000 1.0000 + Mn Mn306 1.0 0.34028 0.81249 0.50000 1.0000 + Mn Mn307 1.0 0.29861 0.85416 0.50000 1.0000 + Mn Mn308 1.0 0.25695 0.89583 0.50000 1.0000 + Mn Mn309 1.0 0.21528 0.93749 0.50000 1.0000 + Mn Mn310 1.0 0.17361 0.97916 0.50000 1.0000 + Mn Mn311 1.0 0.13195 0.02083 0.50000 1.0000 + Mn Mn312 1.0 0.09028 0.06249 0.50000 1.0000 + Mn Mn313 1.0 0.59028 0.64583 0.50000 1.0000 + Mn Mn314 1.0 0.54861 0.68749 0.50000 1.0000 + Mn Mn315 1.0 0.50695 0.72916 0.50000 1.0000 + Mn Mn316 1.0 0.46528 0.77083 0.50000 1.0000 + Mn Mn317 1.0 0.42361 0.81249 0.50000 1.0000 + Mn Mn318 1.0 0.38195 0.85416 0.50000 1.0000 + Mn Mn319 1.0 0.34028 0.89583 0.50000 1.0000 + Mn Mn320 1.0 0.29861 0.93749 0.50000 1.0000 + Mn Mn321 1.0 0.25695 0.97916 0.50000 1.0000 + Mn Mn322 1.0 0.21528 0.02083 0.50000 1.0000 + Mn Mn323 1.0 0.17361 0.06249 0.50000 1.0000 + Mn Mn324 1.0 0.13195 0.10416 0.50000 1.0000 + Mn Mn325 1.0 0.63195 0.68749 0.50000 1.0000 + Mn Mn326 1.0 0.59028 0.72916 0.50000 1.0000 + Mn Mn327 1.0 0.54861 0.77083 0.50000 1.0000 + Mn Mn328 1.0 0.50695 0.81249 0.50000 1.0000 + Mn Mn329 1.0 0.46528 0.85416 0.50000 1.0000 + Mn Mn330 1.0 0.42361 0.89583 0.50000 1.0000 + Mn Mn331 1.0 0.38195 0.93749 0.50000 1.0000 + Mn Mn332 1.0 0.34028 0.97916 0.50000 1.0000 + Mn Mn333 1.0 0.29861 0.02083 0.50000 1.0000 + Mn Mn334 1.0 0.25695 0.06249 0.50000 1.0000 + Mn Mn335 1.0 0.21528 0.10416 0.50000 1.0000 + Mn Mn336 1.0 0.17361 0.14583 0.50000 1.0000 + Mn Mn337 1.0 0.67361 0.72916 0.50000 1.0000 + Mn Mn338 1.0 0.63195 0.77083 0.50000 1.0000 + Mn Mn339 1.0 0.59028 0.81249 0.50000 1.0000 + Mn Mn340 1.0 0.54861 0.85416 0.50000 1.0000 + Mn Mn341 1.0 0.50695 0.89583 0.50000 1.0000 + Mn Mn342 1.0 0.46528 0.93749 0.50000 1.0000 + Mn Mn343 1.0 0.42361 0.97916 0.50000 1.0000 + Mn Mn344 1.0 0.38195 0.02083 0.50000 1.0000 + Mn Mn345 1.0 0.34028 0.06249 0.50000 1.0000 + Mn Mn346 1.0 0.29861 0.10416 0.50000 1.0000 + Mn Mn347 1.0 0.25695 0.14583 0.50000 1.0000 + Mn Mn348 1.0 0.21528 0.18749 0.50000 1.0000 + Mn Mn349 1.0 0.71528 0.77083 0.50000 1.0000 + Mn Mn350 1.0 0.67361 0.81249 0.50000 1.0000 + Mn Mn351 1.0 0.63195 0.85416 0.50000 1.0000 + Mn Mn352 1.0 0.59028 0.89583 0.50000 1.0000 + Mn Mn353 1.0 0.54861 0.93749 0.50000 1.0000 + Mn Mn354 1.0 0.50695 0.97916 0.50000 1.0000 + Mn Mn355 1.0 0.46528 0.02083 0.50000 1.0000 + Mn Mn356 1.0 0.42361 0.06249 0.50000 1.0000 + Mn Mn357 1.0 0.38195 0.10416 0.50000 1.0000 + Mn Mn358 1.0 0.34028 0.14583 0.50000 1.0000 + Mn Mn359 1.0 0.29861 0.18749 0.50000 1.0000 + Mn Mn360 1.0 0.25695 0.22916 0.50000 1.0000 + Mn Mn361 1.0 0.75695 0.81249 0.50000 1.0000 + Mn Mn362 1.0 0.71528 0.85416 0.50000 1.0000 + Mn Mn363 1.0 0.67361 0.89583 0.50000 1.0000 + Mn Mn364 1.0 0.63195 0.93749 0.50000 1.0000 + Mn Mn365 1.0 0.59028 0.97916 0.50000 1.0000 + Mn Mn366 1.0 0.54861 0.02083 0.50000 1.0000 + Mn Mn367 1.0 0.50695 0.06249 0.50000 1.0000 + Mn Mn368 1.0 0.46528 0.10416 0.50000 1.0000 + Mn Mn369 1.0 0.42361 0.14583 0.50000 1.0000 + Mn Mn370 1.0 0.38195 0.18749 0.50000 1.0000 + Mn Mn371 1.0 0.34028 0.22916 0.50000 1.0000 + Mn Mn372 1.0 0.29861 0.27083 0.50000 1.0000 + Mn Mn373 1.0 0.79861 0.85416 0.50000 1.0000 + Mn Mn374 1.0 0.75695 0.89583 0.50000 1.0000 + Mn Mn375 1.0 0.71528 0.93749 0.50000 1.0000 + Mn Mn376 1.0 0.67361 0.97916 0.50000 1.0000 + Mn Mn377 1.0 0.63195 0.02083 0.50000 1.0000 + Mn Mn378 1.0 0.59028 0.06249 0.50000 1.0000 + Mn Mn379 1.0 0.54861 0.10416 0.50000 1.0000 + Mn Mn380 1.0 0.50695 0.14583 0.50000 1.0000 + Mn Mn381 1.0 0.46528 0.18749 0.50000 1.0000 + Mn Mn382 1.0 0.42361 0.22916 0.50000 1.0000 + Mn Mn383 1.0 0.38195 0.27083 0.50000 1.0000 + Mn Mn384 1.0 0.34028 0.31249 0.50000 1.0000 + Mn Mn385 1.0 0.84028 0.89583 0.50000 1.0000 + Mn Mn386 1.0 0.79861 0.93749 0.50000 1.0000 + Mn Mn387 1.0 0.75695 0.97916 0.50000 1.0000 + Mn Mn388 1.0 0.71528 0.02083 0.50000 1.0000 + Mn Mn389 1.0 0.67361 0.06249 0.50000 1.0000 + Mn Mn390 1.0 0.63195 0.10416 0.50000 1.0000 + Mn Mn391 1.0 0.59028 0.14583 0.50000 1.0000 + Mn Mn392 1.0 0.54861 0.18749 0.50000 1.0000 + Mn Mn393 1.0 0.50695 0.22916 0.50000 1.0000 + Mn Mn394 1.0 0.46528 0.27083 0.50000 1.0000 + Mn Mn395 1.0 0.42361 0.31249 0.50000 1.0000 + Mn Mn396 1.0 0.38195 0.35416 0.50000 1.0000 + Mn Mn397 1.0 0.88195 0.93749 0.50000 1.0000 + Mn Mn398 1.0 0.84028 0.97916 0.50000 1.0000 + Mn Mn399 1.0 0.79861 0.02083 0.50000 1.0000 + Mn Mn400 1.0 0.75695 0.06249 0.50000 1.0000 + Mn Mn401 1.0 0.71528 0.10416 0.50000 1.0000 + Mn Mn402 1.0 0.67361 0.14583 0.50000 1.0000 + Mn Mn403 1.0 0.63195 0.18749 0.50000 1.0000 + Mn Mn404 1.0 0.59028 0.22916 0.50000 1.0000 + Mn Mn405 1.0 0.54861 0.27083 0.50000 1.0000 + Mn Mn406 1.0 0.50695 0.31249 0.50000 1.0000 + Mn Mn407 1.0 0.46528 0.35416 0.50000 1.0000 + Mn Mn408 1.0 0.42361 0.39583 0.50000 1.0000 + Mn Mn409 1.0 0.92361 0.97916 0.50000 1.0000 + Mn Mn410 1.0 0.88195 0.02083 0.50000 1.0000 + Mn Mn411 1.0 0.84028 0.06249 0.50000 1.0000 + Mn Mn412 1.0 0.79861 0.10416 0.50000 1.0000 + Mn Mn413 1.0 0.75695 0.14583 0.50000 1.0000 + Mn Mn414 1.0 0.71528 0.18749 0.50000 1.0000 + Mn Mn415 1.0 0.67361 0.22916 0.50000 1.0000 + Mn Mn416 1.0 0.63195 0.27083 0.50000 1.0000 + Mn Mn417 1.0 0.59028 0.31249 0.50000 1.0000 + Mn Mn418 1.0 0.54861 0.35416 0.50000 1.0000 + Mn Mn419 1.0 0.50695 0.39583 0.50000 1.0000 + Mn Mn420 1.0 0.46528 0.43749 0.50000 1.0000 + Mn Mn421 1.0 0.96528 0.02083 0.50000 1.0000 + Mn Mn422 1.0 0.92361 0.06249 0.50000 1.0000 + Mn Mn423 1.0 0.88195 0.10416 0.50000 1.0000 + Mn Mn424 1.0 0.84028 0.14583 0.50000 1.0000 + Mn Mn425 1.0 0.79861 0.18749 0.50000 1.0000 + Mn Mn426 1.0 0.75695 0.22916 0.50000 1.0000 + Mn Mn427 1.0 0.71528 0.27083 0.50000 1.0000 + Mn Mn428 1.0 0.67361 0.31249 0.50000 1.0000 + Mn Mn429 1.0 0.63195 0.35416 0.50000 1.0000 + Mn Mn430 1.0 0.59028 0.39583 0.50000 1.0000 + Mn Mn431 1.0 0.54861 0.43749 0.50000 1.0000 + Mn Mn432 1.0 0.50695 0.47916 0.50000 1.0000 + Mn Mn433 1.0 0.49305 0.52084 0.50000 1.0000 + Mn Mn434 1.0 0.45139 0.56251 0.50000 1.0000 + Mn Mn435 1.0 0.40972 0.60417 0.50000 1.0000 + Mn Mn436 1.0 0.36805 0.64584 0.50000 1.0000 + Mn Mn437 1.0 0.32639 0.68751 0.50000 1.0000 + Mn Mn438 1.0 0.28472 0.72917 0.50000 1.0000 + Mn Mn439 1.0 0.24305 0.77084 0.50000 1.0000 + Mn Mn440 1.0 0.20139 0.81251 0.50000 1.0000 + Mn Mn441 1.0 0.15972 0.85417 0.50000 1.0000 + Mn Mn442 1.0 0.11805 0.89584 0.50000 1.0000 + Mn Mn443 1.0 0.07639 0.93751 0.50000 1.0000 + Mn Mn444 1.0 0.03472 0.97917 0.50000 1.0000 + Mn Mn445 1.0 0.53472 0.56251 0.50000 1.0000 + Mn Mn446 1.0 0.49305 0.60417 0.50000 1.0000 + Mn Mn447 1.0 0.45139 0.64584 0.50000 1.0000 + Mn Mn448 1.0 0.40972 0.68751 0.50000 1.0000 + Mn Mn449 1.0 0.36805 0.72917 0.50000 1.0000 + Mn Mn450 1.0 0.32639 0.77084 0.50000 1.0000 + Mn Mn451 1.0 0.28472 0.81251 0.50000 1.0000 + Mn Mn452 1.0 0.24305 0.85417 0.50000 1.0000 + Mn Mn453 1.0 0.20139 0.89584 0.50000 1.0000 + Mn Mn454 1.0 0.15972 0.93751 0.50000 1.0000 + Mn Mn455 1.0 0.11805 0.97917 0.50000 1.0000 + Mn Mn456 1.0 0.07639 0.02084 0.50000 1.0000 + Mn Mn457 1.0 0.57639 0.60417 0.50000 1.0000 + Mn Mn458 1.0 0.53472 0.64584 0.50000 1.0000 + Mn Mn459 1.0 0.49305 0.68751 0.50000 1.0000 + Mn Mn460 1.0 0.45139 0.72917 0.50000 1.0000 + Mn Mn461 1.0 0.40972 0.77084 0.50000 1.0000 + Mn Mn462 1.0 0.36805 0.81251 0.50000 1.0000 + Mn Mn463 1.0 0.32639 0.85417 0.50000 1.0000 + Mn Mn464 1.0 0.28472 0.89584 0.50000 1.0000 + Mn Mn465 1.0 0.24305 0.93751 0.50000 1.0000 + Mn Mn466 1.0 0.20139 0.97917 0.50000 1.0000 + Mn Mn467 1.0 0.15972 0.02084 0.50000 1.0000 + Mn Mn468 1.0 0.11805 0.06251 0.50000 1.0000 + Mn Mn469 1.0 0.61805 0.64584 0.50000 1.0000 + Mn Mn470 1.0 0.57639 0.68751 0.50000 1.0000 + Mn Mn471 1.0 0.53472 0.72917 0.50000 1.0000 + Mn Mn472 1.0 0.49305 0.77084 0.50000 1.0000 + Mn Mn473 1.0 0.45139 0.81251 0.50000 1.0000 + Mn Mn474 1.0 0.40972 0.85417 0.50000 1.0000 + Mn Mn475 1.0 0.36805 0.89584 0.50000 1.0000 + Mn Mn476 1.0 0.32639 0.93751 0.50000 1.0000 + Mn Mn477 1.0 0.28472 0.97917 0.50000 1.0000 + Mn Mn478 1.0 0.24305 0.02084 0.50000 1.0000 + Mn Mn479 1.0 0.20139 0.06251 0.50000 1.0000 + Mn Mn480 1.0 0.15972 0.10417 0.50000 1.0000 + Mn Mn481 1.0 0.65972 0.68751 0.50000 1.0000 + Mn Mn482 1.0 0.61805 0.72917 0.50000 1.0000 + Mn Mn483 1.0 0.57639 0.77084 0.50000 1.0000 + Mn Mn484 1.0 0.53472 0.81251 0.50000 1.0000 + Mn Mn485 1.0 0.49305 0.85417 0.50000 1.0000 + Mn Mn486 1.0 0.45139 0.89584 0.50000 1.0000 + Mn Mn487 1.0 0.40972 0.93751 0.50000 1.0000 + Mn Mn488 1.0 0.36805 0.97917 0.50000 1.0000 + Mn Mn489 1.0 0.32639 0.02084 0.50000 1.0000 + Mn Mn490 1.0 0.28472 0.06251 0.50000 1.0000 + Mn Mn491 1.0 0.24305 0.10417 0.50000 1.0000 + Mn Mn492 1.0 0.20139 0.14584 0.50000 1.0000 + Mn Mn493 1.0 0.70139 0.72917 0.50000 1.0000 + Mn Mn494 1.0 0.65972 0.77084 0.50000 1.0000 + Mn Mn495 1.0 0.61805 0.81251 0.50000 1.0000 + Mn Mn496 1.0 0.57639 0.85417 0.50000 1.0000 + Mn Mn497 1.0 0.53472 0.89584 0.50000 1.0000 + Mn Mn498 1.0 0.49305 0.93751 0.50000 1.0000 + Mn Mn499 1.0 0.45139 0.97917 0.50000 1.0000 + Mn Mn500 1.0 0.40972 0.02084 0.50000 1.0000 + Mn Mn501 1.0 0.36805 0.06251 0.50000 1.0000 + Mn Mn502 1.0 0.32639 0.10417 0.50000 1.0000 + Mn Mn503 1.0 0.28472 0.14584 0.50000 1.0000 + Mn Mn504 1.0 0.24305 0.18751 0.50000 1.0000 + Mn Mn505 1.0 0.74305 0.77084 0.50000 1.0000 + Mn Mn506 1.0 0.70139 0.81251 0.50000 1.0000 + Mn Mn507 1.0 0.65972 0.85417 0.50000 1.0000 + Mn Mn508 1.0 0.61805 0.89584 0.50000 1.0000 + Mn Mn509 1.0 0.57639 0.93751 0.50000 1.0000 + Mn Mn510 1.0 0.53472 0.97917 0.50000 1.0000 + Mn Mn511 1.0 0.49305 0.02084 0.50000 1.0000 + Mn Mn512 1.0 0.45139 0.06251 0.50000 1.0000 + Mn Mn513 1.0 0.40972 0.10417 0.50000 1.0000 + Mn Mn514 1.0 0.36805 0.14584 0.50000 1.0000 + Mn Mn515 1.0 0.32639 0.18751 0.50000 1.0000 + Mn Mn516 1.0 0.28472 0.22917 0.50000 1.0000 + Mn Mn517 1.0 0.78472 0.81251 0.50000 1.0000 + Mn Mn518 1.0 0.74305 0.85417 0.50000 1.0000 + Mn Mn519 1.0 0.70139 0.89584 0.50000 1.0000 + Mn Mn520 1.0 0.65972 0.93751 0.50000 1.0000 + Mn Mn521 1.0 0.61805 0.97917 0.50000 1.0000 + Mn Mn522 1.0 0.57639 0.02084 0.50000 1.0000 + Mn Mn523 1.0 0.53472 0.06251 0.50000 1.0000 + Mn Mn524 1.0 0.49305 0.10417 0.50000 1.0000 + Mn Mn525 1.0 0.45139 0.14584 0.50000 1.0000 + Mn Mn526 1.0 0.40972 0.18751 0.50000 1.0000 + Mn Mn527 1.0 0.36805 0.22917 0.50000 1.0000 + Mn Mn528 1.0 0.32639 0.27084 0.50000 1.0000 + Mn Mn529 1.0 0.82639 0.85417 0.50000 1.0000 + Mn Mn530 1.0 0.78472 0.89584 0.50000 1.0000 + Mn Mn531 1.0 0.74305 0.93751 0.50000 1.0000 + Mn Mn532 1.0 0.70139 0.97917 0.50000 1.0000 + Mn Mn533 1.0 0.65972 0.02084 0.50000 1.0000 + Mn Mn534 1.0 0.61805 0.06251 0.50000 1.0000 + Mn Mn535 1.0 0.57639 0.10417 0.50000 1.0000 + Mn Mn536 1.0 0.53472 0.14584 0.50000 1.0000 + Mn Mn537 1.0 0.49305 0.18751 0.50000 1.0000 + Mn Mn538 1.0 0.45139 0.22917 0.50000 1.0000 + Mn Mn539 1.0 0.40972 0.27084 0.50000 1.0000 + Mn Mn540 1.0 0.36805 0.31251 0.50000 1.0000 + Mn Mn541 1.0 0.86805 0.89584 0.50000 1.0000 + Mn Mn542 1.0 0.82639 0.93751 0.50000 1.0000 + Mn Mn543 1.0 0.78472 0.97917 0.50000 1.0000 + Mn Mn544 1.0 0.74305 0.02084 0.50000 1.0000 + Mn Mn545 1.0 0.70139 0.06251 0.50000 1.0000 + Mn Mn546 1.0 0.65972 0.10417 0.50000 1.0000 + Mn Mn547 1.0 0.61805 0.14584 0.50000 1.0000 + Mn Mn548 1.0 0.57639 0.18751 0.50000 1.0000 + Mn Mn549 1.0 0.53472 0.22917 0.50000 1.0000 + Mn Mn550 1.0 0.49305 0.27084 0.50000 1.0000 + Mn Mn551 1.0 0.45139 0.31251 0.50000 1.0000 + Mn Mn552 1.0 0.40972 0.35417 0.50000 1.0000 + Mn Mn553 1.0 0.90972 0.93751 0.50000 1.0000 + Mn Mn554 1.0 0.86805 0.97917 0.50000 1.0000 + Mn Mn555 1.0 0.82639 0.02084 0.50000 1.0000 + Mn Mn556 1.0 0.78472 0.06251 0.50000 1.0000 + Mn Mn557 1.0 0.74305 0.10417 0.50000 1.0000 + Mn Mn558 1.0 0.70139 0.14584 0.50000 1.0000 + Mn Mn559 1.0 0.65972 0.18751 0.50000 1.0000 + Mn Mn560 1.0 0.61805 0.22917 0.50000 1.0000 + Mn Mn561 1.0 0.57639 0.27084 0.50000 1.0000 + Mn Mn562 1.0 0.53472 0.31251 0.50000 1.0000 + Mn Mn563 1.0 0.49305 0.35417 0.50000 1.0000 + Mn Mn564 1.0 0.45139 0.39584 0.50000 1.0000 + Mn Mn565 1.0 0.95139 0.97917 0.50000 1.0000 + Mn Mn566 1.0 0.90972 0.02084 0.50000 1.0000 + Mn Mn567 1.0 0.86805 0.06251 0.50000 1.0000 + Mn Mn568 1.0 0.82639 0.10417 0.50000 1.0000 + Mn Mn569 1.0 0.78472 0.14584 0.50000 1.0000 + Mn Mn570 1.0 0.74305 0.18751 0.50000 1.0000 + Mn Mn571 1.0 0.70139 0.22917 0.50000 1.0000 + Mn Mn572 1.0 0.65972 0.27084 0.50000 1.0000 + Mn Mn573 1.0 0.61805 0.31251 0.50000 1.0000 + Mn Mn574 1.0 0.57639 0.35417 0.50000 1.0000 + Mn Mn575 1.0 0.53472 0.39584 0.50000 1.0000 + Mn Mn576 1.0 0.49305 0.43751 0.50000 1.0000 + Ni Ni145 1.0 0.52083 0.52083 0.50000 1.0000 + Ni Ni146 1.0 0.47917 0.56250 0.50000 1.0000 + Ni Ni147 1.0 0.43750 0.60417 0.50000 1.0000 + Ni Ni148 1.0 0.39583 0.64583 0.50000 1.0000 + Ni Ni149 1.0 0.35417 0.68750 0.50000 1.0000 + Ni Ni150 1.0 0.31250 0.72917 0.50000 1.0000 + Ni Ni151 1.0 0.27083 0.77083 0.50000 1.0000 + Ni Ni152 1.0 0.22917 0.81250 0.50000 1.0000 + Ni Ni153 1.0 0.18750 0.85417 0.50000 1.0000 + Ni Ni154 1.0 0.14583 0.89583 0.50000 1.0000 + Ni Ni155 1.0 0.10417 0.93750 0.50000 1.0000 + Ni Ni156 1.0 0.06250 0.97917 0.50000 1.0000 + Ni Ni157 1.0 0.56250 0.56250 0.50000 1.0000 + Ni Ni158 1.0 0.52083 0.60417 0.50000 1.0000 + Ni Ni159 1.0 0.47917 0.64583 0.50000 1.0000 + Ni Ni160 1.0 0.43750 0.68750 0.50000 1.0000 + Ni Ni161 1.0 0.39583 0.72917 0.50000 1.0000 + Ni Ni162 1.0 0.35417 0.77083 0.50000 1.0000 + Ni Ni163 1.0 0.31250 0.81250 0.50000 1.0000 + Ni Ni164 1.0 0.27083 0.85417 0.50000 1.0000 + Ni Ni165 1.0 0.22917 0.89583 0.50000 1.0000 + Ni Ni166 1.0 0.18750 0.93750 0.50000 1.0000 + Ni Ni167 1.0 0.14583 0.97917 0.50000 1.0000 + Ni Ni168 1.0 0.10417 0.02083 0.50000 1.0000 + Ni Ni169 1.0 0.60417 0.60417 0.50000 1.0000 + Ni Ni170 1.0 0.56250 0.64583 0.50000 1.0000 + Ni Ni171 1.0 0.52083 0.68750 0.50000 1.0000 + Ni Ni172 1.0 0.47917 0.72917 0.50000 1.0000 + Ni Ni173 1.0 0.43750 0.77083 0.50000 1.0000 + Ni Ni174 1.0 0.39583 0.81250 0.50000 1.0000 + Ni Ni175 1.0 0.35417 0.85417 0.50000 1.0000 + Ni Ni176 1.0 0.31250 0.89583 0.50000 1.0000 + Ni Ni177 1.0 0.27083 0.93750 0.50000 1.0000 + Ni Ni178 1.0 0.22917 0.97917 0.50000 1.0000 + Ni Ni179 1.0 0.18750 0.02083 0.50000 1.0000 + Ni Ni180 1.0 0.14583 0.06250 0.50000 1.0000 + Ni Ni181 1.0 0.64583 0.64583 0.50000 1.0000 + Ni Ni182 1.0 0.60417 0.68750 0.50000 1.0000 + Ni Ni183 1.0 0.56250 0.72917 0.50000 1.0000 + Ni Ni184 1.0 0.52083 0.77083 0.50000 1.0000 + Ni Ni185 1.0 0.47917 0.81250 0.50000 1.0000 + Ni Ni186 1.0 0.43750 0.85417 0.50000 1.0000 + Ni Ni187 1.0 0.39583 0.89583 0.50000 1.0000 + Ni Ni188 1.0 0.35417 0.93750 0.50000 1.0000 + Ni Ni189 1.0 0.31250 0.97917 0.50000 1.0000 + Ni Ni190 1.0 0.27083 0.02083 0.50000 1.0000 + Ni Ni191 1.0 0.22917 0.06250 0.50000 1.0000 + Ni Ni192 1.0 0.18750 0.10417 0.50000 1.0000 + Ni Ni193 1.0 0.68750 0.68750 0.50000 1.0000 + Ni Ni194 1.0 0.64583 0.72917 0.50000 1.0000 + Ni Ni195 1.0 0.60417 0.77083 0.50000 1.0000 + Ni Ni196 1.0 0.56250 0.81250 0.50000 1.0000 + Ni Ni197 1.0 0.52083 0.85417 0.50000 1.0000 + Ni Ni198 1.0 0.47917 0.89583 0.50000 1.0000 + Ni Ni199 1.0 0.43750 0.93750 0.50000 1.0000 + Ni Ni200 1.0 0.39583 0.97917 0.50000 1.0000 + Ni Ni201 1.0 0.35417 0.02083 0.50000 1.0000 + Ni Ni202 1.0 0.31250 0.06250 0.50000 1.0000 + Ni Ni203 1.0 0.27083 0.10417 0.50000 1.0000 + Ni Ni204 1.0 0.22917 0.14583 0.50000 1.0000 + Ni Ni205 1.0 0.72917 0.72917 0.50000 1.0000 + Ni Ni206 1.0 0.68750 0.77083 0.50000 1.0000 + Ni Ni207 1.0 0.64583 0.81250 0.50000 1.0000 + Ni Ni208 1.0 0.60417 0.85417 0.50000 1.0000 + Ni Ni209 1.0 0.56250 0.89583 0.50000 1.0000 + Ni Ni210 1.0 0.52083 0.93750 0.50000 1.0000 + Ni Ni211 1.0 0.47917 0.97917 0.50000 1.0000 + Ni Ni212 1.0 0.43750 0.02083 0.50000 1.0000 + Ni Ni213 1.0 0.39583 0.06250 0.50000 1.0000 + Ni Ni214 1.0 0.35417 0.10417 0.50000 1.0000 + Ni Ni215 1.0 0.31250 0.14583 0.50000 1.0000 + Ni Ni216 1.0 0.27083 0.18750 0.50000 1.0000 + Ni Ni217 1.0 0.77083 0.77083 0.50000 1.0000 + Ni Ni218 1.0 0.72917 0.81250 0.50000 1.0000 + Ni Ni219 1.0 0.68750 0.85417 0.50000 1.0000 + Ni Ni220 1.0 0.64583 0.89583 0.50000 1.0000 + Ni Ni221 1.0 0.60417 0.93750 0.50000 1.0000 + Ni Ni222 1.0 0.56250 0.97917 0.50000 1.0000 + Ni Ni223 1.0 0.52083 0.02083 0.50000 1.0000 + Ni Ni224 1.0 0.47917 0.06250 0.50000 1.0000 + Ni Ni225 1.0 0.43750 0.10417 0.50000 1.0000 + Ni Ni226 1.0 0.39583 0.14583 0.50000 1.0000 + Ni Ni227 1.0 0.35417 0.18750 0.50000 1.0000 + Ni Ni228 1.0 0.31250 0.22917 0.50000 1.0000 + Ni Ni229 1.0 0.81250 0.81250 0.50000 1.0000 + Ni Ni230 1.0 0.77083 0.85417 0.50000 1.0000 + Ni Ni231 1.0 0.72917 0.89583 0.50000 1.0000 + Ni Ni232 1.0 0.68750 0.93750 0.50000 1.0000 + Ni Ni233 1.0 0.64583 0.97917 0.50000 1.0000 + Ni Ni234 1.0 0.60417 0.02083 0.50000 1.0000 + Ni Ni235 1.0 0.56250 0.06250 0.50000 1.0000 + Ni Ni236 1.0 0.52083 0.10417 0.50000 1.0000 + Ni Ni237 1.0 0.47917 0.14583 0.50000 1.0000 + Ni Ni238 1.0 0.43750 0.18750 0.50000 1.0000 + Ni Ni239 1.0 0.39583 0.22917 0.50000 1.0000 + Ni Ni240 1.0 0.35417 0.27083 0.50000 1.0000 + Ni Ni241 1.0 0.85417 0.85417 0.50000 1.0000 + Ni Ni242 1.0 0.81250 0.89583 0.50000 1.0000 + Ni Ni243 1.0 0.77083 0.93750 0.50000 1.0000 + Ni Ni244 1.0 0.72917 0.97917 0.50000 1.0000 + Ni Ni245 1.0 0.68750 0.02083 0.50000 1.0000 + Ni Ni246 1.0 0.64583 0.06250 0.50000 1.0000 + Ni Ni247 1.0 0.60417 0.10417 0.50000 1.0000 + Ni Ni248 1.0 0.56250 0.14583 0.50000 1.0000 + Ni Ni249 1.0 0.52083 0.18750 0.50000 1.0000 + Ni Ni250 1.0 0.47917 0.22917 0.50000 1.0000 + Ni Ni251 1.0 0.43750 0.27083 0.50000 1.0000 + Ni Ni252 1.0 0.39583 0.31250 0.50000 1.0000 + Ni Ni253 1.0 0.89583 0.89583 0.50000 1.0000 + Ni Ni254 1.0 0.85417 0.93750 0.50000 1.0000 + Ni Ni255 1.0 0.81250 0.97917 0.50000 1.0000 + Ni Ni256 1.0 0.77083 0.02083 0.50000 1.0000 + Ni Ni257 1.0 0.72917 0.06250 0.50000 1.0000 + Ni Ni258 1.0 0.68750 0.10417 0.50000 1.0000 + Ni Ni259 1.0 0.64583 0.14583 0.50000 1.0000 + Ni Ni260 1.0 0.60417 0.18750 0.50000 1.0000 + Ni Ni261 1.0 0.56250 0.22917 0.50000 1.0000 + Ni Ni262 1.0 0.52083 0.27083 0.50000 1.0000 + Ni Ni263 1.0 0.47917 0.31250 0.50000 1.0000 + Ni Ni264 1.0 0.43750 0.35417 0.50000 1.0000 + Ni Ni265 1.0 0.93750 0.93750 0.50000 1.0000 + Ni Ni266 1.0 0.89583 0.97917 0.50000 1.0000 + Ni Ni267 1.0 0.85417 0.02083 0.50000 1.0000 + Ni Ni268 1.0 0.81250 0.06250 0.50000 1.0000 + Ni Ni269 1.0 0.77083 0.10417 0.50000 1.0000 + Ni Ni270 1.0 0.72917 0.14583 0.50000 1.0000 + Ni Ni271 1.0 0.68750 0.18750 0.50000 1.0000 + Ni Ni272 1.0 0.64583 0.22917 0.50000 1.0000 + Ni Ni273 1.0 0.60417 0.27083 0.50000 1.0000 + Ni Ni274 1.0 0.56250 0.31250 0.50000 1.0000 + Ni Ni275 1.0 0.52083 0.35417 0.50000 1.0000 + Ni Ni276 1.0 0.47917 0.39583 0.50000 1.0000 + Ni Ni277 1.0 0.97917 0.97917 0.50000 1.0000 + Ni Ni278 1.0 0.93750 0.02083 0.50000 1.0000 + Ni Ni279 1.0 0.89583 0.06250 0.50000 1.0000 + Ni Ni280 1.0 0.85417 0.10417 0.50000 1.0000 + Ni Ni281 1.0 0.81250 0.14583 0.50000 1.0000 + Ni Ni282 1.0 0.77083 0.18750 0.50000 1.0000 + Ni Ni283 1.0 0.72917 0.22917 0.50000 1.0000 + Ni Ni284 1.0 0.68750 0.27083 0.50000 1.0000 + Ni Ni285 1.0 0.64583 0.31250 0.50000 1.0000 + Ni Ni286 1.0 0.60417 0.35417 0.50000 1.0000 + Ni Ni287 1.0 0.56250 0.39583 0.50000 1.0000 + Ni Ni288 1.0 0.52083 0.43750 0.50000 1.0000 + O O865 1.0 0.47917 0.53523 0.33810 1.0000 + O O866 1.0 0.43750 0.57689 0.33810 1.0000 + O O867 1.0 0.39584 0.61856 0.33810 1.0000 + O O868 1.0 0.35417 0.66023 0.33810 1.0000 + O O869 1.0 0.31250 0.70189 0.33810 1.0000 + O O870 1.0 0.27084 0.74356 0.33810 1.0000 + O O871 1.0 0.22917 0.78523 0.33810 1.0000 + O O872 1.0 0.18750 0.82689 0.33810 1.0000 + O O873 1.0 0.14584 0.86856 0.33810 1.0000 + O O874 1.0 0.10417 0.91023 0.33810 1.0000 + O O875 1.0 0.06250 0.95189 0.33810 1.0000 + O O876 1.0 0.02084 0.99356 0.33810 1.0000 + O O877 1.0 0.52084 0.57689 0.33810 1.0000 + O O878 1.0 0.47917 0.61856 0.33810 1.0000 + O O879 1.0 0.43750 0.66023 0.33810 1.0000 + O O880 1.0 0.39584 0.70189 0.33810 1.0000 + O O881 1.0 0.35417 0.74356 0.33810 1.0000 + O O882 1.0 0.31250 0.78523 0.33810 1.0000 + O O883 1.0 0.27084 0.82689 0.33810 1.0000 + O O884 1.0 0.22917 0.86856 0.33810 1.0000 + O O885 1.0 0.18750 0.91023 0.33810 1.0000 + O O886 1.0 0.14584 0.95189 0.33810 1.0000 + O O887 1.0 0.10417 0.99356 0.33810 1.0000 + O O888 1.0 0.06250 0.03523 0.33810 1.0000 + O O889 1.0 0.56250 0.61856 0.33810 1.0000 + O O890 1.0 0.52084 0.66023 0.33810 1.0000 + O O891 1.0 0.47917 0.70189 0.33810 1.0000 + O O892 1.0 0.43750 0.74356 0.33810 1.0000 + O O893 1.0 0.39584 0.78523 0.33810 1.0000 + O O894 1.0 0.35417 0.82689 0.33810 1.0000 + O O895 1.0 0.31250 0.86856 0.33810 1.0000 + O O896 1.0 0.27084 0.91023 0.33810 1.0000 + O O897 1.0 0.22917 0.95189 0.33810 1.0000 + O O898 1.0 0.18750 0.99356 0.33810 1.0000 + O O899 1.0 0.14584 0.03523 0.33810 1.0000 + O O900 1.0 0.10417 0.07689 0.33810 1.0000 + O O901 1.0 0.60417 0.66023 0.33810 1.0000 + O O902 1.0 0.56250 0.70189 0.33810 1.0000 + O O903 1.0 0.52084 0.74356 0.33810 1.0000 + O O904 1.0 0.47917 0.78523 0.33810 1.0000 + O O905 1.0 0.43750 0.82689 0.33810 1.0000 + O O906 1.0 0.39584 0.86856 0.33810 1.0000 + O O907 1.0 0.35417 0.91023 0.33810 1.0000 + O O908 1.0 0.31250 0.95189 0.33810 1.0000 + O O909 1.0 0.27084 0.99356 0.33810 1.0000 + O O910 1.0 0.22917 0.03523 0.33810 1.0000 + O O911 1.0 0.18750 0.07689 0.33810 1.0000 + O O912 1.0 0.14584 0.11856 0.33810 1.0000 + O O913 1.0 0.64584 0.70189 0.33810 1.0000 + O O914 1.0 0.60417 0.74356 0.33810 1.0000 + O O915 1.0 0.56250 0.78523 0.33810 1.0000 + O O916 1.0 0.52084 0.82689 0.33810 1.0000 + O O917 1.0 0.47917 0.86856 0.33810 1.0000 + O O918 1.0 0.43750 0.91023 0.33810 1.0000 + O O919 1.0 0.39584 0.95189 0.33810 1.0000 + O O920 1.0 0.35417 0.99356 0.33810 1.0000 + O O921 1.0 0.31250 0.03523 0.33810 1.0000 + O O922 1.0 0.27084 0.07689 0.33810 1.0000 + O O923 1.0 0.22917 0.11856 0.33810 1.0000 + O O924 1.0 0.18750 0.16023 0.33810 1.0000 + O O925 1.0 0.68750 0.74356 0.33810 1.0000 + O O926 1.0 0.64584 0.78523 0.33810 1.0000 + O O927 1.0 0.60417 0.82689 0.33810 1.0000 + O O928 1.0 0.56250 0.86856 0.33810 1.0000 + O O929 1.0 0.52084 0.91023 0.33810 1.0000 + O O930 1.0 0.47917 0.95189 0.33810 1.0000 + O O931 1.0 0.43750 0.99356 0.33810 1.0000 + O O932 1.0 0.39584 0.03523 0.33810 1.0000 + O O933 1.0 0.35417 0.07689 0.33810 1.0000 + O O934 1.0 0.31250 0.11856 0.33810 1.0000 + O O935 1.0 0.27084 0.16023 0.33810 1.0000 + O O936 1.0 0.22917 0.20189 0.33810 1.0000 + O O937 1.0 0.72917 0.78523 0.33810 1.0000 + O O938 1.0 0.68750 0.82689 0.33810 1.0000 + O O939 1.0 0.64584 0.86856 0.33810 1.0000 + O O940 1.0 0.60417 0.91023 0.33810 1.0000 + O O941 1.0 0.56250 0.95189 0.33810 1.0000 + O O942 1.0 0.52084 0.99356 0.33810 1.0000 + O O943 1.0 0.47917 0.03523 0.33810 1.0000 + O O944 1.0 0.43750 0.07689 0.33810 1.0000 + O O945 1.0 0.39584 0.11856 0.33810 1.0000 + O O946 1.0 0.35417 0.16023 0.33810 1.0000 + O O947 1.0 0.31250 0.20189 0.33810 1.0000 + O O948 1.0 0.27084 0.24356 0.33810 1.0000 + O O949 1.0 0.77084 0.82689 0.33810 1.0000 + O O950 1.0 0.72917 0.86856 0.33810 1.0000 + O O951 1.0 0.68750 0.91023 0.33810 1.0000 + O O952 1.0 0.64584 0.95189 0.33810 1.0000 + O O953 1.0 0.60417 0.99356 0.33810 1.0000 + O O954 1.0 0.56250 0.03523 0.33810 1.0000 + O O955 1.0 0.52084 0.07689 0.33810 1.0000 + O O956 1.0 0.47917 0.11856 0.33810 1.0000 + O O957 1.0 0.43750 0.16023 0.33810 1.0000 + O O958 1.0 0.39584 0.20189 0.33810 1.0000 + O O959 1.0 0.35417 0.24356 0.33810 1.0000 + O O960 1.0 0.31250 0.28523 0.33810 1.0000 + O O961 1.0 0.81250 0.86856 0.33810 1.0000 + O O962 1.0 0.77084 0.91023 0.33810 1.0000 + O O963 1.0 0.72917 0.95189 0.33810 1.0000 + O O964 1.0 0.68750 0.99356 0.33810 1.0000 + O O965 1.0 0.64584 0.03523 0.33810 1.0000 + O O966 1.0 0.60417 0.07689 0.33810 1.0000 + O O967 1.0 0.56250 0.11856 0.33810 1.0000 + O O968 1.0 0.52084 0.16023 0.33810 1.0000 + O O969 1.0 0.47917 0.20189 0.33810 1.0000 + O O970 1.0 0.43750 0.24356 0.33810 1.0000 + O O971 1.0 0.39584 0.28523 0.33810 1.0000 + O O972 1.0 0.35417 0.32689 0.33810 1.0000 + O O973 1.0 0.85417 0.91023 0.33810 1.0000 + O O974 1.0 0.81250 0.95189 0.33810 1.0000 + O O975 1.0 0.77084 0.99356 0.33810 1.0000 + O O976 1.0 0.72917 0.03523 0.33810 1.0000 + O O977 1.0 0.68750 0.07689 0.33810 1.0000 + O O978 1.0 0.64584 0.11856 0.33810 1.0000 + O O979 1.0 0.60417 0.16023 0.33810 1.0000 + O O980 1.0 0.56250 0.20189 0.33810 1.0000 + O O981 1.0 0.52084 0.24356 0.33810 1.0000 + O O982 1.0 0.47917 0.28523 0.33810 1.0000 + O O983 1.0 0.43750 0.32689 0.33810 1.0000 + O O984 1.0 0.39584 0.36856 0.33810 1.0000 + O O985 1.0 0.89584 0.95189 0.33810 1.0000 + O O986 1.0 0.85417 0.99356 0.33810 1.0000 + O O987 1.0 0.81250 0.03523 0.33810 1.0000 + O O988 1.0 0.77084 0.07689 0.33810 1.0000 + O O989 1.0 0.72917 0.11856 0.33810 1.0000 + O O990 1.0 0.68750 0.16023 0.33810 1.0000 + O O991 1.0 0.64584 0.20189 0.33810 1.0000 + O O992 1.0 0.60417 0.24356 0.33810 1.0000 + O O993 1.0 0.56250 0.28523 0.33810 1.0000 + O O994 1.0 0.52084 0.32689 0.33810 1.0000 + O O995 1.0 0.47917 0.36856 0.33810 1.0000 + O O996 1.0 0.43750 0.41023 0.33810 1.0000 + O O997 1.0 0.93750 0.99356 0.33810 1.0000 + O O998 1.0 0.89584 0.03523 0.33810 1.0000 + O O999 1.0 0.85417 0.07689 0.33810 1.0000 + O O1000 1.0 0.81250 0.11856 0.33810 1.0000 + O O1001 1.0 0.77084 0.16023 0.33810 1.0000 + O O1002 1.0 0.72917 0.20189 0.33810 1.0000 + O O1003 1.0 0.68750 0.24356 0.33810 1.0000 + O O1004 1.0 0.64584 0.28523 0.33810 1.0000 + O O1005 1.0 0.60417 0.32689 0.33810 1.0000 + O O1006 1.0 0.56250 0.36856 0.33810 1.0000 + O O1007 1.0 0.52084 0.41023 0.33810 1.0000 + O O1008 1.0 0.47917 0.45189 0.33810 1.0000 + O O1009 1.0 0.49280 0.54886 0.66190 1.0000 + O O1010 1.0 0.45113 0.59052 0.66190 1.0000 + O O1011 1.0 0.40947 0.63219 0.66190 1.0000 + O O1012 1.0 0.36780 0.67386 0.66190 1.0000 + O O1013 1.0 0.32613 0.71552 0.66190 1.0000 + O O1014 1.0 0.28447 0.75719 0.66190 1.0000 + O O1015 1.0 0.24280 0.79886 0.66190 1.0000 + O O1016 1.0 0.20113 0.84052 0.66190 1.0000 + O O1017 1.0 0.15947 0.88219 0.66190 1.0000 + O O1018 1.0 0.11780 0.92386 0.66190 1.0000 + O O1019 1.0 0.07613 0.96552 0.66190 1.0000 + O O1020 1.0 0.03447 0.00719 0.66190 1.0000 + O O1021 1.0 0.53447 0.59052 0.66190 1.0000 + O O1022 1.0 0.49280 0.63219 0.66190 1.0000 + O O1023 1.0 0.45113 0.67386 0.66190 1.0000 + O O1024 1.0 0.40947 0.71552 0.66190 1.0000 + O O1025 1.0 0.36780 0.75719 0.66190 1.0000 + O O1026 1.0 0.32613 0.79886 0.66190 1.0000 + O O1027 1.0 0.28447 0.84052 0.66190 1.0000 + O O1028 1.0 0.24280 0.88219 0.66190 1.0000 + O O1029 1.0 0.20113 0.92386 0.66190 1.0000 + O O1030 1.0 0.15947 0.96552 0.66190 1.0000 + O O1031 1.0 0.11780 0.00719 0.66190 1.0000 + O O1032 1.0 0.07613 0.04886 0.66190 1.0000 + O O1033 1.0 0.57613 0.63219 0.66190 1.0000 + O O1034 1.0 0.53447 0.67386 0.66190 1.0000 + O O1035 1.0 0.49280 0.71552 0.66190 1.0000 + O O1036 1.0 0.45113 0.75719 0.66190 1.0000 + O O1037 1.0 0.40947 0.79886 0.66190 1.0000 + O O1038 1.0 0.36780 0.84052 0.66190 1.0000 + O O1039 1.0 0.32613 0.88219 0.66190 1.0000 + O O1040 1.0 0.28447 0.92386 0.66190 1.0000 + O O1041 1.0 0.24280 0.96552 0.66190 1.0000 + O O1042 1.0 0.20113 0.00719 0.66190 1.0000 + O O1043 1.0 0.15947 0.04886 0.66190 1.0000 + O O1044 1.0 0.11780 0.09052 0.66190 1.0000 + O O1045 1.0 0.61780 0.67386 0.66190 1.0000 + O O1046 1.0 0.57613 0.71552 0.66190 1.0000 + O O1047 1.0 0.53447 0.75719 0.66190 1.0000 + O O1048 1.0 0.49280 0.79886 0.66190 1.0000 + O O1049 1.0 0.45113 0.84052 0.66190 1.0000 + O O1050 1.0 0.40947 0.88219 0.66190 1.0000 + O O1051 1.0 0.36780 0.92386 0.66190 1.0000 + O O1052 1.0 0.32613 0.96552 0.66190 1.0000 + O O1053 1.0 0.28447 0.00719 0.66190 1.0000 + O O1054 1.0 0.24280 0.04886 0.66190 1.0000 + O O1055 1.0 0.20113 0.09052 0.66190 1.0000 + O O1056 1.0 0.15947 0.13219 0.66190 1.0000 + O O1057 1.0 0.65947 0.71552 0.66190 1.0000 + O O1058 1.0 0.61780 0.75719 0.66190 1.0000 + O O1059 1.0 0.57613 0.79886 0.66190 1.0000 + O O1060 1.0 0.53447 0.84052 0.66190 1.0000 + O O1061 1.0 0.49280 0.88219 0.66190 1.0000 + O O1062 1.0 0.45113 0.92386 0.66190 1.0000 + O O1063 1.0 0.40947 0.96552 0.66190 1.0000 + O O1064 1.0 0.36780 0.00719 0.66190 1.0000 + O O1065 1.0 0.32613 0.04886 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1.0000 + Mn Mn34 1.0 0.70833 0.45833 0.50000 1.0000 + Mn Mn35 1.0 0.66667 0.50000 0.50000 1.0000 + Mn Mn36 1.0 0.62500 0.54167 0.50000 1.0000 + Mn Mn37 1.0 0.12500 0.12500 0.50000 1.0000 + Mn Mn38 1.0 0.08333 0.16667 0.50000 1.0000 + Mn Mn39 1.0 0.04167 0.20833 0.50000 1.0000 + Mn Mn40 1.0 0.00000 0.25000 0.50000 1.0000 + Mn Mn41 1.0 0.95833 0.29167 0.50000 1.0000 + Mn Mn42 1.0 0.91667 0.33333 0.50000 1.0000 + Mn Mn43 1.0 0.87500 0.37500 0.50000 1.0000 + Mn Mn44 1.0 0.83333 0.41667 0.50000 1.0000 + Mn Mn45 1.0 0.79167 0.45833 0.50000 1.0000 + Mn Mn46 1.0 0.75000 0.50000 0.50000 1.0000 + Mn Mn47 1.0 0.70833 0.54167 0.50000 1.0000 + Mn Mn48 1.0 0.66667 0.58333 0.50000 1.0000 + Mn Mn49 1.0 0.16667 0.16667 0.50000 1.0000 + Mn Mn50 1.0 0.12500 0.20833 0.50000 1.0000 + Mn Mn51 1.0 0.08333 0.25000 0.50000 1.0000 + Mn Mn52 1.0 0.04167 0.29167 0.50000 1.0000 + Mn Mn53 1.0 0.00000 0.33333 0.50000 1.0000 + Mn Mn54 1.0 0.95833 0.37500 0.50000 1.0000 + Mn Mn55 1.0 0.91667 0.41667 0.50000 1.0000 + Mn Mn56 1.0 0.87500 0.45833 0.50000 1.0000 + Mn Mn57 1.0 0.83333 0.50000 0.50000 1.0000 + Mn Mn58 1.0 0.79167 0.54167 0.50000 1.0000 + Mn Mn59 1.0 0.75000 0.58333 0.50000 1.0000 + Mn Mn60 1.0 0.70833 0.62500 0.50000 1.0000 + Mn Mn61 1.0 0.20833 0.20833 0.50000 1.0000 + Mn Mn62 1.0 0.16667 0.25000 0.50000 1.0000 + Mn Mn63 1.0 0.12500 0.29167 0.50000 1.0000 + Mn Mn64 1.0 0.08333 0.33333 0.50000 1.0000 + Mn Mn65 1.0 0.04167 0.37500 0.50000 1.0000 + Mn Mn66 1.0 0.00000 0.41667 0.50000 1.0000 + Mn Mn67 1.0 0.95833 0.45833 0.50000 1.0000 + Mn Mn68 1.0 0.91667 0.50000 0.50000 1.0000 + Mn Mn69 1.0 0.87500 0.54167 0.50000 1.0000 + Mn Mn70 1.0 0.83333 0.58333 0.50000 1.0000 + Mn Mn71 1.0 0.79167 0.62500 0.50000 1.0000 + Mn Mn72 1.0 0.75000 0.66667 0.50000 1.0000 + Mn Mn73 1.0 0.25000 0.25000 0.50000 1.0000 + Mn Mn74 1.0 0.20833 0.29167 0.50000 1.0000 + Mn Mn75 1.0 0.16667 0.33333 0.50000 1.0000 + Mn Mn76 1.0 0.12500 0.37500 0.50000 1.0000 + Mn Mn77 1.0 0.08333 0.41667 0.50000 1.0000 + Mn Mn78 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0.50000 1.0000 + Mn Mn144 1.0 0.00000 0.91667 0.50000 1.0000 + Co Co1 1.0 0.98609 0.04172 0.50000 1.0000 + Co Co2 1.0 0.94443 0.08338 0.50000 1.0000 + Co Co3 1.0 0.90276 0.12505 0.50000 1.0000 + Co Co4 1.0 0.86109 0.16672 0.50000 1.0000 + Co Co5 1.0 0.81943 0.20838 0.50000 1.0000 + Co Co6 1.0 0.77776 0.25005 0.50000 1.0000 + Co Co7 1.0 0.73609 0.29172 0.50000 1.0000 + Co Co8 1.0 0.69443 0.33338 0.50000 1.0000 + Co Co9 1.0 0.65276 0.37505 0.50000 1.0000 + Co Co10 1.0 0.61109 0.41672 0.50000 1.0000 + Co Co11 1.0 0.56943 0.45838 0.50000 1.0000 + Co Co12 1.0 0.52776 0.50005 0.50000 1.0000 + Co Co13 1.0 0.02776 0.08338 0.50000 1.0000 + Co Co14 1.0 0.98609 0.12505 0.50000 1.0000 + Co Co15 1.0 0.94443 0.16672 0.50000 1.0000 + Co Co16 1.0 0.90276 0.20838 0.50000 1.0000 + Co Co17 1.0 0.86109 0.25005 0.50000 1.0000 + Co Co18 1.0 0.81943 0.29172 0.50000 1.0000 + Co Co19 1.0 0.77776 0.33338 0.50000 1.0000 + Co Co20 1.0 0.73609 0.37505 0.50000 1.0000 + Co Co21 1.0 0.69443 0.41672 0.50000 1.0000 + Co Co22 1.0 0.65276 0.45838 0.50000 1.0000 + Co Co23 1.0 0.61109 0.50005 0.50000 1.0000 + Co Co24 1.0 0.56943 0.54172 0.50000 1.0000 + Co Co25 1.0 0.06943 0.12505 0.50000 1.0000 + Co Co26 1.0 0.02776 0.16672 0.50000 1.0000 + Co Co27 1.0 0.98609 0.20838 0.50000 1.0000 + Co Co28 1.0 0.94443 0.25005 0.50000 1.0000 + Co Co29 1.0 0.90276 0.29172 0.50000 1.0000 + Co Co30 1.0 0.86109 0.33338 0.50000 1.0000 + Co Co31 1.0 0.81943 0.37505 0.50000 1.0000 + Co Co32 1.0 0.77776 0.41672 0.50000 1.0000 + Co Co33 1.0 0.73609 0.45838 0.50000 1.0000 + Co Co34 1.0 0.69443 0.50005 0.50000 1.0000 + Co Co35 1.0 0.65276 0.54172 0.50000 1.0000 + Co Co36 1.0 0.61109 0.58338 0.50000 1.0000 + Co Co37 1.0 0.11109 0.16672 0.50000 1.0000 + Co Co38 1.0 0.06943 0.20838 0.50000 1.0000 + Co Co39 1.0 0.02776 0.25005 0.50000 1.0000 + Co Co40 1.0 0.98609 0.29172 0.50000 1.0000 + Co Co41 1.0 0.94443 0.33338 0.50000 1.0000 + Co Co42 1.0 0.90276 0.37505 0.50000 1.0000 + Co Co43 1.0 0.86109 0.41672 0.50000 1.0000 + Co Co44 1.0 0.81943 0.45838 0.50000 1.0000 + Co Co45 1.0 0.77776 0.50005 0.50000 1.0000 + Co Co46 1.0 0.73609 0.54172 0.50000 1.0000 + Co Co47 1.0 0.69443 0.58338 0.50000 1.0000 + Co Co48 1.0 0.65276 0.62505 0.50000 1.0000 + Co Co49 1.0 0.15276 0.20838 0.50000 1.0000 + Co Co50 1.0 0.11109 0.25005 0.50000 1.0000 + Co Co51 1.0 0.06943 0.29172 0.50000 1.0000 + Co Co52 1.0 0.02776 0.33338 0.50000 1.0000 + Co Co53 1.0 0.98609 0.37505 0.50000 1.0000 + Co Co54 1.0 0.94443 0.41672 0.50000 1.0000 + Co Co55 1.0 0.90276 0.45838 0.50000 1.0000 + Co Co56 1.0 0.86109 0.50005 0.50000 1.0000 + Co Co57 1.0 0.81943 0.54172 0.50000 1.0000 + Co Co58 1.0 0.77776 0.58338 0.50000 1.0000 + Co Co59 1.0 0.73609 0.62505 0.50000 1.0000 + Co Co60 1.0 0.69443 0.66672 0.50000 1.0000 + Co Co61 1.0 0.19443 0.25005 0.50000 1.0000 + Co Co62 1.0 0.15276 0.29172 0.50000 1.0000 + Co Co63 1.0 0.11109 0.33338 0.50000 1.0000 + Co Co64 1.0 0.06943 0.37505 0.50000 1.0000 + Co Co65 1.0 0.02776 0.41672 0.50000 1.0000 + Co Co66 1.0 0.98609 0.45838 0.50000 1.0000 + Co Co67 1.0 0.94443 0.50005 0.50000 1.0000 + Co Co68 1.0 0.90276 0.54172 0.50000 1.0000 + Co Co69 1.0 0.86109 0.58338 0.50000 1.0000 + Co Co70 1.0 0.81943 0.62505 0.50000 1.0000 + Co Co71 1.0 0.77776 0.66672 0.50000 1.0000 + Co Co72 1.0 0.73609 0.70838 0.50000 1.0000 + Co Co73 1.0 0.23609 0.29172 0.50000 1.0000 + Co Co74 1.0 0.19443 0.33338 0.50000 1.0000 + Co Co75 1.0 0.15276 0.37505 0.50000 1.0000 + Co Co76 1.0 0.11109 0.41672 0.50000 1.0000 + Co Co77 1.0 0.06943 0.45838 0.50000 1.0000 + Co Co78 1.0 0.02776 0.50005 0.50000 1.0000 + Co Co79 1.0 0.98609 0.54172 0.50000 1.0000 + Co Co80 1.0 0.94443 0.58338 0.50000 1.0000 + Co Co81 1.0 0.90276 0.62505 0.50000 1.0000 + Co Co82 1.0 0.86109 0.66672 0.50000 1.0000 + Co Co83 1.0 0.81943 0.70838 0.50000 1.0000 + Co Co84 1.0 0.77776 0.75005 0.50000 1.0000 + Co Co85 1.0 0.27776 0.33338 0.50000 1.0000 + Co Co86 1.0 0.23609 0.37505 0.50000 1.0000 + Co Co87 1.0 0.19443 0.41672 0.50000 1.0000 + Co Co88 1.0 0.15276 0.45838 0.50000 1.0000 + Co Co89 1.0 0.11109 0.50005 0.50000 1.0000 + Co Co90 1.0 0.06943 0.54172 0.50000 1.0000 + Co Co91 1.0 0.02776 0.58338 0.50000 1.0000 + Co Co92 1.0 0.98609 0.62505 0.50000 1.0000 + Co Co93 1.0 0.94443 0.66672 0.50000 1.0000 + Co Co94 1.0 0.90276 0.70838 0.50000 1.0000 + Co Co95 1.0 0.86109 0.75005 0.50000 1.0000 + Co Co96 1.0 0.81943 0.79172 0.50000 1.0000 + Co Co97 1.0 0.31943 0.37505 0.50000 1.0000 + Co Co98 1.0 0.27776 0.41672 0.50000 1.0000 + Co Co99 1.0 0.23609 0.45838 0.50000 1.0000 + Co Co100 1.0 0.19443 0.50005 0.50000 1.0000 + Co Co101 1.0 0.15276 0.54172 0.50000 1.0000 + Co Co102 1.0 0.11109 0.58338 0.50000 1.0000 + Co Co103 1.0 0.06943 0.62505 0.50000 1.0000 + Co Co104 1.0 0.02776 0.66672 0.50000 1.0000 + Co Co105 1.0 0.98609 0.70838 0.50000 1.0000 + Co Co106 1.0 0.94443 0.75005 0.50000 1.0000 + Co Co107 1.0 0.90276 0.79172 0.50000 1.0000 + Co Co108 1.0 0.86109 0.83338 0.50000 1.0000 + Co Co109 1.0 0.36109 0.41672 0.50000 1.0000 + Co Co110 1.0 0.31943 0.45838 0.50000 1.0000 + Co Co111 1.0 0.27776 0.50005 0.50000 1.0000 + Co Co112 1.0 0.23609 0.54172 0.50000 1.0000 + Co Co113 1.0 0.19443 0.58338 0.50000 1.0000 + Co Co114 1.0 0.15276 0.62505 0.50000 1.0000 + Co Co115 1.0 0.11109 0.66672 0.50000 1.0000 + Co Co116 1.0 0.06943 0.70838 0.50000 1.0000 + Co Co117 1.0 0.02776 0.75005 0.50000 1.0000 + Co Co118 1.0 0.98609 0.79172 0.50000 1.0000 + Co Co119 1.0 0.94443 0.83338 0.50000 1.0000 + Co Co120 1.0 0.90276 0.87505 0.50000 1.0000 + Co Co121 1.0 0.40276 0.45838 0.50000 1.0000 + Co Co122 1.0 0.36109 0.50005 0.50000 1.0000 + Co Co123 1.0 0.31943 0.54172 0.50000 1.0000 + Co Co124 1.0 0.27776 0.58338 0.50000 1.0000 + Co Co125 1.0 0.23609 0.62505 0.50000 1.0000 + Co Co126 1.0 0.19443 0.66672 0.50000 1.0000 + Co Co127 1.0 0.15276 0.70838 0.50000 1.0000 + Co Co128 1.0 0.11109 0.75005 0.50000 1.0000 + Co Co129 1.0 0.06943 0.79172 0.50000 1.0000 + Co Co130 1.0 0.02776 0.83338 0.50000 1.0000 + Co Co131 1.0 0.98609 0.87505 0.50000 1.0000 + Co Co132 1.0 0.94443 0.91672 0.50000 1.0000 + Co Co133 1.0 0.44443 0.50005 0.50000 1.0000 + Co Co134 1.0 0.40276 0.54172 0.50000 1.0000 + Co Co135 1.0 0.36109 0.58338 0.50000 1.0000 + Co Co136 1.0 0.31943 0.62505 0.50000 1.0000 + Co Co137 1.0 0.27776 0.66672 0.50000 1.0000 + Co Co138 1.0 0.23609 0.70838 0.50000 1.0000 + Co Co139 1.0 0.19443 0.75005 0.50000 1.0000 + Co Co140 1.0 0.15276 0.79172 0.50000 1.0000 + Co Co141 1.0 0.11109 0.83338 0.50000 1.0000 + Co Co142 1.0 0.06943 0.87505 0.50000 1.0000 + Co Co143 1.0 0.02776 0.91672 0.50000 1.0000 + Co Co144 1.0 0.98609 0.95838 0.50000 1.0000 + Co Co145 1.0 0.01391 0.04162 0.50000 1.0000 + Co Co146 1.0 0.97224 0.08328 0.50000 1.0000 + Co Co147 1.0 0.93057 0.12495 0.50000 1.0000 + Co Co148 1.0 0.88891 0.16662 0.50000 1.0000 + Co Co149 1.0 0.84724 0.20828 0.50000 1.0000 + Co Co150 1.0 0.80557 0.24995 0.50000 1.0000 + Co Co151 1.0 0.76391 0.29162 0.50000 1.0000 + Co Co152 1.0 0.72224 0.33328 0.50000 1.0000 + Co Co153 1.0 0.68057 0.37495 0.50000 1.0000 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0.50000 1.0000 + Co Co176 1.0 0.80557 0.41662 0.50000 1.0000 + Co Co177 1.0 0.76391 0.45828 0.50000 1.0000 + Co Co178 1.0 0.72224 0.49995 0.50000 1.0000 + Co Co179 1.0 0.68057 0.54162 0.50000 1.0000 + Co Co180 1.0 0.63891 0.58328 0.50000 1.0000 + Co Co181 1.0 0.13891 0.16662 0.50000 1.0000 + Co Co182 1.0 0.09724 0.20828 0.50000 1.0000 + Co Co183 1.0 0.05557 0.24995 0.50000 1.0000 + Co Co184 1.0 0.01391 0.29162 0.50000 1.0000 + Co Co185 1.0 0.97224 0.33328 0.50000 1.0000 + Co Co186 1.0 0.93057 0.37495 0.50000 1.0000 + Co Co187 1.0 0.88891 0.41662 0.50000 1.0000 + Co Co188 1.0 0.84724 0.45828 0.50000 1.0000 + Co Co189 1.0 0.80557 0.49995 0.50000 1.0000 + Co Co190 1.0 0.76391 0.54162 0.50000 1.0000 + Co Co191 1.0 0.72224 0.58328 0.50000 1.0000 + Co Co192 1.0 0.68057 0.62495 0.50000 1.0000 + Co Co193 1.0 0.18057 0.20828 0.50000 1.0000 + Co Co194 1.0 0.13891 0.24995 0.50000 1.0000 + Co Co195 1.0 0.09724 0.29162 0.50000 1.0000 + Co Co196 1.0 0.05557 0.33328 0.50000 1.0000 + Co Co197 1.0 0.01391 0.37495 0.50000 1.0000 + Co Co198 1.0 0.97224 0.41662 0.50000 1.0000 + Co Co199 1.0 0.93057 0.45828 0.50000 1.0000 + Co Co200 1.0 0.88891 0.49995 0.50000 1.0000 + Co Co201 1.0 0.84724 0.54162 0.50000 1.0000 + Co Co202 1.0 0.80557 0.58328 0.50000 1.0000 + Co Co203 1.0 0.76391 0.62495 0.50000 1.0000 + Co Co204 1.0 0.72224 0.66662 0.50000 1.0000 + Co Co205 1.0 0.22224 0.24995 0.50000 1.0000 + Co Co206 1.0 0.18057 0.29162 0.50000 1.0000 + Co Co207 1.0 0.13891 0.33328 0.50000 1.0000 + Co Co208 1.0 0.09724 0.37495 0.50000 1.0000 + Co Co209 1.0 0.05557 0.41662 0.50000 1.0000 + Co Co210 1.0 0.01391 0.45828 0.50000 1.0000 + Co Co211 1.0 0.97224 0.49995 0.50000 1.0000 + Co Co212 1.0 0.93057 0.54162 0.50000 1.0000 + Co Co213 1.0 0.88891 0.58328 0.50000 1.0000 + Co Co214 1.0 0.84724 0.62495 0.50000 1.0000 + Co Co215 1.0 0.80557 0.66662 0.50000 1.0000 + Co Co216 1.0 0.76391 0.70828 0.50000 1.0000 + Co Co217 1.0 0.26391 0.29162 0.50000 1.0000 + Co Co218 1.0 0.22224 0.33328 0.50000 1.0000 + Co Co219 1.0 0.18057 0.37495 0.50000 1.0000 + Co Co220 1.0 0.13891 0.41662 0.50000 1.0000 + Co Co221 1.0 0.09724 0.45828 0.50000 1.0000 + Co Co222 1.0 0.05557 0.49995 0.50000 1.0000 + Co Co223 1.0 0.01391 0.54162 0.50000 1.0000 + Co Co224 1.0 0.97224 0.58328 0.50000 1.0000 + Co Co225 1.0 0.93057 0.62495 0.50000 1.0000 + Co Co226 1.0 0.88891 0.66662 0.50000 1.0000 + Co Co227 1.0 0.84724 0.70828 0.50000 1.0000 + Co Co228 1.0 0.80557 0.74995 0.50000 1.0000 + Co Co229 1.0 0.30557 0.33328 0.50000 1.0000 + Co Co230 1.0 0.26391 0.37495 0.50000 1.0000 + Co Co231 1.0 0.22224 0.41662 0.50000 1.0000 + Co Co232 1.0 0.18057 0.45828 0.50000 1.0000 + Co Co233 1.0 0.13891 0.49995 0.50000 1.0000 + Co Co234 1.0 0.09724 0.54162 0.50000 1.0000 + Co Co235 1.0 0.05557 0.58328 0.50000 1.0000 + Co Co236 1.0 0.01391 0.62495 0.50000 1.0000 + Co Co237 1.0 0.97224 0.66662 0.50000 1.0000 + Co Co238 1.0 0.93057 0.70828 0.50000 1.0000 + Co Co239 1.0 0.88891 0.74995 0.50000 1.0000 + Co Co240 1.0 0.84724 0.79162 0.50000 1.0000 + Co Co241 1.0 0.34724 0.37495 0.50000 1.0000 + Co Co242 1.0 0.30557 0.41662 0.50000 1.0000 + Co Co243 1.0 0.26391 0.45828 0.50000 1.0000 + Co Co244 1.0 0.22224 0.49995 0.50000 1.0000 + Co Co245 1.0 0.18057 0.54162 0.50000 1.0000 + Co Co246 1.0 0.13891 0.58328 0.50000 1.0000 + Co Co247 1.0 0.09724 0.62495 0.50000 1.0000 + Co Co248 1.0 0.05557 0.66662 0.50000 1.0000 + Co Co249 1.0 0.01391 0.70828 0.50000 1.0000 + Co Co250 1.0 0.97224 0.74995 0.50000 1.0000 + Co Co251 1.0 0.93057 0.79162 0.50000 1.0000 + Co Co252 1.0 0.88891 0.83328 0.50000 1.0000 + Co Co253 1.0 0.38891 0.41662 0.50000 1.0000 + Co Co254 1.0 0.34724 0.45828 0.50000 1.0000 + Co Co255 1.0 0.30557 0.49995 0.50000 1.0000 + Co Co256 1.0 0.26391 0.54162 0.50000 1.0000 + Co Co257 1.0 0.22224 0.58328 0.50000 1.0000 + Co Co258 1.0 0.18057 0.62495 0.50000 1.0000 + Co Co259 1.0 0.13891 0.66662 0.50000 1.0000 + Co Co260 1.0 0.09724 0.70828 0.50000 1.0000 + Co Co261 1.0 0.05557 0.74995 0.50000 1.0000 + Co Co262 1.0 0.01391 0.79162 0.50000 1.0000 + Co Co263 1.0 0.97224 0.83328 0.50000 1.0000 + Co Co264 1.0 0.93057 0.87495 0.50000 1.0000 + Co Co265 1.0 0.43057 0.45828 0.50000 1.0000 + Co Co266 1.0 0.38891 0.49995 0.50000 1.0000 + Co Co267 1.0 0.34724 0.54162 0.50000 1.0000 + Co Co268 1.0 0.30557 0.58328 0.50000 1.0000 + Co Co269 1.0 0.26391 0.62495 0.50000 1.0000 + Co Co270 1.0 0.22224 0.66662 0.50000 1.0000 + Co Co271 1.0 0.18057 0.70828 0.50000 1.0000 + Co Co272 1.0 0.13891 0.74995 0.50000 1.0000 + Co Co273 1.0 0.09724 0.79162 0.50000 1.0000 + Co Co274 1.0 0.05557 0.83328 0.50000 1.0000 + Co Co275 1.0 0.01391 0.87495 0.50000 1.0000 + Co Co276 1.0 0.97224 0.91662 0.50000 1.0000 + Co Co277 1.0 0.47224 0.49995 0.50000 1.0000 + Co Co278 1.0 0.43057 0.54162 0.50000 1.0000 + Co Co279 1.0 0.38891 0.58328 0.50000 1.0000 + Co Co280 1.0 0.34724 0.62495 0.50000 1.0000 + Co Co281 1.0 0.30557 0.66662 0.50000 1.0000 + Co Co282 1.0 0.26391 0.70828 0.50000 1.0000 + Co Co283 1.0 0.22224 0.74995 0.50000 1.0000 + Co Co284 1.0 0.18057 0.79162 0.50000 1.0000 + Co Co285 1.0 0.13891 0.83328 0.50000 1.0000 + Co Co286 1.0 0.09724 0.87495 0.50000 1.0000 + Co Co287 1.0 0.05557 0.91662 0.50000 1.0000 + Co Co288 1.0 0.01391 0.95828 0.50000 1.0000 + O O1 1.0 0.02804 0.02804 0.33566 1.0000 + O O2 1.0 0.98638 0.06971 0.33566 1.0000 + O O3 1.0 0.94471 0.11138 0.33566 1.0000 + O O4 1.0 0.90304 0.15304 0.33566 1.0000 + O O5 1.0 0.86138 0.19471 0.33566 1.0000 + O O6 1.0 0.81971 0.23638 0.33566 1.0000 + O O7 1.0 0.77804 0.27804 0.33566 1.0000 + O O8 1.0 0.73638 0.31971 0.33566 1.0000 + O O9 1.0 0.69471 0.36138 0.33566 1.0000 + O O10 1.0 0.65304 0.40304 0.33566 1.0000 + O O11 1.0 0.61138 0.44471 0.33566 1.0000 + O O12 1.0 0.56971 0.48638 0.33566 1.0000 + O O13 1.0 0.06971 0.06971 0.33566 1.0000 + O O14 1.0 0.02804 0.11138 0.33566 1.0000 + O O15 1.0 0.98638 0.15304 0.33566 1.0000 + O O16 1.0 0.94471 0.19471 0.33566 1.0000 + O O17 1.0 0.90304 0.23638 0.33566 1.0000 + O O18 1.0 0.86138 0.27804 0.33566 1.0000 + O O19 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0.56890 0.33633 1.0000 + O O679 1.0 0.08336 0.61057 0.33633 1.0000 + O O680 1.0 0.04169 0.65224 0.33633 1.0000 + O O681 1.0 0.00002 0.69390 0.33633 1.0000 + O O682 1.0 0.95836 0.73557 0.33633 1.0000 + O O683 1.0 0.91669 0.77724 0.33633 1.0000 + O O684 1.0 0.87502 0.81890 0.33633 1.0000 + O O685 1.0 0.37502 0.40224 0.33633 1.0000 + O O686 1.0 0.33336 0.44390 0.33633 1.0000 + O O687 1.0 0.29169 0.48557 0.33633 1.0000 + O O688 1.0 0.25002 0.52724 0.33633 1.0000 + O O689 1.0 0.20836 0.56890 0.33633 1.0000 + O O690 1.0 0.16669 0.61057 0.33633 1.0000 + O O691 1.0 0.12502 0.65224 0.33633 1.0000 + O O692 1.0 0.08336 0.69390 0.33633 1.0000 + O O693 1.0 0.04169 0.73557 0.33633 1.0000 + O O694 1.0 0.00002 0.77724 0.33633 1.0000 + O O695 1.0 0.95836 0.81890 0.33633 1.0000 + O O696 1.0 0.91669 0.86057 0.33633 1.0000 + O O697 1.0 0.41669 0.44390 0.33633 1.0000 + O O698 1.0 0.37502 0.48557 0.33633 1.0000 + O O699 1.0 0.33336 0.52724 0.33633 1.0000 + O O700 1.0 0.29169 0.56890 0.33633 1.0000 + O O701 1.0 0.25002 0.61057 0.33633 1.0000 + O O702 1.0 0.20836 0.65224 0.33633 1.0000 + O O703 1.0 0.16669 0.69390 0.33633 1.0000 + O O704 1.0 0.12502 0.73557 0.33633 1.0000 + O O705 1.0 0.08336 0.77724 0.33633 1.0000 + O O706 1.0 0.04169 0.81890 0.33633 1.0000 + O O707 1.0 0.00002 0.86057 0.33633 1.0000 + O O708 1.0 0.95836 0.90224 0.33633 1.0000 + O O709 1.0 0.45836 0.48557 0.33633 1.0000 + O O710 1.0 0.41669 0.52724 0.33633 1.0000 + O O711 1.0 0.37502 0.56890 0.33633 1.0000 + O O712 1.0 0.33336 0.61057 0.33633 1.0000 + O O713 1.0 0.29169 0.65224 0.33633 1.0000 + O O714 1.0 0.25002 0.69390 0.33633 1.0000 + O O715 1.0 0.20836 0.73557 0.33633 1.0000 + O O716 1.0 0.16669 0.77724 0.33633 1.0000 + O O717 1.0 0.12502 0.81890 0.33633 1.0000 + O O718 1.0 0.08336 0.86057 0.33633 1.0000 + O O719 1.0 0.04169 0.90224 0.33633 1.0000 + O O720 1.0 0.00002 0.94390 0.33633 1.0000 + O O721 1.0 0.02804 0.05525 0.66367 1.0000 + O O722 1.0 0.98637 0.09692 0.66367 1.0000 + O O723 1.0 0.94470 0.13858 0.66367 1.0000 + O O724 1.0 0.90304 0.18025 0.66367 1.0000 + O O725 1.0 0.86137 0.22192 0.66367 1.0000 + O O726 1.0 0.81970 0.26358 0.66367 1.0000 + O O727 1.0 0.77804 0.30525 0.66367 1.0000 + O O728 1.0 0.73637 0.34692 0.66367 1.0000 + O O729 1.0 0.69470 0.38858 0.66367 1.0000 + O O730 1.0 0.65304 0.43025 0.66367 1.0000 + O O731 1.0 0.61137 0.47192 0.66367 1.0000 + O O732 1.0 0.56970 0.51358 0.66367 1.0000 + O O733 1.0 0.06970 0.09692 0.66367 1.0000 + O O734 1.0 0.02804 0.13858 0.66367 1.0000 + O O735 1.0 0.98637 0.18025 0.66367 1.0000 + O O736 1.0 0.94470 0.22192 0.66367 1.0000 + O O737 1.0 0.90304 0.26358 0.66367 1.0000 + O O738 1.0 0.86137 0.30525 0.66367 1.0000 + O O739 1.0 0.81970 0.34692 0.66367 1.0000 + O O740 1.0 0.77804 0.38858 0.66367 1.0000 + O O741 1.0 0.73637 0.43025 0.66367 1.0000 + O O742 1.0 0.69470 0.47192 0.66367 1.0000 + O O743 1.0 0.65304 0.51358 0.66367 1.0000 + O O744 1.0 0.61137 0.55525 0.66367 1.0000 + O O745 1.0 0.11137 0.13858 0.66367 1.0000 + O O746 1.0 0.06970 0.18025 0.66367 1.0000 + O O747 1.0 0.02804 0.22192 0.66367 1.0000 + O O748 1.0 0.98637 0.26358 0.66367 1.0000 + O O749 1.0 0.94470 0.30525 0.66367 1.0000 + O O750 1.0 0.90304 0.34692 0.66367 1.0000 + O O751 1.0 0.86137 0.38858 0.66367 1.0000 + O O752 1.0 0.81970 0.43025 0.66367 1.0000 + O O753 1.0 0.77804 0.47192 0.66367 1.0000 + O O754 1.0 0.73637 0.51358 0.66367 1.0000 + O O755 1.0 0.69470 0.55525 0.66367 1.0000 + O O756 1.0 0.65304 0.59692 0.66367 1.0000 + O O757 1.0 0.15304 0.18025 0.66367 1.0000 + O O758 1.0 0.11137 0.22192 0.66367 1.0000 + O O759 1.0 0.06970 0.26358 0.66367 1.0000 + O O760 1.0 0.02804 0.30525 0.66367 1.0000 + O O761 1.0 0.98637 0.34692 0.66367 1.0000 + O O762 1.0 0.94470 0.38858 0.66367 1.0000 + O O763 1.0 0.90304 0.43025 0.66367 1.0000 + O O764 1.0 0.86137 0.47192 0.66367 1.0000 + O O765 1.0 0.81970 0.51358 0.66367 1.0000 + O O766 1.0 0.77804 0.55525 0.66367 1.0000 + O O767 1.0 0.73637 0.59692 0.66367 1.0000 + O O768 1.0 0.69470 0.63858 0.66367 1.0000 + O O769 1.0 0.19470 0.22192 0.66367 1.0000 + O O770 1.0 0.15304 0.26358 0.66367 1.0000 + O O771 1.0 0.11137 0.30525 0.66367 1.0000 + O O772 1.0 0.06970 0.34692 0.66367 1.0000 + O O773 1.0 0.02804 0.38858 0.66367 1.0000 + O O774 1.0 0.98637 0.43025 0.66367 1.0000 + O O775 1.0 0.94470 0.47192 0.66367 1.0000 + O O776 1.0 0.90304 0.51358 0.66367 1.0000 + O O777 1.0 0.86137 0.55525 0.66367 1.0000 + O O778 1.0 0.81970 0.59692 0.66367 1.0000 + O O779 1.0 0.77804 0.63858 0.66367 1.0000 + O O780 1.0 0.73637 0.68025 0.66367 1.0000 + O O781 1.0 0.23637 0.26358 0.66367 1.0000 + O O782 1.0 0.19470 0.30525 0.66367 1.0000 + O O783 1.0 0.15304 0.34692 0.66367 1.0000 + O O784 1.0 0.11137 0.38858 0.66367 1.0000 + O O785 1.0 0.06970 0.43025 0.66367 1.0000 + O O786 1.0 0.02804 0.47192 0.66367 1.0000 + O O787 1.0 0.98637 0.51358 0.66367 1.0000 + O O788 1.0 0.94470 0.55525 0.66367 1.0000 + O O789 1.0 0.90304 0.59692 0.66367 1.0000 + O O790 1.0 0.86137 0.63858 0.66367 1.0000 + O O791 1.0 0.81970 0.68025 0.66367 1.0000 + O O792 1.0 0.77804 0.72192 0.66367 1.0000 + O O793 1.0 0.27804 0.30525 0.66367 1.0000 + O O794 1.0 0.23637 0.34692 0.66367 1.0000 + O O795 1.0 0.19470 0.38858 0.66367 1.0000 + O O796 1.0 0.15304 0.43025 0.66367 1.0000 + O O797 1.0 0.11137 0.47192 0.66367 1.0000 + O O798 1.0 0.06970 0.51358 0.66367 1.0000 + O O799 1.0 0.02804 0.55525 0.66367 1.0000 + O O800 1.0 0.98637 0.59692 0.66367 1.0000 + O O801 1.0 0.94470 0.63858 0.66367 1.0000 + O O802 1.0 0.90304 0.68025 0.66367 1.0000 + O O803 1.0 0.86137 0.72192 0.66367 1.0000 + O O804 1.0 0.81970 0.76358 0.66367 1.0000 + O O805 1.0 0.31970 0.34692 0.66367 1.0000 + O O806 1.0 0.27804 0.38858 0.66367 1.0000 + O O807 1.0 0.23637 0.43025 0.66367 1.0000 + O O808 1.0 0.19470 0.47192 0.66367 1.0000 + O O809 1.0 0.15304 0.51358 0.66367 1.0000 + O O810 1.0 0.11137 0.55525 0.66367 1.0000 + O O811 1.0 0.06970 0.59692 0.66367 1.0000 + O O812 1.0 0.02804 0.63858 0.66367 1.0000 + O O813 1.0 0.98637 0.68025 0.66367 1.0000 + O O814 1.0 0.94470 0.72192 0.66367 1.0000 + O O815 1.0 0.90304 0.76358 0.66367 1.0000 + O O816 1.0 0.86137 0.80525 0.66367 1.0000 + O O817 1.0 0.36137 0.38858 0.66367 1.0000 + O O818 1.0 0.31970 0.43025 0.66367 1.0000 + O O819 1.0 0.27804 0.47192 0.66367 1.0000 + O O820 1.0 0.23637 0.51358 0.66367 1.0000 + O O821 1.0 0.19470 0.55525 0.66367 1.0000 + O O822 1.0 0.15304 0.59692 0.66367 1.0000 + O O823 1.0 0.11137 0.63858 0.66367 1.0000 + O O824 1.0 0.06970 0.68025 0.66367 1.0000 + O O825 1.0 0.02804 0.72192 0.66367 1.0000 + O O826 1.0 0.98637 0.76358 0.66367 1.0000 + O O827 1.0 0.94470 0.80525 0.66367 1.0000 + O O828 1.0 0.90304 0.84692 0.66367 1.0000 + O O829 1.0 0.40304 0.43025 0.66367 1.0000 + O O830 1.0 0.36137 0.47192 0.66367 1.0000 + O O831 1.0 0.31970 0.51358 0.66367 1.0000 + O O832 1.0 0.27804 0.55525 0.66367 1.0000 + O O833 1.0 0.23637 0.59692 0.66367 1.0000 + O O834 1.0 0.19470 0.63858 0.66367 1.0000 + O O835 1.0 0.15304 0.68025 0.66367 1.0000 + O O836 1.0 0.11137 0.72192 0.66367 1.0000 + O O837 1.0 0.06970 0.76358 0.66367 1.0000 + O O838 1.0 0.02804 0.80525 0.66367 1.0000 + O O839 1.0 0.98637 0.84692 0.66367 1.0000 + O O840 1.0 0.94470 0.88858 0.66367 1.0000 + O O841 1.0 0.44470 0.47192 0.66367 1.0000 + O O842 1.0 0.40304 0.51358 0.66367 1.0000 + O O843 1.0 0.36137 0.55525 0.66367 1.0000 + O O844 1.0 0.31970 0.59692 0.66367 1.0000 + O O845 1.0 0.27804 0.63858 0.66367 1.0000 + O O846 1.0 0.23637 0.68025 0.66367 1.0000 + O O847 1.0 0.19470 0.72192 0.66367 1.0000 + O O848 1.0 0.15304 0.76358 0.66367 1.0000 + O O849 1.0 0.11137 0.80525 0.66367 1.0000 + O O850 1.0 0.06970 0.84692 0.66367 1.0000 + O O851 1.0 0.02804 0.88858 0.66367 1.0000 + O O852 1.0 0.98637 0.93025 0.66367 1.0000 + O O853 1.0 0.48637 0.51358 0.66367 1.0000 + O O854 1.0 0.44470 0.55525 0.66367 1.0000 + O O855 1.0 0.40304 0.59692 0.66367 1.0000 + O O856 1.0 0.36137 0.63858 0.66367 1.0000 + O O857 1.0 0.31970 0.68025 0.66367 1.0000 + O O858 1.0 0.27804 0.72192 0.66367 1.0000 + O O859 1.0 0.23637 0.76358 0.66367 1.0000 + O O860 1.0 0.19470 0.80525 0.66367 1.0000 + O O861 1.0 0.15304 0.84692 0.66367 1.0000 + O O862 1.0 0.11137 0.88858 0.66367 1.0000 + O O863 1.0 0.06970 0.93025 0.66367 1.0000 + O O864 1.0 0.02804 0.97192 0.66367 1.0000 + Mn Mn145 1.0 0.50000 0.50000 0.50000 1.0000 + Mn Mn146 1.0 0.45833 0.54167 0.50000 1.0000 + Mn Mn147 1.0 0.41667 0.58333 0.50000 1.0000 + Mn Mn148 1.0 0.37500 0.62500 0.50000 1.0000 + Mn Mn149 1.0 0.33333 0.66667 0.50000 1.0000 + Mn Mn150 1.0 0.29167 0.70833 0.50000 1.0000 + Mn Mn151 1.0 0.25000 0.75000 0.50000 1.0000 + Mn Mn152 1.0 0.20833 0.79167 0.50000 1.0000 + Mn Mn153 1.0 0.16667 0.83333 0.50000 1.0000 + Mn Mn154 1.0 0.12500 0.87500 0.50000 1.0000 + Mn Mn155 1.0 0.08333 0.91667 0.50000 1.0000 + Mn Mn156 1.0 0.54167 0.45833 0.50000 1.0000 + Mn Mn157 1.0 0.54167 0.54167 0.50000 1.0000 + Mn Mn158 1.0 0.50000 0.58333 0.50000 1.0000 + Mn Mn159 1.0 0.45833 0.62500 0.50000 1.0000 + Mn Mn160 1.0 0.41667 0.66667 0.50000 1.0000 + Mn Mn161 1.0 0.37500 0.70833 0.50000 1.0000 + Mn Mn162 1.0 0.33333 0.75000 0.50000 1.0000 + Mn Mn163 1.0 0.29167 0.79167 0.50000 1.0000 + Mn Mn164 1.0 0.25000 0.83333 0.50000 1.0000 + Mn Mn165 1.0 0.20833 0.87500 0.50000 1.0000 + Mn Mn166 1.0 0.16667 0.91667 0.50000 1.0000 + Mn Mn167 1.0 0.12500 0.95833 0.50000 1.0000 + Mn Mn168 1.0 0.08333 0.00000 0.50000 1.0000 + Mn Mn169 1.0 0.58333 0.58333 0.50000 1.0000 + Mn Mn170 1.0 0.54167 0.62500 0.50000 1.0000 + Mn Mn171 1.0 0.50000 0.66667 0.50000 1.0000 + Mn Mn172 1.0 0.45833 0.70833 0.50000 1.0000 + Mn Mn173 1.0 0.41667 0.75000 0.50000 1.0000 + Mn Mn174 1.0 0.37500 0.79167 0.50000 1.0000 + Mn Mn175 1.0 0.33333 0.83333 0.50000 1.0000 + Mn Mn176 1.0 0.29167 0.87500 0.50000 1.0000 + Mn Mn177 1.0 0.25000 0.91667 0.50000 1.0000 + Mn Mn178 1.0 0.20833 0.95833 0.50000 1.0000 + Mn Mn179 1.0 0.16667 0.00000 0.50000 1.0000 + Mn Mn180 1.0 0.12500 0.04167 0.50000 1.0000 + Mn Mn181 1.0 0.62500 0.62500 0.50000 1.0000 + Mn Mn182 1.0 0.58333 0.66667 0.50000 1.0000 + Mn Mn183 1.0 0.54167 0.70833 0.50000 1.0000 + Mn Mn184 1.0 0.50000 0.75000 0.50000 1.0000 + Mn Mn185 1.0 0.45833 0.79167 0.50000 1.0000 + Mn Mn186 1.0 0.41667 0.83333 0.50000 1.0000 + Mn Mn187 1.0 0.37500 0.87500 0.50000 1.0000 + Mn Mn188 1.0 0.33333 0.91667 0.50000 1.0000 + Mn Mn189 1.0 0.29167 0.95833 0.50000 1.0000 + Mn Mn190 1.0 0.25000 0.00000 0.50000 1.0000 + Mn Mn191 1.0 0.20833 0.04167 0.50000 1.0000 + Mn Mn192 1.0 0.16667 0.08333 0.50000 1.0000 + Mn Mn193 1.0 0.66667 0.66667 0.50000 1.0000 + Mn Mn194 1.0 0.62500 0.70833 0.50000 1.0000 + Mn Mn195 1.0 0.58333 0.75000 0.50000 1.0000 + Mn Mn196 1.0 0.54167 0.79167 0.50000 1.0000 + Mn Mn197 1.0 0.50000 0.83333 0.50000 1.0000 + Mn Mn198 1.0 0.45833 0.87500 0.50000 1.0000 + Mn Mn199 1.0 0.41667 0.91667 0.50000 1.0000 + Mn Mn200 1.0 0.37500 0.95833 0.50000 1.0000 + Mn Mn201 1.0 0.33333 0.00000 0.50000 1.0000 + Mn Mn202 1.0 0.29167 0.04167 0.50000 1.0000 + Mn Mn203 1.0 0.25000 0.08333 0.50000 1.0000 + Mn Mn204 1.0 0.20833 0.12500 0.50000 1.0000 + Mn Mn205 1.0 0.70833 0.70833 0.50000 1.0000 + Mn Mn206 1.0 0.66667 0.75000 0.50000 1.0000 + Mn Mn207 1.0 0.62500 0.79167 0.50000 1.0000 + Mn Mn208 1.0 0.58333 0.83333 0.50000 1.0000 + Mn Mn209 1.0 0.54167 0.87500 0.50000 1.0000 + Mn Mn210 1.0 0.50000 0.91667 0.50000 1.0000 + Mn Mn211 1.0 0.45833 0.95833 0.50000 1.0000 + Mn Mn212 1.0 0.41667 0.00000 0.50000 1.0000 + Mn Mn213 1.0 0.37500 0.04167 0.50000 1.0000 + Mn Mn214 1.0 0.33333 0.08333 0.50000 1.0000 + Mn Mn215 1.0 0.29167 0.12500 0.50000 1.0000 + Mn Mn216 1.0 0.25000 0.16667 0.50000 1.0000 + Mn Mn217 1.0 0.75000 0.75000 0.50000 1.0000 + Mn Mn218 1.0 0.70833 0.79167 0.50000 1.0000 + Mn Mn219 1.0 0.66667 0.83333 0.50000 1.0000 + Mn Mn220 1.0 0.62500 0.87500 0.50000 1.0000 + Mn Mn221 1.0 0.58333 0.91667 0.50000 1.0000 + Mn Mn222 1.0 0.54167 0.95833 0.50000 1.0000 + Mn Mn223 1.0 0.50000 0.00000 0.50000 1.0000 + Mn Mn224 1.0 0.45833 0.04167 0.50000 1.0000 + Mn Mn225 1.0 0.41667 0.08333 0.50000 1.0000 + Mn Mn226 1.0 0.37500 0.12500 0.50000 1.0000 + Mn Mn227 1.0 0.33333 0.16667 0.50000 1.0000 + Mn Mn228 1.0 0.29167 0.20833 0.50000 1.0000 + Mn Mn229 1.0 0.79167 0.79167 0.50000 1.0000 + Mn Mn230 1.0 0.75000 0.83333 0.50000 1.0000 + Mn Mn231 1.0 0.70833 0.87500 0.50000 1.0000 + Mn Mn232 1.0 0.66667 0.91667 0.50000 1.0000 + Mn Mn233 1.0 0.62500 0.95833 0.50000 1.0000 + Mn Mn234 1.0 0.58333 0.00000 0.50000 1.0000 + Mn Mn235 1.0 0.54167 0.04167 0.50000 1.0000 + Mn Mn236 1.0 0.50000 0.08333 0.50000 1.0000 + Mn Mn237 1.0 0.45833 0.12500 0.50000 1.0000 + Mn Mn238 1.0 0.41667 0.16667 0.50000 1.0000 + Mn Mn239 1.0 0.37500 0.20833 0.50000 1.0000 + Mn Mn240 1.0 0.33333 0.25000 0.50000 1.0000 + Mn Mn241 1.0 0.83333 0.83333 0.50000 1.0000 + Mn Mn242 1.0 0.79167 0.87500 0.50000 1.0000 + Mn Mn243 1.0 0.75000 0.91667 0.50000 1.0000 + Mn Mn244 1.0 0.70833 0.95833 0.50000 1.0000 + Mn Mn245 1.0 0.66667 0.00000 0.50000 1.0000 + Mn Mn246 1.0 0.62500 0.04167 0.50000 1.0000 + Mn Mn247 1.0 0.58333 0.08333 0.50000 1.0000 + Mn Mn248 1.0 0.54167 0.12500 0.50000 1.0000 + Mn Mn249 1.0 0.50000 0.16667 0.50000 1.0000 + Mn Mn250 1.0 0.45833 0.20833 0.50000 1.0000 + Mn Mn251 1.0 0.41667 0.25000 0.50000 1.0000 + Mn Mn252 1.0 0.37500 0.29167 0.50000 1.0000 + Mn Mn253 1.0 0.87500 0.87500 0.50000 1.0000 + Mn Mn254 1.0 0.83333 0.91667 0.50000 1.0000 + Mn Mn255 1.0 0.79167 0.95833 0.50000 1.0000 + Mn Mn256 1.0 0.75000 0.00000 0.50000 1.0000 + Mn Mn257 1.0 0.70833 0.04167 0.50000 1.0000 + Mn Mn258 1.0 0.66667 0.08333 0.50000 1.0000 + Mn Mn259 1.0 0.62500 0.12500 0.50000 1.0000 + Mn Mn260 1.0 0.58333 0.16667 0.50000 1.0000 + Mn Mn261 1.0 0.54167 0.20833 0.50000 1.0000 + Mn Mn262 1.0 0.50000 0.25000 0.50000 1.0000 + Mn Mn263 1.0 0.45833 0.29167 0.50000 1.0000 + Mn Mn264 1.0 0.41667 0.33333 0.50000 1.0000 + Mn Mn265 1.0 0.91667 0.91667 0.50000 1.0000 + Mn Mn266 1.0 0.87500 0.95833 0.50000 1.0000 + Mn Mn267 1.0 0.83333 0.00000 0.50000 1.0000 + Mn Mn268 1.0 0.79167 0.04167 0.50000 1.0000 + Mn Mn269 1.0 0.75000 0.08333 0.50000 1.0000 + Mn Mn270 1.0 0.70833 0.12500 0.50000 1.0000 + Mn Mn271 1.0 0.66667 0.16667 0.50000 1.0000 + Mn Mn272 1.0 0.62500 0.20833 0.50000 1.0000 + Mn Mn273 1.0 0.58333 0.25000 0.50000 1.0000 + Mn Mn274 1.0 0.54167 0.29167 0.50000 1.0000 + Mn Mn275 1.0 0.50000 0.33333 0.50000 1.0000 + Mn Mn276 1.0 0.45833 0.37500 0.50000 1.0000 + Mn Mn277 1.0 0.95833 0.95833 0.50000 1.0000 + Mn Mn278 1.0 0.91667 0.00000 0.50000 1.0000 + Mn Mn279 1.0 0.87500 0.04167 0.50000 1.0000 + Mn Mn280 1.0 0.83333 0.08333 0.50000 1.0000 + Mn Mn281 1.0 0.79167 0.12500 0.50000 1.0000 + Mn Mn282 1.0 0.75000 0.16667 0.50000 1.0000 + Mn Mn283 1.0 0.70833 0.20833 0.50000 1.0000 + Mn Mn284 1.0 0.66667 0.25000 0.50000 1.0000 + Mn Mn285 1.0 0.62500 0.29167 0.50000 1.0000 + Mn Mn286 1.0 0.58333 0.33333 0.50000 1.0000 + Mn Mn287 1.0 0.54167 0.37500 0.50000 1.0000 + Mn Mn288 1.0 0.50000 0.41667 0.50000 1.0000 + Co Co289 1.0 0.48609 0.54172 0.50000 1.0000 + Co Co290 1.0 0.44443 0.58338 0.50000 1.0000 + Co Co291 1.0 0.40276 0.62505 0.50000 1.0000 + Co Co292 1.0 0.36109 0.66672 0.50000 1.0000 + Co Co293 1.0 0.31943 0.70838 0.50000 1.0000 + Co Co294 1.0 0.27776 0.75005 0.50000 1.0000 + Co Co295 1.0 0.23609 0.79172 0.50000 1.0000 + Co Co296 1.0 0.19443 0.83338 0.50000 1.0000 + Co Co297 1.0 0.15276 0.87505 0.50000 1.0000 + Co Co298 1.0 0.11109 0.91672 0.50000 1.0000 + Co Co299 1.0 0.06943 0.95838 0.50000 1.0000 + Co Co300 1.0 0.02776 0.00005 0.50000 1.0000 + Co Co301 1.0 0.52776 0.58338 0.50000 1.0000 + Co Co302 1.0 0.48609 0.62505 0.50000 1.0000 + Co Co303 1.0 0.44443 0.66672 0.50000 1.0000 + Co Co304 1.0 0.40276 0.70838 0.50000 1.0000 + Co Co305 1.0 0.36109 0.75005 0.50000 1.0000 + Co Co306 1.0 0.31943 0.79172 0.50000 1.0000 + Co Co307 1.0 0.27776 0.83338 0.50000 1.0000 + Co Co308 1.0 0.23609 0.87505 0.50000 1.0000 + Co Co309 1.0 0.19443 0.91672 0.50000 1.0000 + Co Co310 1.0 0.15276 0.95838 0.50000 1.0000 + Co Co311 1.0 0.11109 0.00005 0.50000 1.0000 + Co Co312 1.0 0.06943 0.04172 0.50000 1.0000 + Co Co313 1.0 0.56943 0.62505 0.50000 1.0000 + Co Co314 1.0 0.52776 0.66672 0.50000 1.0000 + Co Co315 1.0 0.48609 0.70838 0.50000 1.0000 + Co Co316 1.0 0.44443 0.75005 0.50000 1.0000 + Co Co317 1.0 0.40276 0.79172 0.50000 1.0000 + Co Co318 1.0 0.36109 0.83338 0.50000 1.0000 + Co Co319 1.0 0.31943 0.87505 0.50000 1.0000 + Co Co320 1.0 0.27776 0.91672 0.50000 1.0000 + Co Co321 1.0 0.23609 0.95838 0.50000 1.0000 + Co Co322 1.0 0.19443 0.00005 0.50000 1.0000 + Co Co323 1.0 0.15276 0.04172 0.50000 1.0000 + Co Co324 1.0 0.11109 0.08338 0.50000 1.0000 + Co Co325 1.0 0.61109 0.66672 0.50000 1.0000 + Co Co326 1.0 0.56943 0.70838 0.50000 1.0000 + Co Co327 1.0 0.52776 0.75005 0.50000 1.0000 + Co Co328 1.0 0.48609 0.79172 0.50000 1.0000 + Co Co329 1.0 0.44443 0.83338 0.50000 1.0000 + Co Co330 1.0 0.40276 0.87505 0.50000 1.0000 + Co Co331 1.0 0.36109 0.91672 0.50000 1.0000 + Co Co332 1.0 0.31943 0.95838 0.50000 1.0000 + Co Co333 1.0 0.27776 0.00005 0.50000 1.0000 + Co Co334 1.0 0.23609 0.04172 0.50000 1.0000 + Co Co335 1.0 0.19443 0.08338 0.50000 1.0000 + Co Co336 1.0 0.15276 0.12505 0.50000 1.0000 + Co Co337 1.0 0.65276 0.70838 0.50000 1.0000 + Co Co338 1.0 0.61109 0.75005 0.50000 1.0000 + Co Co339 1.0 0.56943 0.79172 0.50000 1.0000 + Co Co340 1.0 0.52776 0.83338 0.50000 1.0000 + Co Co341 1.0 0.48609 0.87505 0.50000 1.0000 + Co Co342 1.0 0.44443 0.91672 0.50000 1.0000 + Co Co343 1.0 0.40276 0.95838 0.50000 1.0000 + Co Co344 1.0 0.36109 0.00005 0.50000 1.0000 + Co Co345 1.0 0.31943 0.04172 0.50000 1.0000 + Co Co346 1.0 0.27776 0.08338 0.50000 1.0000 + Co Co347 1.0 0.23609 0.12505 0.50000 1.0000 + Co Co348 1.0 0.19443 0.16672 0.50000 1.0000 + Co Co349 1.0 0.69443 0.75005 0.50000 1.0000 + Co Co350 1.0 0.65276 0.79172 0.50000 1.0000 + Co Co351 1.0 0.61109 0.83338 0.50000 1.0000 + Co Co352 1.0 0.56943 0.87505 0.50000 1.0000 + Co Co353 1.0 0.52776 0.91672 0.50000 1.0000 + Co Co354 1.0 0.48609 0.95838 0.50000 1.0000 + Co Co355 1.0 0.44443 0.00005 0.50000 1.0000 + Co Co356 1.0 0.40276 0.04172 0.50000 1.0000 + Co Co357 1.0 0.36109 0.08338 0.50000 1.0000 + Co Co358 1.0 0.31943 0.12505 0.50000 1.0000 + Co Co359 1.0 0.27776 0.16672 0.50000 1.0000 + Co Co360 1.0 0.23609 0.20838 0.50000 1.0000 + Co Co361 1.0 0.73609 0.79172 0.50000 1.0000 + Co Co362 1.0 0.69443 0.83338 0.50000 1.0000 + Co Co363 1.0 0.65276 0.87505 0.50000 1.0000 + Co Co364 1.0 0.61109 0.91672 0.50000 1.0000 + Co Co365 1.0 0.56943 0.95838 0.50000 1.0000 + Co Co366 1.0 0.52776 0.00005 0.50000 1.0000 + Co Co367 1.0 0.48609 0.04172 0.50000 1.0000 + Co Co368 1.0 0.44443 0.08338 0.50000 1.0000 + Co Co369 1.0 0.40276 0.12505 0.50000 1.0000 + Co Co370 1.0 0.36109 0.16672 0.50000 1.0000 + Co Co371 1.0 0.31943 0.20838 0.50000 1.0000 + Co Co372 1.0 0.27776 0.25005 0.50000 1.0000 + Co Co373 1.0 0.77776 0.83338 0.50000 1.0000 + Co Co374 1.0 0.73609 0.87505 0.50000 1.0000 + Co Co375 1.0 0.69443 0.91672 0.50000 1.0000 + Co Co376 1.0 0.65276 0.95838 0.50000 1.0000 + Co Co377 1.0 0.61109 0.00005 0.50000 1.0000 + Co Co378 1.0 0.56943 0.04172 0.50000 1.0000 + Co Co379 1.0 0.52776 0.08338 0.50000 1.0000 + Co Co380 1.0 0.48609 0.12505 0.50000 1.0000 + Co Co381 1.0 0.44443 0.16672 0.50000 1.0000 + Co Co382 1.0 0.40276 0.20838 0.50000 1.0000 + Co Co383 1.0 0.36109 0.25005 0.50000 1.0000 + Co Co384 1.0 0.31943 0.29172 0.50000 1.0000 + Co Co385 1.0 0.81943 0.87505 0.50000 1.0000 + Co Co386 1.0 0.77776 0.91672 0.50000 1.0000 + Co Co387 1.0 0.73609 0.95838 0.50000 1.0000 + Co Co388 1.0 0.69443 0.00005 0.50000 1.0000 + Co Co389 1.0 0.65276 0.04172 0.50000 1.0000 + Co Co390 1.0 0.61109 0.08338 0.50000 1.0000 + Co Co391 1.0 0.56943 0.12505 0.50000 1.0000 + Co Co392 1.0 0.52776 0.16672 0.50000 1.0000 + Co Co393 1.0 0.48609 0.20838 0.50000 1.0000 + Co Co394 1.0 0.44443 0.25005 0.50000 1.0000 + Co Co395 1.0 0.40276 0.29172 0.50000 1.0000 + Co Co396 1.0 0.36109 0.33338 0.50000 1.0000 + Co Co397 1.0 0.86109 0.91672 0.50000 1.0000 + Co Co398 1.0 0.81943 0.95838 0.50000 1.0000 + Co Co399 1.0 0.77776 0.00005 0.50000 1.0000 + Co Co400 1.0 0.73609 0.04172 0.50000 1.0000 + Co Co401 1.0 0.69443 0.08338 0.50000 1.0000 + Co Co402 1.0 0.65276 0.12505 0.50000 1.0000 + Co Co403 1.0 0.61109 0.16672 0.50000 1.0000 + Co Co404 1.0 0.56943 0.20838 0.50000 1.0000 + Co Co405 1.0 0.52776 0.25005 0.50000 1.0000 + Co Co406 1.0 0.48609 0.29172 0.50000 1.0000 + Co Co407 1.0 0.44443 0.33338 0.50000 1.0000 + Co Co408 1.0 0.40276 0.37505 0.50000 1.0000 + Co Co409 1.0 0.90276 0.95838 0.50000 1.0000 + Co Co410 1.0 0.86109 0.00005 0.50000 1.0000 + Co Co411 1.0 0.81943 0.04172 0.50000 1.0000 + Co Co412 1.0 0.77776 0.08338 0.50000 1.0000 + Co Co413 1.0 0.73609 0.12505 0.50000 1.0000 + Co Co414 1.0 0.69443 0.16672 0.50000 1.0000 + Co Co415 1.0 0.65276 0.20838 0.50000 1.0000 + Co Co416 1.0 0.61109 0.25005 0.50000 1.0000 + Co Co417 1.0 0.56943 0.29172 0.50000 1.0000 + Co Co418 1.0 0.52776 0.33338 0.50000 1.0000 + Co Co419 1.0 0.48609 0.37505 0.50000 1.0000 + Co Co420 1.0 0.44443 0.41672 0.50000 1.0000 + Co Co421 1.0 0.94443 0.00005 0.50000 1.0000 + Co Co422 1.0 0.90276 0.04172 0.50000 1.0000 + Co Co423 1.0 0.86109 0.08338 0.50000 1.0000 + Co Co424 1.0 0.81943 0.12505 0.50000 1.0000 + Co Co425 1.0 0.77776 0.16672 0.50000 1.0000 + Co Co426 1.0 0.73609 0.20838 0.50000 1.0000 + Co Co427 1.0 0.69443 0.25005 0.50000 1.0000 + Co Co428 1.0 0.65276 0.29172 0.50000 1.0000 + Co Co429 1.0 0.61109 0.33338 0.50000 1.0000 + Co Co430 1.0 0.56943 0.37505 0.50000 1.0000 + Co Co431 1.0 0.52776 0.41672 0.50000 1.0000 + Co Co432 1.0 0.48609 0.45838 0.50000 1.0000 + Co Co433 1.0 0.51391 0.54162 0.50000 1.0000 + Co Co434 1.0 0.47224 0.58328 0.50000 1.0000 + Co Co435 1.0 0.43057 0.62495 0.50000 1.0000 + Co Co436 1.0 0.38891 0.66662 0.50000 1.0000 + Co Co437 1.0 0.34724 0.70828 0.50000 1.0000 + Co Co438 1.0 0.30557 0.74995 0.50000 1.0000 + Co Co439 1.0 0.26391 0.79162 0.50000 1.0000 + Co Co440 1.0 0.22224 0.83328 0.50000 1.0000 + Co Co441 1.0 0.18057 0.87495 0.50000 1.0000 + Co Co442 1.0 0.13891 0.91662 0.50000 1.0000 + Co Co443 1.0 0.09724 0.95828 0.50000 1.0000 + Co Co444 1.0 0.05557 0.99995 0.50000 1.0000 + Co Co445 1.0 0.55557 0.58328 0.50000 1.0000 + Co Co446 1.0 0.51391 0.62495 0.50000 1.0000 + Co Co447 1.0 0.47224 0.66662 0.50000 1.0000 + Co Co448 1.0 0.43057 0.70828 0.50000 1.0000 + Co Co449 1.0 0.38891 0.74995 0.50000 1.0000 + Co Co450 1.0 0.34724 0.79162 0.50000 1.0000 + Co Co451 1.0 0.30557 0.83328 0.50000 1.0000 + Co Co452 1.0 0.26391 0.87495 0.50000 1.0000 + Co Co453 1.0 0.22224 0.91662 0.50000 1.0000 + Co Co454 1.0 0.18057 0.95828 0.50000 1.0000 + Co Co455 1.0 0.13891 0.99995 0.50000 1.0000 + Co Co456 1.0 0.09724 0.04162 0.50000 1.0000 + Co Co457 1.0 0.59724 0.62495 0.50000 1.0000 + Co Co458 1.0 0.55557 0.66662 0.50000 1.0000 + Co Co459 1.0 0.51391 0.70828 0.50000 1.0000 + Co Co460 1.0 0.47224 0.74995 0.50000 1.0000 + Co Co461 1.0 0.43057 0.79162 0.50000 1.0000 + Co Co462 1.0 0.38891 0.83328 0.50000 1.0000 + Co Co463 1.0 0.34724 0.87495 0.50000 1.0000 + Co Co464 1.0 0.30557 0.91662 0.50000 1.0000 + Co Co465 1.0 0.26391 0.95828 0.50000 1.0000 + Co Co466 1.0 0.22224 0.99995 0.50000 1.0000 + Co Co467 1.0 0.18057 0.04162 0.50000 1.0000 + Co Co468 1.0 0.13891 0.08328 0.50000 1.0000 + Co Co469 1.0 0.63891 0.66662 0.50000 1.0000 + Co Co470 1.0 0.59724 0.70828 0.50000 1.0000 + Co Co471 1.0 0.55557 0.74995 0.50000 1.0000 + Co Co472 1.0 0.51391 0.79162 0.50000 1.0000 + Co Co473 1.0 0.47224 0.83328 0.50000 1.0000 + Co Co474 1.0 0.43057 0.87495 0.50000 1.0000 + Co Co475 1.0 0.38891 0.91662 0.50000 1.0000 + Co Co476 1.0 0.34724 0.95828 0.50000 1.0000 + Co Co477 1.0 0.30557 0.99995 0.50000 1.0000 + Co Co478 1.0 0.26391 0.04162 0.50000 1.0000 + Co Co479 1.0 0.22224 0.08328 0.50000 1.0000 + Co Co480 1.0 0.18057 0.12495 0.50000 1.0000 + Co Co481 1.0 0.68057 0.70828 0.50000 1.0000 + Co Co482 1.0 0.63891 0.74995 0.50000 1.0000 + Co Co483 1.0 0.59724 0.79162 0.50000 1.0000 + Co Co484 1.0 0.55557 0.83328 0.50000 1.0000 + Co Co485 1.0 0.51391 0.87495 0.50000 1.0000 + Co Co486 1.0 0.47224 0.91662 0.50000 1.0000 + Co Co487 1.0 0.43057 0.95828 0.50000 1.0000 + Co Co488 1.0 0.38891 0.99995 0.50000 1.0000 + Co Co489 1.0 0.34724 0.04162 0.50000 1.0000 + Co Co490 1.0 0.30557 0.08328 0.50000 1.0000 + Co Co491 1.0 0.26391 0.12495 0.50000 1.0000 + Co Co492 1.0 0.22224 0.16662 0.50000 1.0000 + Co Co493 1.0 0.72224 0.74995 0.50000 1.0000 + Co Co494 1.0 0.68057 0.79162 0.50000 1.0000 + Co Co495 1.0 0.63891 0.83328 0.50000 1.0000 + Co Co496 1.0 0.59724 0.87495 0.50000 1.0000 + Co Co497 1.0 0.55557 0.91662 0.50000 1.0000 + Co Co498 1.0 0.51391 0.95828 0.50000 1.0000 + Co Co499 1.0 0.47224 0.99995 0.50000 1.0000 + Co Co500 1.0 0.43057 0.04162 0.50000 1.0000 + Co Co501 1.0 0.38891 0.08328 0.50000 1.0000 + Co Co502 1.0 0.34724 0.12495 0.50000 1.0000 + Co Co503 1.0 0.30557 0.16662 0.50000 1.0000 + Co Co504 1.0 0.26391 0.20828 0.50000 1.0000 + Co Co505 1.0 0.76391 0.79162 0.50000 1.0000 + Co Co506 1.0 0.72224 0.83328 0.50000 1.0000 + Co Co507 1.0 0.68057 0.87495 0.50000 1.0000 + Co Co508 1.0 0.63891 0.91662 0.50000 1.0000 + Co Co509 1.0 0.59724 0.95828 0.50000 1.0000 + Co Co510 1.0 0.55557 0.99995 0.50000 1.0000 + Co Co511 1.0 0.51391 0.04162 0.50000 1.0000 + Co Co512 1.0 0.47224 0.08328 0.50000 1.0000 + Co Co513 1.0 0.43057 0.12495 0.50000 1.0000 + Co Co514 1.0 0.38891 0.16662 0.50000 1.0000 + Co Co515 1.0 0.34724 0.20828 0.50000 1.0000 + Co Co516 1.0 0.30557 0.24995 0.50000 1.0000 + Co Co517 1.0 0.80557 0.83328 0.50000 1.0000 + Co Co518 1.0 0.76391 0.87495 0.50000 1.0000 + Co Co519 1.0 0.72224 0.91662 0.50000 1.0000 + Co Co520 1.0 0.68057 0.95828 0.50000 1.0000 + Co Co521 1.0 0.63891 0.99995 0.50000 1.0000 + Co Co522 1.0 0.59724 0.04162 0.50000 1.0000 + Co Co523 1.0 0.55557 0.08328 0.50000 1.0000 + Co Co524 1.0 0.51391 0.12495 0.50000 1.0000 + Co Co525 1.0 0.47224 0.16662 0.50000 1.0000 + Co Co526 1.0 0.43057 0.20828 0.50000 1.0000 + Co Co527 1.0 0.38891 0.24995 0.50000 1.0000 + Co Co528 1.0 0.34724 0.29162 0.50000 1.0000 + Co Co529 1.0 0.84724 0.87495 0.50000 1.0000 + 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a/tier3/cif_file/orthogonal_2dm-3948_supercell_12x12x1.cif b/tier3/cif_file/orthogonal_2dm-3948_supercell_12x12x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..39cc2c9ae5756059161f1647ad0039e7a6a94931 --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-3948_supercell_12x12x1.cif @@ -0,0 +1,3481 @@ +data_image0 +_chemical_formula_structural Ti144Co432O1152Ti144Co432O1152 +_chemical_formula_sum "Ti288 Co864 O2304" +_cell_length_a 122.138 +_cell_length_b 70.5165 +_cell_length_c 5.97834 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Ti Ti1 1.0 0.00000 0.00000 0.50000 1.0000 + Ti Ti2 1.0 0.04167 0.04167 0.50000 1.0000 + Ti Ti3 1.0 0.08333 0.08333 0.50000 1.0000 + Ti Ti4 1.0 0.12500 0.12500 0.50000 1.0000 + Ti Ti5 1.0 0.16667 0.16667 0.50000 1.0000 + Ti Ti6 1.0 0.20833 0.20833 0.50000 1.0000 + Ti Ti7 1.0 0.25000 0.25000 0.50000 1.0000 + Ti Ti8 1.0 0.29167 0.29167 0.50000 1.0000 + Ti Ti9 1.0 0.33333 0.33333 0.50000 1.0000 + Ti Ti10 1.0 0.37500 0.37500 0.50000 1.0000 + Ti Ti11 1.0 0.41667 0.41667 0.50000 1.0000 + Ti Ti12 1.0 0.45833 0.45833 0.50000 1.0000 + Ti Ti13 1.0 0.04167 0.95833 0.50000 1.0000 + Ti Ti14 1.0 0.08333 0.00000 0.50000 1.0000 + Ti Ti15 1.0 0.12500 0.04167 0.50000 1.0000 + Ti Ti16 1.0 0.16667 0.08333 0.50000 1.0000 + Ti Ti17 1.0 0.20833 0.12500 0.50000 1.0000 + Ti Ti18 1.0 0.25000 0.16667 0.50000 1.0000 + Ti Ti19 1.0 0.29167 0.20833 0.50000 1.0000 + Ti Ti20 1.0 0.33333 0.25000 0.50000 1.0000 + Ti Ti21 1.0 0.37500 0.29167 0.50000 1.0000 + Ti Ti22 1.0 0.41667 0.33333 0.50000 1.0000 + Ti Ti23 1.0 0.45833 0.37500 0.50000 1.0000 + Ti Ti24 1.0 0.50000 0.41667 0.50000 1.0000 + Ti Ti25 1.0 0.08333 0.91667 0.50000 1.0000 + Ti Ti26 1.0 0.12500 0.95833 0.50000 1.0000 + Ti Ti27 1.0 0.16667 0.00000 0.50000 1.0000 + Ti Ti28 1.0 0.20833 0.04167 0.50000 1.0000 + Ti Ti29 1.0 0.25000 0.08333 0.50000 1.0000 + Ti Ti30 1.0 0.29167 0.12500 0.50000 1.0000 + Ti Ti31 1.0 0.33333 0.16667 0.50000 1.0000 + Ti Ti32 1.0 0.37500 0.20833 0.50000 1.0000 + Ti Ti33 1.0 0.41667 0.25000 0.50000 1.0000 + Ti Ti34 1.0 0.45833 0.29167 0.50000 1.0000 + Ti Ti35 1.0 0.50000 0.33333 0.50000 1.0000 + Ti Ti36 1.0 0.54167 0.37500 0.50000 1.0000 + Ti Ti37 1.0 0.12500 0.87500 0.50000 1.0000 + Ti Ti38 1.0 0.16667 0.91667 0.50000 1.0000 + Ti Ti39 1.0 0.20833 0.95833 0.50000 1.0000 + Ti Ti40 1.0 0.25000 0.00000 0.50000 1.0000 + Ti Ti41 1.0 0.29167 0.04167 0.50000 1.0000 + Ti Ti42 1.0 0.33333 0.08333 0.50000 1.0000 + Ti Ti43 1.0 0.37500 0.12500 0.50000 1.0000 + Ti Ti44 1.0 0.41667 0.16667 0.50000 1.0000 + Ti Ti45 1.0 0.45833 0.20833 0.50000 1.0000 + Ti Ti46 1.0 0.50000 0.25000 0.50000 1.0000 + Ti Ti47 1.0 0.54167 0.29167 0.50000 1.0000 + Ti Ti48 1.0 0.58333 0.33333 0.50000 1.0000 + Ti Ti49 1.0 0.16667 0.83333 0.50000 1.0000 + Ti Ti50 1.0 0.20833 0.87500 0.50000 1.0000 + Ti Ti51 1.0 0.25000 0.91667 0.50000 1.0000 + Ti Ti52 1.0 0.29167 0.95833 0.50000 1.0000 + Ti Ti53 1.0 0.33333 0.00000 0.50000 1.0000 + Ti Ti54 1.0 0.37500 0.04167 0.50000 1.0000 + Ti Ti55 1.0 0.41667 0.08333 0.50000 1.0000 + Ti Ti56 1.0 0.45833 0.12500 0.50000 1.0000 + Ti Ti57 1.0 0.50000 0.16667 0.50000 1.0000 + Ti Ti58 1.0 0.54167 0.20833 0.50000 1.0000 + Ti Ti59 1.0 0.58333 0.25000 0.50000 1.0000 + Ti Ti60 1.0 0.62500 0.29167 0.50000 1.0000 + Ti Ti61 1.0 0.20833 0.79167 0.50000 1.0000 + Ti Ti62 1.0 0.25000 0.83333 0.50000 1.0000 + Ti Ti63 1.0 0.29167 0.87500 0.50000 1.0000 + Ti Ti64 1.0 0.33333 0.91667 0.50000 1.0000 + Ti Ti65 1.0 0.37500 0.95833 0.50000 1.0000 + Ti Ti66 1.0 0.41667 1.00000 0.50000 1.0000 + Ti Ti67 1.0 0.45833 0.04167 0.50000 1.0000 + Ti Ti68 1.0 0.50000 0.08333 0.50000 1.0000 + Ti Ti69 1.0 0.54167 0.12500 0.50000 1.0000 + Ti Ti70 1.0 0.58333 0.16667 0.50000 1.0000 + Ti Ti71 1.0 0.62500 0.20833 0.50000 1.0000 + Ti Ti72 1.0 0.66667 0.25000 0.50000 1.0000 + Ti Ti73 1.0 0.25000 0.75000 0.50000 1.0000 + Ti Ti74 1.0 0.29167 0.79167 0.50000 1.0000 + Ti Ti75 1.0 0.33333 0.83333 0.50000 1.0000 + Ti Ti76 1.0 0.37500 0.87500 0.50000 1.0000 + Ti Ti77 1.0 0.41667 0.91667 0.50000 1.0000 + Ti Ti78 1.0 0.45833 0.95833 0.50000 1.0000 + Ti Ti79 1.0 0.50000 1.00000 0.50000 1.0000 + Ti Ti80 1.0 0.54167 0.04167 0.50000 1.0000 + Ti Ti81 1.0 0.58333 0.08333 0.50000 1.0000 + Ti Ti82 1.0 0.62500 0.12500 0.50000 1.0000 + Ti Ti83 1.0 0.66667 0.16667 0.50000 1.0000 + Ti Ti84 1.0 0.70833 0.20833 0.50000 1.0000 + Ti Ti85 1.0 0.29167 0.70833 0.50000 1.0000 + Ti Ti86 1.0 0.33333 0.75000 0.50000 1.0000 + Ti Ti87 1.0 0.37500 0.79167 0.50000 1.0000 + Ti Ti88 1.0 0.41667 0.83333 0.50000 1.0000 + Ti Ti89 1.0 0.45833 0.87500 0.50000 1.0000 + Ti Ti90 1.0 0.50000 0.91667 0.50000 1.0000 + Ti Ti91 1.0 0.54167 0.95833 0.50000 1.0000 + Ti Ti92 1.0 0.58333 1.00000 0.50000 1.0000 + Ti Ti93 1.0 0.62500 0.04167 0.50000 1.0000 + Ti Ti94 1.0 0.66667 0.08333 0.50000 1.0000 + Ti Ti95 1.0 0.70833 0.12500 0.50000 1.0000 + Ti Ti96 1.0 0.75000 0.16667 0.50000 1.0000 + Ti Ti97 1.0 0.33333 0.66667 0.50000 1.0000 + Ti Ti98 1.0 0.37500 0.70833 0.50000 1.0000 + Ti Ti99 1.0 0.41667 0.75000 0.50000 1.0000 + Ti Ti100 1.0 0.45833 0.79167 0.50000 1.0000 + Ti Ti101 1.0 0.50000 0.83333 0.50000 1.0000 + Ti Ti102 1.0 0.54167 0.87500 0.50000 1.0000 + Ti Ti103 1.0 0.58333 0.91667 0.50000 1.0000 + Ti Ti104 1.0 0.62500 0.95833 0.50000 1.0000 + Ti Ti105 1.0 0.66667 1.00000 0.50000 1.0000 + Ti Ti106 1.0 0.70833 0.04167 0.50000 1.0000 + Ti Ti107 1.0 0.75000 0.08333 0.50000 1.0000 + Ti Ti108 1.0 0.79167 0.12500 0.50000 1.0000 + Ti Ti109 1.0 0.37500 0.62500 0.50000 1.0000 + Ti Ti110 1.0 0.41667 0.66667 0.50000 1.0000 + Ti Ti111 1.0 0.45833 0.70833 0.50000 1.0000 + Ti Ti112 1.0 0.50000 0.75000 0.50000 1.0000 + Ti Ti113 1.0 0.54167 0.79167 0.50000 1.0000 + Ti Ti114 1.0 0.58333 0.83333 0.50000 1.0000 + Ti Ti115 1.0 0.62500 0.87500 0.50000 1.0000 + Ti Ti116 1.0 0.66667 0.91667 0.50000 1.0000 + Ti Ti117 1.0 0.70833 0.95833 0.50000 1.0000 + Ti Ti118 1.0 0.75000 1.00000 0.50000 1.0000 + Ti Ti119 1.0 0.79167 0.04167 0.50000 1.0000 + Ti Ti120 1.0 0.83333 0.08333 0.50000 1.0000 + Ti Ti121 1.0 0.41667 0.58333 0.50000 1.0000 + Ti Ti122 1.0 0.45833 0.62500 0.50000 1.0000 + Ti Ti123 1.0 0.50000 0.66667 0.50000 1.0000 + Ti Ti124 1.0 0.54167 0.70833 0.50000 1.0000 + Ti Ti125 1.0 0.58333 0.75000 0.50000 1.0000 + Ti Ti126 1.0 0.62500 0.79167 0.50000 1.0000 + Ti Ti127 1.0 0.66667 0.83333 0.50000 1.0000 + Ti Ti128 1.0 0.70833 0.87500 0.50000 1.0000 + Ti Ti129 1.0 0.75000 0.91667 0.50000 1.0000 + Ti Ti130 1.0 0.79167 0.95833 0.50000 1.0000 + Ti Ti131 1.0 0.83333 1.00000 0.50000 1.0000 + Ti Ti132 1.0 0.87500 0.04167 0.50000 1.0000 + Ti Ti133 1.0 0.45833 0.54167 0.50000 1.0000 + Ti Ti134 1.0 0.50000 0.58333 0.50000 1.0000 + Ti Ti135 1.0 0.54167 0.62500 0.50000 1.0000 + Ti Ti136 1.0 0.58333 0.66667 0.50000 1.0000 + Ti Ti137 1.0 0.62500 0.70833 0.50000 1.0000 + Ti Ti138 1.0 0.66667 0.75000 0.50000 1.0000 + Ti Ti139 1.0 0.70833 0.79167 0.50000 1.0000 + Ti Ti140 1.0 0.75000 0.83333 0.50000 1.0000 + Ti Ti141 1.0 0.79167 0.87500 0.50000 1.0000 + Ti Ti142 1.0 0.83333 0.91667 0.50000 1.0000 + Ti Ti143 1.0 0.87500 0.95833 0.50000 1.0000 + Ti Ti144 1.0 0.91667 0.00000 0.50000 1.0000 + Co Co1 1.0 0.04167 0.00000 0.50000 1.0000 + Co Co2 1.0 0.08333 0.04167 0.50000 1.0000 + Co Co3 1.0 0.12500 0.08333 0.50000 1.0000 + Co Co4 1.0 0.16667 0.12500 0.50000 1.0000 + Co Co5 1.0 0.20833 0.16667 0.50000 1.0000 + Co Co6 1.0 0.25000 0.20833 0.50000 1.0000 + Co Co7 1.0 0.29167 0.25000 0.50000 1.0000 + Co Co8 1.0 0.33333 0.29167 0.50000 1.0000 + Co Co9 1.0 0.37500 0.33333 0.50000 1.0000 + Co Co10 1.0 0.41667 0.37500 0.50000 1.0000 + Co Co11 1.0 0.45833 0.41667 0.50000 1.0000 + Co Co12 1.0 0.50000 0.45833 0.50000 1.0000 + Co Co13 1.0 0.08333 0.95833 0.50000 1.0000 + Co Co14 1.0 0.12500 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Co Co81 1.0 0.62500 0.08333 0.50000 1.0000 + Co Co82 1.0 0.66667 0.12500 0.50000 1.0000 + Co Co83 1.0 0.70833 0.16667 0.50000 1.0000 + Co Co84 1.0 0.75000 0.20833 0.50000 1.0000 + Co Co85 1.0 0.33333 0.70833 0.50000 1.0000 + Co Co86 1.0 0.37500 0.75000 0.50000 1.0000 + Co Co87 1.0 0.41667 0.79167 0.50000 1.0000 + Co Co88 1.0 0.45833 0.83333 0.50000 1.0000 + Co Co89 1.0 0.50000 0.87500 0.50000 1.0000 + Co Co90 1.0 0.54167 0.91667 0.50000 1.0000 + Co Co91 1.0 0.58333 0.95833 0.50000 1.0000 + Co Co92 1.0 0.62500 0.00000 0.50000 1.0000 + Co Co93 1.0 0.66667 0.04167 0.50000 1.0000 + Co Co94 1.0 0.70833 0.08333 0.50000 1.0000 + Co Co95 1.0 0.75000 0.12500 0.50000 1.0000 + Co Co96 1.0 0.79167 0.16667 0.50000 1.0000 + Co Co97 1.0 0.37500 0.66667 0.50000 1.0000 + Co Co98 1.0 0.41667 0.70833 0.50000 1.0000 + Co Co99 1.0 0.45833 0.75000 0.50000 1.0000 + Co Co100 1.0 0.50000 0.79167 0.50000 1.0000 + Co Co101 1.0 0.54167 0.83333 0.50000 1.0000 + Co Co102 1.0 0.58333 0.87500 0.50000 1.0000 + Co Co103 1.0 0.62500 0.91667 0.50000 1.0000 + Co Co104 1.0 0.66667 0.95833 0.50000 1.0000 + Co Co105 1.0 0.70833 1.00000 0.50000 1.0000 + Co Co106 1.0 0.75000 0.04167 0.50000 1.0000 + Co Co107 1.0 0.79167 0.08333 0.50000 1.0000 + Co Co108 1.0 0.83333 0.12500 0.50000 1.0000 + Co Co109 1.0 0.41667 0.62500 0.50000 1.0000 + Co Co110 1.0 0.45833 0.66667 0.50000 1.0000 + Co Co111 1.0 0.50000 0.70833 0.50000 1.0000 + Co Co112 1.0 0.54167 0.75000 0.50000 1.0000 + Co Co113 1.0 0.58333 0.79167 0.50000 1.0000 + Co Co114 1.0 0.62500 0.83333 0.50000 1.0000 + Co Co115 1.0 0.66667 0.87500 0.50000 1.0000 + Co Co116 1.0 0.70833 0.91667 0.50000 1.0000 + Co Co117 1.0 0.75000 0.95833 0.50000 1.0000 + Co Co118 1.0 0.79167 1.00000 0.50000 1.0000 + Co Co119 1.0 0.83333 0.04167 0.50000 1.0000 + Co Co120 1.0 0.87500 0.08333 0.50000 1.0000 + Co Co121 1.0 0.45833 0.58333 0.50000 1.0000 + Co Co122 1.0 0.50000 0.62500 0.50000 1.0000 + Co Co123 1.0 0.54167 0.66667 0.50000 1.0000 + Co Co124 1.0 0.58333 0.70833 0.50000 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1.0 0.92371 0.02113 0.66085 1.0000 + O O997 1.0 0.50704 0.52113 0.66085 1.0000 + O O998 1.0 0.54871 0.56280 0.66085 1.0000 + O O999 1.0 0.59038 0.60446 0.66085 1.0000 + O O1000 1.0 0.63204 0.64613 0.66085 1.0000 + O O1001 1.0 0.67371 0.68780 0.66085 1.0000 + O O1002 1.0 0.71538 0.72946 0.66085 1.0000 + O O1003 1.0 0.75704 0.77113 0.66085 1.0000 + O O1004 1.0 0.79871 0.81280 0.66085 1.0000 + O O1005 1.0 0.84038 0.85446 0.66085 1.0000 + O O1006 1.0 0.88204 0.89613 0.66085 1.0000 + O O1007 1.0 0.92371 0.93780 0.66085 1.0000 + O O1008 1.0 0.96538 0.97946 0.66085 1.0000 + O O1009 1.0 0.04871 0.02054 0.66085 1.0000 + O O1010 1.0 0.09038 0.06220 0.66085 1.0000 + O O1011 1.0 0.13204 0.10387 0.66085 1.0000 + O O1012 1.0 0.17371 0.14554 0.66085 1.0000 + O O1013 1.0 0.21538 0.18720 0.66085 1.0000 + O O1014 1.0 0.25704 0.22887 0.66085 1.0000 + O O1015 1.0 0.29871 0.27054 0.66085 1.0000 + O O1016 1.0 0.34038 0.31220 0.66085 1.0000 + O O1017 1.0 0.38204 0.35387 0.66085 1.0000 + O O1018 1.0 0.42371 0.39554 0.66085 1.0000 + O O1019 1.0 0.46538 0.43720 0.66085 1.0000 + O O1020 1.0 0.50704 0.47887 0.66085 1.0000 + O O1021 1.0 0.09038 0.97887 0.66085 1.0000 + O O1022 1.0 0.13204 0.02054 0.66085 1.0000 + O O1023 1.0 0.17371 0.06220 0.66085 1.0000 + O O1024 1.0 0.21538 0.10387 0.66085 1.0000 + O O1025 1.0 0.25704 0.14554 0.66085 1.0000 + O O1026 1.0 0.29871 0.18720 0.66085 1.0000 + O O1027 1.0 0.34038 0.22887 0.66085 1.0000 + O O1028 1.0 0.38204 0.27054 0.66085 1.0000 + O O1029 1.0 0.42371 0.31220 0.66085 1.0000 + O O1030 1.0 0.46538 0.35387 0.66085 1.0000 + O O1031 1.0 0.50704 0.39554 0.66085 1.0000 + O O1032 1.0 0.54871 0.43720 0.66085 1.0000 + O O1033 1.0 0.13204 0.93720 0.66085 1.0000 + O O1034 1.0 0.17371 0.97887 0.66085 1.0000 + O O1035 1.0 0.21538 0.02054 0.66085 1.0000 + O O1036 1.0 0.25704 0.06220 0.66085 1.0000 + O O1037 1.0 0.29871 0.10387 0.66085 1.0000 + O O1038 1.0 0.34038 0.14554 0.66085 1.0000 + O O1039 1.0 0.38204 0.18720 0.66085 1.0000 + O O1040 1.0 0.42371 0.22887 0.66085 1.0000 + O O1041 1.0 0.46538 0.27054 0.66085 1.0000 + O O1042 1.0 0.50704 0.31220 0.66085 1.0000 + O O1043 1.0 0.54871 0.35387 0.66085 1.0000 + O O1044 1.0 0.59038 0.39554 0.66085 1.0000 + O O1045 1.0 0.17371 0.89554 0.66085 1.0000 + O O1046 1.0 0.21538 0.93720 0.66085 1.0000 + O O1047 1.0 0.25704 0.97887 0.66085 1.0000 + O O1048 1.0 0.29871 0.02054 0.66085 1.0000 + O O1049 1.0 0.34038 0.06220 0.66085 1.0000 + O O1050 1.0 0.38204 0.10387 0.66085 1.0000 + O O1051 1.0 0.42371 0.14554 0.66085 1.0000 + O O1052 1.0 0.46538 0.18720 0.66085 1.0000 + O O1053 1.0 0.50704 0.22887 0.66085 1.0000 + O O1054 1.0 0.54871 0.27054 0.66085 1.0000 + O O1055 1.0 0.59038 0.31220 0.66085 1.0000 + O O1056 1.0 0.63204 0.35387 0.66085 1.0000 + O O1057 1.0 0.21538 0.85387 0.66085 1.0000 + O O1058 1.0 0.25704 0.89554 0.66085 1.0000 + O O1059 1.0 0.29871 0.93720 0.66085 1.0000 + O O1060 1.0 0.34038 0.97887 0.66085 1.0000 + O O1061 1.0 0.38204 0.02054 0.66085 1.0000 + O O1062 1.0 0.42371 0.06220 0.66085 1.0000 + O O1063 1.0 0.46538 0.10387 0.66085 1.0000 + O O1064 1.0 0.50704 0.14554 0.66085 1.0000 + O O1065 1.0 0.54871 0.18720 0.66085 1.0000 + O O1066 1.0 0.59038 0.22887 0.66085 1.0000 + O O1067 1.0 0.63204 0.27054 0.66085 1.0000 + O O1068 1.0 0.67371 0.31220 0.66085 1.0000 + O O1069 1.0 0.25704 0.81220 0.66085 1.0000 + O O1070 1.0 0.29871 0.85387 0.66085 1.0000 + O O1071 1.0 0.34038 0.89554 0.66085 1.0000 + O O1072 1.0 0.38204 0.93720 0.66085 1.0000 + O O1073 1.0 0.42371 0.97887 0.66085 1.0000 + O O1074 1.0 0.46538 0.02054 0.66085 1.0000 + O O1075 1.0 0.50704 0.06220 0.66085 1.0000 + O O1076 1.0 0.54871 0.10387 0.66085 1.0000 + O O1077 1.0 0.59038 0.14554 0.66085 1.0000 + O O1078 1.0 0.63204 0.18720 0.66085 1.0000 + O O1079 1.0 0.67371 0.22887 0.66085 1.0000 + O O1080 1.0 0.71538 0.27054 0.66085 1.0000 + O O1081 1.0 0.29871 0.77054 0.66085 1.0000 + O O1082 1.0 0.34038 0.81220 0.66085 1.0000 + O O1083 1.0 0.38204 0.85387 0.66085 1.0000 + O O1084 1.0 0.42371 0.89554 0.66085 1.0000 + O O1085 1.0 0.46538 0.93720 0.66085 1.0000 + O O1086 1.0 0.50704 0.97887 0.66085 1.0000 + O O1087 1.0 0.54871 0.02054 0.66085 1.0000 + O O1088 1.0 0.59038 0.06220 0.66085 1.0000 + O O1089 1.0 0.63204 0.10387 0.66085 1.0000 + O O1090 1.0 0.67371 0.14554 0.66085 1.0000 + O O1091 1.0 0.71538 0.18720 0.66085 1.0000 + O O1092 1.0 0.75704 0.22887 0.66085 1.0000 + O O1093 1.0 0.34038 0.72887 0.66085 1.0000 + O O1094 1.0 0.38204 0.77054 0.66085 1.0000 + O O1095 1.0 0.42371 0.81220 0.66085 1.0000 + O O1096 1.0 0.46538 0.85387 0.66085 1.0000 + O O1097 1.0 0.50704 0.89554 0.66085 1.0000 + O O1098 1.0 0.54871 0.93720 0.66085 1.0000 + O O1099 1.0 0.59038 0.97887 0.66085 1.0000 + O O1100 1.0 0.63204 0.02054 0.66085 1.0000 + O O1101 1.0 0.67371 0.06220 0.66085 1.0000 + O O1102 1.0 0.71538 0.10387 0.66085 1.0000 + O O1103 1.0 0.75704 0.14554 0.66085 1.0000 + O O1104 1.0 0.79871 0.18720 0.66085 1.0000 + O O1105 1.0 0.38204 0.68720 0.66085 1.0000 + O O1106 1.0 0.42371 0.72887 0.66085 1.0000 + O O1107 1.0 0.46538 0.77054 0.66085 1.0000 + O O1108 1.0 0.50704 0.81220 0.66085 1.0000 + O O1109 1.0 0.54871 0.85387 0.66085 1.0000 + O O1110 1.0 0.59038 0.89554 0.66085 1.0000 + O O1111 1.0 0.63204 0.93720 0.66085 1.0000 + O O1112 1.0 0.67371 0.97887 0.66085 1.0000 + O O1113 1.0 0.71538 0.02054 0.66085 1.0000 + O O1114 1.0 0.75704 0.06220 0.66085 1.0000 + O O1115 1.0 0.79871 0.10387 0.66085 1.0000 + O O1116 1.0 0.84038 0.14554 0.66085 1.0000 + O O1117 1.0 0.42371 0.64554 0.66085 1.0000 + O O1118 1.0 0.46538 0.68720 0.66085 1.0000 + O O1119 1.0 0.50704 0.72887 0.66085 1.0000 + O O1120 1.0 0.54871 0.77054 0.66085 1.0000 + O O1121 1.0 0.59038 0.81220 0.66085 1.0000 + O O1122 1.0 0.63204 0.85387 0.66085 1.0000 + O O1123 1.0 0.67371 0.89554 0.66085 1.0000 + O O1124 1.0 0.71538 0.93720 0.66085 1.0000 + O O1125 1.0 0.75704 0.97887 0.66085 1.0000 + O O1126 1.0 0.79871 0.02054 0.66085 1.0000 + O O1127 1.0 0.84038 0.06220 0.66085 1.0000 + O O1128 1.0 0.88204 0.10387 0.66085 1.0000 + O O1129 1.0 0.46538 0.60387 0.66085 1.0000 + O O1130 1.0 0.50704 0.64554 0.66085 1.0000 + O O1131 1.0 0.54871 0.68720 0.66085 1.0000 + O O1132 1.0 0.59038 0.72887 0.66085 1.0000 + O O1133 1.0 0.63204 0.77054 0.66085 1.0000 + O O1134 1.0 0.67371 0.81220 0.66085 1.0000 + O O1135 1.0 0.71538 0.85387 0.66085 1.0000 + O O1136 1.0 0.75704 0.89554 0.66085 1.0000 + O O1137 1.0 0.79871 0.93720 0.66085 1.0000 + O O1138 1.0 0.84038 0.97887 0.66085 1.0000 + O O1139 1.0 0.88204 0.02054 0.66085 1.0000 + O O1140 1.0 0.92371 0.06220 0.66085 1.0000 + O O1141 1.0 0.50704 0.56220 0.66085 1.0000 + O O1142 1.0 0.54871 0.60387 0.66085 1.0000 + O O1143 1.0 0.59038 0.64554 0.66085 1.0000 + O O1144 1.0 0.63204 0.68720 0.66085 1.0000 + O O1145 1.0 0.67371 0.72887 0.66085 1.0000 + O O1146 1.0 0.71538 0.77054 0.66085 1.0000 + O O1147 1.0 0.75704 0.81220 0.66085 1.0000 + O O1148 1.0 0.79871 0.85387 0.66085 1.0000 + O O1149 1.0 0.84038 0.89554 0.66085 1.0000 + O O1150 1.0 0.88204 0.93720 0.66085 1.0000 + O O1151 1.0 0.92371 0.97887 0.66085 1.0000 + O O1152 1.0 0.96538 0.02054 0.66085 1.0000 + Ti Ti145 1.0 0.50000 0.50000 0.50000 1.0000 + Ti Ti146 1.0 0.54167 0.54167 0.50000 1.0000 + Ti Ti147 1.0 0.58333 0.58333 0.50000 1.0000 + Ti Ti148 1.0 0.62500 0.62500 0.50000 1.0000 + Ti Ti149 1.0 0.66667 0.66667 0.50000 1.0000 + Ti Ti150 1.0 0.70833 0.70833 0.50000 1.0000 + Ti Ti151 1.0 0.75000 0.75000 0.50000 1.0000 + Ti Ti152 1.0 0.79167 0.79167 0.50000 1.0000 + Ti Ti153 1.0 0.83333 0.83333 0.50000 1.0000 + Ti Ti154 1.0 0.87500 0.87500 0.50000 1.0000 + Ti Ti155 1.0 0.91667 0.91667 0.50000 1.0000 + Ti Ti156 1.0 0.95833 0.95833 0.50000 1.0000 + Ti Ti157 1.0 0.54167 0.45833 0.50000 1.0000 + Ti Ti158 1.0 0.58333 0.50000 0.50000 1.0000 + Ti Ti159 1.0 0.62500 0.54167 0.50000 1.0000 + Ti Ti160 1.0 0.66667 0.58333 0.50000 1.0000 + Ti Ti161 1.0 0.70833 0.62500 0.50000 1.0000 + Ti Ti162 1.0 0.75000 0.66667 0.50000 1.0000 + Ti Ti163 1.0 0.79167 0.70833 0.50000 1.0000 + Ti Ti164 1.0 0.83333 0.75000 0.50000 1.0000 + Ti Ti165 1.0 0.87500 0.79167 0.50000 1.0000 + Ti Ti166 1.0 0.91667 0.83333 0.50000 1.0000 + Ti Ti167 1.0 0.95833 0.87500 0.50000 1.0000 + Ti Ti168 1.0 0.00000 0.91667 0.50000 1.0000 + Ti Ti169 1.0 0.58333 0.41667 0.50000 1.0000 + Ti Ti170 1.0 0.62500 0.45833 0.50000 1.0000 + Ti Ti171 1.0 0.66667 0.50000 0.50000 1.0000 + Ti Ti172 1.0 0.70833 0.54167 0.50000 1.0000 + Ti Ti173 1.0 0.75000 0.58333 0.50000 1.0000 + Ti Ti174 1.0 0.79167 0.62500 0.50000 1.0000 + Ti Ti175 1.0 0.83333 0.66667 0.50000 1.0000 + Ti Ti176 1.0 0.87500 0.70833 0.50000 1.0000 + Ti Ti177 1.0 0.91667 0.75000 0.50000 1.0000 + Ti Ti178 1.0 0.95833 0.79167 0.50000 1.0000 + Ti Ti179 1.0 1.00000 0.83333 0.50000 1.0000 + Ti Ti180 1.0 0.04167 0.87500 0.50000 1.0000 + Ti Ti181 1.0 0.62500 0.37500 0.50000 1.0000 + Ti Ti182 1.0 0.66667 0.41667 0.50000 1.0000 + Ti Ti183 1.0 0.70833 0.45833 0.50000 1.0000 + Ti Ti184 1.0 0.75000 0.50000 0.50000 1.0000 + Ti Ti185 1.0 0.79167 0.54167 0.50000 1.0000 + Ti Ti186 1.0 0.83333 0.58333 0.50000 1.0000 + Ti Ti187 1.0 0.87500 0.62500 0.50000 1.0000 + Ti Ti188 1.0 0.91667 0.66667 0.50000 1.0000 + Ti Ti189 1.0 0.95833 0.70833 0.50000 1.0000 + Ti Ti190 1.0 1.00000 0.75000 0.50000 1.0000 + Ti Ti191 1.0 0.04167 0.79167 0.50000 1.0000 + Ti Ti192 1.0 0.08333 0.83333 0.50000 1.0000 + Ti Ti193 1.0 0.66667 0.33333 0.50000 1.0000 + Ti Ti194 1.0 0.70833 0.37500 0.50000 1.0000 + Ti Ti195 1.0 0.75000 0.41667 0.50000 1.0000 + Ti Ti196 1.0 0.79167 0.45833 0.50000 1.0000 + Ti Ti197 1.0 0.83333 0.50000 0.50000 1.0000 + Ti Ti198 1.0 0.87500 0.54167 0.50000 1.0000 + Ti Ti199 1.0 0.91667 0.58333 0.50000 1.0000 + Ti Ti200 1.0 0.95833 0.62500 0.50000 1.0000 + Ti Ti201 1.0 0.00000 0.66667 0.50000 1.0000 + Ti Ti202 1.0 0.04167 0.70833 0.50000 1.0000 + Ti Ti203 1.0 0.08333 0.75000 0.50000 1.0000 + Ti Ti204 1.0 0.12500 0.79167 0.50000 1.0000 + Ti Ti205 1.0 0.70833 0.29167 0.50000 1.0000 + Ti Ti206 1.0 0.75000 0.33333 0.50000 1.0000 + Ti Ti207 1.0 0.79167 0.37500 0.50000 1.0000 + Ti Ti208 1.0 0.83333 0.41667 0.50000 1.0000 + Ti Ti209 1.0 0.87500 0.45833 0.50000 1.0000 + Ti Ti210 1.0 0.91667 0.50000 0.50000 1.0000 + Ti Ti211 1.0 0.95833 0.54167 0.50000 1.0000 + Ti Ti212 1.0 0.00000 0.58333 0.50000 1.0000 + Ti Ti213 1.0 0.04167 0.62500 0.50000 1.0000 + Ti Ti214 1.0 0.08333 0.66667 0.50000 1.0000 + Ti Ti215 1.0 0.12500 0.70833 0.50000 1.0000 + Ti Ti216 1.0 0.16667 0.75000 0.50000 1.0000 + Ti Ti217 1.0 0.75000 0.25000 0.50000 1.0000 + Ti Ti218 1.0 0.79167 0.29167 0.50000 1.0000 + Ti Ti219 1.0 0.83333 0.33333 0.50000 1.0000 + Ti Ti220 1.0 0.87500 0.37500 0.50000 1.0000 + Ti Ti221 1.0 0.91667 0.41667 0.50000 1.0000 + Ti Ti222 1.0 0.95833 0.45833 0.50000 1.0000 + Ti Ti223 1.0 0.00000 0.50000 0.50000 1.0000 + Ti Ti224 1.0 0.04167 0.54167 0.50000 1.0000 + Ti Ti225 1.0 0.08333 0.58333 0.50000 1.0000 + Ti Ti226 1.0 0.12500 0.62500 0.50000 1.0000 + Ti Ti227 1.0 0.16667 0.66667 0.50000 1.0000 + Ti Ti228 1.0 0.20833 0.70833 0.50000 1.0000 + Ti Ti229 1.0 0.79167 0.20833 0.50000 1.0000 + Ti Ti230 1.0 0.83333 0.25000 0.50000 1.0000 + Ti Ti231 1.0 0.87500 0.29167 0.50000 1.0000 + Ti Ti232 1.0 0.91667 0.33333 0.50000 1.0000 + Ti Ti233 1.0 0.95833 0.37500 0.50000 1.0000 + Ti Ti234 1.0 1.00000 0.41667 0.50000 1.0000 + Ti Ti235 1.0 0.04167 0.45833 0.50000 1.0000 + Ti Ti236 1.0 0.08333 0.50000 0.50000 1.0000 + Ti Ti237 1.0 0.12500 0.54167 0.50000 1.0000 + Ti Ti238 1.0 0.16667 0.58333 0.50000 1.0000 + Ti Ti239 1.0 0.20833 0.62500 0.50000 1.0000 + Ti Ti240 1.0 0.25000 0.66667 0.50000 1.0000 + Ti Ti241 1.0 0.83333 0.16667 0.50000 1.0000 + Ti Ti242 1.0 0.87500 0.20833 0.50000 1.0000 + Ti Ti243 1.0 0.91667 0.25000 0.50000 1.0000 + Ti Ti244 1.0 0.95833 0.29167 0.50000 1.0000 + Ti Ti245 1.0 1.00000 0.33333 0.50000 1.0000 + Ti Ti246 1.0 0.04167 0.37500 0.50000 1.0000 + Ti Ti247 1.0 0.08333 0.41667 0.50000 1.0000 + Ti Ti248 1.0 0.12500 0.45833 0.50000 1.0000 + Ti Ti249 1.0 0.16667 0.50000 0.50000 1.0000 + Ti Ti250 1.0 0.20833 0.54167 0.50000 1.0000 + Ti Ti251 1.0 0.25000 0.58333 0.50000 1.0000 + Ti Ti252 1.0 0.29167 0.62500 0.50000 1.0000 + Ti Ti253 1.0 0.87500 0.12500 0.50000 1.0000 + Ti Ti254 1.0 0.91667 0.16667 0.50000 1.0000 + Ti Ti255 1.0 0.95833 0.20833 0.50000 1.0000 + Ti Ti256 1.0 1.00000 0.25000 0.50000 1.0000 + Ti Ti257 1.0 0.04167 0.29167 0.50000 1.0000 + Ti Ti258 1.0 0.08333 0.33333 0.50000 1.0000 + Ti Ti259 1.0 0.12500 0.37500 0.50000 1.0000 + Ti Ti260 1.0 0.16667 0.41667 0.50000 1.0000 + Ti Ti261 1.0 0.20833 0.45833 0.50000 1.0000 + Ti Ti262 1.0 0.25000 0.50000 0.50000 1.0000 + Ti Ti263 1.0 0.29167 0.54167 0.50000 1.0000 + Ti Ti264 1.0 0.33333 0.58333 0.50000 1.0000 + Ti Ti265 1.0 0.91667 0.08333 0.50000 1.0000 + Ti Ti266 1.0 0.95833 0.12500 0.50000 1.0000 + Ti Ti267 1.0 0.00000 0.16667 0.50000 1.0000 + Ti Ti268 1.0 0.04167 0.20833 0.50000 1.0000 + Ti Ti269 1.0 0.08333 0.25000 0.50000 1.0000 + Ti Ti270 1.0 0.12500 0.29167 0.50000 1.0000 + Ti Ti271 1.0 0.16667 0.33333 0.50000 1.0000 + Ti Ti272 1.0 0.20833 0.37500 0.50000 1.0000 + Ti Ti273 1.0 0.25000 0.41667 0.50000 1.0000 + Ti Ti274 1.0 0.29167 0.45833 0.50000 1.0000 + Ti Ti275 1.0 0.33333 0.50000 0.50000 1.0000 + Ti Ti276 1.0 0.37500 0.54167 0.50000 1.0000 + Ti Ti277 1.0 0.95833 0.04167 0.50000 1.0000 + Ti Ti278 1.0 1.00000 0.08333 0.50000 1.0000 + Ti Ti279 1.0 0.04167 0.12500 0.50000 1.0000 + Ti Ti280 1.0 0.08333 0.16667 0.50000 1.0000 + Ti Ti281 1.0 0.12500 0.20833 0.50000 1.0000 + Ti Ti282 1.0 0.16667 0.25000 0.50000 1.0000 + Ti Ti283 1.0 0.20833 0.29167 0.50000 1.0000 + Ti Ti284 1.0 0.25000 0.33333 0.50000 1.0000 + Ti Ti285 1.0 0.29167 0.37500 0.50000 1.0000 + Ti Ti286 1.0 0.33333 0.41667 0.50000 1.0000 + Ti Ti287 1.0 0.37500 0.45833 0.50000 1.0000 + Ti Ti288 1.0 0.41667 0.50000 0.50000 1.0000 + Co Co433 1.0 0.54167 0.50000 0.50000 1.0000 + Co Co434 1.0 0.58333 0.54167 0.50000 1.0000 + Co Co435 1.0 0.62500 0.58333 0.50000 1.0000 + Co Co436 1.0 0.66667 0.62500 0.50000 1.0000 + Co Co437 1.0 0.70833 0.66667 0.50000 1.0000 + Co Co438 1.0 0.75000 0.70833 0.50000 1.0000 + Co Co439 1.0 0.79167 0.75000 0.50000 1.0000 + Co Co440 1.0 0.83333 0.79167 0.50000 1.0000 + Co Co441 1.0 0.87500 0.83333 0.50000 1.0000 + Co Co442 1.0 0.91667 0.87500 0.50000 1.0000 + Co Co443 1.0 0.95833 0.91667 0.50000 1.0000 + Co Co444 1.0 1.00000 0.95833 0.50000 1.0000 + Co Co445 1.0 0.58333 0.45833 0.50000 1.0000 + Co Co446 1.0 0.62500 0.50000 0.50000 1.0000 + Co Co447 1.0 0.66667 0.54167 0.50000 1.0000 + Co Co448 1.0 0.70833 0.58333 0.50000 1.0000 + Co Co449 1.0 0.75000 0.62500 0.50000 1.0000 + Co Co450 1.0 0.79167 0.66667 0.50000 1.0000 + Co Co451 1.0 0.83333 0.70833 0.50000 1.0000 + Co Co452 1.0 0.87500 0.75000 0.50000 1.0000 + Co Co453 1.0 0.91667 0.79167 0.50000 1.0000 + Co Co454 1.0 0.95833 0.83333 0.50000 1.0000 + Co Co455 1.0 0.00000 0.87500 0.50000 1.0000 + Co Co456 1.0 0.04167 0.91667 0.50000 1.0000 + Co Co457 1.0 0.62500 0.41667 0.50000 1.0000 + Co Co458 1.0 0.66667 0.45833 0.50000 1.0000 + Co Co459 1.0 0.70833 0.50000 0.50000 1.0000 + Co Co460 1.0 0.75000 0.54167 0.50000 1.0000 + Co Co461 1.0 0.79167 0.58333 0.50000 1.0000 + Co Co462 1.0 0.83333 0.62500 0.50000 1.0000 + Co Co463 1.0 0.87500 0.66667 0.50000 1.0000 + Co Co464 1.0 0.91667 0.70833 0.50000 1.0000 + Co Co465 1.0 0.95833 0.75000 0.50000 1.0000 + Co Co466 1.0 0.00000 0.79167 0.50000 1.0000 + Co Co467 1.0 0.04167 0.83333 0.50000 1.0000 + Co Co468 1.0 0.08333 0.87500 0.50000 1.0000 + Co Co469 1.0 0.66667 0.37500 0.50000 1.0000 + Co Co470 1.0 0.70833 0.41667 0.50000 1.0000 + Co Co471 1.0 0.75000 0.45833 0.50000 1.0000 + Co Co472 1.0 0.79167 0.50000 0.50000 1.0000 + Co Co473 1.0 0.83333 0.54167 0.50000 1.0000 + Co Co474 1.0 0.87500 0.58333 0.50000 1.0000 + Co Co475 1.0 0.91667 0.62500 0.50000 1.0000 + Co Co476 1.0 0.95833 0.66667 0.50000 1.0000 + Co Co477 1.0 0.00000 0.70833 0.50000 1.0000 + Co Co478 1.0 0.04167 0.75000 0.50000 1.0000 + Co Co479 1.0 0.08333 0.79167 0.50000 1.0000 + Co Co480 1.0 0.12500 0.83333 0.50000 1.0000 + Co Co481 1.0 0.70833 0.33333 0.50000 1.0000 + Co Co482 1.0 0.75000 0.37500 0.50000 1.0000 + Co Co483 1.0 0.79167 0.41667 0.50000 1.0000 + Co Co484 1.0 0.83333 0.45833 0.50000 1.0000 + Co Co485 1.0 0.87500 0.50000 0.50000 1.0000 + Co Co486 1.0 0.91667 0.54167 0.50000 1.0000 + Co Co487 1.0 0.95833 0.58333 0.50000 1.0000 + Co Co488 1.0 0.00000 0.62500 0.50000 1.0000 + Co Co489 1.0 0.04167 0.66667 0.50000 1.0000 + Co Co490 1.0 0.08333 0.70833 0.50000 1.0000 + Co Co491 1.0 0.12500 0.75000 0.50000 1.0000 + Co Co492 1.0 0.16667 0.79167 0.50000 1.0000 + Co Co493 1.0 0.75000 0.29167 0.50000 1.0000 + Co Co494 1.0 0.79167 0.33333 0.50000 1.0000 + Co Co495 1.0 0.83333 0.37500 0.50000 1.0000 + Co Co496 1.0 0.87500 0.41667 0.50000 1.0000 + Co Co497 1.0 0.91667 0.45833 0.50000 1.0000 + Co Co498 1.0 0.95833 0.50000 0.50000 1.0000 + Co Co499 1.0 0.00000 0.54167 0.50000 1.0000 + Co Co500 1.0 0.04167 0.58333 0.50000 1.0000 + Co Co501 1.0 0.08333 0.62500 0.50000 1.0000 + Co Co502 1.0 0.12500 0.66667 0.50000 1.0000 + Co Co503 1.0 0.16667 0.70833 0.50000 1.0000 + Co Co504 1.0 0.20833 0.75000 0.50000 1.0000 + Co Co505 1.0 0.79167 0.25000 0.50000 1.0000 + Co Co506 1.0 0.83333 0.29167 0.50000 1.0000 + Co Co507 1.0 0.87500 0.33333 0.50000 1.0000 + Co Co508 1.0 0.91667 0.37500 0.50000 1.0000 + Co Co509 1.0 0.95833 0.41667 0.50000 1.0000 + Co Co510 1.0 1.00000 0.45833 0.50000 1.0000 + Co Co511 1.0 0.04167 0.50000 0.50000 1.0000 + Co Co512 1.0 0.08333 0.54167 0.50000 1.0000 + Co Co513 1.0 0.12500 0.58333 0.50000 1.0000 + Co Co514 1.0 0.16667 0.62500 0.50000 1.0000 + Co Co515 1.0 0.20833 0.66667 0.50000 1.0000 + Co Co516 1.0 0.25000 0.70833 0.50000 1.0000 + Co Co517 1.0 0.83333 0.20833 0.50000 1.0000 + Co Co518 1.0 0.87500 0.25000 0.50000 1.0000 + Co Co519 1.0 0.91667 0.29167 0.50000 1.0000 + Co Co520 1.0 0.95833 0.33333 0.50000 1.0000 + Co Co521 1.0 0.00000 0.37500 0.50000 1.0000 + Co Co522 1.0 0.04167 0.41667 0.50000 1.0000 + Co Co523 1.0 0.08333 0.45833 0.50000 1.0000 + Co Co524 1.0 0.12500 0.50000 0.50000 1.0000 + Co Co525 1.0 0.16667 0.54167 0.50000 1.0000 + Co Co526 1.0 0.20833 0.58333 0.50000 1.0000 + Co Co527 1.0 0.25000 0.62500 0.50000 1.0000 + Co Co528 1.0 0.29167 0.66667 0.50000 1.0000 + Co Co529 1.0 0.87500 0.16667 0.50000 1.0000 + Co Co530 1.0 0.91667 0.20833 0.50000 1.0000 + Co Co531 1.0 0.95833 0.25000 0.50000 1.0000 + Co Co532 1.0 0.00000 0.29167 0.50000 1.0000 + Co Co533 1.0 0.04167 0.33333 0.50000 1.0000 + Co Co534 1.0 0.08333 0.37500 0.50000 1.0000 + Co Co535 1.0 0.12500 0.41667 0.50000 1.0000 + Co Co536 1.0 0.16667 0.45833 0.50000 1.0000 + Co Co537 1.0 0.20833 0.50000 0.50000 1.0000 + Co Co538 1.0 0.25000 0.54167 0.50000 1.0000 + Co Co539 1.0 0.29167 0.58333 0.50000 1.0000 + Co Co540 1.0 0.33333 0.62500 0.50000 1.0000 + Co Co541 1.0 0.91667 0.12500 0.50000 1.0000 + Co Co542 1.0 0.95833 0.16667 0.50000 1.0000 + Co Co543 1.0 0.00000 0.20833 0.50000 1.0000 + Co Co544 1.0 0.04167 0.25000 0.50000 1.0000 + Co Co545 1.0 0.08333 0.29167 0.50000 1.0000 + Co Co546 1.0 0.12500 0.33333 0.50000 1.0000 + Co Co547 1.0 0.16667 0.37500 0.50000 1.0000 + Co Co548 1.0 0.20833 0.41667 0.50000 1.0000 + Co Co549 1.0 0.25000 0.45833 0.50000 1.0000 + Co Co550 1.0 0.29167 0.50000 0.50000 1.0000 + Co Co551 1.0 0.33333 0.54167 0.50000 1.0000 + Co Co552 1.0 0.37500 0.58333 0.50000 1.0000 + Co Co553 1.0 0.95833 0.08333 0.50000 1.0000 + Co Co554 1.0 1.00000 0.12500 0.50000 1.0000 + Co Co555 1.0 0.04167 0.16667 0.50000 1.0000 + Co Co556 1.0 0.08333 0.20833 0.50000 1.0000 + Co Co557 1.0 0.12500 0.25000 0.50000 1.0000 + Co Co558 1.0 0.16667 0.29167 0.50000 1.0000 + Co Co559 1.0 0.20833 0.33333 0.50000 1.0000 + Co Co560 1.0 0.25000 0.37500 0.50000 1.0000 + Co Co561 1.0 0.29167 0.41667 0.50000 1.0000 + Co Co562 1.0 0.33333 0.45833 0.50000 1.0000 + Co Co563 1.0 0.37500 0.50000 0.50000 1.0000 + Co Co564 1.0 0.41667 0.54167 0.50000 1.0000 + Co Co565 1.0 0.00000 0.04167 0.50000 1.0000 + Co Co566 1.0 0.04167 0.08333 0.50000 1.0000 + Co Co567 1.0 0.08333 0.12500 0.50000 1.0000 + Co Co568 1.0 0.12500 0.16667 0.50000 1.0000 + Co Co569 1.0 0.16667 0.20833 0.50000 1.0000 + Co Co570 1.0 0.20833 0.25000 0.50000 1.0000 + Co Co571 1.0 0.25000 0.29167 0.50000 1.0000 + Co Co572 1.0 0.29167 0.33333 0.50000 1.0000 + Co Co573 1.0 0.33333 0.37500 0.50000 1.0000 + Co Co574 1.0 0.37500 0.41667 0.50000 1.0000 + Co Co575 1.0 0.41667 0.45833 0.50000 1.0000 + Co Co576 1.0 0.45833 0.50000 0.50000 1.0000 + Co Co577 1.0 0.52083 0.47917 0.50000 1.0000 + Co Co578 1.0 0.56250 0.52083 0.50000 1.0000 + Co Co579 1.0 0.60417 0.56250 0.50000 1.0000 + Co Co580 1.0 0.64583 0.60417 0.50000 1.0000 + Co Co581 1.0 0.68750 0.64583 0.50000 1.0000 + Co Co582 1.0 0.72917 0.68750 0.50000 1.0000 + Co Co583 1.0 0.77083 0.72917 0.50000 1.0000 + Co Co584 1.0 0.81250 0.77083 0.50000 1.0000 + Co Co585 1.0 0.85417 0.81250 0.50000 1.0000 + Co Co586 1.0 0.89583 0.85417 0.50000 1.0000 + Co Co587 1.0 0.93750 0.89583 0.50000 1.0000 + Co Co588 1.0 0.97917 0.93750 0.50000 1.0000 + Co Co589 1.0 0.56250 0.43750 0.50000 1.0000 + Co Co590 1.0 0.60417 0.47917 0.50000 1.0000 + Co Co591 1.0 0.64583 0.52083 0.50000 1.0000 + Co Co592 1.0 0.68750 0.56250 0.50000 1.0000 + Co Co593 1.0 0.72917 0.60417 0.50000 1.0000 + Co Co594 1.0 0.77083 0.64583 0.50000 1.0000 + Co Co595 1.0 0.81250 0.68750 0.50000 1.0000 + Co Co596 1.0 0.85417 0.72917 0.50000 1.0000 + Co Co597 1.0 0.89583 0.77083 0.50000 1.0000 + Co Co598 1.0 0.93750 0.81250 0.50000 1.0000 + Co Co599 1.0 0.97917 0.85417 0.50000 1.0000 + Co Co600 1.0 0.02083 0.89583 0.50000 1.0000 + Co Co601 1.0 0.60417 0.39583 0.50000 1.0000 + Co Co602 1.0 0.64583 0.43750 0.50000 1.0000 + Co Co603 1.0 0.68750 0.47917 0.50000 1.0000 + Co Co604 1.0 0.72917 0.52083 0.50000 1.0000 + Co Co605 1.0 0.77083 0.56250 0.50000 1.0000 + Co Co606 1.0 0.81250 0.60417 0.50000 1.0000 + Co Co607 1.0 0.85417 0.64583 0.50000 1.0000 + Co Co608 1.0 0.89583 0.68750 0.50000 1.0000 + Co Co609 1.0 0.93750 0.72917 0.50000 1.0000 + Co Co610 1.0 0.97917 0.77083 0.50000 1.0000 + Co Co611 1.0 0.02083 0.81250 0.50000 1.0000 + Co Co612 1.0 0.06250 0.85417 0.50000 1.0000 + Co Co613 1.0 0.64583 0.35417 0.50000 1.0000 + Co Co614 1.0 0.68750 0.39583 0.50000 1.0000 + Co Co615 1.0 0.72917 0.43750 0.50000 1.0000 + Co Co616 1.0 0.77083 0.47917 0.50000 1.0000 + Co Co617 1.0 0.81250 0.52083 0.50000 1.0000 + Co Co618 1.0 0.85417 0.56250 0.50000 1.0000 + Co Co619 1.0 0.89583 0.60417 0.50000 1.0000 + Co Co620 1.0 0.93750 0.64583 0.50000 1.0000 + Co Co621 1.0 0.97917 0.68750 0.50000 1.0000 + Co Co622 1.0 0.02083 0.72917 0.50000 1.0000 + Co Co623 1.0 0.06250 0.77083 0.50000 1.0000 + Co Co624 1.0 0.10417 0.81250 0.50000 1.0000 + Co Co625 1.0 0.68750 0.31250 0.50000 1.0000 + Co Co626 1.0 0.72917 0.35417 0.50000 1.0000 + Co Co627 1.0 0.77083 0.39583 0.50000 1.0000 + Co Co628 1.0 0.81250 0.43750 0.50000 1.0000 + Co Co629 1.0 0.85417 0.47917 0.50000 1.0000 + Co Co630 1.0 0.89583 0.52083 0.50000 1.0000 + Co Co631 1.0 0.93750 0.56250 0.50000 1.0000 + Co Co632 1.0 0.97917 0.60417 0.50000 1.0000 + Co Co633 1.0 0.02083 0.64583 0.50000 1.0000 + Co Co634 1.0 0.06250 0.68750 0.50000 1.0000 + Co Co635 1.0 0.10417 0.72917 0.50000 1.0000 + Co Co636 1.0 0.14583 0.77083 0.50000 1.0000 + Co Co637 1.0 0.72917 0.27083 0.50000 1.0000 + Co Co638 1.0 0.77083 0.31250 0.50000 1.0000 + Co Co639 1.0 0.81250 0.35417 0.50000 1.0000 + Co Co640 1.0 0.85417 0.39583 0.50000 1.0000 + Co Co641 1.0 0.89583 0.43750 0.50000 1.0000 + Co Co642 1.0 0.93750 0.47917 0.50000 1.0000 + Co Co643 1.0 0.97917 0.52083 0.50000 1.0000 + Co Co644 1.0 0.02083 0.56250 0.50000 1.0000 + Co Co645 1.0 0.06250 0.60417 0.50000 1.0000 + Co Co646 1.0 0.10417 0.64583 0.50000 1.0000 + Co Co647 1.0 0.14583 0.68750 0.50000 1.0000 + Co Co648 1.0 0.18750 0.72917 0.50000 1.0000 + Co Co649 1.0 0.77083 0.22917 0.50000 1.0000 + Co Co650 1.0 0.81250 0.27083 0.50000 1.0000 + Co Co651 1.0 0.85417 0.31250 0.50000 1.0000 + Co Co652 1.0 0.89583 0.35417 0.50000 1.0000 + Co Co653 1.0 0.93750 0.39583 0.50000 1.0000 + Co Co654 1.0 0.97917 0.43750 0.50000 1.0000 + Co Co655 1.0 0.02083 0.47917 0.50000 1.0000 + Co Co656 1.0 0.06250 0.52083 0.50000 1.0000 + Co Co657 1.0 0.10417 0.56250 0.50000 1.0000 + Co Co658 1.0 0.14583 0.60417 0.50000 1.0000 + Co Co659 1.0 0.18750 0.64583 0.50000 1.0000 + Co Co660 1.0 0.22917 0.68750 0.50000 1.0000 + Co Co661 1.0 0.81250 0.18750 0.50000 1.0000 + Co Co662 1.0 0.85417 0.22917 0.50000 1.0000 + Co Co663 1.0 0.89583 0.27083 0.50000 1.0000 + Co Co664 1.0 0.93750 0.31250 0.50000 1.0000 + Co Co665 1.0 0.97917 0.35417 0.50000 1.0000 + Co Co666 1.0 0.02083 0.39583 0.50000 1.0000 + Co Co667 1.0 0.06250 0.43750 0.50000 1.0000 + Co Co668 1.0 0.10417 0.47917 0.50000 1.0000 + Co Co669 1.0 0.14583 0.52083 0.50000 1.0000 + Co Co670 1.0 0.18750 0.56250 0.50000 1.0000 + Co Co671 1.0 0.22917 0.60417 0.50000 1.0000 + Co Co672 1.0 0.27083 0.64583 0.50000 1.0000 + Co Co673 1.0 0.85417 0.14583 0.50000 1.0000 + Co Co674 1.0 0.89583 0.18750 0.50000 1.0000 + Co Co675 1.0 0.93750 0.22917 0.50000 1.0000 + Co Co676 1.0 0.97917 0.27083 0.50000 1.0000 + Co Co677 1.0 0.02083 0.31250 0.50000 1.0000 + Co Co678 1.0 0.06250 0.35417 0.50000 1.0000 + Co Co679 1.0 0.10417 0.39583 0.50000 1.0000 + Co Co680 1.0 0.14583 0.43750 0.50000 1.0000 + Co Co681 1.0 0.18750 0.47917 0.50000 1.0000 + Co Co682 1.0 0.22917 0.52083 0.50000 1.0000 + Co Co683 1.0 0.27083 0.56250 0.50000 1.0000 + Co Co684 1.0 0.31250 0.60417 0.50000 1.0000 + Co Co685 1.0 0.89583 0.10417 0.50000 1.0000 + Co Co686 1.0 0.93750 0.14583 0.50000 1.0000 + Co Co687 1.0 0.97917 0.18750 0.50000 1.0000 + Co Co688 1.0 0.02083 0.22917 0.50000 1.0000 + Co Co689 1.0 0.06250 0.27083 0.50000 1.0000 + Co Co690 1.0 0.10417 0.31250 0.50000 1.0000 + Co Co691 1.0 0.14583 0.35417 0.50000 1.0000 + Co Co692 1.0 0.18750 0.39583 0.50000 1.0000 + Co Co693 1.0 0.22917 0.43750 0.50000 1.0000 + Co Co694 1.0 0.27083 0.47917 0.50000 1.0000 + Co Co695 1.0 0.31250 0.52083 0.50000 1.0000 + Co Co696 1.0 0.35417 0.56250 0.50000 1.0000 + Co Co697 1.0 0.93750 0.06250 0.50000 1.0000 + Co Co698 1.0 0.97917 0.10417 0.50000 1.0000 + Co Co699 1.0 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O2182 1.0 0.96538 0.85387 0.66085 1.0000 + O O2183 1.0 0.00704 0.89554 0.66085 1.0000 + O O2184 1.0 0.04871 0.93720 0.66085 1.0000 + O O2185 1.0 0.63204 0.43720 0.66085 1.0000 + O O2186 1.0 0.67371 0.47887 0.66085 1.0000 + O O2187 1.0 0.71538 0.52054 0.66085 1.0000 + O O2188 1.0 0.75704 0.56220 0.66085 1.0000 + O O2189 1.0 0.79871 0.60387 0.66085 1.0000 + O O2190 1.0 0.84038 0.64554 0.66085 1.0000 + O O2191 1.0 0.88204 0.68720 0.66085 1.0000 + O O2192 1.0 0.92371 0.72887 0.66085 1.0000 + O O2193 1.0 0.96538 0.77054 0.66085 1.0000 + O O2194 1.0 0.00704 0.81220 0.66085 1.0000 + O O2195 1.0 0.04871 0.85387 0.66085 1.0000 + O O2196 1.0 0.09038 0.89554 0.66085 1.0000 + O O2197 1.0 0.67371 0.39554 0.66085 1.0000 + O O2198 1.0 0.71538 0.43720 0.66085 1.0000 + O O2199 1.0 0.75704 0.47887 0.66085 1.0000 + O O2200 1.0 0.79871 0.52054 0.66085 1.0000 + O O2201 1.0 0.84038 0.56220 0.66085 1.0000 + O O2202 1.0 0.88204 0.60387 0.66085 1.0000 + O O2203 1.0 0.92371 0.64554 0.66085 1.0000 + O O2204 1.0 0.96538 0.68720 0.66085 1.0000 + O O2205 1.0 0.00704 0.72887 0.66085 1.0000 + O O2206 1.0 0.04871 0.77054 0.66085 1.0000 + O O2207 1.0 0.09038 0.81220 0.66085 1.0000 + O O2208 1.0 0.13204 0.85387 0.66085 1.0000 + O O2209 1.0 0.71538 0.35387 0.66085 1.0000 + O O2210 1.0 0.75704 0.39554 0.66085 1.0000 + O O2211 1.0 0.79871 0.43720 0.66085 1.0000 + O O2212 1.0 0.84038 0.47887 0.66085 1.0000 + O O2213 1.0 0.88204 0.52054 0.66085 1.0000 + O O2214 1.0 0.92371 0.56220 0.66085 1.0000 + O O2215 1.0 0.96538 0.60387 0.66085 1.0000 + O O2216 1.0 0.00704 0.64554 0.66085 1.0000 + O O2217 1.0 0.04871 0.68720 0.66085 1.0000 + O O2218 1.0 0.09038 0.72887 0.66085 1.0000 + O O2219 1.0 0.13204 0.77054 0.66085 1.0000 + O O2220 1.0 0.17371 0.81220 0.66085 1.0000 + O O2221 1.0 0.75704 0.31220 0.66085 1.0000 + O O2222 1.0 0.79871 0.35387 0.66085 1.0000 + O O2223 1.0 0.84038 0.39554 0.66085 1.0000 + O O2224 1.0 0.88204 0.43720 0.66085 1.0000 + O O2225 1.0 0.92371 0.47887 0.66085 1.0000 + O O2226 1.0 0.96538 0.52054 0.66085 1.0000 + O O2227 1.0 0.00704 0.56220 0.66085 1.0000 + O O2228 1.0 0.04871 0.60387 0.66085 1.0000 + O O2229 1.0 0.09038 0.64554 0.66085 1.0000 + O O2230 1.0 0.13204 0.68720 0.66085 1.0000 + O O2231 1.0 0.17371 0.72887 0.66085 1.0000 + O O2232 1.0 0.21538 0.77054 0.66085 1.0000 + O O2233 1.0 0.79871 0.27054 0.66085 1.0000 + O O2234 1.0 0.84038 0.31220 0.66085 1.0000 + O O2235 1.0 0.88204 0.35387 0.66085 1.0000 + O O2236 1.0 0.92371 0.39554 0.66085 1.0000 + O O2237 1.0 0.96538 0.43720 0.66085 1.0000 + O O2238 1.0 0.00704 0.47887 0.66085 1.0000 + O O2239 1.0 0.04871 0.52054 0.66085 1.0000 + O O2240 1.0 0.09038 0.56220 0.66085 1.0000 + O O2241 1.0 0.13204 0.60387 0.66085 1.0000 + O O2242 1.0 0.17371 0.64554 0.66085 1.0000 + O O2243 1.0 0.21538 0.68720 0.66085 1.0000 + O O2244 1.0 0.25704 0.72887 0.66085 1.0000 + O O2245 1.0 0.84038 0.22887 0.66085 1.0000 + O O2246 1.0 0.88204 0.27054 0.66085 1.0000 + O O2247 1.0 0.92371 0.31220 0.66085 1.0000 + O O2248 1.0 0.96538 0.35387 0.66085 1.0000 + O O2249 1.0 0.00704 0.39554 0.66085 1.0000 + O O2250 1.0 0.04871 0.43720 0.66085 1.0000 + O O2251 1.0 0.09038 0.47887 0.66085 1.0000 + O O2252 1.0 0.13204 0.52054 0.66085 1.0000 + O O2253 1.0 0.17371 0.56220 0.66085 1.0000 + O O2254 1.0 0.21538 0.60387 0.66085 1.0000 + O O2255 1.0 0.25704 0.64554 0.66085 1.0000 + O O2256 1.0 0.29871 0.68720 0.66085 1.0000 + O O2257 1.0 0.88204 0.18720 0.66085 1.0000 + O O2258 1.0 0.92371 0.22887 0.66085 1.0000 + O O2259 1.0 0.96538 0.27054 0.66085 1.0000 + O O2260 1.0 0.00704 0.31220 0.66085 1.0000 + O O2261 1.0 0.04871 0.35387 0.66085 1.0000 + O O2262 1.0 0.09038 0.39554 0.66085 1.0000 + O O2263 1.0 0.13204 0.43720 0.66085 1.0000 + O O2264 1.0 0.17371 0.47887 0.66085 1.0000 + O O2265 1.0 0.21538 0.52054 0.66085 1.0000 + O O2266 1.0 0.25704 0.56220 0.66085 1.0000 + O O2267 1.0 0.29871 0.60387 0.66085 1.0000 + O O2268 1.0 0.34038 0.64554 0.66085 1.0000 + O O2269 1.0 0.92371 0.14554 0.66085 1.0000 + O O2270 1.0 0.96538 0.18720 0.66085 1.0000 + O O2271 1.0 0.00704 0.22887 0.66085 1.0000 + O O2272 1.0 0.04871 0.27054 0.66085 1.0000 + O O2273 1.0 0.09038 0.31220 0.66085 1.0000 + O O2274 1.0 0.13204 0.35387 0.66085 1.0000 + O O2275 1.0 0.17371 0.39554 0.66085 1.0000 + O O2276 1.0 0.21538 0.43720 0.66085 1.0000 + O O2277 1.0 0.25704 0.47887 0.66085 1.0000 + O O2278 1.0 0.29871 0.52054 0.66085 1.0000 + O O2279 1.0 0.34038 0.56220 0.66085 1.0000 + O O2280 1.0 0.38204 0.60387 0.66085 1.0000 + O O2281 1.0 0.96538 0.10387 0.66085 1.0000 + O O2282 1.0 0.00704 0.14554 0.66085 1.0000 + O O2283 1.0 0.04871 0.18720 0.66085 1.0000 + O O2284 1.0 0.09038 0.22887 0.66085 1.0000 + O O2285 1.0 0.13204 0.27054 0.66085 1.0000 + O O2286 1.0 0.17371 0.31220 0.66085 1.0000 + O O2287 1.0 0.21538 0.35387 0.66085 1.0000 + O O2288 1.0 0.25704 0.39554 0.66085 1.0000 + O O2289 1.0 0.29871 0.43720 0.66085 1.0000 + O O2290 1.0 0.34038 0.47887 0.66085 1.0000 + O O2291 1.0 0.38204 0.52054 0.66085 1.0000 + O O2292 1.0 0.42371 0.56220 0.66085 1.0000 + O O2293 1.0 0.00704 0.06220 0.66085 1.0000 + O O2294 1.0 0.04871 0.10387 0.66085 1.0000 + O O2295 1.0 0.09038 0.14554 0.66085 1.0000 + O O2296 1.0 0.13204 0.18720 0.66085 1.0000 + O O2297 1.0 0.17371 0.22887 0.66085 1.0000 + O O2298 1.0 0.21538 0.27054 0.66085 1.0000 + O O2299 1.0 0.25704 0.31220 0.66085 1.0000 + O O2300 1.0 0.29871 0.35387 0.66085 1.0000 + O O2301 1.0 0.34038 0.39554 0.66085 1.0000 + O O2302 1.0 0.38204 0.43720 0.66085 1.0000 + O O2303 1.0 0.42371 0.47887 0.66085 1.0000 + O O2304 1.0 0.46538 0.52054 0.66085 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-3954_supercell_12x12x1.cif b/tier3/cif_file/orthogonal_2dm-3954_supercell_12x12x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..16538dc1ce2fe5d9d5479116f278a3cde2d9d197 --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-3954_supercell_12x12x1.cif @@ -0,0 +1,3481 @@ +data_image0 +_chemical_formula_structural Mn432Sb144O1152Mn432Sb144O1152 +_chemical_formula_sum "Mn864 Sb288 O2304" +_cell_length_a 124.698 +_cell_length_b 73.3629 +_cell_length_c 5.99518 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Mn Mn1 1.0 0.03474 0.03125 0.50002 1.0000 + Mn Mn2 1.0 0.07641 0.07292 0.50002 1.0000 + Mn Mn3 1.0 0.11808 0.11458 0.50002 1.0000 + Mn Mn4 1.0 0.15974 0.15625 0.50002 1.0000 + Mn Mn5 1.0 0.20141 0.19792 0.50002 1.0000 + Mn Mn6 1.0 0.24308 0.23958 0.50002 1.0000 + Mn Mn7 1.0 0.28474 0.28125 0.50002 1.0000 + Mn Mn8 1.0 0.32641 0.32292 0.50002 1.0000 + Mn Mn9 1.0 0.36808 0.36458 0.50002 1.0000 + Mn Mn10 1.0 0.40974 0.40625 0.50002 1.0000 + Mn Mn11 1.0 0.45141 0.44792 0.50002 1.0000 + Mn Mn12 1.0 0.49308 0.48958 0.50002 1.0000 + Mn Mn13 1.0 0.07641 0.98958 0.50002 1.0000 + Mn Mn14 1.0 0.11808 0.03125 0.50002 1.0000 + Mn Mn15 1.0 0.15974 0.07292 0.50002 1.0000 + Mn Mn16 1.0 0.20141 0.11458 0.50002 1.0000 + Mn Mn17 1.0 0.24308 0.15625 0.50002 1.0000 + Mn Mn18 1.0 0.28474 0.19792 0.50002 1.0000 + Mn Mn19 1.0 0.32641 0.23958 0.50002 1.0000 + Mn Mn20 1.0 0.36808 0.28125 0.50002 1.0000 + Mn Mn21 1.0 0.40974 0.32292 0.50002 1.0000 + Mn Mn22 1.0 0.45141 0.36458 0.50002 1.0000 + Mn Mn23 1.0 0.49308 0.40625 0.50002 1.0000 + Mn Mn24 1.0 0.53474 0.44792 0.50002 1.0000 + Mn Mn25 1.0 0.11808 0.94792 0.50002 1.0000 + Mn Mn26 1.0 0.15974 0.98958 0.50002 1.0000 + Mn Mn27 1.0 0.20141 0.03125 0.50002 1.0000 + Mn Mn28 1.0 0.24308 0.07292 0.50002 1.0000 + Mn Mn29 1.0 0.28474 0.11458 0.50002 1.0000 + Mn Mn30 1.0 0.32641 0.15625 0.50002 1.0000 + Mn Mn31 1.0 0.36808 0.19792 0.50002 1.0000 + Mn Mn32 1.0 0.40974 0.23958 0.50002 1.0000 + Mn Mn33 1.0 0.45141 0.28125 0.50002 1.0000 + Mn Mn34 1.0 0.49308 0.32292 0.50002 1.0000 + Mn Mn35 1.0 0.53474 0.36458 0.50002 1.0000 + Mn Mn36 1.0 0.57641 0.40625 0.50002 1.0000 + Mn Mn37 1.0 0.15974 0.90625 0.50002 1.0000 + Mn Mn38 1.0 0.20141 0.94792 0.50002 1.0000 + Mn Mn39 1.0 0.24308 0.98958 0.50002 1.0000 + Mn Mn40 1.0 0.28474 0.03125 0.50002 1.0000 + Mn Mn41 1.0 0.32641 0.07292 0.50002 1.0000 + Mn Mn42 1.0 0.36808 0.11458 0.50002 1.0000 + Mn Mn43 1.0 0.40974 0.15625 0.50002 1.0000 + Mn Mn44 1.0 0.45141 0.19792 0.50002 1.0000 + Mn Mn45 1.0 0.49308 0.23958 0.50002 1.0000 + Mn Mn46 1.0 0.53474 0.28125 0.50002 1.0000 + Mn Mn47 1.0 0.57641 0.32292 0.50002 1.0000 + Mn Mn48 1.0 0.61808 0.36458 0.50002 1.0000 + Mn Mn49 1.0 0.20141 0.86458 0.50002 1.0000 + Mn Mn50 1.0 0.24308 0.90625 0.50002 1.0000 + Mn Mn51 1.0 0.28474 0.94792 0.50002 1.0000 + Mn Mn52 1.0 0.32641 0.98958 0.50002 1.0000 + Mn Mn53 1.0 0.36808 0.03125 0.50002 1.0000 + Mn Mn54 1.0 0.40974 0.07292 0.50002 1.0000 + Mn Mn55 1.0 0.45141 0.11458 0.50002 1.0000 + Mn Mn56 1.0 0.49308 0.15625 0.50002 1.0000 + Mn Mn57 1.0 0.53474 0.19792 0.50002 1.0000 + Mn Mn58 1.0 0.57641 0.23958 0.50002 1.0000 + Mn Mn59 1.0 0.61808 0.28125 0.50002 1.0000 + Mn Mn60 1.0 0.65974 0.32292 0.50002 1.0000 + Mn Mn61 1.0 0.24308 0.82292 0.50002 1.0000 + Mn Mn62 1.0 0.28474 0.86458 0.50002 1.0000 + Mn Mn63 1.0 0.32641 0.90625 0.50002 1.0000 + Mn Mn64 1.0 0.36808 0.94792 0.50002 1.0000 + Mn Mn65 1.0 0.40974 0.98958 0.50002 1.0000 + Mn Mn66 1.0 0.45141 0.03125 0.50002 1.0000 + Mn Mn67 1.0 0.49308 0.07292 0.50002 1.0000 + Mn Mn68 1.0 0.53474 0.11458 0.50002 1.0000 + Mn Mn69 1.0 0.57641 0.15625 0.50002 1.0000 + Mn Mn70 1.0 0.61808 0.19792 0.50002 1.0000 + Mn Mn71 1.0 0.65974 0.23958 0.50002 1.0000 + Mn Mn72 1.0 0.70141 0.28125 0.50002 1.0000 + Mn Mn73 1.0 0.28474 0.78125 0.50002 1.0000 + Mn Mn74 1.0 0.32641 0.82292 0.50002 1.0000 + Mn Mn75 1.0 0.36808 0.86458 0.50002 1.0000 + Mn Mn76 1.0 0.40974 0.90625 0.50002 1.0000 + Mn Mn77 1.0 0.45141 0.94792 0.50002 1.0000 + Mn Mn78 1.0 0.49308 0.98958 0.50002 1.0000 + Mn Mn79 1.0 0.53474 0.03125 0.50002 1.0000 + Mn Mn80 1.0 0.57641 0.07292 0.50002 1.0000 + Mn Mn81 1.0 0.61808 0.11458 0.50002 1.0000 + Mn Mn82 1.0 0.65974 0.15625 0.50002 1.0000 + Mn Mn83 1.0 0.70141 0.19792 0.50002 1.0000 + Mn Mn84 1.0 0.74308 0.23958 0.50002 1.0000 + Mn Mn85 1.0 0.32641 0.73958 0.50002 1.0000 + Mn Mn86 1.0 0.36808 0.78125 0.50002 1.0000 + Mn Mn87 1.0 0.40974 0.82292 0.50002 1.0000 + Mn Mn88 1.0 0.45141 0.86458 0.50002 1.0000 + Mn Mn89 1.0 0.49308 0.90625 0.50002 1.0000 + Mn Mn90 1.0 0.53474 0.94792 0.50002 1.0000 + Mn Mn91 1.0 0.57641 0.98958 0.50002 1.0000 + Mn Mn92 1.0 0.61808 0.03125 0.50002 1.0000 + Mn Mn93 1.0 0.65974 0.07292 0.50002 1.0000 + Mn Mn94 1.0 0.70141 0.11458 0.50002 1.0000 + Mn Mn95 1.0 0.74308 0.15625 0.50002 1.0000 + Mn Mn96 1.0 0.78474 0.19792 0.50002 1.0000 + Mn Mn97 1.0 0.36808 0.69792 0.50002 1.0000 + Mn Mn98 1.0 0.40974 0.73958 0.50002 1.0000 + Mn Mn99 1.0 0.45141 0.78125 0.50002 1.0000 + Mn Mn100 1.0 0.49308 0.82292 0.50002 1.0000 + Mn Mn101 1.0 0.53474 0.86458 0.50002 1.0000 + Mn Mn102 1.0 0.57641 0.90625 0.50002 1.0000 + Mn Mn103 1.0 0.61808 0.94792 0.50002 1.0000 + Mn Mn104 1.0 0.65974 0.98958 0.50002 1.0000 + Mn Mn105 1.0 0.70141 0.03125 0.50002 1.0000 + Mn Mn106 1.0 0.74308 0.07292 0.50002 1.0000 + Mn Mn107 1.0 0.78474 0.11458 0.50002 1.0000 + Mn Mn108 1.0 0.82641 0.15625 0.50002 1.0000 + Mn Mn109 1.0 0.40974 0.65625 0.50002 1.0000 + Mn Mn110 1.0 0.45141 0.69792 0.50002 1.0000 + Mn Mn111 1.0 0.49308 0.73958 0.50002 1.0000 + Mn Mn112 1.0 0.53474 0.78125 0.50002 1.0000 + Mn Mn113 1.0 0.57641 0.82292 0.50002 1.0000 + Mn Mn114 1.0 0.61808 0.86458 0.50002 1.0000 + Mn Mn115 1.0 0.65974 0.90625 0.50002 1.0000 + Mn Mn116 1.0 0.70141 0.94792 0.50002 1.0000 + Mn Mn117 1.0 0.74308 0.98958 0.50002 1.0000 + Mn Mn118 1.0 0.78474 0.03125 0.50002 1.0000 + Mn Mn119 1.0 0.82641 0.07292 0.50002 1.0000 + Mn Mn120 1.0 0.86808 0.11458 0.50002 1.0000 + Mn Mn121 1.0 0.45141 0.61458 0.50002 1.0000 + Mn Mn122 1.0 0.49308 0.65625 0.50002 1.0000 + Mn Mn123 1.0 0.53474 0.69792 0.50002 1.0000 + Mn Mn124 1.0 0.57641 0.73958 0.50002 1.0000 + Mn Mn125 1.0 0.61808 0.78125 0.50002 1.0000 + Mn Mn126 1.0 0.65974 0.82292 0.50002 1.0000 + Mn Mn127 1.0 0.70141 0.86458 0.50002 1.0000 + Mn Mn128 1.0 0.74308 0.90625 0.50002 1.0000 + Mn Mn129 1.0 0.78474 0.94792 0.50002 1.0000 + Mn Mn130 1.0 0.82641 0.98958 0.50002 1.0000 + Mn Mn131 1.0 0.86808 0.03125 0.50002 1.0000 + Mn Mn132 1.0 0.90974 0.07292 0.50002 1.0000 + Mn Mn133 1.0 0.49308 0.57292 0.50002 1.0000 + Mn Mn134 1.0 0.53474 0.61458 0.50002 1.0000 + Mn Mn135 1.0 0.57641 0.65625 0.50002 1.0000 + Mn Mn136 1.0 0.61808 0.69792 0.50002 1.0000 + Mn Mn137 1.0 0.65974 0.73958 0.50002 1.0000 + Mn Mn138 1.0 0.70141 0.78125 0.50002 1.0000 + Mn Mn139 1.0 0.74308 0.82292 0.50002 1.0000 + Mn Mn140 1.0 0.78474 0.86458 0.50002 1.0000 + Mn Mn141 1.0 0.82641 0.90625 0.50002 1.0000 + Mn Mn142 1.0 0.86808 0.94792 0.50002 1.0000 + Mn Mn143 1.0 0.90974 0.98958 0.50002 1.0000 + Mn Mn144 1.0 0.95141 0.03125 0.50002 1.0000 + Mn Mn145 1.0 0.03475 0.98958 0.49998 1.0000 + Mn Mn146 1.0 0.07641 0.03125 0.49998 1.0000 + Mn Mn147 1.0 0.11808 0.07292 0.49998 1.0000 + Mn Mn148 1.0 0.15975 0.11458 0.49998 1.0000 + Mn Mn149 1.0 0.20141 0.15625 0.49998 1.0000 + Mn Mn150 1.0 0.24308 0.19792 0.49998 1.0000 + Mn Mn151 1.0 0.28475 0.23958 0.49998 1.0000 + Mn Mn152 1.0 0.32641 0.28125 0.49998 1.0000 + Mn Mn153 1.0 0.36808 0.32292 0.49998 1.0000 + Mn Mn154 1.0 0.40975 0.36458 0.49998 1.0000 + Mn Mn155 1.0 0.45141 0.40625 0.49998 1.0000 + Mn Mn156 1.0 0.49308 0.44792 0.49998 1.0000 + Mn Mn157 1.0 0.07641 0.94792 0.49998 1.0000 + Mn Mn158 1.0 0.11808 0.98958 0.49998 1.0000 + Mn Mn159 1.0 0.15975 0.03125 0.49998 1.0000 + Mn Mn160 1.0 0.20141 0.07292 0.49998 1.0000 + Mn Mn161 1.0 0.24308 0.11458 0.49998 1.0000 + Mn Mn162 1.0 0.28475 0.15625 0.49998 1.0000 + Mn Mn163 1.0 0.32641 0.19792 0.49998 1.0000 + Mn Mn164 1.0 0.36808 0.23958 0.49998 1.0000 + Mn Mn165 1.0 0.40975 0.28125 0.49998 1.0000 + Mn Mn166 1.0 0.45141 0.32292 0.49998 1.0000 + Mn Mn167 1.0 0.49308 0.36458 0.49998 1.0000 + Mn Mn168 1.0 0.53475 0.40625 0.49998 1.0000 + Mn Mn169 1.0 0.11808 0.90625 0.49998 1.0000 + Mn Mn170 1.0 0.15975 0.94792 0.49998 1.0000 + Mn Mn171 1.0 0.20141 0.98958 0.49998 1.0000 + Mn Mn172 1.0 0.24308 0.03125 0.49998 1.0000 + Mn Mn173 1.0 0.28475 0.07292 0.49998 1.0000 + Mn Mn174 1.0 0.32641 0.11458 0.49998 1.0000 + Mn Mn175 1.0 0.36808 0.15625 0.49998 1.0000 + Mn Mn176 1.0 0.40975 0.19792 0.49998 1.0000 + Mn Mn177 1.0 0.45141 0.23958 0.49998 1.0000 + Mn Mn178 1.0 0.49308 0.28125 0.49998 1.0000 + Mn Mn179 1.0 0.53475 0.32292 0.49998 1.0000 + Mn Mn180 1.0 0.57641 0.36458 0.49998 1.0000 + Mn Mn181 1.0 0.15975 0.86458 0.49998 1.0000 + Mn Mn182 1.0 0.20141 0.90625 0.49998 1.0000 + Mn Mn183 1.0 0.24308 0.94792 0.49998 1.0000 + Mn Mn184 1.0 0.28475 0.98958 0.49998 1.0000 + Mn Mn185 1.0 0.32641 0.03125 0.49998 1.0000 + Mn Mn186 1.0 0.36808 0.07292 0.49998 1.0000 + Mn Mn187 1.0 0.40975 0.11458 0.49998 1.0000 + Mn Mn188 1.0 0.45141 0.15625 0.49998 1.0000 + Mn Mn189 1.0 0.49308 0.19792 0.49998 1.0000 + Mn Mn190 1.0 0.53475 0.23958 0.49998 1.0000 + Mn Mn191 1.0 0.57641 0.28125 0.49998 1.0000 + Mn Mn192 1.0 0.61808 0.32292 0.49998 1.0000 + Mn Mn193 1.0 0.20141 0.82292 0.49998 1.0000 + Mn Mn194 1.0 0.24308 0.86458 0.49998 1.0000 + Mn Mn195 1.0 0.28475 0.90625 0.49998 1.0000 + Mn Mn196 1.0 0.32641 0.94792 0.49998 1.0000 + Mn Mn197 1.0 0.36808 0.98958 0.49998 1.0000 + Mn Mn198 1.0 0.40975 0.03125 0.49998 1.0000 + Mn Mn199 1.0 0.45141 0.07292 0.49998 1.0000 + Mn Mn200 1.0 0.49308 0.11458 0.49998 1.0000 + Mn Mn201 1.0 0.53475 0.15625 0.49998 1.0000 + Mn Mn202 1.0 0.57641 0.19792 0.49998 1.0000 + Mn Mn203 1.0 0.61808 0.23958 0.49998 1.0000 + Mn Mn204 1.0 0.65975 0.28125 0.49998 1.0000 + Mn Mn205 1.0 0.24308 0.78125 0.49998 1.0000 + Mn Mn206 1.0 0.28475 0.82292 0.49998 1.0000 + Mn Mn207 1.0 0.32641 0.86458 0.49998 1.0000 + Mn Mn208 1.0 0.36808 0.90625 0.49998 1.0000 + Mn Mn209 1.0 0.40975 0.94792 0.49998 1.0000 + Mn Mn210 1.0 0.45141 0.98958 0.49998 1.0000 + Mn Mn211 1.0 0.49308 0.03125 0.49998 1.0000 + Mn Mn212 1.0 0.53475 0.07292 0.49998 1.0000 + Mn Mn213 1.0 0.57641 0.11458 0.49998 1.0000 + Mn Mn214 1.0 0.61808 0.15625 0.49998 1.0000 + Mn Mn215 1.0 0.65975 0.19792 0.49998 1.0000 + Mn Mn216 1.0 0.70141 0.23958 0.49998 1.0000 + Mn Mn217 1.0 0.28475 0.73958 0.49998 1.0000 + Mn Mn218 1.0 0.32641 0.78125 0.49998 1.0000 + Mn Mn219 1.0 0.36808 0.82292 0.49998 1.0000 + Mn Mn220 1.0 0.40975 0.86458 0.49998 1.0000 + Mn Mn221 1.0 0.45141 0.90625 0.49998 1.0000 + Mn Mn222 1.0 0.49308 0.94792 0.49998 1.0000 + Mn Mn223 1.0 0.53475 0.98958 0.49998 1.0000 + Mn Mn224 1.0 0.57641 0.03125 0.49998 1.0000 + Mn Mn225 1.0 0.61808 0.07292 0.49998 1.0000 + Mn Mn226 1.0 0.65975 0.11458 0.49998 1.0000 + Mn Mn227 1.0 0.70141 0.15625 0.49998 1.0000 + Mn Mn228 1.0 0.74308 0.19792 0.49998 1.0000 + Mn Mn229 1.0 0.32641 0.69792 0.49998 1.0000 + Mn Mn230 1.0 0.36808 0.73958 0.49998 1.0000 + Mn Mn231 1.0 0.40975 0.78125 0.49998 1.0000 + Mn Mn232 1.0 0.45141 0.82292 0.49998 1.0000 + Mn Mn233 1.0 0.49308 0.86458 0.49998 1.0000 + Mn Mn234 1.0 0.53475 0.90625 0.49998 1.0000 + Mn Mn235 1.0 0.57641 0.94792 0.49998 1.0000 + Mn Mn236 1.0 0.61808 0.98958 0.49998 1.0000 + Mn Mn237 1.0 0.65975 0.03125 0.49998 1.0000 + Mn Mn238 1.0 0.70141 0.07292 0.49998 1.0000 + Mn Mn239 1.0 0.74308 0.11458 0.49998 1.0000 + Mn Mn240 1.0 0.78475 0.15625 0.49998 1.0000 + Mn Mn241 1.0 0.36808 0.65625 0.49998 1.0000 + Mn Mn242 1.0 0.40975 0.69792 0.49998 1.0000 + Mn Mn243 1.0 0.45141 0.73958 0.49998 1.0000 + Mn Mn244 1.0 0.49308 0.78125 0.49998 1.0000 + Mn Mn245 1.0 0.53475 0.82292 0.49998 1.0000 + Mn Mn246 1.0 0.57641 0.86458 0.49998 1.0000 + Mn Mn247 1.0 0.61808 0.90625 0.49998 1.0000 + Mn Mn248 1.0 0.65975 0.94792 0.49998 1.0000 + Mn Mn249 1.0 0.70141 0.98958 0.49998 1.0000 + Mn Mn250 1.0 0.74308 0.03125 0.49998 1.0000 + Mn Mn251 1.0 0.78475 0.07292 0.49998 1.0000 + Mn Mn252 1.0 0.82641 0.11458 0.49998 1.0000 + Mn Mn253 1.0 0.40975 0.61458 0.49998 1.0000 + Mn Mn254 1.0 0.45141 0.65625 0.49998 1.0000 + Mn Mn255 1.0 0.49308 0.69792 0.49998 1.0000 + Mn Mn256 1.0 0.53475 0.73958 0.49998 1.0000 + Mn Mn257 1.0 0.57641 0.78125 0.49998 1.0000 + Mn Mn258 1.0 0.61808 0.82292 0.49998 1.0000 + Mn Mn259 1.0 0.65975 0.86458 0.49998 1.0000 + Mn Mn260 1.0 0.70141 0.90625 0.49998 1.0000 + Mn Mn261 1.0 0.74308 0.94792 0.49998 1.0000 + Mn Mn262 1.0 0.78475 0.98958 0.49998 1.0000 + Mn Mn263 1.0 0.82641 0.03125 0.49998 1.0000 + Mn Mn264 1.0 0.86808 0.07292 0.49998 1.0000 + Mn Mn265 1.0 0.45141 0.57292 0.49998 1.0000 + Mn Mn266 1.0 0.49308 0.61458 0.49998 1.0000 + Mn Mn267 1.0 0.53475 0.65625 0.49998 1.0000 + Mn Mn268 1.0 0.57641 0.69792 0.49998 1.0000 + Mn Mn269 1.0 0.61808 0.73958 0.49998 1.0000 + Mn Mn270 1.0 0.65975 0.78125 0.49998 1.0000 + Mn Mn271 1.0 0.70141 0.82292 0.49998 1.0000 + Mn Mn272 1.0 0.74308 0.86458 0.49998 1.0000 + Mn Mn273 1.0 0.78475 0.90625 0.49998 1.0000 + Mn Mn274 1.0 0.82641 0.94792 0.49998 1.0000 + Mn Mn275 1.0 0.86808 0.98958 0.49998 1.0000 + Mn Mn276 1.0 0.90975 0.03125 0.49998 1.0000 + Mn Mn277 1.0 0.49308 0.53125 0.49998 1.0000 + Mn Mn278 1.0 0.53475 0.57292 0.49998 1.0000 + Mn Mn279 1.0 0.57641 0.61458 0.49998 1.0000 + Mn Mn280 1.0 0.61808 0.65625 0.49998 1.0000 + Mn Mn281 1.0 0.65975 0.69792 0.49998 1.0000 + Mn Mn282 1.0 0.70141 0.73958 0.49998 1.0000 + Mn Mn283 1.0 0.74308 0.78125 0.49998 1.0000 + Mn Mn284 1.0 0.78475 0.82292 0.49998 1.0000 + Mn Mn285 1.0 0.82641 0.86458 0.49998 1.0000 + Mn Mn286 1.0 0.86808 0.90625 0.49998 1.0000 + Mn Mn287 1.0 0.90975 0.94792 0.49998 1.0000 + Mn Mn288 1.0 0.95141 0.98958 0.49998 1.0000 + Mn Mn289 1.0 0.01391 0.01042 0.50000 1.0000 + Mn Mn290 1.0 0.05558 0.05209 0.50000 1.0000 + Mn Mn291 1.0 0.09724 0.09375 0.50000 1.0000 + Mn Mn292 1.0 0.13891 0.13542 0.50000 1.0000 + Mn Mn293 1.0 0.18058 0.17709 0.50000 1.0000 + Mn Mn294 1.0 0.22224 0.21875 0.50000 1.0000 + Mn Mn295 1.0 0.26391 0.26042 0.50000 1.0000 + Mn Mn296 1.0 0.30558 0.30209 0.50000 1.0000 + Mn Mn297 1.0 0.34724 0.34375 0.50000 1.0000 + Mn Mn298 1.0 0.38891 0.38542 0.50000 1.0000 + Mn Mn299 1.0 0.43058 0.42709 0.50000 1.0000 + Mn Mn300 1.0 0.47224 0.46875 0.50000 1.0000 + Mn Mn301 1.0 0.05558 0.96875 0.50000 1.0000 + Mn Mn302 1.0 0.09724 0.01042 0.50000 1.0000 + Mn Mn303 1.0 0.13891 0.05209 0.50000 1.0000 + Mn Mn304 1.0 0.18058 0.09375 0.50000 1.0000 + Mn Mn305 1.0 0.22224 0.13542 0.50000 1.0000 + Mn Mn306 1.0 0.26391 0.17709 0.50000 1.0000 + Mn Mn307 1.0 0.30558 0.21875 0.50000 1.0000 + Mn Mn308 1.0 0.34724 0.26042 0.50000 1.0000 + Mn Mn309 1.0 0.38891 0.30209 0.50000 1.0000 + Mn Mn310 1.0 0.43058 0.34375 0.50000 1.0000 + Mn Mn311 1.0 0.47224 0.38542 0.50000 1.0000 + Mn Mn312 1.0 0.51391 0.42709 0.50000 1.0000 + Mn Mn313 1.0 0.09724 0.92709 0.50000 1.0000 + Mn Mn314 1.0 0.13891 0.96875 0.50000 1.0000 + Mn Mn315 1.0 0.18058 0.01042 0.50000 1.0000 + Mn Mn316 1.0 0.22224 0.05209 0.50000 1.0000 + Mn Mn317 1.0 0.26391 0.09375 0.50000 1.0000 + Mn Mn318 1.0 0.30558 0.13542 0.50000 1.0000 + Mn Mn319 1.0 0.34724 0.17709 0.50000 1.0000 + Mn Mn320 1.0 0.38891 0.21875 0.50000 1.0000 + Mn Mn321 1.0 0.43058 0.26042 0.50000 1.0000 + Mn Mn322 1.0 0.47224 0.30209 0.50000 1.0000 + Mn Mn323 1.0 0.51391 0.34375 0.50000 1.0000 + Mn Mn324 1.0 0.55558 0.38542 0.50000 1.0000 + Mn Mn325 1.0 0.13891 0.88542 0.50000 1.0000 + Mn Mn326 1.0 0.18058 0.92709 0.50000 1.0000 + Mn Mn327 1.0 0.22224 0.96875 0.50000 1.0000 + Mn Mn328 1.0 0.26391 0.01042 0.50000 1.0000 + Mn Mn329 1.0 0.30558 0.05209 0.50000 1.0000 + Mn Mn330 1.0 0.34724 0.09375 0.50000 1.0000 + Mn Mn331 1.0 0.38891 0.13542 0.50000 1.0000 + Mn Mn332 1.0 0.43058 0.17709 0.50000 1.0000 + Mn Mn333 1.0 0.47224 0.21875 0.50000 1.0000 + Mn Mn334 1.0 0.51391 0.26042 0.50000 1.0000 + Mn Mn335 1.0 0.55558 0.30209 0.50000 1.0000 + Mn Mn336 1.0 0.59724 0.34375 0.50000 1.0000 + Mn Mn337 1.0 0.18058 0.84375 0.50000 1.0000 + Mn Mn338 1.0 0.22224 0.88542 0.50000 1.0000 + Mn Mn339 1.0 0.26391 0.92709 0.50000 1.0000 + Mn Mn340 1.0 0.30558 0.96875 0.50000 1.0000 + Mn Mn341 1.0 0.34724 0.01042 0.50000 1.0000 + Mn Mn342 1.0 0.38891 0.05209 0.50000 1.0000 + Mn Mn343 1.0 0.43058 0.09375 0.50000 1.0000 + Mn Mn344 1.0 0.47224 0.13542 0.50000 1.0000 + Mn Mn345 1.0 0.51391 0.17709 0.50000 1.0000 + Mn Mn346 1.0 0.55558 0.21875 0.50000 1.0000 + Mn Mn347 1.0 0.59724 0.26042 0.50000 1.0000 + Mn Mn348 1.0 0.63891 0.30209 0.50000 1.0000 + Mn Mn349 1.0 0.22224 0.80209 0.50000 1.0000 + Mn Mn350 1.0 0.26391 0.84375 0.50000 1.0000 + Mn Mn351 1.0 0.30558 0.88542 0.50000 1.0000 + Mn Mn352 1.0 0.34724 0.92709 0.50000 1.0000 + Mn Mn353 1.0 0.38891 0.96875 0.50000 1.0000 + Mn Mn354 1.0 0.43058 0.01042 0.50000 1.0000 + Mn Mn355 1.0 0.47224 0.05209 0.50000 1.0000 + Mn Mn356 1.0 0.51391 0.09375 0.50000 1.0000 + Mn Mn357 1.0 0.55558 0.13542 0.50000 1.0000 + Mn Mn358 1.0 0.59724 0.17709 0.50000 1.0000 + Mn Mn359 1.0 0.63891 0.21875 0.50000 1.0000 + Mn Mn360 1.0 0.68058 0.26042 0.50000 1.0000 + Mn Mn361 1.0 0.26391 0.76042 0.50000 1.0000 + Mn Mn362 1.0 0.30558 0.80209 0.50000 1.0000 + Mn Mn363 1.0 0.34724 0.84375 0.50000 1.0000 + Mn Mn364 1.0 0.38891 0.88542 0.50000 1.0000 + Mn Mn365 1.0 0.43058 0.92709 0.50000 1.0000 + Mn Mn366 1.0 0.47224 0.96875 0.50000 1.0000 + Mn Mn367 1.0 0.51391 0.01042 0.50000 1.0000 + Mn Mn368 1.0 0.55558 0.05209 0.50000 1.0000 + Mn Mn369 1.0 0.59724 0.09375 0.50000 1.0000 + Mn Mn370 1.0 0.63891 0.13542 0.50000 1.0000 + Mn Mn371 1.0 0.68058 0.17709 0.50000 1.0000 + Mn Mn372 1.0 0.72224 0.21875 0.50000 1.0000 + Mn Mn373 1.0 0.30558 0.71875 0.50000 1.0000 + Mn Mn374 1.0 0.34724 0.76042 0.50000 1.0000 + Mn Mn375 1.0 0.38891 0.80209 0.50000 1.0000 + Mn Mn376 1.0 0.43058 0.84375 0.50000 1.0000 + Mn Mn377 1.0 0.47224 0.88542 0.50000 1.0000 + Mn Mn378 1.0 0.51391 0.92709 0.50000 1.0000 + Mn Mn379 1.0 0.55558 0.96875 0.50000 1.0000 + Mn Mn380 1.0 0.59724 0.01042 0.50000 1.0000 + Mn Mn381 1.0 0.63891 0.05209 0.50000 1.0000 + Mn Mn382 1.0 0.68058 0.09375 0.50000 1.0000 + Mn Mn383 1.0 0.72224 0.13542 0.50000 1.0000 + Mn Mn384 1.0 0.76391 0.17709 0.50000 1.0000 + Mn Mn385 1.0 0.34724 0.67709 0.50000 1.0000 + Mn Mn386 1.0 0.38891 0.71875 0.50000 1.0000 + Mn Mn387 1.0 0.43058 0.76042 0.50000 1.0000 + Mn Mn388 1.0 0.47224 0.80209 0.50000 1.0000 + Mn Mn389 1.0 0.51391 0.84375 0.50000 1.0000 + Mn Mn390 1.0 0.55558 0.88542 0.50000 1.0000 + Mn Mn391 1.0 0.59724 0.92709 0.50000 1.0000 + Mn Mn392 1.0 0.63891 0.96875 0.50000 1.0000 + Mn Mn393 1.0 0.68058 0.01042 0.50000 1.0000 + Mn Mn394 1.0 0.72224 0.05209 0.50000 1.0000 + Mn Mn395 1.0 0.76391 0.09375 0.50000 1.0000 + Mn Mn396 1.0 0.80558 0.13542 0.50000 1.0000 + Mn Mn397 1.0 0.38891 0.63542 0.50000 1.0000 + Mn Mn398 1.0 0.43058 0.67709 0.50000 1.0000 + Mn Mn399 1.0 0.47224 0.71875 0.50000 1.0000 + Mn Mn400 1.0 0.51391 0.76042 0.50000 1.0000 + Mn Mn401 1.0 0.55558 0.80209 0.50000 1.0000 + Mn Mn402 1.0 0.59724 0.84375 0.50000 1.0000 + Mn Mn403 1.0 0.63891 0.88542 0.50000 1.0000 + Mn Mn404 1.0 0.68058 0.92709 0.50000 1.0000 + Mn Mn405 1.0 0.72224 0.96875 0.50000 1.0000 + Mn Mn406 1.0 0.76391 0.01042 0.50000 1.0000 + Mn Mn407 1.0 0.80558 0.05209 0.50000 1.0000 + Mn Mn408 1.0 0.84724 0.09375 0.50000 1.0000 + Mn Mn409 1.0 0.43058 0.59375 0.50000 1.0000 + Mn Mn410 1.0 0.47224 0.63542 0.50000 1.0000 + Mn Mn411 1.0 0.51391 0.67709 0.50000 1.0000 + Mn Mn412 1.0 0.55558 0.71875 0.50000 1.0000 + Mn Mn413 1.0 0.59724 0.76042 0.50000 1.0000 + Mn Mn414 1.0 0.63891 0.80209 0.50000 1.0000 + Mn Mn415 1.0 0.68058 0.84375 0.50000 1.0000 + Mn Mn416 1.0 0.72224 0.88542 0.50000 1.0000 + Mn Mn417 1.0 0.76391 0.92709 0.50000 1.0000 + Mn Mn418 1.0 0.80558 0.96875 0.50000 1.0000 + Mn Mn419 1.0 0.84724 0.01042 0.50000 1.0000 + Mn Mn420 1.0 0.88891 0.05209 0.50000 1.0000 + Mn Mn421 1.0 0.47224 0.55209 0.50000 1.0000 + Mn Mn422 1.0 0.51391 0.59375 0.50000 1.0000 + Mn Mn423 1.0 0.55558 0.63542 0.50000 1.0000 + Mn Mn424 1.0 0.59724 0.67709 0.50000 1.0000 + Mn Mn425 1.0 0.63891 0.71875 0.50000 1.0000 + Mn Mn426 1.0 0.68058 0.76042 0.50000 1.0000 + Mn Mn427 1.0 0.72224 0.80209 0.50000 1.0000 + Mn Mn428 1.0 0.76391 0.84375 0.50000 1.0000 + Mn Mn429 1.0 0.80558 0.88542 0.50000 1.0000 + Mn Mn430 1.0 0.84724 0.92709 0.50000 1.0000 + Mn Mn431 1.0 0.88891 0.96875 0.50000 1.0000 + Mn Mn432 1.0 0.93058 0.01042 0.50000 1.0000 + Sb Sb1 1.0 0.05558 0.01041 0.50000 1.0000 + Sb Sb2 1.0 0.09724 0.05207 0.50000 1.0000 + Sb Sb3 1.0 0.13891 0.09374 0.50000 1.0000 + Sb Sb4 1.0 0.18058 0.13541 0.50000 1.0000 + Sb Sb5 1.0 0.22224 0.17707 0.50000 1.0000 + Sb Sb6 1.0 0.26391 0.21874 0.50000 1.0000 + Sb Sb7 1.0 0.30558 0.26041 0.50000 1.0000 + Sb Sb8 1.0 0.34724 0.30207 0.50000 1.0000 + Sb Sb9 1.0 0.38891 0.34374 0.50000 1.0000 + Sb Sb10 1.0 0.43058 0.38541 0.50000 1.0000 + Sb Sb11 1.0 0.47224 0.42707 0.50000 1.0000 + Sb Sb12 1.0 0.51391 0.46874 0.50000 1.0000 + Sb Sb13 1.0 0.09724 0.96874 0.50000 1.0000 + Sb Sb14 1.0 0.13891 0.01041 0.50000 1.0000 + Sb Sb15 1.0 0.18058 0.05207 0.50000 1.0000 + Sb Sb16 1.0 0.22224 0.09374 0.50000 1.0000 + Sb Sb17 1.0 0.26391 0.13541 0.50000 1.0000 + Sb Sb18 1.0 0.30558 0.17707 0.50000 1.0000 + Sb Sb19 1.0 0.34724 0.21874 0.50000 1.0000 + Sb Sb20 1.0 0.38891 0.26041 0.50000 1.0000 + Sb Sb21 1.0 0.43058 0.30207 0.50000 1.0000 + Sb Sb22 1.0 0.47224 0.34374 0.50000 1.0000 + Sb Sb23 1.0 0.51391 0.38541 0.50000 1.0000 + Sb Sb24 1.0 0.55558 0.42707 0.50000 1.0000 + Sb Sb25 1.0 0.13891 0.92707 0.50000 1.0000 + Sb Sb26 1.0 0.18058 0.96874 0.50000 1.0000 + Sb Sb27 1.0 0.22224 0.01041 0.50000 1.0000 + Sb Sb28 1.0 0.26391 0.05207 0.50000 1.0000 + Sb Sb29 1.0 0.30558 0.09374 0.50000 1.0000 + Sb Sb30 1.0 0.34724 0.13541 0.50000 1.0000 + Sb Sb31 1.0 0.38891 0.17707 0.50000 1.0000 + Sb Sb32 1.0 0.43058 0.21874 0.50000 1.0000 + Sb Sb33 1.0 0.47224 0.26041 0.50000 1.0000 + Sb Sb34 1.0 0.51391 0.30207 0.50000 1.0000 + Sb Sb35 1.0 0.55558 0.34374 0.50000 1.0000 + Sb Sb36 1.0 0.59724 0.38541 0.50000 1.0000 + Sb Sb37 1.0 0.18058 0.88541 0.50000 1.0000 + Sb Sb38 1.0 0.22224 0.92707 0.50000 1.0000 + Sb Sb39 1.0 0.26391 0.96874 0.50000 1.0000 + Sb Sb40 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1.0000 + O O1117 1.0 0.41615 0.63542 0.66640 1.0000 + O O1118 1.0 0.45782 0.67708 0.66640 1.0000 + O O1119 1.0 0.49949 0.71875 0.66640 1.0000 + O O1120 1.0 0.54115 0.76042 0.66640 1.0000 + O O1121 1.0 0.58282 0.80208 0.66640 1.0000 + O O1122 1.0 0.62449 0.84375 0.66640 1.0000 + O O1123 1.0 0.66615 0.88542 0.66640 1.0000 + O O1124 1.0 0.70782 0.92708 0.66640 1.0000 + O O1125 1.0 0.74949 0.96875 0.66640 1.0000 + O O1126 1.0 0.79115 0.01042 0.66640 1.0000 + O O1127 1.0 0.83282 0.05208 0.66640 1.0000 + O O1128 1.0 0.87449 0.09375 0.66640 1.0000 + O O1129 1.0 0.45782 0.59375 0.66640 1.0000 + O O1130 1.0 0.49949 0.63542 0.66640 1.0000 + O O1131 1.0 0.54115 0.67708 0.66640 1.0000 + O O1132 1.0 0.58282 0.71875 0.66640 1.0000 + O O1133 1.0 0.62449 0.76042 0.66640 1.0000 + O O1134 1.0 0.66615 0.80208 0.66640 1.0000 + O O1135 1.0 0.70782 0.84375 0.66640 1.0000 + O O1136 1.0 0.74949 0.88542 0.66640 1.0000 + O O1137 1.0 0.79115 0.92708 0.66640 1.0000 + O O1138 1.0 0.83282 0.96875 0.66640 1.0000 + O O1139 1.0 0.87449 0.01042 0.66640 1.0000 + O O1140 1.0 0.91615 0.05208 0.66640 1.0000 + O O1141 1.0 0.49949 0.55208 0.66640 1.0000 + O O1142 1.0 0.54115 0.59375 0.66640 1.0000 + O O1143 1.0 0.58282 0.63542 0.66640 1.0000 + O O1144 1.0 0.62449 0.67708 0.66640 1.0000 + O O1145 1.0 0.66615 0.71875 0.66640 1.0000 + O O1146 1.0 0.70782 0.76042 0.66640 1.0000 + O O1147 1.0 0.74949 0.80208 0.66640 1.0000 + O O1148 1.0 0.79115 0.84375 0.66640 1.0000 + O O1149 1.0 0.83282 0.88542 0.66640 1.0000 + O O1150 1.0 0.87449 0.92708 0.66640 1.0000 + O O1151 1.0 0.91615 0.96875 0.66640 1.0000 + O O1152 1.0 0.95782 0.01042 0.66640 1.0000 + Mn Mn433 1.0 0.53474 0.53125 0.50002 1.0000 + Mn Mn434 1.0 0.57641 0.57292 0.50002 1.0000 + Mn Mn435 1.0 0.61808 0.61458 0.50002 1.0000 + Mn Mn436 1.0 0.65974 0.65625 0.50002 1.0000 + Mn Mn437 1.0 0.70141 0.69792 0.50002 1.0000 + Mn Mn438 1.0 0.74308 0.73958 0.50002 1.0000 + Mn Mn439 1.0 0.78474 0.78125 0.50002 1.0000 + Mn Mn440 1.0 0.82641 0.82292 0.50002 1.0000 + Mn Mn441 1.0 0.86808 0.86458 0.50002 1.0000 + Mn Mn442 1.0 0.90974 0.90625 0.50002 1.0000 + Mn Mn443 1.0 0.95141 0.94792 0.50002 1.0000 + Mn Mn444 1.0 0.99308 0.98958 0.50002 1.0000 + Mn Mn445 1.0 0.57641 0.48958 0.50002 1.0000 + Mn Mn446 1.0 0.61808 0.53125 0.50002 1.0000 + Mn Mn447 1.0 0.65974 0.57292 0.50002 1.0000 + Mn Mn448 1.0 0.70141 0.61458 0.50002 1.0000 + Mn Mn449 1.0 0.74308 0.65625 0.50002 1.0000 + Mn Mn450 1.0 0.78474 0.69792 0.50002 1.0000 + Mn Mn451 1.0 0.82641 0.73958 0.50002 1.0000 + Mn Mn452 1.0 0.86808 0.78125 0.50002 1.0000 + Mn Mn453 1.0 0.90974 0.82292 0.50002 1.0000 + Mn Mn454 1.0 0.95141 0.86458 0.50002 1.0000 + Mn Mn455 1.0 0.99308 0.90625 0.50002 1.0000 + Mn Mn456 1.0 0.03474 0.94792 0.50002 1.0000 + Mn Mn457 1.0 0.61808 0.44792 0.50002 1.0000 + Mn Mn458 1.0 0.65974 0.48958 0.50002 1.0000 + Mn Mn459 1.0 0.70141 0.53125 0.50002 1.0000 + Mn Mn460 1.0 0.74308 0.57292 0.50002 1.0000 + Mn Mn461 1.0 0.78474 0.61458 0.50002 1.0000 + Mn Mn462 1.0 0.82641 0.65625 0.50002 1.0000 + Mn Mn463 1.0 0.86808 0.69792 0.50002 1.0000 + Mn Mn464 1.0 0.90974 0.73958 0.50002 1.0000 + Mn Mn465 1.0 0.95141 0.78125 0.50002 1.0000 + Mn Mn466 1.0 0.99308 0.82292 0.50002 1.0000 + Mn Mn467 1.0 0.03474 0.86458 0.50002 1.0000 + Mn Mn468 1.0 0.07641 0.90625 0.50002 1.0000 + Mn Mn469 1.0 0.65974 0.40625 0.50002 1.0000 + Mn Mn470 1.0 0.70141 0.44792 0.50002 1.0000 + Mn Mn471 1.0 0.74308 0.48958 0.50002 1.0000 + Mn Mn472 1.0 0.78474 0.53125 0.50002 1.0000 + Mn Mn473 1.0 0.82641 0.57292 0.50002 1.0000 + Mn Mn474 1.0 0.86808 0.61458 0.50002 1.0000 + Mn Mn475 1.0 0.90974 0.65625 0.50002 1.0000 + Mn Mn476 1.0 0.95141 0.69792 0.50002 1.0000 + Mn Mn477 1.0 0.99308 0.73958 0.50002 1.0000 + Mn Mn478 1.0 0.03474 0.78125 0.50002 1.0000 + Mn Mn479 1.0 0.07641 0.82292 0.50002 1.0000 + Mn Mn480 1.0 0.11808 0.86458 0.50002 1.0000 + Mn Mn481 1.0 0.70141 0.36458 0.50002 1.0000 + Mn Mn482 1.0 0.74308 0.40625 0.50002 1.0000 + Mn Mn483 1.0 0.78474 0.44792 0.50002 1.0000 + Mn Mn484 1.0 0.82641 0.48958 0.50002 1.0000 + Mn Mn485 1.0 0.86808 0.53125 0.50002 1.0000 + Mn Mn486 1.0 0.90974 0.57292 0.50002 1.0000 + Mn Mn487 1.0 0.95141 0.61458 0.50002 1.0000 + Mn Mn488 1.0 0.99308 0.65625 0.50002 1.0000 + Mn Mn489 1.0 0.03474 0.69792 0.50002 1.0000 + Mn Mn490 1.0 0.07641 0.73958 0.50002 1.0000 + Mn Mn491 1.0 0.11808 0.78125 0.50002 1.0000 + Mn Mn492 1.0 0.15974 0.82292 0.50002 1.0000 + Mn Mn493 1.0 0.74308 0.32292 0.50002 1.0000 + Mn Mn494 1.0 0.78474 0.36458 0.50002 1.0000 + Mn Mn495 1.0 0.82641 0.40625 0.50002 1.0000 + Mn Mn496 1.0 0.86808 0.44792 0.50002 1.0000 + Mn Mn497 1.0 0.90974 0.48958 0.50002 1.0000 + Mn Mn498 1.0 0.95141 0.53125 0.50002 1.0000 + Mn Mn499 1.0 0.99308 0.57292 0.50002 1.0000 + Mn Mn500 1.0 0.03474 0.61458 0.50002 1.0000 + Mn Mn501 1.0 0.07641 0.65625 0.50002 1.0000 + Mn Mn502 1.0 0.11808 0.69792 0.50002 1.0000 + Mn Mn503 1.0 0.15974 0.73958 0.50002 1.0000 + Mn Mn504 1.0 0.20141 0.78125 0.50002 1.0000 + Mn Mn505 1.0 0.78474 0.28125 0.50002 1.0000 + Mn Mn506 1.0 0.82641 0.32292 0.50002 1.0000 + Mn Mn507 1.0 0.86808 0.36458 0.50002 1.0000 + Mn Mn508 1.0 0.90974 0.40625 0.50002 1.0000 + Mn Mn509 1.0 0.95141 0.44792 0.50002 1.0000 + Mn Mn510 1.0 0.99308 0.48958 0.50002 1.0000 + Mn Mn511 1.0 0.03474 0.53125 0.50002 1.0000 + Mn Mn512 1.0 0.07641 0.57292 0.50002 1.0000 + Mn Mn513 1.0 0.11808 0.61458 0.50002 1.0000 + Mn Mn514 1.0 0.15974 0.65625 0.50002 1.0000 + Mn Mn515 1.0 0.20141 0.69792 0.50002 1.0000 + Mn Mn516 1.0 0.24308 0.73958 0.50002 1.0000 + Mn Mn517 1.0 0.82641 0.23958 0.50002 1.0000 + Mn Mn518 1.0 0.86808 0.28125 0.50002 1.0000 + Mn Mn519 1.0 0.90974 0.32292 0.50002 1.0000 + Mn Mn520 1.0 0.95141 0.36458 0.50002 1.0000 + Mn Mn521 1.0 0.99308 0.40625 0.50002 1.0000 + Mn Mn522 1.0 0.03474 0.44792 0.50002 1.0000 + Mn Mn523 1.0 0.07641 0.48958 0.50002 1.0000 + Mn Mn524 1.0 0.11808 0.53125 0.50002 1.0000 + Mn Mn525 1.0 0.15974 0.57292 0.50002 1.0000 + Mn Mn526 1.0 0.20141 0.61458 0.50002 1.0000 + Mn Mn527 1.0 0.24308 0.65625 0.50002 1.0000 + Mn Mn528 1.0 0.28474 0.69792 0.50002 1.0000 + Mn Mn529 1.0 0.86808 0.19792 0.50002 1.0000 + Mn Mn530 1.0 0.90974 0.23958 0.50002 1.0000 + Mn Mn531 1.0 0.95141 0.28125 0.50002 1.0000 + Mn Mn532 1.0 0.99308 0.32292 0.50002 1.0000 + Mn Mn533 1.0 0.03474 0.36458 0.50002 1.0000 + Mn Mn534 1.0 0.07641 0.40625 0.50002 1.0000 + Mn Mn535 1.0 0.11808 0.44792 0.50002 1.0000 + Mn Mn536 1.0 0.15974 0.48958 0.50002 1.0000 + Mn Mn537 1.0 0.20141 0.53125 0.50002 1.0000 + Mn Mn538 1.0 0.24308 0.57292 0.50002 1.0000 + Mn Mn539 1.0 0.28474 0.61458 0.50002 1.0000 + Mn Mn540 1.0 0.32641 0.65625 0.50002 1.0000 + Mn Mn541 1.0 0.90974 0.15625 0.50002 1.0000 + Mn Mn542 1.0 0.95141 0.19792 0.50002 1.0000 + Mn Mn543 1.0 0.99308 0.23958 0.50002 1.0000 + Mn Mn544 1.0 0.03474 0.28125 0.50002 1.0000 + Mn Mn545 1.0 0.07641 0.32292 0.50002 1.0000 + Mn Mn546 1.0 0.11808 0.36458 0.50002 1.0000 + Mn Mn547 1.0 0.15974 0.40625 0.50002 1.0000 + Mn Mn548 1.0 0.20141 0.44792 0.50002 1.0000 + Mn Mn549 1.0 0.24308 0.48958 0.50002 1.0000 + Mn Mn550 1.0 0.28474 0.53125 0.50002 1.0000 + Mn Mn551 1.0 0.32641 0.57292 0.50002 1.0000 + Mn Mn552 1.0 0.36808 0.61458 0.50002 1.0000 + Mn Mn553 1.0 0.95141 0.11458 0.50002 1.0000 + Mn Mn554 1.0 0.99308 0.15625 0.50002 1.0000 + Mn Mn555 1.0 0.03474 0.19792 0.50002 1.0000 + Mn Mn556 1.0 0.07641 0.23958 0.50002 1.0000 + Mn Mn557 1.0 0.11808 0.28125 0.50002 1.0000 + Mn Mn558 1.0 0.15974 0.32292 0.50002 1.0000 + Mn Mn559 1.0 0.20141 0.36458 0.50002 1.0000 + Mn Mn560 1.0 0.24308 0.40625 0.50002 1.0000 + Mn Mn561 1.0 0.28474 0.44792 0.50002 1.0000 + Mn Mn562 1.0 0.32641 0.48958 0.50002 1.0000 + Mn Mn563 1.0 0.36808 0.53125 0.50002 1.0000 + Mn Mn564 1.0 0.40974 0.57292 0.50002 1.0000 + Mn Mn565 1.0 0.99308 0.07292 0.50002 1.0000 + Mn Mn566 1.0 0.03474 0.11458 0.50002 1.0000 + Mn Mn567 1.0 0.07641 0.15625 0.50002 1.0000 + Mn Mn568 1.0 0.11808 0.19792 0.50002 1.0000 + Mn Mn569 1.0 0.15974 0.23958 0.50002 1.0000 + Mn Mn570 1.0 0.20141 0.28125 0.50002 1.0000 + Mn Mn571 1.0 0.24308 0.32292 0.50002 1.0000 + Mn Mn572 1.0 0.28474 0.36458 0.50002 1.0000 + Mn Mn573 1.0 0.32641 0.40625 0.50002 1.0000 + Mn Mn574 1.0 0.36808 0.44792 0.50002 1.0000 + Mn Mn575 1.0 0.40974 0.48958 0.50002 1.0000 + Mn Mn576 1.0 0.45141 0.53125 0.50002 1.0000 + Mn Mn577 1.0 0.53475 0.48958 0.49998 1.0000 + Mn Mn578 1.0 0.57641 0.53125 0.49998 1.0000 + Mn Mn579 1.0 0.61808 0.57292 0.49998 1.0000 + Mn Mn580 1.0 0.65975 0.61458 0.49998 1.0000 + Mn Mn581 1.0 0.70141 0.65625 0.49998 1.0000 + Mn Mn582 1.0 0.74308 0.69792 0.49998 1.0000 + Mn Mn583 1.0 0.78475 0.73958 0.49998 1.0000 + Mn Mn584 1.0 0.82641 0.78125 0.49998 1.0000 + Mn Mn585 1.0 0.86808 0.82292 0.49998 1.0000 + Mn Mn586 1.0 0.90975 0.86458 0.49998 1.0000 + Mn Mn587 1.0 0.95141 0.90625 0.49998 1.0000 + Mn Mn588 1.0 0.99308 0.94792 0.49998 1.0000 + Mn Mn589 1.0 0.57641 0.44792 0.49998 1.0000 + Mn Mn590 1.0 0.61808 0.48958 0.49998 1.0000 + Mn Mn591 1.0 0.65975 0.53125 0.49998 1.0000 + Mn Mn592 1.0 0.70141 0.57292 0.49998 1.0000 + Mn Mn593 1.0 0.74308 0.61458 0.49998 1.0000 + Mn Mn594 1.0 0.78475 0.65625 0.49998 1.0000 + Mn Mn595 1.0 0.82641 0.69792 0.49998 1.0000 + Mn Mn596 1.0 0.86808 0.73958 0.49998 1.0000 + Mn Mn597 1.0 0.90975 0.78125 0.49998 1.0000 + Mn Mn598 1.0 0.95141 0.82292 0.49998 1.0000 + Mn Mn599 1.0 0.99308 0.86458 0.49998 1.0000 + Mn Mn600 1.0 0.03475 0.90625 0.49998 1.0000 + Mn Mn601 1.0 0.61808 0.40625 0.49998 1.0000 + Mn Mn602 1.0 0.65975 0.44792 0.49998 1.0000 + Mn Mn603 1.0 0.70141 0.48958 0.49998 1.0000 + Mn Mn604 1.0 0.74308 0.53125 0.49998 1.0000 + Mn Mn605 1.0 0.78475 0.57292 0.49998 1.0000 + Mn Mn606 1.0 0.82641 0.61458 0.49998 1.0000 + Mn Mn607 1.0 0.86808 0.65625 0.49998 1.0000 + Mn Mn608 1.0 0.90975 0.69792 0.49998 1.0000 + Mn Mn609 1.0 0.95141 0.73958 0.49998 1.0000 + Mn Mn610 1.0 0.99308 0.78125 0.49998 1.0000 + Mn Mn611 1.0 0.03475 0.82292 0.49998 1.0000 + Mn Mn612 1.0 0.07641 0.86458 0.49998 1.0000 + Mn Mn613 1.0 0.65975 0.36458 0.49998 1.0000 + Mn Mn614 1.0 0.70141 0.40625 0.49998 1.0000 + Mn Mn615 1.0 0.74308 0.44792 0.49998 1.0000 + Mn Mn616 1.0 0.78475 0.48958 0.49998 1.0000 + Mn Mn617 1.0 0.82641 0.53125 0.49998 1.0000 + Mn Mn618 1.0 0.86808 0.57292 0.49998 1.0000 + Mn Mn619 1.0 0.90975 0.61458 0.49998 1.0000 + Mn Mn620 1.0 0.95141 0.65625 0.49998 1.0000 + Mn Mn621 1.0 0.99308 0.69792 0.49998 1.0000 + Mn Mn622 1.0 0.03475 0.73958 0.49998 1.0000 + Mn Mn623 1.0 0.07641 0.78125 0.49998 1.0000 + Mn Mn624 1.0 0.11808 0.82292 0.49998 1.0000 + Mn Mn625 1.0 0.70141 0.32292 0.49998 1.0000 + Mn Mn626 1.0 0.74308 0.36458 0.49998 1.0000 + Mn Mn627 1.0 0.78475 0.40625 0.49998 1.0000 + Mn Mn628 1.0 0.82641 0.44792 0.49998 1.0000 + Mn Mn629 1.0 0.86808 0.48958 0.49998 1.0000 + Mn Mn630 1.0 0.90975 0.53125 0.49998 1.0000 + Mn Mn631 1.0 0.95141 0.57292 0.49998 1.0000 + Mn Mn632 1.0 0.99308 0.61458 0.49998 1.0000 + Mn Mn633 1.0 0.03475 0.65625 0.49998 1.0000 + Mn Mn634 1.0 0.07641 0.69792 0.49998 1.0000 + Mn Mn635 1.0 0.11808 0.73958 0.49998 1.0000 + Mn Mn636 1.0 0.15975 0.78125 0.49998 1.0000 + Mn Mn637 1.0 0.74308 0.28125 0.49998 1.0000 + Mn Mn638 1.0 0.78475 0.32292 0.49998 1.0000 + Mn Mn639 1.0 0.82641 0.36458 0.49998 1.0000 + Mn Mn640 1.0 0.86808 0.40625 0.49998 1.0000 + Mn Mn641 1.0 0.90975 0.44792 0.49998 1.0000 + Mn Mn642 1.0 0.95141 0.48958 0.49998 1.0000 + Mn Mn643 1.0 0.99308 0.53125 0.49998 1.0000 + Mn Mn644 1.0 0.03475 0.57292 0.49998 1.0000 + Mn Mn645 1.0 0.07641 0.61458 0.49998 1.0000 + Mn Mn646 1.0 0.11808 0.65625 0.49998 1.0000 + Mn Mn647 1.0 0.15975 0.69792 0.49998 1.0000 + Mn Mn648 1.0 0.20141 0.73958 0.49998 1.0000 + Mn Mn649 1.0 0.78475 0.23958 0.49998 1.0000 + Mn Mn650 1.0 0.82641 0.28125 0.49998 1.0000 + Mn Mn651 1.0 0.86808 0.32292 0.49998 1.0000 + Mn Mn652 1.0 0.90975 0.36458 0.49998 1.0000 + Mn Mn653 1.0 0.95141 0.40625 0.49998 1.0000 + Mn Mn654 1.0 0.99308 0.44792 0.49998 1.0000 + Mn Mn655 1.0 0.03475 0.48958 0.49998 1.0000 + Mn Mn656 1.0 0.07641 0.53125 0.49998 1.0000 + Mn Mn657 1.0 0.11808 0.57292 0.49998 1.0000 + Mn Mn658 1.0 0.15975 0.61458 0.49998 1.0000 + Mn Mn659 1.0 0.20141 0.65625 0.49998 1.0000 + Mn Mn660 1.0 0.24308 0.69792 0.49998 1.0000 + Mn Mn661 1.0 0.82641 0.19792 0.49998 1.0000 + Mn Mn662 1.0 0.86808 0.23958 0.49998 1.0000 + Mn Mn663 1.0 0.90975 0.28125 0.49998 1.0000 + Mn Mn664 1.0 0.95141 0.32292 0.49998 1.0000 + Mn Mn665 1.0 0.99308 0.36458 0.49998 1.0000 + Mn Mn666 1.0 0.03475 0.40625 0.49998 1.0000 + Mn Mn667 1.0 0.07641 0.44792 0.49998 1.0000 + Mn Mn668 1.0 0.11808 0.48958 0.49998 1.0000 + Mn Mn669 1.0 0.15975 0.53125 0.49998 1.0000 + Mn Mn670 1.0 0.20141 0.57292 0.49998 1.0000 + Mn Mn671 1.0 0.24308 0.61458 0.49998 1.0000 + Mn Mn672 1.0 0.28475 0.65625 0.49998 1.0000 + Mn Mn673 1.0 0.86808 0.15625 0.49998 1.0000 + Mn Mn674 1.0 0.90975 0.19792 0.49998 1.0000 + Mn Mn675 1.0 0.95141 0.23958 0.49998 1.0000 + Mn Mn676 1.0 0.99308 0.28125 0.49998 1.0000 + Mn Mn677 1.0 0.03475 0.32292 0.49998 1.0000 + Mn Mn678 1.0 0.07641 0.36458 0.49998 1.0000 + Mn Mn679 1.0 0.11808 0.40625 0.49998 1.0000 + Mn Mn680 1.0 0.15975 0.44792 0.49998 1.0000 + Mn Mn681 1.0 0.20141 0.48958 0.49998 1.0000 + Mn Mn682 1.0 0.24308 0.53125 0.49998 1.0000 + Mn Mn683 1.0 0.28475 0.57292 0.49998 1.0000 + Mn Mn684 1.0 0.32641 0.61458 0.49998 1.0000 + Mn Mn685 1.0 0.90975 0.11458 0.49998 1.0000 + Mn Mn686 1.0 0.95141 0.15625 0.49998 1.0000 + Mn Mn687 1.0 0.99308 0.19792 0.49998 1.0000 + Mn Mn688 1.0 0.03475 0.23958 0.49998 1.0000 + Mn Mn689 1.0 0.07641 0.28125 0.49998 1.0000 + Mn Mn690 1.0 0.11808 0.32292 0.49998 1.0000 + Mn Mn691 1.0 0.15975 0.36458 0.49998 1.0000 + Mn Mn692 1.0 0.20141 0.40625 0.49998 1.0000 + Mn Mn693 1.0 0.24308 0.44792 0.49998 1.0000 + Mn Mn694 1.0 0.28475 0.48958 0.49998 1.0000 + Mn Mn695 1.0 0.32641 0.53125 0.49998 1.0000 + Mn Mn696 1.0 0.36808 0.57292 0.49998 1.0000 + Mn Mn697 1.0 0.95141 0.07292 0.49998 1.0000 + Mn Mn698 1.0 0.99308 0.11458 0.49998 1.0000 + Mn Mn699 1.0 0.03475 0.15625 0.49998 1.0000 + Mn Mn700 1.0 0.07641 0.19792 0.49998 1.0000 + Mn Mn701 1.0 0.11808 0.23958 0.49998 1.0000 + Mn Mn702 1.0 0.15975 0.28125 0.49998 1.0000 + Mn Mn703 1.0 0.20141 0.32292 0.49998 1.0000 + Mn Mn704 1.0 0.24308 0.36458 0.49998 1.0000 + Mn Mn705 1.0 0.28475 0.40625 0.49998 1.0000 + Mn Mn706 1.0 0.32641 0.44792 0.49998 1.0000 + Mn Mn707 1.0 0.36808 0.48958 0.49998 1.0000 + Mn Mn708 1.0 0.40975 0.53125 0.49998 1.0000 + Mn Mn709 1.0 0.99308 0.03125 0.49998 1.0000 + Mn Mn710 1.0 0.03475 0.07292 0.49998 1.0000 + Mn Mn711 1.0 0.07641 0.11458 0.49998 1.0000 + Mn Mn712 1.0 0.11808 0.15625 0.49998 1.0000 + Mn Mn713 1.0 0.15975 0.19792 0.49998 1.0000 + Mn Mn714 1.0 0.20141 0.23958 0.49998 1.0000 + Mn Mn715 1.0 0.24308 0.28125 0.49998 1.0000 + Mn Mn716 1.0 0.28475 0.32292 0.49998 1.0000 + Mn Mn717 1.0 0.32641 0.36458 0.49998 1.0000 + Mn Mn718 1.0 0.36808 0.40625 0.49998 1.0000 + Mn Mn719 1.0 0.40975 0.44792 0.49998 1.0000 + Mn Mn720 1.0 0.45141 0.48958 0.49998 1.0000 + Mn Mn721 1.0 0.51391 0.51042 0.50000 1.0000 + Mn Mn722 1.0 0.55558 0.55209 0.50000 1.0000 + Mn Mn723 1.0 0.59724 0.59375 0.50000 1.0000 + Mn Mn724 1.0 0.63891 0.63542 0.50000 1.0000 + Mn Mn725 1.0 0.68058 0.67709 0.50000 1.0000 + Mn Mn726 1.0 0.72224 0.71875 0.50000 1.0000 + Mn Mn727 1.0 0.76391 0.76042 0.50000 1.0000 + Mn Mn728 1.0 0.80558 0.80209 0.50000 1.0000 + Mn Mn729 1.0 0.84724 0.84375 0.50000 1.0000 + Mn Mn730 1.0 0.88891 0.88542 0.50000 1.0000 + Mn Mn731 1.0 0.93058 0.92709 0.50000 1.0000 + Mn Mn732 1.0 0.97224 0.96875 0.50000 1.0000 + Mn Mn733 1.0 0.55558 0.46875 0.50000 1.0000 + Mn Mn734 1.0 0.59724 0.51042 0.50000 1.0000 + Mn Mn735 1.0 0.63891 0.55209 0.50000 1.0000 + Mn Mn736 1.0 0.68058 0.59375 0.50000 1.0000 + Mn Mn737 1.0 0.72224 0.63542 0.50000 1.0000 + Mn Mn738 1.0 0.76391 0.67709 0.50000 1.0000 + Mn Mn739 1.0 0.80558 0.71875 0.50000 1.0000 + Mn Mn740 1.0 0.84724 0.76042 0.50000 1.0000 + Mn Mn741 1.0 0.88891 0.80209 0.50000 1.0000 + Mn Mn742 1.0 0.93058 0.84375 0.50000 1.0000 + Mn Mn743 1.0 0.97224 0.88542 0.50000 1.0000 + Mn Mn744 1.0 0.01391 0.92709 0.50000 1.0000 + Mn Mn745 1.0 0.59724 0.42709 0.50000 1.0000 + Mn Mn746 1.0 0.63891 0.46875 0.50000 1.0000 + Mn Mn747 1.0 0.68058 0.51042 0.50000 1.0000 + Mn Mn748 1.0 0.72224 0.55209 0.50000 1.0000 + Mn Mn749 1.0 0.76391 0.59375 0.50000 1.0000 + Mn Mn750 1.0 0.80558 0.63542 0.50000 1.0000 + Mn Mn751 1.0 0.84724 0.67709 0.50000 1.0000 + Mn Mn752 1.0 0.88891 0.71875 0.50000 1.0000 + Mn Mn753 1.0 0.93058 0.76042 0.50000 1.0000 + Mn Mn754 1.0 0.97224 0.80209 0.50000 1.0000 + Mn Mn755 1.0 0.01391 0.84375 0.50000 1.0000 + Mn Mn756 1.0 0.05558 0.88542 0.50000 1.0000 + Mn Mn757 1.0 0.63891 0.38542 0.50000 1.0000 + Mn Mn758 1.0 0.68058 0.42709 0.50000 1.0000 + Mn Mn759 1.0 0.72224 0.46875 0.50000 1.0000 + Mn Mn760 1.0 0.76391 0.51042 0.50000 1.0000 + Mn Mn761 1.0 0.80558 0.55209 0.50000 1.0000 + Mn Mn762 1.0 0.84724 0.59375 0.50000 1.0000 + Mn Mn763 1.0 0.88891 0.63542 0.50000 1.0000 + Mn Mn764 1.0 0.93058 0.67709 0.50000 1.0000 + Mn Mn765 1.0 0.97224 0.71875 0.50000 1.0000 + Mn Mn766 1.0 0.01391 0.76042 0.50000 1.0000 + Mn Mn767 1.0 0.05558 0.80209 0.50000 1.0000 + Mn Mn768 1.0 0.09724 0.84375 0.50000 1.0000 + Mn Mn769 1.0 0.68058 0.34375 0.50000 1.0000 + Mn Mn770 1.0 0.72224 0.38542 0.50000 1.0000 + Mn Mn771 1.0 0.76391 0.42709 0.50000 1.0000 + Mn Mn772 1.0 0.80558 0.46875 0.50000 1.0000 + Mn Mn773 1.0 0.84724 0.51042 0.50000 1.0000 + Mn Mn774 1.0 0.88891 0.55209 0.50000 1.0000 + Mn Mn775 1.0 0.93058 0.59375 0.50000 1.0000 + Mn Mn776 1.0 0.97224 0.63542 0.50000 1.0000 + Mn Mn777 1.0 0.01391 0.67709 0.50000 1.0000 + Mn Mn778 1.0 0.05558 0.71875 0.50000 1.0000 + Mn Mn779 1.0 0.09724 0.76042 0.50000 1.0000 + Mn Mn780 1.0 0.13891 0.80209 0.50000 1.0000 + Mn Mn781 1.0 0.72224 0.30209 0.50000 1.0000 + Mn Mn782 1.0 0.76391 0.34375 0.50000 1.0000 + Mn Mn783 1.0 0.80558 0.38542 0.50000 1.0000 + Mn Mn784 1.0 0.84724 0.42709 0.50000 1.0000 + Mn Mn785 1.0 0.88891 0.46875 0.50000 1.0000 + Mn Mn786 1.0 0.93058 0.51042 0.50000 1.0000 + Mn Mn787 1.0 0.97224 0.55209 0.50000 1.0000 + Mn Mn788 1.0 0.01391 0.59375 0.50000 1.0000 + Mn Mn789 1.0 0.05558 0.63542 0.50000 1.0000 + Mn Mn790 1.0 0.09724 0.67709 0.50000 1.0000 + Mn Mn791 1.0 0.13891 0.71875 0.50000 1.0000 + Mn Mn792 1.0 0.18058 0.76042 0.50000 1.0000 + Mn Mn793 1.0 0.76391 0.26042 0.50000 1.0000 + Mn Mn794 1.0 0.80558 0.30209 0.50000 1.0000 + Mn Mn795 1.0 0.84724 0.34375 0.50000 1.0000 + Mn Mn796 1.0 0.88891 0.38542 0.50000 1.0000 + Mn Mn797 1.0 0.93058 0.42709 0.50000 1.0000 + Mn Mn798 1.0 0.97224 0.46875 0.50000 1.0000 + Mn Mn799 1.0 0.01391 0.51042 0.50000 1.0000 + Mn Mn800 1.0 0.05558 0.55209 0.50000 1.0000 + Mn Mn801 1.0 0.09724 0.59375 0.50000 1.0000 + Mn Mn802 1.0 0.13891 0.63542 0.50000 1.0000 + Mn Mn803 1.0 0.18058 0.67709 0.50000 1.0000 + Mn Mn804 1.0 0.22224 0.71875 0.50000 1.0000 + Mn Mn805 1.0 0.80558 0.21875 0.50000 1.0000 + Mn Mn806 1.0 0.84724 0.26042 0.50000 1.0000 + Mn Mn807 1.0 0.88891 0.30209 0.50000 1.0000 + Mn Mn808 1.0 0.93058 0.34375 0.50000 1.0000 + Mn Mn809 1.0 0.97224 0.38542 0.50000 1.0000 + Mn Mn810 1.0 0.01391 0.42709 0.50000 1.0000 + Mn Mn811 1.0 0.05558 0.46875 0.50000 1.0000 + Mn Mn812 1.0 0.09724 0.51042 0.50000 1.0000 + Mn Mn813 1.0 0.13891 0.55209 0.50000 1.0000 + Mn Mn814 1.0 0.18058 0.59375 0.50000 1.0000 + Mn Mn815 1.0 0.22224 0.63542 0.50000 1.0000 + Mn Mn816 1.0 0.26391 0.67709 0.50000 1.0000 + Mn Mn817 1.0 0.84724 0.17709 0.50000 1.0000 + Mn Mn818 1.0 0.88891 0.21875 0.50000 1.0000 + Mn Mn819 1.0 0.93058 0.26042 0.50000 1.0000 + Mn Mn820 1.0 0.97224 0.30209 0.50000 1.0000 + Mn Mn821 1.0 0.01391 0.34375 0.50000 1.0000 + Mn Mn822 1.0 0.05558 0.38542 0.50000 1.0000 + Mn Mn823 1.0 0.09724 0.42709 0.50000 1.0000 + Mn Mn824 1.0 0.13891 0.46875 0.50000 1.0000 + Mn Mn825 1.0 0.18058 0.51042 0.50000 1.0000 + Mn Mn826 1.0 0.22224 0.55209 0.50000 1.0000 + Mn Mn827 1.0 0.26391 0.59375 0.50000 1.0000 + Mn Mn828 1.0 0.30558 0.63542 0.50000 1.0000 + Mn Mn829 1.0 0.88891 0.13542 0.50000 1.0000 + Mn Mn830 1.0 0.93058 0.17709 0.50000 1.0000 + Mn Mn831 1.0 0.97224 0.21875 0.50000 1.0000 + Mn Mn832 1.0 0.01391 0.26042 0.50000 1.0000 + Mn Mn833 1.0 0.05558 0.30209 0.50000 1.0000 + Mn Mn834 1.0 0.09724 0.34375 0.50000 1.0000 + Mn Mn835 1.0 0.13891 0.38542 0.50000 1.0000 + Mn Mn836 1.0 0.18058 0.42709 0.50000 1.0000 + Mn Mn837 1.0 0.22224 0.46875 0.50000 1.0000 + Mn Mn838 1.0 0.26391 0.51042 0.50000 1.0000 + Mn Mn839 1.0 0.30558 0.55209 0.50000 1.0000 + Mn Mn840 1.0 0.34724 0.59375 0.50000 1.0000 + Mn Mn841 1.0 0.93058 0.09375 0.50000 1.0000 + Mn Mn842 1.0 0.97224 0.13542 0.50000 1.0000 + Mn Mn843 1.0 0.01391 0.17709 0.50000 1.0000 + Mn Mn844 1.0 0.05558 0.21875 0.50000 1.0000 + Mn Mn845 1.0 0.09724 0.26042 0.50000 1.0000 + Mn Mn846 1.0 0.13891 0.30209 0.50000 1.0000 + Mn Mn847 1.0 0.18058 0.34375 0.50000 1.0000 + Mn Mn848 1.0 0.22224 0.38542 0.50000 1.0000 + Mn Mn849 1.0 0.26391 0.42709 0.50000 1.0000 + Mn Mn850 1.0 0.30558 0.46875 0.50000 1.0000 + Mn Mn851 1.0 0.34724 0.51042 0.50000 1.0000 + Mn Mn852 1.0 0.38891 0.55209 0.50000 1.0000 + Mn Mn853 1.0 0.97224 0.05209 0.50000 1.0000 + Mn Mn854 1.0 0.01391 0.09375 0.50000 1.0000 + Mn Mn855 1.0 0.05558 0.13542 0.50000 1.0000 + Mn Mn856 1.0 0.09724 0.17709 0.50000 1.0000 + Mn Mn857 1.0 0.13891 0.21875 0.50000 1.0000 + Mn Mn858 1.0 0.18058 0.26042 0.50000 1.0000 + Mn Mn859 1.0 0.22224 0.30209 0.50000 1.0000 + Mn Mn860 1.0 0.26391 0.34375 0.50000 1.0000 + Mn Mn861 1.0 0.30558 0.38542 0.50000 1.0000 + Mn Mn862 1.0 0.34724 0.42709 0.50000 1.0000 + Mn Mn863 1.0 0.38891 0.46875 0.50000 1.0000 + Mn Mn864 1.0 0.43058 0.51042 0.50000 1.0000 + Sb Sb145 1.0 0.55558 0.51041 0.50000 1.0000 + Sb Sb146 1.0 0.59724 0.55207 0.50000 1.0000 + Sb Sb147 1.0 0.63891 0.59374 0.50000 1.0000 + Sb Sb148 1.0 0.68058 0.63541 0.50000 1.0000 + Sb Sb149 1.0 0.72224 0.67707 0.50000 1.0000 + Sb Sb150 1.0 0.76391 0.71874 0.50000 1.0000 + Sb Sb151 1.0 0.80558 0.76041 0.50000 1.0000 + Sb Sb152 1.0 0.84724 0.80207 0.50000 1.0000 + Sb Sb153 1.0 0.88891 0.84374 0.50000 1.0000 + Sb Sb154 1.0 0.93058 0.88541 0.50000 1.0000 + Sb Sb155 1.0 0.97224 0.92707 0.50000 1.0000 + Sb Sb156 1.0 0.01391 0.96874 0.50000 1.0000 + Sb Sb157 1.0 0.59724 0.46874 0.50000 1.0000 + Sb Sb158 1.0 0.63891 0.51041 0.50000 1.0000 + Sb Sb159 1.0 0.68058 0.55207 0.50000 1.0000 + Sb Sb160 1.0 0.72224 0.59374 0.50000 1.0000 + Sb Sb161 1.0 0.76391 0.63541 0.50000 1.0000 + Sb Sb162 1.0 0.80558 0.67707 0.50000 1.0000 + Sb Sb163 1.0 0.84724 0.71874 0.50000 1.0000 + Sb Sb164 1.0 0.88891 0.76041 0.50000 1.0000 + Sb Sb165 1.0 0.93058 0.80207 0.50000 1.0000 + Sb Sb166 1.0 0.97224 0.84374 0.50000 1.0000 + Sb Sb167 1.0 0.01391 0.88541 0.50000 1.0000 + Sb Sb168 1.0 0.05558 0.92707 0.50000 1.0000 + Sb Sb169 1.0 0.63891 0.42707 0.50000 1.0000 + Sb Sb170 1.0 0.68058 0.46874 0.50000 1.0000 + Sb Sb171 1.0 0.72224 0.51041 0.50000 1.0000 + Sb Sb172 1.0 0.76391 0.55207 0.50000 1.0000 + Sb Sb173 1.0 0.80558 0.59374 0.50000 1.0000 + Sb Sb174 1.0 0.84724 0.63541 0.50000 1.0000 + Sb Sb175 1.0 0.88891 0.67707 0.50000 1.0000 + Sb Sb176 1.0 0.93058 0.71874 0.50000 1.0000 + Sb Sb177 1.0 0.97224 0.76041 0.50000 1.0000 + Sb Sb178 1.0 0.01391 0.80207 0.50000 1.0000 + Sb Sb179 1.0 0.05558 0.84374 0.50000 1.0000 + Sb Sb180 1.0 0.09724 0.88541 0.50000 1.0000 + Sb Sb181 1.0 0.68058 0.38541 0.50000 1.0000 + Sb Sb182 1.0 0.72224 0.42707 0.50000 1.0000 + Sb Sb183 1.0 0.76391 0.46874 0.50000 1.0000 + Sb Sb184 1.0 0.80558 0.51041 0.50000 1.0000 + Sb Sb185 1.0 0.84724 0.55207 0.50000 1.0000 + Sb Sb186 1.0 0.88891 0.59374 0.50000 1.0000 + Sb Sb187 1.0 0.93058 0.63541 0.50000 1.0000 + Sb Sb188 1.0 0.97224 0.67707 0.50000 1.0000 + Sb Sb189 1.0 0.01391 0.71874 0.50000 1.0000 + Sb Sb190 1.0 0.05558 0.76041 0.50000 1.0000 + Sb Sb191 1.0 0.09724 0.80207 0.50000 1.0000 + Sb Sb192 1.0 0.13891 0.84374 0.50000 1.0000 + Sb Sb193 1.0 0.72224 0.34374 0.50000 1.0000 + Sb Sb194 1.0 0.76391 0.38541 0.50000 1.0000 + Sb Sb195 1.0 0.80558 0.42707 0.50000 1.0000 + Sb Sb196 1.0 0.84724 0.46874 0.50000 1.0000 + Sb Sb197 1.0 0.88891 0.51041 0.50000 1.0000 + Sb Sb198 1.0 0.93058 0.55207 0.50000 1.0000 + Sb Sb199 1.0 0.97224 0.59374 0.50000 1.0000 + Sb Sb200 1.0 0.01391 0.63541 0.50000 1.0000 + Sb Sb201 1.0 0.05558 0.67707 0.50000 1.0000 + Sb Sb202 1.0 0.09724 0.71874 0.50000 1.0000 + Sb Sb203 1.0 0.13891 0.76041 0.50000 1.0000 + Sb Sb204 1.0 0.18058 0.80207 0.50000 1.0000 + Sb Sb205 1.0 0.76391 0.30207 0.50000 1.0000 + Sb Sb206 1.0 0.80558 0.34374 0.50000 1.0000 + Sb Sb207 1.0 0.84724 0.38541 0.50000 1.0000 + Sb Sb208 1.0 0.88891 0.42707 0.50000 1.0000 + Sb Sb209 1.0 0.93058 0.46874 0.50000 1.0000 + Sb Sb210 1.0 0.97224 0.51041 0.50000 1.0000 + Sb Sb211 1.0 0.01391 0.55207 0.50000 1.0000 + Sb Sb212 1.0 0.05558 0.59374 0.50000 1.0000 + Sb Sb213 1.0 0.09724 0.63541 0.50000 1.0000 + Sb Sb214 1.0 0.13891 0.67707 0.50000 1.0000 + Sb Sb215 1.0 0.18058 0.71874 0.50000 1.0000 + Sb Sb216 1.0 0.22224 0.76041 0.50000 1.0000 + Sb Sb217 1.0 0.80558 0.26041 0.50000 1.0000 + Sb Sb218 1.0 0.84724 0.30207 0.50000 1.0000 + Sb Sb219 1.0 0.88891 0.34374 0.50000 1.0000 + Sb Sb220 1.0 0.93058 0.38541 0.50000 1.0000 + Sb Sb221 1.0 0.97224 0.42707 0.50000 1.0000 + Sb Sb222 1.0 0.01391 0.46874 0.50000 1.0000 + Sb Sb223 1.0 0.05558 0.51041 0.50000 1.0000 + Sb Sb224 1.0 0.09724 0.55207 0.50000 1.0000 + Sb Sb225 1.0 0.13891 0.59374 0.50000 1.0000 + Sb Sb226 1.0 0.18058 0.63541 0.50000 1.0000 + Sb Sb227 1.0 0.22224 0.67707 0.50000 1.0000 + Sb Sb228 1.0 0.26391 0.71874 0.50000 1.0000 + Sb Sb229 1.0 0.84724 0.21874 0.50000 1.0000 + Sb Sb230 1.0 0.88891 0.26041 0.50000 1.0000 + Sb Sb231 1.0 0.93058 0.30207 0.50000 1.0000 + Sb Sb232 1.0 0.97224 0.34374 0.50000 1.0000 + Sb Sb233 1.0 0.01391 0.38541 0.50000 1.0000 + Sb Sb234 1.0 0.05558 0.42707 0.50000 1.0000 + Sb Sb235 1.0 0.09724 0.46874 0.50000 1.0000 + Sb Sb236 1.0 0.13891 0.51041 0.50000 1.0000 + Sb Sb237 1.0 0.18058 0.55207 0.50000 1.0000 + Sb Sb238 1.0 0.22224 0.59374 0.50000 1.0000 + Sb Sb239 1.0 0.26391 0.63541 0.50000 1.0000 + Sb Sb240 1.0 0.30558 0.67707 0.50000 1.0000 + Sb Sb241 1.0 0.88891 0.17707 0.50000 1.0000 + Sb Sb242 1.0 0.93058 0.21874 0.50000 1.0000 + Sb Sb243 1.0 0.97224 0.26041 0.50000 1.0000 + Sb Sb244 1.0 0.01391 0.30207 0.50000 1.0000 + Sb Sb245 1.0 0.05558 0.34374 0.50000 1.0000 + Sb Sb246 1.0 0.09724 0.38541 0.50000 1.0000 + Sb Sb247 1.0 0.13891 0.42707 0.50000 1.0000 + Sb Sb248 1.0 0.18058 0.46874 0.50000 1.0000 + Sb Sb249 1.0 0.22224 0.51041 0.50000 1.0000 + Sb Sb250 1.0 0.26391 0.55207 0.50000 1.0000 + Sb Sb251 1.0 0.30558 0.59374 0.50000 1.0000 + Sb Sb252 1.0 0.34724 0.63541 0.50000 1.0000 + Sb Sb253 1.0 0.93058 0.13541 0.50000 1.0000 + Sb Sb254 1.0 0.97224 0.17707 0.50000 1.0000 + Sb Sb255 1.0 0.01391 0.21874 0.50000 1.0000 + Sb Sb256 1.0 0.05558 0.26041 0.50000 1.0000 + Sb Sb257 1.0 0.09724 0.30207 0.50000 1.0000 + Sb Sb258 1.0 0.13891 0.34374 0.50000 1.0000 + Sb Sb259 1.0 0.18058 0.38541 0.50000 1.0000 + Sb Sb260 1.0 0.22224 0.42707 0.50000 1.0000 + Sb Sb261 1.0 0.26391 0.46874 0.50000 1.0000 + Sb Sb262 1.0 0.30558 0.51041 0.50000 1.0000 + Sb Sb263 1.0 0.34724 0.55207 0.50000 1.0000 + Sb Sb264 1.0 0.38891 0.59374 0.50000 1.0000 + Sb Sb265 1.0 0.97224 0.09374 0.50000 1.0000 + Sb Sb266 1.0 0.01391 0.13541 0.50000 1.0000 + Sb Sb267 1.0 0.05558 0.17707 0.50000 1.0000 + Sb Sb268 1.0 0.09724 0.21874 0.50000 1.0000 + Sb Sb269 1.0 0.13891 0.26041 0.50000 1.0000 + Sb Sb270 1.0 0.18058 0.30207 0.50000 1.0000 + Sb Sb271 1.0 0.22224 0.34374 0.50000 1.0000 + Sb Sb272 1.0 0.26391 0.38541 0.50000 1.0000 + Sb Sb273 1.0 0.30558 0.42707 0.50000 1.0000 + Sb Sb274 1.0 0.34724 0.46874 0.50000 1.0000 + Sb Sb275 1.0 0.38891 0.51041 0.50000 1.0000 + Sb Sb276 1.0 0.43058 0.55207 0.50000 1.0000 + Sb Sb277 1.0 0.01391 0.05207 0.50000 1.0000 + Sb Sb278 1.0 0.05558 0.09374 0.50000 1.0000 + Sb Sb279 1.0 0.09724 0.13541 0.50000 1.0000 + Sb Sb280 1.0 0.13891 0.17707 0.50000 1.0000 + Sb Sb281 1.0 0.18058 0.21874 0.50000 1.0000 + Sb Sb282 1.0 0.22224 0.26041 0.50000 1.0000 + Sb Sb283 1.0 0.26391 0.30207 0.50000 1.0000 + Sb Sb284 1.0 0.30558 0.34374 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0.50000 1.0000 + Te Te9 1.0 0.00003 0.51132 0.50000 1.0000 + Te Te10 1.0 0.00003 0.57382 0.50000 1.0000 + Te Te11 1.0 0.00003 0.63632 0.50000 1.0000 + Te Te12 1.0 0.00003 0.69882 0.50000 1.0000 + Te Te13 1.0 0.00003 0.76132 0.50000 1.0000 + Te Te14 1.0 0.00003 0.82382 0.50000 1.0000 + Te Te15 1.0 0.00003 0.88632 0.50000 1.0000 + Te Te16 1.0 0.00003 0.94882 0.50000 1.0000 + Te Te17 1.0 0.06253 0.01132 0.50000 1.0000 + Te Te18 1.0 0.06253 0.07382 0.50000 1.0000 + Te Te19 1.0 0.06253 0.13632 0.50000 1.0000 + Te Te20 1.0 0.06253 0.19882 0.50000 1.0000 + Te Te21 1.0 0.06253 0.26132 0.50000 1.0000 + Te Te22 1.0 0.06253 0.32382 0.50000 1.0000 + Te Te23 1.0 0.06253 0.38632 0.50000 1.0000 + Te Te24 1.0 0.06253 0.44882 0.50000 1.0000 + Te Te25 1.0 0.06253 0.51132 0.50000 1.0000 + Te Te26 1.0 0.06253 0.57382 0.50000 1.0000 + Te Te27 1.0 0.06253 0.63632 0.50000 1.0000 + Te Te28 1.0 0.06253 0.69882 0.50000 1.0000 + Te Te29 1.0 0.06253 0.76132 0.50000 1.0000 + Te Te30 1.0 0.06253 0.82382 0.50000 1.0000 + Te Te31 1.0 0.06253 0.88632 0.50000 1.0000 + Te Te32 1.0 0.06253 0.94882 0.50000 1.0000 + Te Te33 1.0 0.12503 0.01132 0.50000 1.0000 + Te Te34 1.0 0.12503 0.07382 0.50000 1.0000 + Te Te35 1.0 0.12503 0.13632 0.50000 1.0000 + Te Te36 1.0 0.12503 0.19882 0.50000 1.0000 + Te Te37 1.0 0.12503 0.26132 0.50000 1.0000 + Te Te38 1.0 0.12503 0.32382 0.50000 1.0000 + Te Te39 1.0 0.12503 0.38632 0.50000 1.0000 + Te Te40 1.0 0.12503 0.44882 0.50000 1.0000 + Te Te41 1.0 0.12503 0.51132 0.50000 1.0000 + Te Te42 1.0 0.12503 0.57382 0.50000 1.0000 + Te Te43 1.0 0.12503 0.63632 0.50000 1.0000 + Te Te44 1.0 0.12503 0.69882 0.50000 1.0000 + Te Te45 1.0 0.12503 0.76132 0.50000 1.0000 + Te Te46 1.0 0.12503 0.82382 0.50000 1.0000 + Te Te47 1.0 0.12503 0.88632 0.50000 1.0000 + Te Te48 1.0 0.12503 0.94882 0.50000 1.0000 + Te Te49 1.0 0.18753 0.01132 0.50000 1.0000 + Te Te50 1.0 0.18753 0.07382 0.50000 1.0000 + Te Te51 1.0 0.18753 0.13632 0.50000 1.0000 + Te Te52 1.0 0.18753 0.19882 0.50000 1.0000 + 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0.37503 0.01132 0.50000 1.0000 + Te Te98 1.0 0.37503 0.07382 0.50000 1.0000 + Te Te99 1.0 0.37503 0.13632 0.50000 1.0000 + Te Te100 1.0 0.37503 0.19882 0.50000 1.0000 + Te Te101 1.0 0.37503 0.26132 0.50000 1.0000 + Te Te102 1.0 0.37503 0.32382 0.50000 1.0000 + Te Te103 1.0 0.37503 0.38632 0.50000 1.0000 + Te Te104 1.0 0.37503 0.44882 0.50000 1.0000 + Te Te105 1.0 0.37503 0.51132 0.50000 1.0000 + Te Te106 1.0 0.37503 0.57382 0.50000 1.0000 + Te Te107 1.0 0.37503 0.63632 0.50000 1.0000 + Te Te108 1.0 0.37503 0.69882 0.50000 1.0000 + Te Te109 1.0 0.37503 0.76132 0.50000 1.0000 + Te Te110 1.0 0.37503 0.82382 0.50000 1.0000 + Te Te111 1.0 0.37503 0.88632 0.50000 1.0000 + Te Te112 1.0 0.37503 0.94882 0.50000 1.0000 + Te Te113 1.0 0.43753 0.01132 0.50000 1.0000 + Te Te114 1.0 0.43753 0.07382 0.50000 1.0000 + Te Te115 1.0 0.43753 0.13632 0.50000 1.0000 + Te Te116 1.0 0.43753 0.19882 0.50000 1.0000 + Te Te117 1.0 0.43753 0.26132 0.50000 1.0000 + Te Te118 1.0 0.43753 0.32382 0.50000 1.0000 + Te 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0.14494 0.32346 1.0000 + O O948 1.0 0.71878 0.20744 0.32346 1.0000 + O O949 1.0 0.71878 0.26994 0.32346 1.0000 + O O950 1.0 0.71878 0.33244 0.32346 1.0000 + O O951 1.0 0.71878 0.39494 0.32346 1.0000 + O O952 1.0 0.71878 0.45744 0.32346 1.0000 + O O953 1.0 0.71878 0.51994 0.32346 1.0000 + O O954 1.0 0.71878 0.58244 0.32346 1.0000 + O O955 1.0 0.71878 0.64494 0.32346 1.0000 + O O956 1.0 0.71878 0.70744 0.32346 1.0000 + O O957 1.0 0.71878 0.76994 0.32346 1.0000 + O O958 1.0 0.71878 0.83244 0.32346 1.0000 + O O959 1.0 0.71878 0.89494 0.32346 1.0000 + O O960 1.0 0.71878 0.95744 0.32346 1.0000 + O O961 1.0 0.78128 0.01994 0.32346 1.0000 + O O962 1.0 0.78128 0.08244 0.32346 1.0000 + O O963 1.0 0.78128 0.14494 0.32346 1.0000 + O O964 1.0 0.78128 0.20744 0.32346 1.0000 + O O965 1.0 0.78128 0.26994 0.32346 1.0000 + O O966 1.0 0.78128 0.33244 0.32346 1.0000 + O O967 1.0 0.78128 0.39494 0.32346 1.0000 + O O968 1.0 0.78128 0.45744 0.32346 1.0000 + O O969 1.0 0.78128 0.51994 0.32346 1.0000 + O O970 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1.0000 + O O993 1.0 0.90628 0.01994 0.32346 1.0000 + O O994 1.0 0.90628 0.08244 0.32346 1.0000 + O O995 1.0 0.90628 0.14494 0.32346 1.0000 + O O996 1.0 0.90628 0.20744 0.32346 1.0000 + O O997 1.0 0.90628 0.26994 0.32346 1.0000 + O O998 1.0 0.90628 0.33244 0.32346 1.0000 + O O999 1.0 0.90628 0.39494 0.32346 1.0000 + O O1000 1.0 0.90628 0.45744 0.32346 1.0000 + O O1001 1.0 0.90628 0.51994 0.32346 1.0000 + O O1002 1.0 0.90628 0.58244 0.32346 1.0000 + O O1003 1.0 0.90628 0.64494 0.32346 1.0000 + O O1004 1.0 0.90628 0.70744 0.32346 1.0000 + O O1005 1.0 0.90628 0.76994 0.32346 1.0000 + O O1006 1.0 0.90628 0.83244 0.32346 1.0000 + O O1007 1.0 0.90628 0.89494 0.32346 1.0000 + O O1008 1.0 0.90628 0.95744 0.32346 1.0000 + O O1009 1.0 0.96878 0.01994 0.32346 1.0000 + O O1010 1.0 0.96878 0.08244 0.32346 1.0000 + O O1011 1.0 0.96878 0.14494 0.32346 1.0000 + O O1012 1.0 0.96878 0.20744 0.32346 1.0000 + O O1013 1.0 0.96878 0.26994 0.32346 1.0000 + O O1014 1.0 0.96878 0.33244 0.32346 1.0000 + O O1015 1.0 0.96878 0.39494 0.32346 1.0000 + O O1016 1.0 0.96878 0.45744 0.32346 1.0000 + O O1017 1.0 0.96878 0.51994 0.32346 1.0000 + O O1018 1.0 0.96878 0.58244 0.32346 1.0000 + O O1019 1.0 0.96878 0.64494 0.32346 1.0000 + O O1020 1.0 0.96878 0.70744 0.32346 1.0000 + O O1021 1.0 0.96878 0.76994 0.32346 1.0000 + O O1022 1.0 0.96878 0.83244 0.32346 1.0000 + O O1023 1.0 0.96878 0.89494 0.32346 1.0000 + O O1024 1.0 0.96878 0.95744 0.32346 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-4071_supercell_12x12x1.cif b/tier3/cif_file/orthogonal_2dm-4071_supercell_12x12x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..b4bf969b94a2f75466b3eb3c17285b4a3f4d4eeb --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-4071_supercell_12x12x1.cif @@ -0,0 +1,1897 @@ +data_image0 +_chemical_formula_structural Zn288Co432O1152 +_chemical_formula_sum "Zn288 Co432 O1152" +_cell_length_a 60.7911 +_cell_length_b 69.2724 +_cell_length_c 6.9527 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Zn Zn1 1.0 0.02496 0.00000 0.71234 1.0000 + Zn Zn2 1.0 0.02496 0.08333 0.71234 1.0000 + Zn Zn3 1.0 0.02496 0.16667 0.71234 1.0000 + Zn Zn4 1.0 0.02496 0.25000 0.71234 1.0000 + Zn Zn5 1.0 0.02496 0.33333 0.71234 1.0000 + Zn Zn6 1.0 0.02496 0.41667 0.71234 1.0000 + Zn Zn7 1.0 0.02496 0.50000 0.71234 1.0000 + Zn Zn8 1.0 0.02496 0.58333 0.71234 1.0000 + Zn Zn9 1.0 0.02496 0.66667 0.71234 1.0000 + Zn Zn10 1.0 0.02496 0.75000 0.71234 1.0000 + Zn Zn11 1.0 0.02496 0.83333 0.71234 1.0000 + Zn Zn12 1.0 0.02496 0.91667 0.71234 1.0000 + Zn Zn13 1.0 0.10830 0.00000 0.71234 1.0000 + Zn Zn14 1.0 0.10830 0.08333 0.71234 1.0000 + Zn Zn15 1.0 0.10830 0.16667 0.71234 1.0000 + Zn Zn16 1.0 0.10830 0.25000 0.71234 1.0000 + Zn Zn17 1.0 0.10830 0.33333 0.71234 1.0000 + Zn Zn18 1.0 0.10830 0.41667 0.71234 1.0000 + Zn Zn19 1.0 0.10830 0.50000 0.71234 1.0000 + Zn Zn20 1.0 0.10830 0.58333 0.71234 1.0000 + Zn Zn21 1.0 0.10830 0.66667 0.71234 1.0000 + Zn Zn22 1.0 0.10830 0.75000 0.71234 1.0000 + Zn Zn23 1.0 0.10830 0.83333 0.71234 1.0000 + Zn Zn24 1.0 0.10830 0.91667 0.71234 1.0000 + Zn Zn25 1.0 0.19163 0.00000 0.71234 1.0000 + Zn Zn26 1.0 0.19163 0.08333 0.71234 1.0000 + Zn Zn27 1.0 0.19163 0.16667 0.71234 1.0000 + Zn Zn28 1.0 0.19163 0.25000 0.71234 1.0000 + Zn Zn29 1.0 0.19163 0.33333 0.71234 1.0000 + Zn Zn30 1.0 0.19163 0.41667 0.71234 1.0000 + Zn Zn31 1.0 0.19163 0.50000 0.71234 1.0000 + Zn Zn32 1.0 0.19163 0.58333 0.71234 1.0000 + Zn Zn33 1.0 0.19163 0.66667 0.71234 1.0000 + Zn Zn34 1.0 0.19163 0.75000 0.71234 1.0000 + Zn Zn35 1.0 0.19163 0.83333 0.71234 1.0000 + Zn Zn36 1.0 0.19163 0.91667 0.71234 1.0000 + Zn Zn37 1.0 0.27496 0.00000 0.71234 1.0000 + Zn Zn38 1.0 0.27496 0.08333 0.71234 1.0000 + Zn Zn39 1.0 0.27496 0.16667 0.71234 1.0000 + Zn Zn40 1.0 0.27496 0.25000 0.71234 1.0000 + Zn Zn41 1.0 0.27496 0.33333 0.71234 1.0000 + Zn Zn42 1.0 0.27496 0.41667 0.71234 1.0000 + Zn Zn43 1.0 0.27496 0.50000 0.71234 1.0000 + Zn Zn44 1.0 0.27496 0.58333 0.71234 1.0000 + Zn Zn45 1.0 0.27496 0.66667 0.71234 1.0000 + Zn Zn46 1.0 0.27496 0.75000 0.71234 1.0000 + Zn Zn47 1.0 0.27496 0.83333 0.71234 1.0000 + Zn Zn48 1.0 0.27496 0.91667 0.71234 1.0000 + Zn Zn49 1.0 0.35830 0.00000 0.71234 1.0000 + Zn Zn50 1.0 0.35830 0.08333 0.71234 1.0000 + Zn Zn51 1.0 0.35830 0.16667 0.71234 1.0000 + Zn Zn52 1.0 0.35830 0.25000 0.71234 1.0000 + Zn Zn53 1.0 0.35830 0.33333 0.71234 1.0000 + Zn Zn54 1.0 0.35830 0.41667 0.71234 1.0000 + Zn Zn55 1.0 0.35830 0.50000 0.71234 1.0000 + Zn Zn56 1.0 0.35830 0.58333 0.71234 1.0000 + Zn Zn57 1.0 0.35830 0.66667 0.71234 1.0000 + Zn Zn58 1.0 0.35830 0.75000 0.71234 1.0000 + Zn Zn59 1.0 0.35830 0.83333 0.71234 1.0000 + Zn Zn60 1.0 0.35830 0.91667 0.71234 1.0000 + Zn Zn61 1.0 0.44163 0.00000 0.71234 1.0000 + Zn Zn62 1.0 0.44163 0.08333 0.71234 1.0000 + Zn Zn63 1.0 0.44163 0.16667 0.71234 1.0000 + Zn Zn64 1.0 0.44163 0.25000 0.71234 1.0000 + Zn Zn65 1.0 0.44163 0.33333 0.71234 1.0000 + Zn Zn66 1.0 0.44163 0.41667 0.71234 1.0000 + Zn Zn67 1.0 0.44163 0.50000 0.71234 1.0000 + Zn Zn68 1.0 0.44163 0.58333 0.71234 1.0000 + Zn Zn69 1.0 0.44163 0.66667 0.71234 1.0000 + Zn Zn70 1.0 0.44163 0.75000 0.71234 1.0000 + Zn Zn71 1.0 0.44163 0.83333 0.71234 1.0000 + Zn Zn72 1.0 0.44163 0.91667 0.71234 1.0000 + Zn Zn73 1.0 0.52496 0.00000 0.71234 1.0000 + Zn Zn74 1.0 0.52496 0.08333 0.71234 1.0000 + Zn Zn75 1.0 0.52496 0.16667 0.71234 1.0000 + Zn Zn76 1.0 0.52496 0.25000 0.71234 1.0000 + Zn Zn77 1.0 0.52496 0.33333 0.71234 1.0000 + Zn Zn78 1.0 0.52496 0.41667 0.71234 1.0000 + Zn Zn79 1.0 0.52496 0.50000 0.71234 1.0000 + Zn Zn80 1.0 0.52496 0.58333 0.71234 1.0000 + Zn Zn81 1.0 0.52496 0.66667 0.71234 1.0000 + Zn Zn82 1.0 0.52496 0.75000 0.71234 1.0000 + Zn Zn83 1.0 0.52496 0.83333 0.71234 1.0000 + Zn Zn84 1.0 0.52496 0.91667 0.71234 1.0000 + Zn Zn85 1.0 0.60830 0.00000 0.71234 1.0000 + Zn Zn86 1.0 0.60830 0.08333 0.71234 1.0000 + Zn Zn87 1.0 0.60830 0.16667 0.71234 1.0000 + Zn Zn88 1.0 0.60830 0.25000 0.71234 1.0000 + Zn Zn89 1.0 0.60830 0.33333 0.71234 1.0000 + Zn Zn90 1.0 0.60830 0.41667 0.71234 1.0000 + Zn Zn91 1.0 0.60830 0.50000 0.71234 1.0000 + Zn Zn92 1.0 0.60830 0.58333 0.71234 1.0000 + Zn Zn93 1.0 0.60830 0.66667 0.71234 1.0000 + Zn Zn94 1.0 0.60830 0.75000 0.71234 1.0000 + Zn Zn95 1.0 0.60830 0.83333 0.71234 1.0000 + Zn Zn96 1.0 0.60830 0.91667 0.71234 1.0000 + Zn Zn97 1.0 0.69163 0.00000 0.71234 1.0000 + Zn Zn98 1.0 0.69163 0.08333 0.71234 1.0000 + Zn Zn99 1.0 0.69163 0.16667 0.71234 1.0000 + Zn Zn100 1.0 0.69163 0.25000 0.71234 1.0000 + Zn Zn101 1.0 0.69163 0.33333 0.71234 1.0000 + Zn Zn102 1.0 0.69163 0.41667 0.71234 1.0000 + Zn Zn103 1.0 0.69163 0.50000 0.71234 1.0000 + Zn Zn104 1.0 0.69163 0.58333 0.71234 1.0000 + Zn Zn105 1.0 0.69163 0.66667 0.71234 1.0000 + Zn Zn106 1.0 0.69163 0.75000 0.71234 1.0000 + Zn Zn107 1.0 0.69163 0.83333 0.71234 1.0000 + Zn Zn108 1.0 0.69163 0.91667 0.71234 1.0000 + Zn Zn109 1.0 0.77496 0.00000 0.71234 1.0000 + Zn Zn110 1.0 0.77496 0.08333 0.71234 1.0000 + Zn Zn111 1.0 0.77496 0.16667 0.71234 1.0000 + Zn Zn112 1.0 0.77496 0.25000 0.71234 1.0000 + Zn Zn113 1.0 0.77496 0.33333 0.71234 1.0000 + Zn Zn114 1.0 0.77496 0.41667 0.71234 1.0000 + Zn Zn115 1.0 0.77496 0.50000 0.71234 1.0000 + Zn Zn116 1.0 0.77496 0.58333 0.71234 1.0000 + Zn Zn117 1.0 0.77496 0.66667 0.71234 1.0000 + Zn Zn118 1.0 0.77496 0.75000 0.71234 1.0000 + Zn Zn119 1.0 0.77496 0.83333 0.71234 1.0000 + Zn Zn120 1.0 0.77496 0.91667 0.71234 1.0000 + Zn Zn121 1.0 0.85830 0.00000 0.71234 1.0000 + Zn Zn122 1.0 0.85830 0.08333 0.71234 1.0000 + Zn Zn123 1.0 0.85830 0.16667 0.71234 1.0000 + Zn Zn124 1.0 0.85830 0.25000 0.71234 1.0000 + Zn Zn125 1.0 0.85830 0.33333 0.71234 1.0000 + Zn Zn126 1.0 0.85830 0.41667 0.71234 1.0000 + Zn Zn127 1.0 0.85830 0.50000 0.71234 1.0000 + Zn Zn128 1.0 0.85830 0.58333 0.71234 1.0000 + Zn Zn129 1.0 0.85830 0.66667 0.71234 1.0000 + Zn Zn130 1.0 0.85830 0.75000 0.71234 1.0000 + Zn Zn131 1.0 0.85830 0.83333 0.71234 1.0000 + Zn Zn132 1.0 0.85830 0.91667 0.71234 1.0000 + Zn Zn133 1.0 0.94163 0.00000 0.71234 1.0000 + Zn Zn134 1.0 0.94163 0.08333 0.71234 1.0000 + Zn Zn135 1.0 0.94163 0.16667 0.71234 1.0000 + Zn Zn136 1.0 0.94163 0.25000 0.71234 1.0000 + Zn Zn137 1.0 0.94163 0.33333 0.71234 1.0000 + Zn Zn138 1.0 0.94163 0.41667 0.71234 1.0000 + Zn Zn139 1.0 0.94163 0.50000 0.71234 1.0000 + Zn Zn140 1.0 0.94163 0.58333 0.71234 1.0000 + Zn Zn141 1.0 0.94163 0.66667 0.71234 1.0000 + Zn Zn142 1.0 0.94163 0.75000 0.71234 1.0000 + Zn Zn143 1.0 0.94163 0.83333 0.71234 1.0000 + Zn Zn144 1.0 0.94163 0.91667 0.71234 1.0000 + Zn Zn145 1.0 0.02250 0.00000 0.28766 1.0000 + Zn Zn146 1.0 0.02250 0.08333 0.28766 1.0000 + Zn Zn147 1.0 0.02250 0.16667 0.28766 1.0000 + Zn Zn148 1.0 0.02250 0.25000 0.28766 1.0000 + Zn Zn149 1.0 0.02250 0.33333 0.28766 1.0000 + Zn Zn150 1.0 0.02250 0.41667 0.28766 1.0000 + Zn Zn151 1.0 0.02250 0.50000 0.28766 1.0000 + Zn Zn152 1.0 0.02250 0.58333 0.28766 1.0000 + Zn Zn153 1.0 0.02250 0.66667 0.28766 1.0000 + Zn Zn154 1.0 0.02250 0.75000 0.28766 1.0000 + Zn Zn155 1.0 0.02250 0.83333 0.28766 1.0000 + Zn Zn156 1.0 0.02250 0.91667 0.28766 1.0000 + Zn Zn157 1.0 0.10583 0.00000 0.28766 1.0000 + Zn Zn158 1.0 0.10583 0.08333 0.28766 1.0000 + Zn Zn159 1.0 0.10583 0.16667 0.28766 1.0000 + Zn Zn160 1.0 0.10583 0.25000 0.28766 1.0000 + Zn Zn161 1.0 0.10583 0.33333 0.28766 1.0000 + Zn Zn162 1.0 0.10583 0.41667 0.28766 1.0000 + Zn Zn163 1.0 0.10583 0.50000 0.28766 1.0000 + Zn Zn164 1.0 0.10583 0.58333 0.28766 1.0000 + Zn Zn165 1.0 0.10583 0.66667 0.28766 1.0000 + Zn Zn166 1.0 0.10583 0.75000 0.28766 1.0000 + Zn Zn167 1.0 0.10583 0.83333 0.28766 1.0000 + Zn Zn168 1.0 0.10583 0.91667 0.28766 1.0000 + Zn Zn169 1.0 0.18917 0.00000 0.28766 1.0000 + Zn Zn170 1.0 0.18917 0.08333 0.28766 1.0000 + Zn Zn171 1.0 0.18917 0.16667 0.28766 1.0000 + Zn Zn172 1.0 0.18917 0.25000 0.28766 1.0000 + Zn Zn173 1.0 0.18917 0.33333 0.28766 1.0000 + Zn Zn174 1.0 0.18917 0.41667 0.28766 1.0000 + Zn Zn175 1.0 0.18917 0.50000 0.28766 1.0000 + Zn Zn176 1.0 0.18917 0.58333 0.28766 1.0000 + Zn Zn177 1.0 0.18917 0.66667 0.28766 1.0000 + Zn Zn178 1.0 0.18917 0.75000 0.28766 1.0000 + Zn Zn179 1.0 0.18917 0.83333 0.28766 1.0000 + Zn Zn180 1.0 0.18917 0.91667 0.28766 1.0000 + Zn Zn181 1.0 0.27250 0.00000 0.28766 1.0000 + Zn Zn182 1.0 0.27250 0.08333 0.28766 1.0000 + Zn Zn183 1.0 0.27250 0.16667 0.28766 1.0000 + Zn Zn184 1.0 0.27250 0.25000 0.28766 1.0000 + Zn Zn185 1.0 0.27250 0.33333 0.28766 1.0000 + Zn Zn186 1.0 0.27250 0.41667 0.28766 1.0000 + Zn Zn187 1.0 0.27250 0.50000 0.28766 1.0000 + Zn Zn188 1.0 0.27250 0.58333 0.28766 1.0000 + Zn Zn189 1.0 0.27250 0.66667 0.28766 1.0000 + Zn Zn190 1.0 0.27250 0.75000 0.28766 1.0000 + Zn Zn191 1.0 0.27250 0.83333 0.28766 1.0000 + Zn Zn192 1.0 0.27250 0.91667 0.28766 1.0000 + Zn Zn193 1.0 0.35583 0.00000 0.28766 1.0000 + Zn Zn194 1.0 0.35583 0.08333 0.28766 1.0000 + Zn Zn195 1.0 0.35583 0.16667 0.28766 1.0000 + Zn Zn196 1.0 0.35583 0.25000 0.28766 1.0000 + Zn Zn197 1.0 0.35583 0.33333 0.28766 1.0000 + Zn Zn198 1.0 0.35583 0.41667 0.28766 1.0000 + Zn Zn199 1.0 0.35583 0.50000 0.28766 1.0000 + Zn Zn200 1.0 0.35583 0.58333 0.28766 1.0000 + Zn Zn201 1.0 0.35583 0.66667 0.28766 1.0000 + Zn Zn202 1.0 0.35583 0.75000 0.28766 1.0000 + Zn Zn203 1.0 0.35583 0.83333 0.28766 1.0000 + Zn Zn204 1.0 0.35583 0.91667 0.28766 1.0000 + Zn Zn205 1.0 0.43917 0.00000 0.28766 1.0000 + Zn Zn206 1.0 0.43917 0.08333 0.28766 1.0000 + Zn Zn207 1.0 0.43917 0.16667 0.28766 1.0000 + Zn Zn208 1.0 0.43917 0.25000 0.28766 1.0000 + Zn Zn209 1.0 0.43917 0.33333 0.28766 1.0000 + Zn Zn210 1.0 0.43917 0.41667 0.28766 1.0000 + Zn Zn211 1.0 0.43917 0.50000 0.28766 1.0000 + Zn Zn212 1.0 0.43917 0.58333 0.28766 1.0000 + Zn Zn213 1.0 0.43917 0.66667 0.28766 1.0000 + Zn Zn214 1.0 0.43917 0.75000 0.28766 1.0000 + Zn Zn215 1.0 0.43917 0.83333 0.28766 1.0000 + Zn Zn216 1.0 0.43917 0.91667 0.28766 1.0000 + Zn Zn217 1.0 0.52250 0.00000 0.28766 1.0000 + Zn Zn218 1.0 0.52250 0.08333 0.28766 1.0000 + Zn Zn219 1.0 0.52250 0.16667 0.28766 1.0000 + Zn Zn220 1.0 0.52250 0.25000 0.28766 1.0000 + Zn Zn221 1.0 0.52250 0.33333 0.28766 1.0000 + Zn Zn222 1.0 0.52250 0.41667 0.28766 1.0000 + Zn Zn223 1.0 0.52250 0.50000 0.28766 1.0000 + Zn Zn224 1.0 0.52250 0.58333 0.28766 1.0000 + Zn Zn225 1.0 0.52250 0.66667 0.28766 1.0000 + Zn Zn226 1.0 0.52250 0.75000 0.28766 1.0000 + Zn Zn227 1.0 0.52250 0.83333 0.28766 1.0000 + Zn Zn228 1.0 0.52250 0.91667 0.28766 1.0000 + Zn Zn229 1.0 0.60583 0.00000 0.28766 1.0000 + Zn Zn230 1.0 0.60583 0.08333 0.28766 1.0000 + Zn Zn231 1.0 0.60583 0.16667 0.28766 1.0000 + Zn Zn232 1.0 0.60583 0.25000 0.28766 1.0000 + Zn Zn233 1.0 0.60583 0.33333 0.28766 1.0000 + Zn Zn234 1.0 0.60583 0.41667 0.28766 1.0000 + Zn Zn235 1.0 0.60583 0.50000 0.28766 1.0000 + Zn Zn236 1.0 0.60583 0.58333 0.28766 1.0000 + Zn Zn237 1.0 0.60583 0.66667 0.28766 1.0000 + Zn Zn238 1.0 0.60583 0.75000 0.28766 1.0000 + Zn Zn239 1.0 0.60583 0.83333 0.28766 1.0000 + Zn Zn240 1.0 0.60583 0.91667 0.28766 1.0000 + Zn Zn241 1.0 0.68917 0.00000 0.28766 1.0000 + Zn Zn242 1.0 0.68917 0.08333 0.28766 1.0000 + Zn Zn243 1.0 0.68917 0.16667 0.28766 1.0000 + Zn Zn244 1.0 0.68917 0.25000 0.28766 1.0000 + Zn Zn245 1.0 0.68917 0.33333 0.28766 1.0000 + Zn Zn246 1.0 0.68917 0.41667 0.28766 1.0000 + Zn Zn247 1.0 0.68917 0.50000 0.28766 1.0000 + Zn Zn248 1.0 0.68917 0.58333 0.28766 1.0000 + Zn Zn249 1.0 0.68917 0.66667 0.28766 1.0000 + Zn Zn250 1.0 0.68917 0.75000 0.28766 1.0000 + Zn Zn251 1.0 0.68917 0.83333 0.28766 1.0000 + Zn Zn252 1.0 0.68917 0.91667 0.28766 1.0000 + Zn Zn253 1.0 0.77250 0.00000 0.28766 1.0000 + Zn Zn254 1.0 0.77250 0.08333 0.28766 1.0000 + Zn Zn255 1.0 0.77250 0.16667 0.28766 1.0000 + Zn Zn256 1.0 0.77250 0.25000 0.28766 1.0000 + Zn Zn257 1.0 0.77250 0.33333 0.28766 1.0000 + Zn Zn258 1.0 0.77250 0.41667 0.28766 1.0000 + Zn Zn259 1.0 0.77250 0.50000 0.28766 1.0000 + Zn Zn260 1.0 0.77250 0.58333 0.28766 1.0000 + Zn Zn261 1.0 0.77250 0.66667 0.28766 1.0000 + Zn Zn262 1.0 0.77250 0.75000 0.28766 1.0000 + Zn Zn263 1.0 0.77250 0.83333 0.28766 1.0000 + Zn Zn264 1.0 0.77250 0.91667 0.28766 1.0000 + Zn Zn265 1.0 0.85583 0.00000 0.28766 1.0000 + Zn Zn266 1.0 0.85583 0.08333 0.28766 1.0000 + Zn Zn267 1.0 0.85583 0.16667 0.28766 1.0000 + Zn Zn268 1.0 0.85583 0.25000 0.28766 1.0000 + Zn Zn269 1.0 0.85583 0.33333 0.28766 1.0000 + Zn Zn270 1.0 0.85583 0.41667 0.28766 1.0000 + Zn Zn271 1.0 0.85583 0.50000 0.28766 1.0000 + Zn Zn272 1.0 0.85583 0.58333 0.28766 1.0000 + Zn Zn273 1.0 0.85583 0.66667 0.28766 1.0000 + Zn Zn274 1.0 0.85583 0.75000 0.28766 1.0000 + Zn Zn275 1.0 0.85583 0.83333 0.28766 1.0000 + Zn Zn276 1.0 0.85583 0.91667 0.28766 1.0000 + Zn Zn277 1.0 0.93917 0.00000 0.28766 1.0000 + Zn Zn278 1.0 0.93917 0.08333 0.28766 1.0000 + Zn Zn279 1.0 0.93917 0.16667 0.28766 1.0000 + Zn Zn280 1.0 0.93917 0.25000 0.28766 1.0000 + Zn Zn281 1.0 0.93917 0.33333 0.28766 1.0000 + Zn Zn282 1.0 0.93917 0.41667 0.28766 1.0000 + Zn Zn283 1.0 0.93917 0.50000 0.28766 1.0000 + Zn Zn284 1.0 0.93917 0.58333 0.28766 1.0000 + Zn Zn285 1.0 0.93917 0.66667 0.28766 1.0000 + Zn Zn286 1.0 0.93917 0.75000 0.28766 1.0000 + Zn Zn287 1.0 0.93917 0.83333 0.28766 1.0000 + Zn Zn288 1.0 0.93917 0.91667 0.28766 1.0000 + Co Co1 1.0 0.02373 0.04167 0.50000 1.0000 + Co Co2 1.0 0.02373 0.12500 0.50000 1.0000 + Co Co3 1.0 0.02373 0.20833 0.50000 1.0000 + Co Co4 1.0 0.02373 0.29167 0.50000 1.0000 + Co Co5 1.0 0.02373 0.37500 0.50000 1.0000 + Co Co6 1.0 0.02373 0.45833 0.50000 1.0000 + Co Co7 1.0 0.02373 0.54167 0.50000 1.0000 + Co Co8 1.0 0.02373 0.62500 0.50000 1.0000 + Co Co9 1.0 0.02373 0.70833 0.50000 1.0000 + Co Co10 1.0 0.02373 0.79167 0.50000 1.0000 + Co Co11 1.0 0.02373 0.87500 0.50000 1.0000 + Co Co12 1.0 0.02373 0.95833 0.50000 1.0000 + Co Co13 1.0 0.10706 0.04167 0.50000 1.0000 + Co Co14 1.0 0.10706 0.12500 0.50000 1.0000 + Co Co15 1.0 0.10706 0.20833 0.50000 1.0000 + Co Co16 1.0 0.10706 0.29167 0.50000 1.0000 + Co Co17 1.0 0.10706 0.37500 0.50000 1.0000 + Co Co18 1.0 0.10706 0.45833 0.50000 1.0000 + Co Co19 1.0 0.10706 0.54167 0.50000 1.0000 + Co Co20 1.0 0.10706 0.62500 0.50000 1.0000 + Co Co21 1.0 0.10706 0.70833 0.50000 1.0000 + Co Co22 1.0 0.10706 0.79167 0.50000 1.0000 + Co Co23 1.0 0.10706 0.87500 0.50000 1.0000 + Co Co24 1.0 0.10706 0.95833 0.50000 1.0000 + Co Co25 1.0 0.19040 0.04167 0.50000 1.0000 + Co Co26 1.0 0.19040 0.12500 0.50000 1.0000 + Co Co27 1.0 0.19040 0.20833 0.50000 1.0000 + Co Co28 1.0 0.19040 0.29167 0.50000 1.0000 + Co Co29 1.0 0.19040 0.37500 0.50000 1.0000 + Co Co30 1.0 0.19040 0.45833 0.50000 1.0000 + Co Co31 1.0 0.19040 0.54167 0.50000 1.0000 + Co Co32 1.0 0.19040 0.62500 0.50000 1.0000 + Co Co33 1.0 0.19040 0.70833 0.50000 1.0000 + Co Co34 1.0 0.19040 0.79167 0.50000 1.0000 + Co Co35 1.0 0.19040 0.87500 0.50000 1.0000 + Co Co36 1.0 0.19040 0.95833 0.50000 1.0000 + Co Co37 1.0 0.27373 0.04167 0.50000 1.0000 + Co Co38 1.0 0.27373 0.12500 0.50000 1.0000 + Co Co39 1.0 0.27373 0.20833 0.50000 1.0000 + Co Co40 1.0 0.27373 0.29167 0.50000 1.0000 + Co Co41 1.0 0.27373 0.37500 0.50000 1.0000 + Co Co42 1.0 0.27373 0.45833 0.50000 1.0000 + Co Co43 1.0 0.27373 0.54167 0.50000 1.0000 + Co Co44 1.0 0.27373 0.62500 0.50000 1.0000 + Co Co45 1.0 0.27373 0.70833 0.50000 1.0000 + Co Co46 1.0 0.27373 0.79167 0.50000 1.0000 + Co Co47 1.0 0.27373 0.87500 0.50000 1.0000 + Co Co48 1.0 0.27373 0.95833 0.50000 1.0000 + Co Co49 1.0 0.35706 0.04167 0.50000 1.0000 + Co Co50 1.0 0.35706 0.12500 0.50000 1.0000 + Co Co51 1.0 0.35706 0.20833 0.50000 1.0000 + Co Co52 1.0 0.35706 0.29167 0.50000 1.0000 + Co Co53 1.0 0.35706 0.37500 0.50000 1.0000 + Co Co54 1.0 0.35706 0.45833 0.50000 1.0000 + Co Co55 1.0 0.35706 0.54167 0.50000 1.0000 + Co Co56 1.0 0.35706 0.62500 0.50000 1.0000 + Co Co57 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O1061 1.0 0.37113 0.35620 0.35078 1.0000 + O O1062 1.0 0.37113 0.43953 0.35078 1.0000 + O O1063 1.0 0.37113 0.52287 0.35078 1.0000 + O O1064 1.0 0.37113 0.60620 0.35078 1.0000 + O O1065 1.0 0.37113 0.68953 0.35078 1.0000 + O O1066 1.0 0.37113 0.77287 0.35078 1.0000 + O O1067 1.0 0.37113 0.85620 0.35078 1.0000 + O O1068 1.0 0.37113 0.93953 0.35078 1.0000 + O O1069 1.0 0.45446 0.02287 0.35078 1.0000 + O O1070 1.0 0.45446 0.10620 0.35078 1.0000 + O O1071 1.0 0.45446 0.18953 0.35078 1.0000 + O O1072 1.0 0.45446 0.27287 0.35078 1.0000 + O O1073 1.0 0.45446 0.35620 0.35078 1.0000 + O O1074 1.0 0.45446 0.43953 0.35078 1.0000 + O O1075 1.0 0.45446 0.52287 0.35078 1.0000 + O O1076 1.0 0.45446 0.60620 0.35078 1.0000 + O O1077 1.0 0.45446 0.68953 0.35078 1.0000 + O O1078 1.0 0.45446 0.77287 0.35078 1.0000 + O O1079 1.0 0.45446 0.85620 0.35078 1.0000 + O O1080 1.0 0.45446 0.93953 0.35078 1.0000 + O O1081 1.0 0.53779 0.02287 0.35078 1.0000 + O O1082 1.0 0.53779 0.10620 0.35078 1.0000 + O O1083 1.0 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0.02287 0.35078 1.0000 + O O1106 1.0 0.70446 0.10620 0.35078 1.0000 + O O1107 1.0 0.70446 0.18953 0.35078 1.0000 + O O1108 1.0 0.70446 0.27287 0.35078 1.0000 + O O1109 1.0 0.70446 0.35620 0.35078 1.0000 + O O1110 1.0 0.70446 0.43953 0.35078 1.0000 + O O1111 1.0 0.70446 0.52287 0.35078 1.0000 + O O1112 1.0 0.70446 0.60620 0.35078 1.0000 + O O1113 1.0 0.70446 0.68953 0.35078 1.0000 + O O1114 1.0 0.70446 0.77287 0.35078 1.0000 + O O1115 1.0 0.70446 0.85620 0.35078 1.0000 + O O1116 1.0 0.70446 0.93953 0.35078 1.0000 + O O1117 1.0 0.78779 0.02287 0.35078 1.0000 + O O1118 1.0 0.78779 0.10620 0.35078 1.0000 + O O1119 1.0 0.78779 0.18953 0.35078 1.0000 + O O1120 1.0 0.78779 0.27287 0.35078 1.0000 + O O1121 1.0 0.78779 0.35620 0.35078 1.0000 + O O1122 1.0 0.78779 0.43953 0.35078 1.0000 + O O1123 1.0 0.78779 0.52287 0.35078 1.0000 + O O1124 1.0 0.78779 0.60620 0.35078 1.0000 + O O1125 1.0 0.78779 0.68953 0.35078 1.0000 + O O1126 1.0 0.78779 0.77287 0.35078 1.0000 + O O1127 1.0 0.78779 0.85620 0.35078 1.0000 + O O1128 1.0 0.78779 0.93953 0.35078 1.0000 + O O1129 1.0 0.87113 0.02287 0.35078 1.0000 + O O1130 1.0 0.87113 0.10620 0.35078 1.0000 + O O1131 1.0 0.87113 0.18953 0.35078 1.0000 + O O1132 1.0 0.87113 0.27287 0.35078 1.0000 + O O1133 1.0 0.87113 0.35620 0.35078 1.0000 + O O1134 1.0 0.87113 0.43953 0.35078 1.0000 + O O1135 1.0 0.87113 0.52287 0.35078 1.0000 + O O1136 1.0 0.87113 0.60620 0.35078 1.0000 + O O1137 1.0 0.87113 0.68953 0.35078 1.0000 + O O1138 1.0 0.87113 0.77287 0.35078 1.0000 + O O1139 1.0 0.87113 0.85620 0.35078 1.0000 + O O1140 1.0 0.87113 0.93953 0.35078 1.0000 + O O1141 1.0 0.95446 0.02287 0.35078 1.0000 + O O1142 1.0 0.95446 0.10620 0.35078 1.0000 + O O1143 1.0 0.95446 0.18953 0.35078 1.0000 + O O1144 1.0 0.95446 0.27287 0.35078 1.0000 + O O1145 1.0 0.95446 0.35620 0.35078 1.0000 + O O1146 1.0 0.95446 0.43953 0.35078 1.0000 + O O1147 1.0 0.95446 0.52287 0.35078 1.0000 + O O1148 1.0 0.95446 0.60620 0.35078 1.0000 + O O1149 1.0 0.95446 0.68953 0.35078 1.0000 + O O1150 1.0 0.95446 0.77287 0.35078 1.0000 + O O1151 1.0 0.95446 0.85620 0.35078 1.0000 + O O1152 1.0 0.95446 0.93953 0.35078 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-4108_supercell_12x12x1.cif b/tier3/cif_file/orthogonal_2dm-4108_supercell_12x12x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..51dd76bb0436496627a77144785afb4dd3193e25 --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-4108_supercell_12x12x1.cif @@ -0,0 +1,1897 @@ +data_image0 +_chemical_formula_structural Zn288Cr432O1152 +_chemical_formula_sum "Zn288 Cr432 O1152" +_cell_length_a 61.6047 +_cell_length_b 70.517 +_cell_length_c 6.95539 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Zn Zn1 1.0 0.02158 0.00000 0.71245 1.0000 + Zn Zn2 1.0 0.02158 0.08333 0.71245 1.0000 + Zn Zn3 1.0 0.02158 0.16667 0.71245 1.0000 + Zn Zn4 1.0 0.02158 0.25000 0.71245 1.0000 + Zn Zn5 1.0 0.02158 0.33333 0.71245 1.0000 + Zn Zn6 1.0 0.02158 0.41667 0.71245 1.0000 + Zn Zn7 1.0 0.02158 0.50000 0.71245 1.0000 + Zn Zn8 1.0 0.02158 0.58333 0.71245 1.0000 + Zn Zn9 1.0 0.02158 0.66667 0.71245 1.0000 + Zn Zn10 1.0 0.02158 0.75000 0.71245 1.0000 + Zn Zn11 1.0 0.02158 0.83333 0.71245 1.0000 + Zn Zn12 1.0 0.02158 0.91667 0.71245 1.0000 + Zn Zn13 1.0 0.10491 0.00000 0.71245 1.0000 + Zn Zn14 1.0 0.10491 0.08333 0.71245 1.0000 + Zn Zn15 1.0 0.10491 0.16667 0.71245 1.0000 + Zn Zn16 1.0 0.10491 0.25000 0.71245 1.0000 + Zn Zn17 1.0 0.10491 0.33333 0.71245 1.0000 + Zn Zn18 1.0 0.10491 0.41667 0.71245 1.0000 + Zn Zn19 1.0 0.10491 0.50000 0.71245 1.0000 + Zn Zn20 1.0 0.10491 0.58333 0.71245 1.0000 + Zn Zn21 1.0 0.10491 0.66667 0.71245 1.0000 + Zn Zn22 1.0 0.10491 0.75000 0.71245 1.0000 + Zn Zn23 1.0 0.10491 0.83333 0.71245 1.0000 + Zn Zn24 1.0 0.10491 0.91667 0.71245 1.0000 + Zn Zn25 1.0 0.18824 0.00000 0.71245 1.0000 + Zn Zn26 1.0 0.18824 0.08333 0.71245 1.0000 + Zn Zn27 1.0 0.18824 0.16667 0.71245 1.0000 + Zn Zn28 1.0 0.18824 0.25000 0.71245 1.0000 + Zn Zn29 1.0 0.18824 0.33333 0.71245 1.0000 + Zn Zn30 1.0 0.18824 0.41667 0.71245 1.0000 + Zn Zn31 1.0 0.18824 0.50000 0.71245 1.0000 + Zn Zn32 1.0 0.18824 0.58333 0.71245 1.0000 + Zn Zn33 1.0 0.18824 0.66667 0.71245 1.0000 + Zn Zn34 1.0 0.18824 0.75000 0.71245 1.0000 + Zn Zn35 1.0 0.18824 0.83333 0.71245 1.0000 + Zn Zn36 1.0 0.18824 0.91667 0.71245 1.0000 + Zn Zn37 1.0 0.27158 0.00000 0.71245 1.0000 + Zn Zn38 1.0 0.27158 0.08333 0.71245 1.0000 + Zn Zn39 1.0 0.27158 0.16667 0.71245 1.0000 + Zn Zn40 1.0 0.27158 0.25000 0.71245 1.0000 + Zn Zn41 1.0 0.27158 0.33333 0.71245 1.0000 + Zn Zn42 1.0 0.27158 0.41667 0.71245 1.0000 + Zn Zn43 1.0 0.27158 0.50000 0.71245 1.0000 + Zn Zn44 1.0 0.27158 0.58333 0.71245 1.0000 + Zn Zn45 1.0 0.27158 0.66667 0.71245 1.0000 + Zn Zn46 1.0 0.27158 0.75000 0.71245 1.0000 + Zn Zn47 1.0 0.27158 0.83333 0.71245 1.0000 + Zn Zn48 1.0 0.27158 0.91667 0.71245 1.0000 + Zn Zn49 1.0 0.35491 0.00000 0.71245 1.0000 + Zn Zn50 1.0 0.35491 0.08333 0.71245 1.0000 + Zn Zn51 1.0 0.35491 0.16667 0.71245 1.0000 + Zn Zn52 1.0 0.35491 0.25000 0.71245 1.0000 + Zn Zn53 1.0 0.35491 0.33333 0.71245 1.0000 + Zn Zn54 1.0 0.35491 0.41667 0.71245 1.0000 + Zn Zn55 1.0 0.35491 0.50000 0.71245 1.0000 + Zn Zn56 1.0 0.35491 0.58333 0.71245 1.0000 + Zn Zn57 1.0 0.35491 0.66667 0.71245 1.0000 + Zn Zn58 1.0 0.35491 0.75000 0.71245 1.0000 + Zn Zn59 1.0 0.35491 0.83333 0.71245 1.0000 + Zn Zn60 1.0 0.35491 0.91667 0.71245 1.0000 + Zn Zn61 1.0 0.43824 0.00000 0.71245 1.0000 + Zn Zn62 1.0 0.43824 0.08333 0.71245 1.0000 + Zn Zn63 1.0 0.43824 0.16667 0.71245 1.0000 + Zn Zn64 1.0 0.43824 0.25000 0.71245 1.0000 + Zn Zn65 1.0 0.43824 0.33333 0.71245 1.0000 + Zn Zn66 1.0 0.43824 0.41667 0.71245 1.0000 + Zn Zn67 1.0 0.43824 0.50000 0.71245 1.0000 + Zn Zn68 1.0 0.43824 0.58333 0.71245 1.0000 + Zn Zn69 1.0 0.43824 0.66667 0.71245 1.0000 + Zn Zn70 1.0 0.43824 0.75000 0.71245 1.0000 + Zn Zn71 1.0 0.43824 0.83333 0.71245 1.0000 + Zn Zn72 1.0 0.43824 0.91667 0.71245 1.0000 + Zn Zn73 1.0 0.52158 0.00000 0.71245 1.0000 + Zn Zn74 1.0 0.52158 0.08333 0.71245 1.0000 + Zn Zn75 1.0 0.52158 0.16667 0.71245 1.0000 + Zn Zn76 1.0 0.52158 0.25000 0.71245 1.0000 + Zn Zn77 1.0 0.52158 0.33333 0.71245 1.0000 + Zn Zn78 1.0 0.52158 0.41667 0.71245 1.0000 + Zn Zn79 1.0 0.52158 0.50000 0.71245 1.0000 + Zn Zn80 1.0 0.52158 0.58333 0.71245 1.0000 + Zn Zn81 1.0 0.52158 0.66667 0.71245 1.0000 + Zn Zn82 1.0 0.52158 0.75000 0.71245 1.0000 + Zn Zn83 1.0 0.52158 0.83333 0.71245 1.0000 + Zn Zn84 1.0 0.52158 0.91667 0.71245 1.0000 + Zn Zn85 1.0 0.60491 0.00000 0.71245 1.0000 + Zn Zn86 1.0 0.60491 0.08333 0.71245 1.0000 + Zn Zn87 1.0 0.60491 0.16667 0.71245 1.0000 + Zn Zn88 1.0 0.60491 0.25000 0.71245 1.0000 + Zn Zn89 1.0 0.60491 0.33333 0.71245 1.0000 + Zn Zn90 1.0 0.60491 0.41667 0.71245 1.0000 + Zn Zn91 1.0 0.60491 0.50000 0.71245 1.0000 + Zn Zn92 1.0 0.60491 0.58333 0.71245 1.0000 + Zn Zn93 1.0 0.60491 0.66667 0.71245 1.0000 + Zn Zn94 1.0 0.60491 0.75000 0.71245 1.0000 + Zn Zn95 1.0 0.60491 0.83333 0.71245 1.0000 + Zn Zn96 1.0 0.60491 0.91667 0.71245 1.0000 + Zn Zn97 1.0 0.68824 0.00000 0.71245 1.0000 + Zn Zn98 1.0 0.68824 0.08333 0.71245 1.0000 + Zn Zn99 1.0 0.68824 0.16667 0.71245 1.0000 + Zn Zn100 1.0 0.68824 0.25000 0.71245 1.0000 + Zn Zn101 1.0 0.68824 0.33333 0.71245 1.0000 + Zn Zn102 1.0 0.68824 0.41667 0.71245 1.0000 + Zn Zn103 1.0 0.68824 0.50000 0.71245 1.0000 + Zn Zn104 1.0 0.68824 0.58333 0.71245 1.0000 + Zn Zn105 1.0 0.68824 0.66667 0.71245 1.0000 + Zn Zn106 1.0 0.68824 0.75000 0.71245 1.0000 + Zn Zn107 1.0 0.68824 0.83333 0.71245 1.0000 + Zn Zn108 1.0 0.68824 0.91667 0.71245 1.0000 + Zn Zn109 1.0 0.77158 0.00000 0.71245 1.0000 + Zn Zn110 1.0 0.77158 0.08333 0.71245 1.0000 + Zn Zn111 1.0 0.77158 0.16667 0.71245 1.0000 + Zn Zn112 1.0 0.77158 0.25000 0.71245 1.0000 + Zn Zn113 1.0 0.77158 0.33333 0.71245 1.0000 + Zn Zn114 1.0 0.77158 0.41667 0.71245 1.0000 + Zn Zn115 1.0 0.77158 0.50000 0.71245 1.0000 + Zn Zn116 1.0 0.77158 0.58333 0.71245 1.0000 + Zn Zn117 1.0 0.77158 0.66667 0.71245 1.0000 + Zn Zn118 1.0 0.77158 0.75000 0.71245 1.0000 + Zn Zn119 1.0 0.77158 0.83333 0.71245 1.0000 + Zn Zn120 1.0 0.77158 0.91667 0.71245 1.0000 + Zn Zn121 1.0 0.85491 0.00000 0.71245 1.0000 + Zn Zn122 1.0 0.85491 0.08333 0.71245 1.0000 + Zn Zn123 1.0 0.85491 0.16667 0.71245 1.0000 + Zn Zn124 1.0 0.85491 0.25000 0.71245 1.0000 + Zn Zn125 1.0 0.85491 0.33333 0.71245 1.0000 + Zn Zn126 1.0 0.85491 0.41667 0.71245 1.0000 + Zn Zn127 1.0 0.85491 0.50000 0.71245 1.0000 + Zn Zn128 1.0 0.85491 0.58333 0.71245 1.0000 + Zn Zn129 1.0 0.85491 0.66667 0.71245 1.0000 + Zn Zn130 1.0 0.85491 0.75000 0.71245 1.0000 + Zn Zn131 1.0 0.85491 0.83333 0.71245 1.0000 + Zn Zn132 1.0 0.85491 0.91667 0.71245 1.0000 + Zn Zn133 1.0 0.93824 0.00000 0.71245 1.0000 + Zn Zn134 1.0 0.93824 0.08333 0.71245 1.0000 + Zn Zn135 1.0 0.93824 0.16667 0.71245 1.0000 + Zn Zn136 1.0 0.93824 0.25000 0.71245 1.0000 + Zn Zn137 1.0 0.93824 0.33333 0.71245 1.0000 + Zn Zn138 1.0 0.93824 0.41667 0.71245 1.0000 + Zn Zn139 1.0 0.93824 0.50000 0.71245 1.0000 + Zn Zn140 1.0 0.93824 0.58333 0.71245 1.0000 + Zn Zn141 1.0 0.93824 0.66667 0.71245 1.0000 + Zn Zn142 1.0 0.93824 0.75000 0.71245 1.0000 + Zn Zn143 1.0 0.93824 0.83333 0.71245 1.0000 + Zn Zn144 1.0 0.93824 0.91667 0.71245 1.0000 + Zn Zn145 1.0 0.02337 0.00000 0.28755 1.0000 + Zn Zn146 1.0 0.02337 0.08333 0.28755 1.0000 + Zn Zn147 1.0 0.02337 0.16667 0.28755 1.0000 + Zn Zn148 1.0 0.02337 0.25000 0.28755 1.0000 + Zn Zn149 1.0 0.02337 0.33333 0.28755 1.0000 + Zn Zn150 1.0 0.02337 0.41667 0.28755 1.0000 + Zn Zn151 1.0 0.02337 0.50000 0.28755 1.0000 + Zn Zn152 1.0 0.02337 0.58333 0.28755 1.0000 + Zn Zn153 1.0 0.02337 0.66667 0.28755 1.0000 + Zn Zn154 1.0 0.02337 0.75000 0.28755 1.0000 + Zn Zn155 1.0 0.02337 0.83333 0.28755 1.0000 + Zn Zn156 1.0 0.02337 0.91667 0.28755 1.0000 + Zn Zn157 1.0 0.10670 0.00000 0.28755 1.0000 + Zn Zn158 1.0 0.10670 0.08333 0.28755 1.0000 + Zn Zn159 1.0 0.10670 0.16667 0.28755 1.0000 + Zn Zn160 1.0 0.10670 0.25000 0.28755 1.0000 + Zn Zn161 1.0 0.10670 0.33333 0.28755 1.0000 + Zn Zn162 1.0 0.10670 0.41667 0.28755 1.0000 + Zn Zn163 1.0 0.10670 0.50000 0.28755 1.0000 + Zn Zn164 1.0 0.10670 0.58333 0.28755 1.0000 + Zn Zn165 1.0 0.10670 0.66667 0.28755 1.0000 + Zn Zn166 1.0 0.10670 0.75000 0.28755 1.0000 + Zn Zn167 1.0 0.10670 0.83333 0.28755 1.0000 + Zn Zn168 1.0 0.10670 0.91667 0.28755 1.0000 + Zn Zn169 1.0 0.19004 0.00000 0.28755 1.0000 + Zn Zn170 1.0 0.19004 0.08333 0.28755 1.0000 + Zn Zn171 1.0 0.19004 0.16667 0.28755 1.0000 + Zn Zn172 1.0 0.19004 0.25000 0.28755 1.0000 + Zn Zn173 1.0 0.19004 0.33333 0.28755 1.0000 + Zn Zn174 1.0 0.19004 0.41667 0.28755 1.0000 + Zn Zn175 1.0 0.19004 0.50000 0.28755 1.0000 + Zn Zn176 1.0 0.19004 0.58333 0.28755 1.0000 + Zn Zn177 1.0 0.19004 0.66667 0.28755 1.0000 + Zn Zn178 1.0 0.19004 0.75000 0.28755 1.0000 + Zn Zn179 1.0 0.19004 0.83333 0.28755 1.0000 + Zn Zn180 1.0 0.19004 0.91667 0.28755 1.0000 + Zn Zn181 1.0 0.27337 0.00000 0.28755 1.0000 + Zn Zn182 1.0 0.27337 0.08333 0.28755 1.0000 + Zn Zn183 1.0 0.27337 0.16667 0.28755 1.0000 + Zn Zn184 1.0 0.27337 0.25000 0.28755 1.0000 + Zn Zn185 1.0 0.27337 0.33333 0.28755 1.0000 + Zn Zn186 1.0 0.27337 0.41667 0.28755 1.0000 + Zn Zn187 1.0 0.27337 0.50000 0.28755 1.0000 + Zn Zn188 1.0 0.27337 0.58333 0.28755 1.0000 + Zn Zn189 1.0 0.27337 0.66667 0.28755 1.0000 + Zn Zn190 1.0 0.27337 0.75000 0.28755 1.0000 + Zn Zn191 1.0 0.27337 0.83333 0.28755 1.0000 + Zn Zn192 1.0 0.27337 0.91667 0.28755 1.0000 + Zn Zn193 1.0 0.35670 0.00000 0.28755 1.0000 + Zn Zn194 1.0 0.35670 0.08333 0.28755 1.0000 + Zn Zn195 1.0 0.35670 0.16667 0.28755 1.0000 + Zn Zn196 1.0 0.35670 0.25000 0.28755 1.0000 + Zn Zn197 1.0 0.35670 0.33333 0.28755 1.0000 + Zn Zn198 1.0 0.35670 0.41667 0.28755 1.0000 + Zn Zn199 1.0 0.35670 0.50000 0.28755 1.0000 + Zn Zn200 1.0 0.35670 0.58333 0.28755 1.0000 + Zn Zn201 1.0 0.35670 0.66667 0.28755 1.0000 + Zn Zn202 1.0 0.35670 0.75000 0.28755 1.0000 + Zn Zn203 1.0 0.35670 0.83333 0.28755 1.0000 + Zn Zn204 1.0 0.35670 0.91667 0.28755 1.0000 + Zn Zn205 1.0 0.44004 0.00000 0.28755 1.0000 + Zn Zn206 1.0 0.44004 0.08333 0.28755 1.0000 + Zn Zn207 1.0 0.44004 0.16667 0.28755 1.0000 + Zn Zn208 1.0 0.44004 0.25000 0.28755 1.0000 + Zn Zn209 1.0 0.44004 0.33333 0.28755 1.0000 + Zn Zn210 1.0 0.44004 0.41667 0.28755 1.0000 + Zn Zn211 1.0 0.44004 0.50000 0.28755 1.0000 + Zn Zn212 1.0 0.44004 0.58333 0.28755 1.0000 + Zn Zn213 1.0 0.44004 0.66667 0.28755 1.0000 + Zn Zn214 1.0 0.44004 0.75000 0.28755 1.0000 + Zn Zn215 1.0 0.44004 0.83333 0.28755 1.0000 + Zn Zn216 1.0 0.44004 0.91667 0.28755 1.0000 + Zn Zn217 1.0 0.52337 0.00000 0.28755 1.0000 + Zn Zn218 1.0 0.52337 0.08333 0.28755 1.0000 + Zn Zn219 1.0 0.52337 0.16667 0.28755 1.0000 + Zn Zn220 1.0 0.52337 0.25000 0.28755 1.0000 + Zn Zn221 1.0 0.52337 0.33333 0.28755 1.0000 + Zn Zn222 1.0 0.52337 0.41667 0.28755 1.0000 + Zn Zn223 1.0 0.52337 0.50000 0.28755 1.0000 + Zn Zn224 1.0 0.52337 0.58333 0.28755 1.0000 + Zn Zn225 1.0 0.52337 0.66667 0.28755 1.0000 + Zn Zn226 1.0 0.52337 0.75000 0.28755 1.0000 + Zn Zn227 1.0 0.52337 0.83333 0.28755 1.0000 + Zn Zn228 1.0 0.52337 0.91667 0.28755 1.0000 + Zn Zn229 1.0 0.60670 0.00000 0.28755 1.0000 + Zn Zn230 1.0 0.60670 0.08333 0.28755 1.0000 + Zn Zn231 1.0 0.60670 0.16667 0.28755 1.0000 + Zn Zn232 1.0 0.60670 0.25000 0.28755 1.0000 + Zn Zn233 1.0 0.60670 0.33333 0.28755 1.0000 + Zn Zn234 1.0 0.60670 0.41667 0.28755 1.0000 + Zn Zn235 1.0 0.60670 0.50000 0.28755 1.0000 + Zn Zn236 1.0 0.60670 0.58333 0.28755 1.0000 + Zn Zn237 1.0 0.60670 0.66667 0.28755 1.0000 + Zn Zn238 1.0 0.60670 0.75000 0.28755 1.0000 + Zn Zn239 1.0 0.60670 0.83333 0.28755 1.0000 + Zn Zn240 1.0 0.60670 0.91667 0.28755 1.0000 + Zn Zn241 1.0 0.69004 0.00000 0.28755 1.0000 + Zn Zn242 1.0 0.69004 0.08333 0.28755 1.0000 + Zn Zn243 1.0 0.69004 0.16667 0.28755 1.0000 + Zn Zn244 1.0 0.69004 0.25000 0.28755 1.0000 + Zn Zn245 1.0 0.69004 0.33333 0.28755 1.0000 + Zn Zn246 1.0 0.69004 0.41667 0.28755 1.0000 + Zn Zn247 1.0 0.69004 0.50000 0.28755 1.0000 + Zn Zn248 1.0 0.69004 0.58333 0.28755 1.0000 + Zn Zn249 1.0 0.69004 0.66667 0.28755 1.0000 + Zn Zn250 1.0 0.69004 0.75000 0.28755 1.0000 + Zn Zn251 1.0 0.69004 0.83333 0.28755 1.0000 + Zn Zn252 1.0 0.69004 0.91667 0.28755 1.0000 + Zn Zn253 1.0 0.77337 0.00000 0.28755 1.0000 + Zn Zn254 1.0 0.77337 0.08333 0.28755 1.0000 + Zn Zn255 1.0 0.77337 0.16667 0.28755 1.0000 + Zn Zn256 1.0 0.77337 0.25000 0.28755 1.0000 + Zn Zn257 1.0 0.77337 0.33333 0.28755 1.0000 + Zn Zn258 1.0 0.77337 0.41667 0.28755 1.0000 + Zn Zn259 1.0 0.77337 0.50000 0.28755 1.0000 + Zn Zn260 1.0 0.77337 0.58333 0.28755 1.0000 + Zn Zn261 1.0 0.77337 0.66667 0.28755 1.0000 + Zn Zn262 1.0 0.77337 0.75000 0.28755 1.0000 + Zn Zn263 1.0 0.77337 0.83333 0.28755 1.0000 + Zn Zn264 1.0 0.77337 0.91667 0.28755 1.0000 + Zn Zn265 1.0 0.85670 0.00000 0.28755 1.0000 + Zn Zn266 1.0 0.85670 0.08333 0.28755 1.0000 + Zn Zn267 1.0 0.85670 0.16667 0.28755 1.0000 + Zn Zn268 1.0 0.85670 0.25000 0.28755 1.0000 + Zn Zn269 1.0 0.85670 0.33333 0.28755 1.0000 + Zn Zn270 1.0 0.85670 0.41667 0.28755 1.0000 + Zn Zn271 1.0 0.85670 0.50000 0.28755 1.0000 + Zn Zn272 1.0 0.85670 0.58333 0.28755 1.0000 + Zn Zn273 1.0 0.85670 0.66667 0.28755 1.0000 + Zn Zn274 1.0 0.85670 0.75000 0.28755 1.0000 + Zn Zn275 1.0 0.85670 0.83333 0.28755 1.0000 + Zn Zn276 1.0 0.85670 0.91667 0.28755 1.0000 + Zn Zn277 1.0 0.94004 0.00000 0.28755 1.0000 + Zn Zn278 1.0 0.94004 0.08333 0.28755 1.0000 + Zn Zn279 1.0 0.94004 0.16667 0.28755 1.0000 + Zn Zn280 1.0 0.94004 0.25000 0.28755 1.0000 + Zn Zn281 1.0 0.94004 0.33333 0.28755 1.0000 + Zn Zn282 1.0 0.94004 0.41667 0.28755 1.0000 + Zn Zn283 1.0 0.94004 0.50000 0.28755 1.0000 + Zn Zn284 1.0 0.94004 0.58333 0.28755 1.0000 + Zn Zn285 1.0 0.94004 0.66667 0.28755 1.0000 + Zn Zn286 1.0 0.94004 0.75000 0.28755 1.0000 + Zn Zn287 1.0 0.94004 0.83333 0.28755 1.0000 + Zn Zn288 1.0 0.94004 0.91667 0.28755 1.0000 + Cr Cr1 1.0 0.02247 0.04167 0.50000 1.0000 + Cr Cr2 1.0 0.02247 0.12500 0.50000 1.0000 + Cr Cr3 1.0 0.02247 0.20833 0.50000 1.0000 + Cr Cr4 1.0 0.02247 0.29167 0.50000 1.0000 + Cr Cr5 1.0 0.02247 0.37500 0.50000 1.0000 + Cr Cr6 1.0 0.02247 0.45833 0.50000 1.0000 + Cr Cr7 1.0 0.02247 0.54167 0.50000 1.0000 + Cr Cr8 1.0 0.02247 0.62500 0.50000 1.0000 + Cr Cr9 1.0 0.02247 0.70833 0.50000 1.0000 + Cr Cr10 1.0 0.02247 0.79167 0.50000 1.0000 + Cr Cr11 1.0 0.02247 0.87500 0.50000 1.0000 + Cr Cr12 1.0 0.02247 0.95833 0.50000 1.0000 + Cr Cr13 1.0 0.10581 0.04167 0.50000 1.0000 + Cr Cr14 1.0 0.10581 0.12500 0.50000 1.0000 + Cr Cr15 1.0 0.10581 0.20833 0.50000 1.0000 + Cr Cr16 1.0 0.10581 0.29167 0.50000 1.0000 + Cr Cr17 1.0 0.10581 0.37500 0.50000 1.0000 + Cr Cr18 1.0 0.10581 0.45833 0.50000 1.0000 + Cr Cr19 1.0 0.10581 0.54167 0.50000 1.0000 + Cr Cr20 1.0 0.10581 0.62500 0.50000 1.0000 + Cr Cr21 1.0 0.10581 0.70833 0.50000 1.0000 + Cr Cr22 1.0 0.10581 0.79167 0.50000 1.0000 + Cr Cr23 1.0 0.10581 0.87500 0.50000 1.0000 + Cr Cr24 1.0 0.10581 0.95833 0.50000 1.0000 + Cr Cr25 1.0 0.18914 0.04167 0.50000 1.0000 + Cr Cr26 1.0 0.18914 0.12500 0.50000 1.0000 + Cr Cr27 1.0 0.18914 0.20833 0.50000 1.0000 + Cr Cr28 1.0 0.18914 0.29167 0.50000 1.0000 + Cr Cr29 1.0 0.18914 0.37500 0.50000 1.0000 + Cr Cr30 1.0 0.18914 0.45833 0.50000 1.0000 + Cr Cr31 1.0 0.18914 0.54167 0.50000 1.0000 + Cr Cr32 1.0 0.18914 0.62500 0.50000 1.0000 + Cr Cr33 1.0 0.18914 0.70833 0.50000 1.0000 + Cr Cr34 1.0 0.18914 0.79167 0.50000 1.0000 + Cr Cr35 1.0 0.18914 0.87500 0.50000 1.0000 + Cr Cr36 1.0 0.18914 0.95833 0.50000 1.0000 + Cr Cr37 1.0 0.27247 0.04167 0.50000 1.0000 + Cr Cr38 1.0 0.27247 0.12500 0.50000 1.0000 + Cr Cr39 1.0 0.27247 0.20833 0.50000 1.0000 + Cr Cr40 1.0 0.27247 0.29167 0.50000 1.0000 + Cr Cr41 1.0 0.27247 0.37500 0.50000 1.0000 + Cr Cr42 1.0 0.27247 0.45833 0.50000 1.0000 + Cr Cr43 1.0 0.27247 0.54167 0.50000 1.0000 + Cr Cr44 1.0 0.27247 0.62500 0.50000 1.0000 + Cr Cr45 1.0 0.27247 0.70833 0.50000 1.0000 + Cr Cr46 1.0 0.27247 0.79167 0.50000 1.0000 + Cr Cr47 1.0 0.27247 0.87500 0.50000 1.0000 + Cr Cr48 1.0 0.27247 0.95833 0.50000 1.0000 + Cr Cr49 1.0 0.35581 0.04167 0.50000 1.0000 + Cr Cr50 1.0 0.35581 0.12500 0.50000 1.0000 + Cr Cr51 1.0 0.35581 0.20833 0.50000 1.0000 + Cr Cr52 1.0 0.35581 0.29167 0.50000 1.0000 + Cr Cr53 1.0 0.35581 0.37500 0.50000 1.0000 + Cr Cr54 1.0 0.35581 0.45833 0.50000 1.0000 + Cr Cr55 1.0 0.35581 0.54167 0.50000 1.0000 + Cr Cr56 1.0 0.35581 0.62500 0.50000 1.0000 + Cr Cr57 1.0 0.35581 0.70833 0.50000 1.0000 + Cr Cr58 1.0 0.35581 0.79167 0.50000 1.0000 + Cr Cr59 1.0 0.35581 0.87500 0.50000 1.0000 + Cr Cr60 1.0 0.35581 0.95833 0.50000 1.0000 + Cr Cr61 1.0 0.43914 0.04167 0.50000 1.0000 + Cr Cr62 1.0 0.43914 0.12500 0.50000 1.0000 + Cr Cr63 1.0 0.43914 0.20833 0.50000 1.0000 + Cr Cr64 1.0 0.43914 0.29167 0.50000 1.0000 + Cr Cr65 1.0 0.43914 0.37500 0.50000 1.0000 + Cr Cr66 1.0 0.43914 0.45833 0.50000 1.0000 + Cr Cr67 1.0 0.43914 0.54167 0.50000 1.0000 + Cr Cr68 1.0 0.43914 0.62500 0.50000 1.0000 + Cr Cr69 1.0 0.43914 0.70833 0.50000 1.0000 + Cr Cr70 1.0 0.43914 0.79167 0.50000 1.0000 + Cr Cr71 1.0 0.43914 0.87500 0.50000 1.0000 + Cr Cr72 1.0 0.43914 0.95833 0.50000 1.0000 + Cr Cr73 1.0 0.52247 0.04167 0.50000 1.0000 + Cr Cr74 1.0 0.52247 0.12500 0.50000 1.0000 + Cr Cr75 1.0 0.52247 0.20833 0.50000 1.0000 + Cr Cr76 1.0 0.52247 0.29167 0.50000 1.0000 + Cr Cr77 1.0 0.52247 0.37500 0.50000 1.0000 + Cr Cr78 1.0 0.52247 0.45833 0.50000 1.0000 + Cr Cr79 1.0 0.52247 0.54167 0.50000 1.0000 + Cr Cr80 1.0 0.52247 0.62500 0.50000 1.0000 + Cr Cr81 1.0 0.52247 0.70833 0.50000 1.0000 + Cr Cr82 1.0 0.52247 0.79167 0.50000 1.0000 + Cr Cr83 1.0 0.52247 0.87500 0.50000 1.0000 + Cr Cr84 1.0 0.52247 0.95833 0.50000 1.0000 + Cr Cr85 1.0 0.60581 0.04167 0.50000 1.0000 + Cr Cr86 1.0 0.60581 0.12500 0.50000 1.0000 + Cr Cr87 1.0 0.60581 0.20833 0.50000 1.0000 + Cr Cr88 1.0 0.60581 0.29167 0.50000 1.0000 + Cr Cr89 1.0 0.60581 0.37500 0.50000 1.0000 + Cr Cr90 1.0 0.60581 0.45833 0.50000 1.0000 + Cr Cr91 1.0 0.60581 0.54167 0.50000 1.0000 + Cr Cr92 1.0 0.60581 0.62500 0.50000 1.0000 + Cr Cr93 1.0 0.60581 0.70833 0.50000 1.0000 + Cr Cr94 1.0 0.60581 0.79167 0.50000 1.0000 + Cr Cr95 1.0 0.60581 0.87500 0.50000 1.0000 + Cr Cr96 1.0 0.60581 0.95833 0.50000 1.0000 + Cr Cr97 1.0 0.68914 0.04167 0.50000 1.0000 + Cr Cr98 1.0 0.68914 0.12500 0.50000 1.0000 + Cr Cr99 1.0 0.68914 0.20833 0.50000 1.0000 + Cr Cr100 1.0 0.68914 0.29167 0.50000 1.0000 + Cr Cr101 1.0 0.68914 0.37500 0.50000 1.0000 + Cr Cr102 1.0 0.68914 0.45833 0.50000 1.0000 + Cr Cr103 1.0 0.68914 0.54167 0.50000 1.0000 + Cr Cr104 1.0 0.68914 0.62500 0.50000 1.0000 + Cr Cr105 1.0 0.68914 0.70833 0.50000 1.0000 + Cr Cr106 1.0 0.68914 0.79167 0.50000 1.0000 + Cr Cr107 1.0 0.68914 0.87500 0.50000 1.0000 + Cr Cr108 1.0 0.68914 0.95833 0.50000 1.0000 + Cr Cr109 1.0 0.77247 0.04167 0.50000 1.0000 + Cr Cr110 1.0 0.77247 0.12500 0.50000 1.0000 + Cr Cr111 1.0 0.77247 0.20833 0.50000 1.0000 + Cr Cr112 1.0 0.77247 0.29167 0.50000 1.0000 + Cr Cr113 1.0 0.77247 0.37500 0.50000 1.0000 + Cr Cr114 1.0 0.77247 0.45833 0.50000 1.0000 + Cr Cr115 1.0 0.77247 0.54167 0.50000 1.0000 + Cr Cr116 1.0 0.77247 0.62500 0.50000 1.0000 + Cr Cr117 1.0 0.77247 0.70833 0.50000 1.0000 + Cr Cr118 1.0 0.77247 0.79167 0.50000 1.0000 + Cr Cr119 1.0 0.77247 0.87500 0.50000 1.0000 + Cr Cr120 1.0 0.77247 0.95833 0.50000 1.0000 + Cr Cr121 1.0 0.85581 0.04167 0.50000 1.0000 + Cr Cr122 1.0 0.85581 0.12500 0.50000 1.0000 + Cr Cr123 1.0 0.85581 0.20833 0.50000 1.0000 + Cr Cr124 1.0 0.85581 0.29167 0.50000 1.0000 + Cr Cr125 1.0 0.85581 0.37500 0.50000 1.0000 + Cr Cr126 1.0 0.85581 0.45833 0.50000 1.0000 + Cr Cr127 1.0 0.85581 0.54167 0.50000 1.0000 + Cr Cr128 1.0 0.85581 0.62500 0.50000 1.0000 + Cr Cr129 1.0 0.85581 0.70833 0.50000 1.0000 + Cr Cr130 1.0 0.85581 0.79167 0.50000 1.0000 + Cr Cr131 1.0 0.85581 0.87500 0.50000 1.0000 + Cr Cr132 1.0 0.85581 0.95833 0.50000 1.0000 + Cr Cr133 1.0 0.93914 0.04167 0.50000 1.0000 + Cr Cr134 1.0 0.93914 0.12500 0.50000 1.0000 + Cr Cr135 1.0 0.93914 0.20833 0.50000 1.0000 + Cr Cr136 1.0 0.93914 0.29167 0.50000 1.0000 + Cr Cr137 1.0 0.93914 0.37500 0.50000 1.0000 + Cr Cr138 1.0 0.93914 0.45833 0.50000 1.0000 + Cr Cr139 1.0 0.93914 0.54167 0.50000 1.0000 + Cr Cr140 1.0 0.93914 0.62500 0.50000 1.0000 + Cr Cr141 1.0 0.93914 0.70833 0.50000 1.0000 + Cr Cr142 1.0 0.93914 0.79167 0.50000 1.0000 + Cr Cr143 1.0 0.93914 0.87500 0.50000 1.0000 + Cr Cr144 1.0 0.93914 0.95833 0.50000 1.0000 + Cr Cr145 1.0 0.06414 0.06250 0.50000 1.0000 + Cr Cr146 1.0 0.06414 0.14583 0.50000 1.0000 + Cr Cr147 1.0 0.06414 0.22916 0.50000 1.0000 + Cr Cr148 1.0 0.06414 0.31250 0.50000 1.0000 + Cr Cr149 1.0 0.06414 0.39583 0.50000 1.0000 + Cr Cr150 1.0 0.06414 0.47916 0.50000 1.0000 + Cr Cr151 1.0 0.06414 0.56250 0.50000 1.0000 + Cr Cr152 1.0 0.06414 0.64583 0.50000 1.0000 + Cr Cr153 1.0 0.06414 0.72916 0.50000 1.0000 + Cr Cr154 1.0 0.06414 0.81250 0.50000 1.0000 + Cr Cr155 1.0 0.06414 0.89583 0.50000 1.0000 + Cr Cr156 1.0 0.06414 0.97916 0.50000 1.0000 + Cr Cr157 1.0 0.14747 0.06250 0.50000 1.0000 + Cr Cr158 1.0 0.14747 0.14583 0.50000 1.0000 + Cr Cr159 1.0 0.14747 0.22916 0.50000 1.0000 + Cr Cr160 1.0 0.14747 0.31250 0.50000 1.0000 + Cr Cr161 1.0 0.14747 0.39583 0.50000 1.0000 + Cr Cr162 1.0 0.14747 0.47916 0.50000 1.0000 + Cr Cr163 1.0 0.14747 0.56250 0.50000 1.0000 + Cr Cr164 1.0 0.14747 0.64583 0.50000 1.0000 + Cr Cr165 1.0 0.14747 0.72916 0.50000 1.0000 + Cr Cr166 1.0 0.14747 0.81250 0.50000 1.0000 + Cr Cr167 1.0 0.14747 0.89583 0.50000 1.0000 + Cr Cr168 1.0 0.14747 0.97916 0.50000 1.0000 + Cr Cr169 1.0 0.23081 0.06250 0.50000 1.0000 + Cr Cr170 1.0 0.23081 0.14583 0.50000 1.0000 + Cr Cr171 1.0 0.23081 0.22916 0.50000 1.0000 + Cr Cr172 1.0 0.23081 0.31250 0.50000 1.0000 + Cr Cr173 1.0 0.23081 0.39583 0.50000 1.0000 + Cr Cr174 1.0 0.23081 0.47916 0.50000 1.0000 + Cr Cr175 1.0 0.23081 0.56250 0.50000 1.0000 + Cr Cr176 1.0 0.23081 0.64583 0.50000 1.0000 + Cr Cr177 1.0 0.23081 0.72916 0.50000 1.0000 + Cr Cr178 1.0 0.23081 0.81250 0.50000 1.0000 + Cr Cr179 1.0 0.23081 0.89583 0.50000 1.0000 + Cr Cr180 1.0 0.23081 0.97916 0.50000 1.0000 + Cr Cr181 1.0 0.31414 0.06250 0.50000 1.0000 + Cr Cr182 1.0 0.31414 0.14583 0.50000 1.0000 + Cr Cr183 1.0 0.31414 0.22916 0.50000 1.0000 + Cr Cr184 1.0 0.31414 0.31250 0.50000 1.0000 + Cr Cr185 1.0 0.31414 0.39583 0.50000 1.0000 + Cr Cr186 1.0 0.31414 0.47916 0.50000 1.0000 + Cr Cr187 1.0 0.31414 0.56250 0.50000 1.0000 + Cr Cr188 1.0 0.31414 0.64583 0.50000 1.0000 + Cr Cr189 1.0 0.31414 0.72916 0.50000 1.0000 + Cr Cr190 1.0 0.31414 0.81250 0.50000 1.0000 + Cr Cr191 1.0 0.31414 0.89583 0.50000 1.0000 + Cr Cr192 1.0 0.31414 0.97916 0.50000 1.0000 + Cr Cr193 1.0 0.39747 0.06250 0.50000 1.0000 + Cr Cr194 1.0 0.39747 0.14583 0.50000 1.0000 + Cr Cr195 1.0 0.39747 0.22916 0.50000 1.0000 + Cr Cr196 1.0 0.39747 0.31250 0.50000 1.0000 + Cr Cr197 1.0 0.39747 0.39583 0.50000 1.0000 + Cr Cr198 1.0 0.39747 0.47916 0.50000 1.0000 + Cr Cr199 1.0 0.39747 0.56250 0.50000 1.0000 + Cr Cr200 1.0 0.39747 0.64583 0.50000 1.0000 + Cr Cr201 1.0 0.39747 0.72916 0.50000 1.0000 + Cr Cr202 1.0 0.39747 0.81250 0.50000 1.0000 + Cr Cr203 1.0 0.39747 0.89583 0.50000 1.0000 + Cr Cr204 1.0 0.39747 0.97916 0.50000 1.0000 + Cr Cr205 1.0 0.48081 0.06250 0.50000 1.0000 + Cr Cr206 1.0 0.48081 0.14583 0.50000 1.0000 + Cr Cr207 1.0 0.48081 0.22916 0.50000 1.0000 + Cr Cr208 1.0 0.48081 0.31250 0.50000 1.0000 + Cr Cr209 1.0 0.48081 0.39583 0.50000 1.0000 + Cr Cr210 1.0 0.48081 0.47916 0.50000 1.0000 + Cr Cr211 1.0 0.48081 0.56250 0.50000 1.0000 + Cr Cr212 1.0 0.48081 0.64583 0.50000 1.0000 + Cr Cr213 1.0 0.48081 0.72916 0.50000 1.0000 + Cr Cr214 1.0 0.48081 0.81250 0.50000 1.0000 + Cr Cr215 1.0 0.48081 0.89583 0.50000 1.0000 + Cr Cr216 1.0 0.48081 0.97916 0.50000 1.0000 + Cr Cr217 1.0 0.56414 0.06250 0.50000 1.0000 + Cr Cr218 1.0 0.56414 0.14583 0.50000 1.0000 + Cr Cr219 1.0 0.56414 0.22916 0.50000 1.0000 + Cr Cr220 1.0 0.56414 0.31250 0.50000 1.0000 + Cr Cr221 1.0 0.56414 0.39583 0.50000 1.0000 + Cr Cr222 1.0 0.56414 0.47916 0.50000 1.0000 + Cr Cr223 1.0 0.56414 0.56250 0.50000 1.0000 + Cr Cr224 1.0 0.56414 0.64583 0.50000 1.0000 + Cr Cr225 1.0 0.56414 0.72916 0.50000 1.0000 + Cr Cr226 1.0 0.56414 0.81250 0.50000 1.0000 + Cr Cr227 1.0 0.56414 0.89583 0.50000 1.0000 + Cr Cr228 1.0 0.56414 0.97916 0.50000 1.0000 + Cr Cr229 1.0 0.64747 0.06250 0.50000 1.0000 + Cr Cr230 1.0 0.64747 0.14583 0.50000 1.0000 + Cr Cr231 1.0 0.64747 0.22916 0.50000 1.0000 + Cr Cr232 1.0 0.64747 0.31250 0.50000 1.0000 + Cr Cr233 1.0 0.64747 0.39583 0.50000 1.0000 + Cr Cr234 1.0 0.64747 0.47916 0.50000 1.0000 + Cr Cr235 1.0 0.64747 0.56250 0.50000 1.0000 + Cr Cr236 1.0 0.64747 0.64583 0.50000 1.0000 + Cr Cr237 1.0 0.64747 0.72916 0.50000 1.0000 + Cr Cr238 1.0 0.64747 0.81250 0.50000 1.0000 + Cr Cr239 1.0 0.64747 0.89583 0.50000 1.0000 + Cr Cr240 1.0 0.64747 0.97916 0.50000 1.0000 + Cr Cr241 1.0 0.73081 0.06250 0.50000 1.0000 + Cr Cr242 1.0 0.73081 0.14583 0.50000 1.0000 + Cr Cr243 1.0 0.73081 0.22916 0.50000 1.0000 + Cr Cr244 1.0 0.73081 0.31250 0.50000 1.0000 + Cr Cr245 1.0 0.73081 0.39583 0.50000 1.0000 + Cr Cr246 1.0 0.73081 0.47916 0.50000 1.0000 + Cr Cr247 1.0 0.73081 0.56250 0.50000 1.0000 + Cr Cr248 1.0 0.73081 0.64583 0.50000 1.0000 + Cr Cr249 1.0 0.73081 0.72916 0.50000 1.0000 + Cr Cr250 1.0 0.73081 0.81250 0.50000 1.0000 + Cr Cr251 1.0 0.73081 0.89583 0.50000 1.0000 + Cr Cr252 1.0 0.73081 0.97916 0.50000 1.0000 + Cr Cr253 1.0 0.81414 0.06250 0.50000 1.0000 + Cr Cr254 1.0 0.81414 0.14583 0.50000 1.0000 + Cr Cr255 1.0 0.81414 0.22916 0.50000 1.0000 + Cr Cr256 1.0 0.81414 0.31250 0.50000 1.0000 + Cr Cr257 1.0 0.81414 0.39583 0.50000 1.0000 + Cr Cr258 1.0 0.81414 0.47916 0.50000 1.0000 + Cr Cr259 1.0 0.81414 0.56250 0.50000 1.0000 + Cr Cr260 1.0 0.81414 0.64583 0.50000 1.0000 + Cr Cr261 1.0 0.81414 0.72916 0.50000 1.0000 + Cr Cr262 1.0 0.81414 0.81250 0.50000 1.0000 + Cr Cr263 1.0 0.81414 0.89583 0.50000 1.0000 + Cr Cr264 1.0 0.81414 0.97916 0.50000 1.0000 + Cr Cr265 1.0 0.89747 0.06250 0.50000 1.0000 + Cr Cr266 1.0 0.89747 0.14583 0.50000 1.0000 + Cr Cr267 1.0 0.89747 0.22916 0.50000 1.0000 + Cr Cr268 1.0 0.89747 0.31250 0.50000 1.0000 + Cr Cr269 1.0 0.89747 0.39583 0.50000 1.0000 + Cr Cr270 1.0 0.89747 0.47916 0.50000 1.0000 + Cr Cr271 1.0 0.89747 0.56250 0.50000 1.0000 + Cr Cr272 1.0 0.89747 0.64583 0.50000 1.0000 + Cr Cr273 1.0 0.89747 0.72916 0.50000 1.0000 + Cr Cr274 1.0 0.89747 0.81250 0.50000 1.0000 + Cr Cr275 1.0 0.89747 0.89583 0.50000 1.0000 + Cr Cr276 1.0 0.89747 0.97916 0.50000 1.0000 + Cr Cr277 1.0 0.98081 0.06250 0.50000 1.0000 + Cr Cr278 1.0 0.98081 0.14583 0.50000 1.0000 + Cr Cr279 1.0 0.98081 0.22916 0.50000 1.0000 + Cr Cr280 1.0 0.98081 0.31250 0.50000 1.0000 + Cr Cr281 1.0 0.98081 0.39583 0.50000 1.0000 + Cr Cr282 1.0 0.98081 0.47916 0.50000 1.0000 + Cr Cr283 1.0 0.98081 0.56250 0.50000 1.0000 + Cr Cr284 1.0 0.98081 0.64583 0.50000 1.0000 + Cr Cr285 1.0 0.98081 0.72916 0.50000 1.0000 + Cr Cr286 1.0 0.98081 0.81250 0.50000 1.0000 + Cr Cr287 1.0 0.98081 0.89583 0.50000 1.0000 + Cr Cr288 1.0 0.98081 0.97916 0.50000 1.0000 + Cr Cr289 1.0 0.06414 0.02084 0.50000 1.0000 + Cr Cr290 1.0 0.06414 0.10417 0.50000 1.0000 + Cr Cr291 1.0 0.06414 0.18750 0.50000 1.0000 + Cr Cr292 1.0 0.06414 0.27084 0.50000 1.0000 + Cr Cr293 1.0 0.06414 0.35417 0.50000 1.0000 + Cr Cr294 1.0 0.06414 0.43750 0.50000 1.0000 + Cr Cr295 1.0 0.06414 0.52084 0.50000 1.0000 + Cr Cr296 1.0 0.06414 0.60417 0.50000 1.0000 + Cr Cr297 1.0 0.06414 0.68750 0.50000 1.0000 + Cr Cr298 1.0 0.06414 0.77084 0.50000 1.0000 + Cr Cr299 1.0 0.06414 0.85417 0.50000 1.0000 + Cr Cr300 1.0 0.06414 0.93750 0.50000 1.0000 + Cr Cr301 1.0 0.14747 0.02084 0.50000 1.0000 + Cr Cr302 1.0 0.14747 0.10417 0.50000 1.0000 + Cr Cr303 1.0 0.14747 0.18750 0.50000 1.0000 + Cr Cr304 1.0 0.14747 0.27084 0.50000 1.0000 + Cr Cr305 1.0 0.14747 0.35417 0.50000 1.0000 + Cr Cr306 1.0 0.14747 0.43750 0.50000 1.0000 + Cr Cr307 1.0 0.14747 0.52084 0.50000 1.0000 + Cr Cr308 1.0 0.14747 0.60417 0.50000 1.0000 + Cr Cr309 1.0 0.14747 0.68750 0.50000 1.0000 + Cr Cr310 1.0 0.14747 0.77084 0.50000 1.0000 + Cr Cr311 1.0 0.14747 0.85417 0.50000 1.0000 + Cr Cr312 1.0 0.14747 0.93750 0.50000 1.0000 + Cr Cr313 1.0 0.23081 0.02084 0.50000 1.0000 + Cr Cr314 1.0 0.23081 0.10417 0.50000 1.0000 + Cr Cr315 1.0 0.23081 0.18750 0.50000 1.0000 + Cr Cr316 1.0 0.23081 0.27084 0.50000 1.0000 + Cr Cr317 1.0 0.23081 0.35417 0.50000 1.0000 + Cr Cr318 1.0 0.23081 0.43750 0.50000 1.0000 + Cr Cr319 1.0 0.23081 0.52084 0.50000 1.0000 + Cr Cr320 1.0 0.23081 0.60417 0.50000 1.0000 + Cr Cr321 1.0 0.23081 0.68750 0.50000 1.0000 + Cr Cr322 1.0 0.23081 0.77084 0.50000 1.0000 + Cr Cr323 1.0 0.23081 0.85417 0.50000 1.0000 + Cr Cr324 1.0 0.23081 0.93750 0.50000 1.0000 + Cr Cr325 1.0 0.31414 0.02084 0.50000 1.0000 + Cr Cr326 1.0 0.31414 0.10417 0.50000 1.0000 + Cr Cr327 1.0 0.31414 0.18750 0.50000 1.0000 + Cr Cr328 1.0 0.31414 0.27084 0.50000 1.0000 + Cr Cr329 1.0 0.31414 0.35417 0.50000 1.0000 + Cr Cr330 1.0 0.31414 0.43750 0.50000 1.0000 + Cr Cr331 1.0 0.31414 0.52084 0.50000 1.0000 + Cr Cr332 1.0 0.31414 0.60417 0.50000 1.0000 + Cr Cr333 1.0 0.31414 0.68750 0.50000 1.0000 + Cr Cr334 1.0 0.31414 0.77084 0.50000 1.0000 + Cr Cr335 1.0 0.31414 0.85417 0.50000 1.0000 + Cr Cr336 1.0 0.31414 0.93750 0.50000 1.0000 + Cr Cr337 1.0 0.39747 0.02084 0.50000 1.0000 + Cr Cr338 1.0 0.39747 0.10417 0.50000 1.0000 + Cr Cr339 1.0 0.39747 0.18750 0.50000 1.0000 + Cr Cr340 1.0 0.39747 0.27084 0.50000 1.0000 + Cr Cr341 1.0 0.39747 0.35417 0.50000 1.0000 + Cr Cr342 1.0 0.39747 0.43750 0.50000 1.0000 + Cr Cr343 1.0 0.39747 0.52084 0.50000 1.0000 + Cr Cr344 1.0 0.39747 0.60417 0.50000 1.0000 + Cr Cr345 1.0 0.39747 0.68750 0.50000 1.0000 + Cr Cr346 1.0 0.39747 0.77084 0.50000 1.0000 + Cr Cr347 1.0 0.39747 0.85417 0.50000 1.0000 + Cr Cr348 1.0 0.39747 0.93750 0.50000 1.0000 + Cr Cr349 1.0 0.48081 0.02084 0.50000 1.0000 + Cr Cr350 1.0 0.48081 0.10417 0.50000 1.0000 + Cr Cr351 1.0 0.48081 0.18750 0.50000 1.0000 + Cr Cr352 1.0 0.48081 0.27084 0.50000 1.0000 + Cr Cr353 1.0 0.48081 0.35417 0.50000 1.0000 + Cr Cr354 1.0 0.48081 0.43750 0.50000 1.0000 + Cr Cr355 1.0 0.48081 0.52084 0.50000 1.0000 + Cr Cr356 1.0 0.48081 0.60417 0.50000 1.0000 + Cr Cr357 1.0 0.48081 0.68750 0.50000 1.0000 + Cr Cr358 1.0 0.48081 0.77084 0.50000 1.0000 + Cr Cr359 1.0 0.48081 0.85417 0.50000 1.0000 + Cr Cr360 1.0 0.48081 0.93750 0.50000 1.0000 + Cr Cr361 1.0 0.56414 0.02084 0.50000 1.0000 + Cr Cr362 1.0 0.56414 0.10417 0.50000 1.0000 + Cr Cr363 1.0 0.56414 0.18750 0.50000 1.0000 + Cr Cr364 1.0 0.56414 0.27084 0.50000 1.0000 + Cr Cr365 1.0 0.56414 0.35417 0.50000 1.0000 + Cr Cr366 1.0 0.56414 0.43750 0.50000 1.0000 + Cr Cr367 1.0 0.56414 0.52084 0.50000 1.0000 + Cr Cr368 1.0 0.56414 0.60417 0.50000 1.0000 + Cr Cr369 1.0 0.56414 0.68750 0.50000 1.0000 + Cr Cr370 1.0 0.56414 0.77084 0.50000 1.0000 + Cr Cr371 1.0 0.56414 0.85417 0.50000 1.0000 + Cr Cr372 1.0 0.56414 0.93750 0.50000 1.0000 + Cr Cr373 1.0 0.64747 0.02084 0.50000 1.0000 + Cr Cr374 1.0 0.64747 0.10417 0.50000 1.0000 + Cr Cr375 1.0 0.64747 0.18750 0.50000 1.0000 + Cr Cr376 1.0 0.64747 0.27084 0.50000 1.0000 + Cr Cr377 1.0 0.64747 0.35417 0.50000 1.0000 + Cr Cr378 1.0 0.64747 0.43750 0.50000 1.0000 + Cr Cr379 1.0 0.64747 0.52084 0.50000 1.0000 + Cr Cr380 1.0 0.64747 0.60417 0.50000 1.0000 + Cr Cr381 1.0 0.64747 0.68750 0.50000 1.0000 + Cr Cr382 1.0 0.64747 0.77084 0.50000 1.0000 + Cr Cr383 1.0 0.64747 0.85417 0.50000 1.0000 + Cr Cr384 1.0 0.64747 0.93750 0.50000 1.0000 + Cr Cr385 1.0 0.73081 0.02084 0.50000 1.0000 + Cr Cr386 1.0 0.73081 0.10417 0.50000 1.0000 + Cr Cr387 1.0 0.73081 0.18750 0.50000 1.0000 + Cr Cr388 1.0 0.73081 0.27084 0.50000 1.0000 + Cr Cr389 1.0 0.73081 0.35417 0.50000 1.0000 + Cr Cr390 1.0 0.73081 0.43750 0.50000 1.0000 + Cr Cr391 1.0 0.73081 0.52084 0.50000 1.0000 + Cr Cr392 1.0 0.73081 0.60417 0.50000 1.0000 + Cr Cr393 1.0 0.73081 0.68750 0.50000 1.0000 + Cr Cr394 1.0 0.73081 0.77084 0.50000 1.0000 + Cr Cr395 1.0 0.73081 0.85417 0.50000 1.0000 + Cr Cr396 1.0 0.73081 0.93750 0.50000 1.0000 + Cr Cr397 1.0 0.81414 0.02084 0.50000 1.0000 + Cr Cr398 1.0 0.81414 0.10417 0.50000 1.0000 + Cr Cr399 1.0 0.81414 0.18750 0.50000 1.0000 + Cr Cr400 1.0 0.81414 0.27084 0.50000 1.0000 + Cr Cr401 1.0 0.81414 0.35417 0.50000 1.0000 + Cr Cr402 1.0 0.81414 0.43750 0.50000 1.0000 + Cr Cr403 1.0 0.81414 0.52084 0.50000 1.0000 + Cr Cr404 1.0 0.81414 0.60417 0.50000 1.0000 + Cr Cr405 1.0 0.81414 0.68750 0.50000 1.0000 + Cr Cr406 1.0 0.81414 0.77084 0.50000 1.0000 + Cr Cr407 1.0 0.81414 0.85417 0.50000 1.0000 + Cr Cr408 1.0 0.81414 0.93750 0.50000 1.0000 + Cr Cr409 1.0 0.89747 0.02084 0.50000 1.0000 + Cr Cr410 1.0 0.89747 0.10417 0.50000 1.0000 + Cr Cr411 1.0 0.89747 0.18750 0.50000 1.0000 + Cr Cr412 1.0 0.89747 0.27084 0.50000 1.0000 + Cr Cr413 1.0 0.89747 0.35417 0.50000 1.0000 + Cr Cr414 1.0 0.89747 0.43750 0.50000 1.0000 + Cr Cr415 1.0 0.89747 0.52084 0.50000 1.0000 + Cr Cr416 1.0 0.89747 0.60417 0.50000 1.0000 + Cr Cr417 1.0 0.89747 0.68750 0.50000 1.0000 + Cr Cr418 1.0 0.89747 0.77084 0.50000 1.0000 + Cr Cr419 1.0 0.89747 0.85417 0.50000 1.0000 + Cr Cr420 1.0 0.89747 0.93750 0.50000 1.0000 + Cr Cr421 1.0 0.98081 0.02084 0.50000 1.0000 + Cr Cr422 1.0 0.98081 0.10417 0.50000 1.0000 + Cr Cr423 1.0 0.98081 0.18750 0.50000 1.0000 + Cr Cr424 1.0 0.98081 0.27084 0.50000 1.0000 + Cr Cr425 1.0 0.98081 0.35417 0.50000 1.0000 + Cr Cr426 1.0 0.98081 0.43750 0.50000 1.0000 + Cr Cr427 1.0 0.98081 0.52084 0.50000 1.0000 + Cr Cr428 1.0 0.98081 0.60417 0.50000 1.0000 + Cr Cr429 1.0 0.98081 0.68750 0.50000 1.0000 + Cr Cr430 1.0 0.98081 0.77084 0.50000 1.0000 + Cr Cr431 1.0 0.98081 0.85417 0.50000 1.0000 + Cr Cr432 1.0 0.98081 0.93750 0.50000 1.0000 + O O1 1.0 0.05356 0.00000 0.33964 1.0000 + O O2 1.0 0.05356 0.08333 0.33964 1.0000 + O O3 1.0 0.05356 0.16667 0.33964 1.0000 + O O4 1.0 0.05356 0.25000 0.33964 1.0000 + O O5 1.0 0.05356 0.33333 0.33964 1.0000 + O O6 1.0 0.05356 0.41667 0.33964 1.0000 + O O7 1.0 0.05356 0.50000 0.33964 1.0000 + O O8 1.0 0.05356 0.58333 0.33964 1.0000 + O O9 1.0 0.05356 0.66667 0.33964 1.0000 + O O10 1.0 0.05356 0.75000 0.33964 1.0000 + O O11 1.0 0.05356 0.83333 0.33964 1.0000 + O O12 1.0 0.05356 0.91667 0.33964 1.0000 + O O13 1.0 0.13689 0.00000 0.33964 1.0000 + O O14 1.0 0.13689 0.08333 0.33964 1.0000 + O O15 1.0 0.13689 0.16667 0.33964 1.0000 + O O16 1.0 0.13689 0.25000 0.33964 1.0000 + O O17 1.0 0.13689 0.33333 0.33964 1.0000 + O O18 1.0 0.13689 0.41667 0.33964 1.0000 + O O19 1.0 0.13689 0.50000 0.33964 1.0000 + O O20 1.0 0.13689 0.58333 0.33964 1.0000 + O O21 1.0 0.13689 0.66667 0.33964 1.0000 + O O22 1.0 0.13689 0.75000 0.33964 1.0000 + O O23 1.0 0.13689 0.83333 0.33964 1.0000 + O O24 1.0 0.13689 0.91667 0.33964 1.0000 + O O25 1.0 0.22022 0.00000 0.33964 1.0000 + O O26 1.0 0.22022 0.08333 0.33964 1.0000 + O O27 1.0 0.22022 0.16667 0.33964 1.0000 + O O28 1.0 0.22022 0.25000 0.33964 1.0000 + O O29 1.0 0.22022 0.33333 0.33964 1.0000 + O O30 1.0 0.22022 0.41667 0.33964 1.0000 + O O31 1.0 0.22022 0.50000 0.33964 1.0000 + O O32 1.0 0.22022 0.58333 0.33964 1.0000 + O O33 1.0 0.22022 0.66667 0.33964 1.0000 + O O34 1.0 0.22022 0.75000 0.33964 1.0000 + O O35 1.0 0.22022 0.83333 0.33964 1.0000 + O O36 1.0 0.22022 0.91667 0.33964 1.0000 + O O37 1.0 0.30356 0.00000 0.33964 1.0000 + O O38 1.0 0.30356 0.08333 0.33964 1.0000 + O O39 1.0 0.30356 0.16667 0.33964 1.0000 + O O40 1.0 0.30356 0.25000 0.33964 1.0000 + O O41 1.0 0.30356 0.33333 0.33964 1.0000 + O O42 1.0 0.30356 0.41667 0.33964 1.0000 + O O43 1.0 0.30356 0.50000 0.33964 1.0000 + O O44 1.0 0.30356 0.58333 0.33964 1.0000 + O O45 1.0 0.30356 0.66667 0.33964 1.0000 + O O46 1.0 0.30356 0.75000 0.33964 1.0000 + O O47 1.0 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new file mode 100644 index 0000000000000000000000000000000000000000..a328c150ae9a37469f3f0b9b1769c35c5ffe4afe --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-4116_supercell_16x16x1.cif @@ -0,0 +1,1561 @@ +data_image0 +_chemical_formula_structural Mn256Co256O1024 +_chemical_formula_sum "Mn256 Co256 O1024" +_cell_length_a 46.5736 +_cell_length_b 80.7642 +_cell_length_c 5.98288 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Mn Mn1 1.0 0.03125 0.03124 0.50023 1.0000 + Mn Mn2 1.0 0.03125 0.09374 0.50023 1.0000 + Mn Mn3 1.0 0.03125 0.15624 0.50023 1.0000 + Mn Mn4 1.0 0.03125 0.21874 0.50023 1.0000 + Mn Mn5 1.0 0.03125 0.28124 0.50023 1.0000 + Mn Mn6 1.0 0.03125 0.34374 0.50023 1.0000 + Mn Mn7 1.0 0.03125 0.40624 0.50023 1.0000 + Mn Mn8 1.0 0.03125 0.46874 0.50023 1.0000 + Mn Mn9 1.0 0.03125 0.53124 0.50023 1.0000 + Mn Mn10 1.0 0.03125 0.59374 0.50023 1.0000 + Mn Mn11 1.0 0.03125 0.65624 0.50023 1.0000 + Mn Mn12 1.0 0.03125 0.71874 0.50023 1.0000 + Mn Mn13 1.0 0.03125 0.78124 0.50023 1.0000 + Mn Mn14 1.0 0.03125 0.84374 0.50023 1.0000 + Mn Mn15 1.0 0.03125 0.90624 0.50023 1.0000 + Mn Mn16 1.0 0.03125 0.96874 0.50023 1.0000 + Mn Mn17 1.0 0.09375 0.03124 0.50023 1.0000 + Mn Mn18 1.0 0.09375 0.09374 0.50023 1.0000 + Mn Mn19 1.0 0.09375 0.15624 0.50023 1.0000 + Mn Mn20 1.0 0.09375 0.21874 0.50023 1.0000 + Mn Mn21 1.0 0.09375 0.28124 0.50023 1.0000 + Mn Mn22 1.0 0.09375 0.34374 0.50023 1.0000 + Mn Mn23 1.0 0.09375 0.40624 0.50023 1.0000 + Mn Mn24 1.0 0.09375 0.46874 0.50023 1.0000 + Mn Mn25 1.0 0.09375 0.53124 0.50023 1.0000 + Mn Mn26 1.0 0.09375 0.59374 0.50023 1.0000 + Mn Mn27 1.0 0.09375 0.65624 0.50023 1.0000 + Mn Mn28 1.0 0.09375 0.71874 0.50023 1.0000 + Mn Mn29 1.0 0.09375 0.78124 0.50023 1.0000 + Mn Mn30 1.0 0.09375 0.84374 0.50023 1.0000 + Mn Mn31 1.0 0.09375 0.90624 0.50023 1.0000 + Mn Mn32 1.0 0.09375 0.96874 0.50023 1.0000 + Mn Mn33 1.0 0.15625 0.03124 0.50023 1.0000 + Mn Mn34 1.0 0.15625 0.09374 0.50023 1.0000 + Mn Mn35 1.0 0.15625 0.15624 0.50023 1.0000 + Mn Mn36 1.0 0.15625 0.21874 0.50023 1.0000 + Mn Mn37 1.0 0.15625 0.28124 0.50023 1.0000 + Mn Mn38 1.0 0.15625 0.34374 0.50023 1.0000 + Mn Mn39 1.0 0.15625 0.40624 0.50023 1.0000 + Mn Mn40 1.0 0.15625 0.46874 0.50023 1.0000 + Mn Mn41 1.0 0.15625 0.53124 0.50023 1.0000 + Mn Mn42 1.0 0.15625 0.59374 0.50023 1.0000 + Mn Mn43 1.0 0.15625 0.65624 0.50023 1.0000 + Mn Mn44 1.0 0.15625 0.71874 0.50023 1.0000 + Mn Mn45 1.0 0.15625 0.78124 0.50023 1.0000 + Mn Mn46 1.0 0.15625 0.84374 0.50023 1.0000 + Mn Mn47 1.0 0.15625 0.90624 0.50023 1.0000 + Mn Mn48 1.0 0.15625 0.96874 0.50023 1.0000 + Mn Mn49 1.0 0.21875 0.03124 0.50023 1.0000 + Mn Mn50 1.0 0.21875 0.09374 0.50023 1.0000 + Mn Mn51 1.0 0.21875 0.15624 0.50023 1.0000 + Mn Mn52 1.0 0.21875 0.21874 0.50023 1.0000 + Mn Mn53 1.0 0.21875 0.28124 0.50023 1.0000 + Mn Mn54 1.0 0.21875 0.34374 0.50023 1.0000 + Mn Mn55 1.0 0.21875 0.40624 0.50023 1.0000 + Mn Mn56 1.0 0.21875 0.46874 0.50023 1.0000 + Mn Mn57 1.0 0.21875 0.53124 0.50023 1.0000 + Mn Mn58 1.0 0.21875 0.59374 0.50023 1.0000 + Mn Mn59 1.0 0.21875 0.65624 0.50023 1.0000 + Mn Mn60 1.0 0.21875 0.71874 0.50023 1.0000 + Mn Mn61 1.0 0.21875 0.78124 0.50023 1.0000 + Mn Mn62 1.0 0.21875 0.84374 0.50023 1.0000 + Mn Mn63 1.0 0.21875 0.90624 0.50023 1.0000 + Mn Mn64 1.0 0.21875 0.96874 0.50023 1.0000 + Mn Mn65 1.0 0.28125 0.03124 0.50023 1.0000 + Mn Mn66 1.0 0.28125 0.09374 0.50023 1.0000 + Mn Mn67 1.0 0.28125 0.15624 0.50023 1.0000 + Mn Mn68 1.0 0.28125 0.21874 0.50023 1.0000 + Mn Mn69 1.0 0.28125 0.28124 0.50023 1.0000 + Mn Mn70 1.0 0.28125 0.34374 0.50023 1.0000 + Mn Mn71 1.0 0.28125 0.40624 0.50023 1.0000 + Mn Mn72 1.0 0.28125 0.46874 0.50023 1.0000 + Mn Mn73 1.0 0.28125 0.53124 0.50023 1.0000 + Mn Mn74 1.0 0.28125 0.59374 0.50023 1.0000 + Mn Mn75 1.0 0.28125 0.65624 0.50023 1.0000 + Mn Mn76 1.0 0.28125 0.71874 0.50023 1.0000 + Mn Mn77 1.0 0.28125 0.78124 0.50023 1.0000 + Mn Mn78 1.0 0.28125 0.84374 0.50023 1.0000 + Mn Mn79 1.0 0.28125 0.90624 0.50023 1.0000 + Mn Mn80 1.0 0.28125 0.96874 0.50023 1.0000 + Mn Mn81 1.0 0.34375 0.03124 0.50023 1.0000 + Mn Mn82 1.0 0.34375 0.09374 0.50023 1.0000 + Mn Mn83 1.0 0.34375 0.15624 0.50023 1.0000 + Mn Mn84 1.0 0.34375 0.21874 0.50023 1.0000 + Mn Mn85 1.0 0.34375 0.28124 0.50023 1.0000 + Mn Mn86 1.0 0.34375 0.34374 0.50023 1.0000 + Mn Mn87 1.0 0.34375 0.40624 0.50023 1.0000 + Mn Mn88 1.0 0.34375 0.46874 0.50023 1.0000 + Mn Mn89 1.0 0.34375 0.53124 0.50023 1.0000 + Mn Mn90 1.0 0.34375 0.59374 0.50023 1.0000 + Mn Mn91 1.0 0.34375 0.65624 0.50023 1.0000 + Mn Mn92 1.0 0.34375 0.71874 0.50023 1.0000 + Mn Mn93 1.0 0.34375 0.78124 0.50023 1.0000 + Mn Mn94 1.0 0.34375 0.84374 0.50023 1.0000 + Mn Mn95 1.0 0.34375 0.90624 0.50023 1.0000 + Mn Mn96 1.0 0.34375 0.96874 0.50023 1.0000 + Mn Mn97 1.0 0.40625 0.03124 0.50023 1.0000 + Mn Mn98 1.0 0.40625 0.09374 0.50023 1.0000 + Mn Mn99 1.0 0.40625 0.15624 0.50023 1.0000 + Mn Mn100 1.0 0.40625 0.21874 0.50023 1.0000 + Mn Mn101 1.0 0.40625 0.28124 0.50023 1.0000 + Mn Mn102 1.0 0.40625 0.34374 0.50023 1.0000 + Mn Mn103 1.0 0.40625 0.40624 0.50023 1.0000 + Mn Mn104 1.0 0.40625 0.46874 0.50023 1.0000 + Mn Mn105 1.0 0.40625 0.53124 0.50023 1.0000 + Mn Mn106 1.0 0.40625 0.59374 0.50023 1.0000 + Mn Mn107 1.0 0.40625 0.65624 0.50023 1.0000 + Mn Mn108 1.0 0.40625 0.71874 0.50023 1.0000 + Mn Mn109 1.0 0.40625 0.78124 0.50023 1.0000 + Mn Mn110 1.0 0.40625 0.84374 0.50023 1.0000 + Mn Mn111 1.0 0.40625 0.90624 0.50023 1.0000 + Mn Mn112 1.0 0.40625 0.96874 0.50023 1.0000 + Mn Mn113 1.0 0.46875 0.03124 0.50023 1.0000 + Mn Mn114 1.0 0.46875 0.09374 0.50023 1.0000 + Mn Mn115 1.0 0.46875 0.15624 0.50023 1.0000 + Mn Mn116 1.0 0.46875 0.21874 0.50023 1.0000 + Mn Mn117 1.0 0.46875 0.28124 0.50023 1.0000 + Mn Mn118 1.0 0.46875 0.34374 0.50023 1.0000 + Mn Mn119 1.0 0.46875 0.40624 0.50023 1.0000 + Mn Mn120 1.0 0.46875 0.46874 0.50023 1.0000 + Mn Mn121 1.0 0.46875 0.53124 0.50023 1.0000 + Mn Mn122 1.0 0.46875 0.59374 0.50023 1.0000 + Mn Mn123 1.0 0.46875 0.65624 0.50023 1.0000 + Mn Mn124 1.0 0.46875 0.71874 0.50023 1.0000 + Mn Mn125 1.0 0.46875 0.78124 0.50023 1.0000 + Mn Mn126 1.0 0.46875 0.84374 0.50023 1.0000 + Mn Mn127 1.0 0.46875 0.90624 0.50023 1.0000 + Mn Mn128 1.0 0.46875 0.96874 0.50023 1.0000 + Mn Mn129 1.0 0.53125 0.03124 0.50023 1.0000 + Mn Mn130 1.0 0.53125 0.09374 0.50023 1.0000 + Mn Mn131 1.0 0.53125 0.15624 0.50023 1.0000 + Mn Mn132 1.0 0.53125 0.21874 0.50023 1.0000 + Mn Mn133 1.0 0.53125 0.28124 0.50023 1.0000 + Mn Mn134 1.0 0.53125 0.34374 0.50023 1.0000 + Mn Mn135 1.0 0.53125 0.40624 0.50023 1.0000 + Mn Mn136 1.0 0.53125 0.46874 0.50023 1.0000 + Mn Mn137 1.0 0.53125 0.53124 0.50023 1.0000 + Mn Mn138 1.0 0.53125 0.59374 0.50023 1.0000 + Mn Mn139 1.0 0.53125 0.65624 0.50023 1.0000 + Mn Mn140 1.0 0.53125 0.71874 0.50023 1.0000 + Mn Mn141 1.0 0.53125 0.78124 0.50023 1.0000 + Mn Mn142 1.0 0.53125 0.84374 0.50023 1.0000 + Mn Mn143 1.0 0.53125 0.90624 0.50023 1.0000 + Mn Mn144 1.0 0.53125 0.96874 0.50023 1.0000 + Mn Mn145 1.0 0.59375 0.03124 0.50023 1.0000 + Mn Mn146 1.0 0.59375 0.09374 0.50023 1.0000 + Mn Mn147 1.0 0.59375 0.15624 0.50023 1.0000 + Mn Mn148 1.0 0.59375 0.21874 0.50023 1.0000 + Mn Mn149 1.0 0.59375 0.28124 0.50023 1.0000 + Mn Mn150 1.0 0.59375 0.34374 0.50023 1.0000 + Mn Mn151 1.0 0.59375 0.40624 0.50023 1.0000 + Mn Mn152 1.0 0.59375 0.46874 0.50023 1.0000 + Mn Mn153 1.0 0.59375 0.53124 0.50023 1.0000 + Mn Mn154 1.0 0.59375 0.59374 0.50023 1.0000 + Mn Mn155 1.0 0.59375 0.65624 0.50023 1.0000 + Mn Mn156 1.0 0.59375 0.71874 0.50023 1.0000 + Mn Mn157 1.0 0.59375 0.78124 0.50023 1.0000 + Mn Mn158 1.0 0.59375 0.84374 0.50023 1.0000 + Mn Mn159 1.0 0.59375 0.90624 0.50023 1.0000 + Mn Mn160 1.0 0.59375 0.96874 0.50023 1.0000 + Mn Mn161 1.0 0.65625 0.03124 0.50023 1.0000 + Mn Mn162 1.0 0.65625 0.09374 0.50023 1.0000 + Mn Mn163 1.0 0.65625 0.15624 0.50023 1.0000 + Mn Mn164 1.0 0.65625 0.21874 0.50023 1.0000 + Mn Mn165 1.0 0.65625 0.28124 0.50023 1.0000 + Mn Mn166 1.0 0.65625 0.34374 0.50023 1.0000 + Mn Mn167 1.0 0.65625 0.40624 0.50023 1.0000 + Mn Mn168 1.0 0.65625 0.46874 0.50023 1.0000 + Mn Mn169 1.0 0.65625 0.53124 0.50023 1.0000 + Mn Mn170 1.0 0.65625 0.59374 0.50023 1.0000 + Mn Mn171 1.0 0.65625 0.65624 0.50023 1.0000 + Mn Mn172 1.0 0.65625 0.71874 0.50023 1.0000 + Mn Mn173 1.0 0.65625 0.78124 0.50023 1.0000 + Mn Mn174 1.0 0.65625 0.84374 0.50023 1.0000 + Mn Mn175 1.0 0.65625 0.90624 0.50023 1.0000 + Mn Mn176 1.0 0.65625 0.96874 0.50023 1.0000 + Mn Mn177 1.0 0.71875 0.03124 0.50023 1.0000 + Mn Mn178 1.0 0.71875 0.09374 0.50023 1.0000 + Mn Mn179 1.0 0.71875 0.15624 0.50023 1.0000 + Mn Mn180 1.0 0.71875 0.21874 0.50023 1.0000 + Mn Mn181 1.0 0.71875 0.28124 0.50023 1.0000 + Mn Mn182 1.0 0.71875 0.34374 0.50023 1.0000 + Mn Mn183 1.0 0.71875 0.40624 0.50023 1.0000 + Mn Mn184 1.0 0.71875 0.46874 0.50023 1.0000 + Mn Mn185 1.0 0.71875 0.53124 0.50023 1.0000 + Mn Mn186 1.0 0.71875 0.59374 0.50023 1.0000 + Mn Mn187 1.0 0.71875 0.65624 0.50023 1.0000 + Mn Mn188 1.0 0.71875 0.71874 0.50023 1.0000 + Mn Mn189 1.0 0.71875 0.78124 0.50023 1.0000 + Mn Mn190 1.0 0.71875 0.84374 0.50023 1.0000 + Mn Mn191 1.0 0.71875 0.90624 0.50023 1.0000 + Mn Mn192 1.0 0.71875 0.96874 0.50023 1.0000 + Mn Mn193 1.0 0.78125 0.03124 0.50023 1.0000 + Mn Mn194 1.0 0.78125 0.09374 0.50023 1.0000 + Mn Mn195 1.0 0.78125 0.15624 0.50023 1.0000 + Mn Mn196 1.0 0.78125 0.21874 0.50023 1.0000 + Mn Mn197 1.0 0.78125 0.28124 0.50023 1.0000 + Mn Mn198 1.0 0.78125 0.34374 0.50023 1.0000 + Mn Mn199 1.0 0.78125 0.40624 0.50023 1.0000 + Mn Mn200 1.0 0.78125 0.46874 0.50023 1.0000 + Mn Mn201 1.0 0.78125 0.53124 0.50023 1.0000 + Mn Mn202 1.0 0.78125 0.59374 0.50023 1.0000 + Mn Mn203 1.0 0.78125 0.65624 0.50023 1.0000 + Mn Mn204 1.0 0.78125 0.71874 0.50023 1.0000 + Mn Mn205 1.0 0.78125 0.78124 0.50023 1.0000 + Mn Mn206 1.0 0.78125 0.84374 0.50023 1.0000 + Mn Mn207 1.0 0.78125 0.90624 0.50023 1.0000 + Mn Mn208 1.0 0.78125 0.96874 0.50023 1.0000 + Mn Mn209 1.0 0.84375 0.03124 0.50023 1.0000 + Mn Mn210 1.0 0.84375 0.09374 0.50023 1.0000 + Mn Mn211 1.0 0.84375 0.15624 0.50023 1.0000 + Mn Mn212 1.0 0.84375 0.21874 0.50023 1.0000 + Mn Mn213 1.0 0.84375 0.28124 0.50023 1.0000 + Mn Mn214 1.0 0.84375 0.34374 0.50023 1.0000 + Mn Mn215 1.0 0.84375 0.40624 0.50023 1.0000 + Mn Mn216 1.0 0.84375 0.46874 0.50023 1.0000 + Mn Mn217 1.0 0.84375 0.53124 0.50023 1.0000 + Mn Mn218 1.0 0.84375 0.59374 0.50023 1.0000 + Mn Mn219 1.0 0.84375 0.65624 0.50023 1.0000 + Mn Mn220 1.0 0.84375 0.71874 0.50023 1.0000 + Mn Mn221 1.0 0.84375 0.78124 0.50023 1.0000 + Mn Mn222 1.0 0.84375 0.84374 0.50023 1.0000 + Mn Mn223 1.0 0.84375 0.90624 0.50023 1.0000 + Mn Mn224 1.0 0.84375 0.96874 0.50023 1.0000 + Mn Mn225 1.0 0.90625 0.03124 0.50023 1.0000 + Mn Mn226 1.0 0.90625 0.09374 0.50023 1.0000 + Mn Mn227 1.0 0.90625 0.15624 0.50023 1.0000 + Mn Mn228 1.0 0.90625 0.21874 0.50023 1.0000 + Mn Mn229 1.0 0.90625 0.28124 0.50023 1.0000 + Mn Mn230 1.0 0.90625 0.34374 0.50023 1.0000 + Mn Mn231 1.0 0.90625 0.40624 0.50023 1.0000 + Mn Mn232 1.0 0.90625 0.46874 0.50023 1.0000 + Mn Mn233 1.0 0.90625 0.53124 0.50023 1.0000 + Mn Mn234 1.0 0.90625 0.59374 0.50023 1.0000 + Mn Mn235 1.0 0.90625 0.65624 0.50023 1.0000 + Mn Mn236 1.0 0.90625 0.71874 0.50023 1.0000 + Mn Mn237 1.0 0.90625 0.78124 0.50023 1.0000 + Mn Mn238 1.0 0.90625 0.84374 0.50023 1.0000 + Mn Mn239 1.0 0.90625 0.90624 0.50023 1.0000 + Mn Mn240 1.0 0.90625 0.96874 0.50023 1.0000 + Mn Mn241 1.0 0.96875 0.03124 0.50023 1.0000 + Mn Mn242 1.0 0.96875 0.09374 0.50023 1.0000 + Mn Mn243 1.0 0.96875 0.15624 0.50023 1.0000 + Mn Mn244 1.0 0.96875 0.21874 0.50023 1.0000 + Mn Mn245 1.0 0.96875 0.28124 0.50023 1.0000 + Mn Mn246 1.0 0.96875 0.34374 0.50023 1.0000 + Mn Mn247 1.0 0.96875 0.40624 0.50023 1.0000 + Mn Mn248 1.0 0.96875 0.46874 0.50023 1.0000 + Mn Mn249 1.0 0.96875 0.53124 0.50023 1.0000 + Mn Mn250 1.0 0.96875 0.59374 0.50023 1.0000 + Mn Mn251 1.0 0.96875 0.65624 0.50023 1.0000 + Mn Mn252 1.0 0.96875 0.71874 0.50023 1.0000 + Mn Mn253 1.0 0.96875 0.78124 0.50023 1.0000 + Mn Mn254 1.0 0.96875 0.84374 0.50023 1.0000 + Mn Mn255 1.0 0.96875 0.90624 0.50023 1.0000 + Mn Mn256 1.0 0.96875 0.96874 0.50023 1.0000 + Co Co1 1.0 0.00000 0.00001 0.50012 1.0000 + Co Co2 1.0 0.00000 0.06251 0.50012 1.0000 + Co Co3 1.0 0.00000 0.12501 0.50012 1.0000 + Co Co4 1.0 0.00000 0.18751 0.50012 1.0000 + Co Co5 1.0 0.00000 0.25001 0.50012 1.0000 + Co Co6 1.0 0.00000 0.31251 0.50012 1.0000 + Co Co7 1.0 0.00000 0.37501 0.50012 1.0000 + Co Co8 1.0 0.00000 0.43751 0.50012 1.0000 + Co Co9 1.0 0.00000 0.50001 0.50012 1.0000 + Co Co10 1.0 0.00000 0.56251 0.50012 1.0000 + Co Co11 1.0 0.00000 0.62501 0.50012 1.0000 + Co Co12 1.0 0.00000 0.68751 0.50012 1.0000 + Co Co13 1.0 0.00000 0.75001 0.50012 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Co Co36 1.0 0.12500 0.18751 0.50012 1.0000 + Co Co37 1.0 0.12500 0.25001 0.50012 1.0000 + Co Co38 1.0 0.12500 0.31251 0.50012 1.0000 + Co Co39 1.0 0.12500 0.37501 0.50012 1.0000 + Co Co40 1.0 0.12500 0.43751 0.50012 1.0000 + Co Co41 1.0 0.12500 0.50001 0.50012 1.0000 + Co Co42 1.0 0.12500 0.56251 0.50012 1.0000 + Co Co43 1.0 0.12500 0.62501 0.50012 1.0000 + Co Co44 1.0 0.12500 0.68751 0.50012 1.0000 + Co Co45 1.0 0.12500 0.75001 0.50012 1.0000 + Co Co46 1.0 0.12500 0.81251 0.50012 1.0000 + Co Co47 1.0 0.12500 0.87501 0.50012 1.0000 + Co Co48 1.0 0.12500 0.93751 0.50012 1.0000 + Co Co49 1.0 0.18750 0.00001 0.50012 1.0000 + Co Co50 1.0 0.18750 0.06251 0.50012 1.0000 + Co Co51 1.0 0.18750 0.12501 0.50012 1.0000 + Co Co52 1.0 0.18750 0.18751 0.50012 1.0000 + Co Co53 1.0 0.18750 0.25001 0.50012 1.0000 + Co Co54 1.0 0.18750 0.31251 0.50012 1.0000 + Co Co55 1.0 0.18750 0.37501 0.50012 1.0000 + Co Co56 1.0 0.18750 0.43751 0.50012 1.0000 + Co Co57 1.0 0.18750 0.50001 0.50012 1.0000 + Co Co58 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0.96876 0.69793 0.34344 1.0000 + O O1021 1.0 0.96876 0.76043 0.34344 1.0000 + O O1022 1.0 0.96876 0.82293 0.34344 1.0000 + O O1023 1.0 0.96876 0.88543 0.34344 1.0000 + O O1024 1.0 0.96876 0.94793 0.34344 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-4151_supercell_12x12x1.cif b/tier3/cif_file/orthogonal_2dm-4151_supercell_12x12x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..b9769004a2046e18df3e2835ac17c907ed23c7b1 --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-4151_supercell_12x12x1.cif @@ -0,0 +1,1753 @@ +data_image0 +_chemical_formula_structural Li288V288F1152 +_chemical_formula_sum "Li288 V288 F1152" +_cell_length_a 74.1611 +_cell_length_b 84.0222 +_cell_length_c 6.5628 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + 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b/tier3/cif_file/orthogonal_2dm-4156_supercell_16x16x1.cif @@ -0,0 +1,1561 @@ +data_image0 +_chemical_formula_structural Fe256Co256O1024 +_chemical_formula_sum "Fe256 Co256 O1024" +_cell_length_a 46.5934 +_cell_length_b 80.2759 +_cell_length_c 5.92438 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Fe Fe1 1.0 0.00000 0.00000 0.50000 1.0000 + Fe Fe2 1.0 0.00000 0.06250 0.50000 1.0000 + Fe Fe3 1.0 0.00000 0.12500 0.50000 1.0000 + Fe Fe4 1.0 0.00000 0.18750 0.50000 1.0000 + Fe Fe5 1.0 0.00000 0.25000 0.50000 1.0000 + Fe Fe6 1.0 0.00000 0.31250 0.50000 1.0000 + Fe Fe7 1.0 0.00000 0.37500 0.50000 1.0000 + Fe Fe8 1.0 0.00000 0.43750 0.50000 1.0000 + Fe Fe9 1.0 0.00000 0.50000 0.50000 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Fe Fe32 1.0 0.06250 0.93750 0.50000 1.0000 + Fe Fe33 1.0 0.12500 0.00000 0.50000 1.0000 + Fe Fe34 1.0 0.12500 0.06250 0.50000 1.0000 + Fe Fe35 1.0 0.12500 0.12500 0.50000 1.0000 + Fe Fe36 1.0 0.12500 0.18750 0.50000 1.0000 + Fe Fe37 1.0 0.12500 0.25000 0.50000 1.0000 + Fe Fe38 1.0 0.12500 0.31250 0.50000 1.0000 + Fe Fe39 1.0 0.12500 0.37500 0.50000 1.0000 + Fe Fe40 1.0 0.12500 0.43750 0.50000 1.0000 + Fe Fe41 1.0 0.12500 0.50000 0.50000 1.0000 + Fe Fe42 1.0 0.12500 0.56250 0.50000 1.0000 + Fe Fe43 1.0 0.12500 0.62500 0.50000 1.0000 + Fe Fe44 1.0 0.12500 0.68750 0.50000 1.0000 + Fe Fe45 1.0 0.12500 0.75000 0.50000 1.0000 + Fe Fe46 1.0 0.12500 0.81250 0.50000 1.0000 + Fe Fe47 1.0 0.12500 0.87500 0.50000 1.0000 + Fe Fe48 1.0 0.12500 0.93750 0.50000 1.0000 + Fe Fe49 1.0 0.18750 0.00000 0.50000 1.0000 + Fe Fe50 1.0 0.18750 0.06250 0.50000 1.0000 + Fe Fe51 1.0 0.18750 0.12500 0.50000 1.0000 + Fe Fe52 1.0 0.18750 0.18750 0.50000 1.0000 + Fe Fe53 1.0 0.18750 0.25000 0.50000 1.0000 + Fe Fe54 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0.33971 1.0000 + F F1711 1.0 0.21496 0.31073 0.33971 1.0000 + F F1712 1.0 0.25663 0.35239 0.33971 1.0000 + F F1713 1.0 0.29829 0.39406 0.33971 1.0000 + F F1714 1.0 0.33996 0.43573 0.33971 1.0000 + F F1715 1.0 0.38163 0.47739 0.33971 1.0000 + F F1716 1.0 0.42329 0.51906 0.33971 1.0000 + F F1717 1.0 0.00663 0.01906 0.33971 1.0000 + F F1718 1.0 0.04829 0.06073 0.33971 1.0000 + F F1719 1.0 0.08996 0.10239 0.33971 1.0000 + F F1720 1.0 0.13163 0.14406 0.33971 1.0000 + F F1721 1.0 0.17329 0.18573 0.33971 1.0000 + F F1722 1.0 0.21496 0.22739 0.33971 1.0000 + F F1723 1.0 0.25663 0.26906 0.33971 1.0000 + F F1724 1.0 0.29829 0.31073 0.33971 1.0000 + F F1725 1.0 0.33996 0.35239 0.33971 1.0000 + F F1726 1.0 0.38163 0.39406 0.33971 1.0000 + F F1727 1.0 0.42329 0.43573 0.33971 1.0000 + F F1728 1.0 0.46496 0.47739 0.33971 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-4233_supercell_12x12x1.cif b/tier3/cif_file/orthogonal_2dm-4233_supercell_12x12x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..f8d0971c139f07aeea6fba43de2c3648a4732803 --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-4233_supercell_12x12x1.cif @@ -0,0 +1,3193 @@ +data_image0 +_chemical_formula_structural Fe432O144F1008Fe432O144F1008 +_chemical_formula_sum "Fe864 O288 F2016" +_cell_length_a 127.097 +_cell_length_b 73.3796 +_cell_length_c 6.04345 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Fe Fe1 1.0 0.01441 0.00000 0.48955 1.0000 + Fe Fe2 1.0 0.05608 0.04167 0.48955 1.0000 + Fe Fe3 1.0 0.09775 0.08333 0.48955 1.0000 + Fe Fe4 1.0 0.13941 0.12500 0.48955 1.0000 + Fe Fe5 1.0 0.18108 0.16667 0.48955 1.0000 + Fe Fe6 1.0 0.22275 0.20833 0.48955 1.0000 + Fe Fe7 1.0 0.26441 0.25000 0.48955 1.0000 + Fe Fe8 1.0 0.30608 0.29167 0.48955 1.0000 + Fe Fe9 1.0 0.34775 0.33333 0.48955 1.0000 + Fe Fe10 1.0 0.38941 0.37500 0.48955 1.0000 + Fe Fe11 1.0 0.43108 0.41667 0.48955 1.0000 + Fe Fe12 1.0 0.47275 0.45833 0.48955 1.0000 + Fe Fe13 1.0 0.05608 0.95833 0.48955 1.0000 + Fe Fe14 1.0 0.09775 0.00000 0.48955 1.0000 + Fe Fe15 1.0 0.13941 0.04167 0.48955 1.0000 + Fe Fe16 1.0 0.18108 0.08333 0.48955 1.0000 + Fe Fe17 1.0 0.22275 0.12500 0.48955 1.0000 + Fe Fe18 1.0 0.26441 0.16667 0.48955 1.0000 + Fe Fe19 1.0 0.30608 0.20833 0.48955 1.0000 + Fe Fe20 1.0 0.34775 0.25000 0.48955 1.0000 + Fe Fe21 1.0 0.38941 0.29167 0.48955 1.0000 + Fe Fe22 1.0 0.43108 0.33333 0.48955 1.0000 + Fe Fe23 1.0 0.47275 0.37500 0.48955 1.0000 + Fe Fe24 1.0 0.51441 0.41667 0.48955 1.0000 + Fe Fe25 1.0 0.09775 0.91667 0.48955 1.0000 + Fe Fe26 1.0 0.13941 0.95833 0.48955 1.0000 + Fe Fe27 1.0 0.18108 0.00000 0.48955 1.0000 + Fe Fe28 1.0 0.22275 0.04167 0.48955 1.0000 + Fe Fe29 1.0 0.26441 0.08333 0.48955 1.0000 + Fe Fe30 1.0 0.30608 0.12500 0.48955 1.0000 + Fe Fe31 1.0 0.34775 0.16667 0.48955 1.0000 + Fe Fe32 1.0 0.38941 0.20833 0.48955 1.0000 + Fe Fe33 1.0 0.43108 0.25000 0.48955 1.0000 + Fe Fe34 1.0 0.47275 0.29167 0.48955 1.0000 + Fe Fe35 1.0 0.51441 0.33333 0.48955 1.0000 + Fe Fe36 1.0 0.55608 0.37500 0.48955 1.0000 + Fe Fe37 1.0 0.13941 0.87500 0.48955 1.0000 + Fe Fe38 1.0 0.18108 0.91667 0.48955 1.0000 + Fe Fe39 1.0 0.22275 0.95833 0.48955 1.0000 + Fe Fe40 1.0 0.26441 0.00000 0.48955 1.0000 + Fe Fe41 1.0 0.30608 0.04167 0.48955 1.0000 + Fe Fe42 1.0 0.34775 0.08333 0.48955 1.0000 + Fe Fe43 1.0 0.38941 0.12500 0.48955 1.0000 + Fe Fe44 1.0 0.43108 0.16667 0.48955 1.0000 + Fe Fe45 1.0 0.47275 0.20833 0.48955 1.0000 + Fe Fe46 1.0 0.51441 0.25000 0.48955 1.0000 + Fe Fe47 1.0 0.55608 0.29167 0.48955 1.0000 + Fe Fe48 1.0 0.59775 0.33333 0.48955 1.0000 + Fe Fe49 1.0 0.18108 0.83333 0.48955 1.0000 + Fe Fe50 1.0 0.22275 0.87500 0.48955 1.0000 + Fe Fe51 1.0 0.26441 0.91667 0.48955 1.0000 + Fe Fe52 1.0 0.30608 0.95833 0.48955 1.0000 + Fe Fe53 1.0 0.34775 1.00000 0.48955 1.0000 + Fe Fe54 1.0 0.38941 0.04167 0.48955 1.0000 + Fe Fe55 1.0 0.43108 0.08333 0.48955 1.0000 + Fe Fe56 1.0 0.47275 0.12500 0.48955 1.0000 + Fe Fe57 1.0 0.51441 0.16667 0.48955 1.0000 + Fe Fe58 1.0 0.55608 0.20833 0.48955 1.0000 + Fe Fe59 1.0 0.59775 0.25000 0.48955 1.0000 + Fe Fe60 1.0 0.63941 0.29167 0.48955 1.0000 + Fe Fe61 1.0 0.22275 0.79167 0.48955 1.0000 + Fe Fe62 1.0 0.26441 0.83333 0.48955 1.0000 + Fe Fe63 1.0 0.30608 0.87500 0.48955 1.0000 + Fe Fe64 1.0 0.34775 0.91667 0.48955 1.0000 + Fe Fe65 1.0 0.38941 0.95833 0.48955 1.0000 + Fe Fe66 1.0 0.43108 0.00000 0.48955 1.0000 + Fe Fe67 1.0 0.47275 0.04167 0.48955 1.0000 + Fe Fe68 1.0 0.51441 0.08333 0.48955 1.0000 + Fe Fe69 1.0 0.55608 0.12500 0.48955 1.0000 + Fe Fe70 1.0 0.59775 0.16667 0.48955 1.0000 + Fe Fe71 1.0 0.63941 0.20833 0.48955 1.0000 + Fe Fe72 1.0 0.68108 0.25000 0.48955 1.0000 + Fe Fe73 1.0 0.26441 0.75000 0.48955 1.0000 + Fe Fe74 1.0 0.30608 0.79167 0.48955 1.0000 + Fe Fe75 1.0 0.34775 0.83333 0.48955 1.0000 + Fe Fe76 1.0 0.38941 0.87500 0.48955 1.0000 + Fe Fe77 1.0 0.43108 0.91667 0.48955 1.0000 + Fe Fe78 1.0 0.47275 0.95833 0.48955 1.0000 + Fe Fe79 1.0 0.51441 0.00000 0.48955 1.0000 + Fe Fe80 1.0 0.55608 0.04167 0.48955 1.0000 + Fe Fe81 1.0 0.59775 0.08333 0.48955 1.0000 + Fe Fe82 1.0 0.63941 0.12500 0.48955 1.0000 + Fe Fe83 1.0 0.68108 0.16667 0.48955 1.0000 + Fe Fe84 1.0 0.72275 0.20833 0.48955 1.0000 + Fe Fe85 1.0 0.30608 0.70833 0.48955 1.0000 + Fe Fe86 1.0 0.34775 0.75000 0.48955 1.0000 + Fe Fe87 1.0 0.38941 0.79167 0.48955 1.0000 + Fe Fe88 1.0 0.43108 0.83333 0.48955 1.0000 + Fe Fe89 1.0 0.47275 0.87500 0.48955 1.0000 + Fe Fe90 1.0 0.51441 0.91667 0.48955 1.0000 + Fe Fe91 1.0 0.55608 0.95833 0.48955 1.0000 + Fe Fe92 1.0 0.59775 0.00000 0.48955 1.0000 + Fe Fe93 1.0 0.63941 0.04167 0.48955 1.0000 + Fe Fe94 1.0 0.68108 0.08333 0.48955 1.0000 + Fe Fe95 1.0 0.72275 0.12500 0.48955 1.0000 + Fe Fe96 1.0 0.76441 0.16667 0.48955 1.0000 + Fe Fe97 1.0 0.34775 0.66667 0.48955 1.0000 + Fe Fe98 1.0 0.38941 0.70833 0.48955 1.0000 + Fe Fe99 1.0 0.43108 0.75000 0.48955 1.0000 + Fe Fe100 1.0 0.47275 0.79167 0.48955 1.0000 + Fe Fe101 1.0 0.51441 0.83333 0.48955 1.0000 + Fe Fe102 1.0 0.55608 0.87500 0.48955 1.0000 + Fe Fe103 1.0 0.59775 0.91667 0.48955 1.0000 + Fe Fe104 1.0 0.63941 0.95833 0.48955 1.0000 + Fe Fe105 1.0 0.68108 1.00000 0.48955 1.0000 + Fe Fe106 1.0 0.72275 0.04167 0.48955 1.0000 + Fe Fe107 1.0 0.76441 0.08333 0.48955 1.0000 + Fe Fe108 1.0 0.80608 0.12500 0.48955 1.0000 + Fe Fe109 1.0 0.38941 0.62500 0.48955 1.0000 + Fe Fe110 1.0 0.43108 0.66667 0.48955 1.0000 + Fe Fe111 1.0 0.47275 0.70833 0.48955 1.0000 + Fe Fe112 1.0 0.51441 0.75000 0.48955 1.0000 + Fe Fe113 1.0 0.55608 0.79167 0.48955 1.0000 + Fe Fe114 1.0 0.59775 0.83333 0.48955 1.0000 + Fe Fe115 1.0 0.63941 0.87500 0.48955 1.0000 + Fe Fe116 1.0 0.68108 0.91667 0.48955 1.0000 + Fe Fe117 1.0 0.72275 0.95833 0.48955 1.0000 + Fe Fe118 1.0 0.76441 0.00000 0.48955 1.0000 + Fe Fe119 1.0 0.80608 0.04167 0.48955 1.0000 + Fe Fe120 1.0 0.84775 0.08333 0.48955 1.0000 + Fe Fe121 1.0 0.43108 0.58333 0.48955 1.0000 + Fe Fe122 1.0 0.47275 0.62500 0.48955 1.0000 + Fe Fe123 1.0 0.51441 0.66667 0.48955 1.0000 + Fe Fe124 1.0 0.55608 0.70833 0.48955 1.0000 + Fe Fe125 1.0 0.59775 0.75000 0.48955 1.0000 + Fe Fe126 1.0 0.63941 0.79167 0.48955 1.0000 + Fe Fe127 1.0 0.68108 0.83333 0.48955 1.0000 + Fe Fe128 1.0 0.72275 0.87500 0.48955 1.0000 + Fe Fe129 1.0 0.76441 0.91667 0.48955 1.0000 + Fe Fe130 1.0 0.80608 0.95833 0.48955 1.0000 + Fe Fe131 1.0 0.84775 0.00000 0.48955 1.0000 + Fe Fe132 1.0 0.88941 0.04167 0.48955 1.0000 + Fe Fe133 1.0 0.47275 0.54167 0.48955 1.0000 + Fe Fe134 1.0 0.51441 0.58333 0.48955 1.0000 + Fe Fe135 1.0 0.55608 0.62500 0.48955 1.0000 + Fe Fe136 1.0 0.59775 0.66667 0.48955 1.0000 + Fe Fe137 1.0 0.63941 0.70833 0.48955 1.0000 + Fe Fe138 1.0 0.68108 0.75000 0.48955 1.0000 + Fe Fe139 1.0 0.72275 0.79167 0.48955 1.0000 + Fe Fe140 1.0 0.76441 0.83333 0.48955 1.0000 + Fe Fe141 1.0 0.80608 0.87500 0.48955 1.0000 + Fe Fe142 1.0 0.84775 0.91667 0.48955 1.0000 + Fe Fe143 1.0 0.88941 0.95833 0.48955 1.0000 + Fe Fe144 1.0 0.93108 1.00000 0.48955 1.0000 + Fe Fe145 1.0 0.03446 0.02005 0.48955 1.0000 + Fe Fe146 1.0 0.07613 0.06171 0.48955 1.0000 + Fe Fe147 1.0 0.11779 0.10338 0.48955 1.0000 + Fe Fe148 1.0 0.15946 0.14505 0.48955 1.0000 + Fe Fe149 1.0 0.20113 0.18671 0.48955 1.0000 + Fe Fe150 1.0 0.24279 0.22838 0.48955 1.0000 + Fe Fe151 1.0 0.28446 0.27005 0.48955 1.0000 + Fe Fe152 1.0 0.32613 0.31171 0.48955 1.0000 + Fe Fe153 1.0 0.36779 0.35338 0.48955 1.0000 + Fe Fe154 1.0 0.40946 0.39505 0.48955 1.0000 + Fe Fe155 1.0 0.45113 0.43671 0.48955 1.0000 + Fe Fe156 1.0 0.49279 0.47838 0.48955 1.0000 + Fe Fe157 1.0 0.07613 0.97838 0.48955 1.0000 + Fe Fe158 1.0 0.11779 0.02005 0.48955 1.0000 + Fe Fe159 1.0 0.15946 0.06171 0.48955 1.0000 + Fe Fe160 1.0 0.20113 0.10338 0.48955 1.0000 + Fe Fe161 1.0 0.24279 0.14505 0.48955 1.0000 + Fe Fe162 1.0 0.28446 0.18671 0.48955 1.0000 + Fe Fe163 1.0 0.32613 0.22838 0.48955 1.0000 + Fe Fe164 1.0 0.36779 0.27005 0.48955 1.0000 + Fe Fe165 1.0 0.40946 0.31171 0.48955 1.0000 + Fe Fe166 1.0 0.45113 0.35338 0.48955 1.0000 + Fe Fe167 1.0 0.49279 0.39505 0.48955 1.0000 + Fe Fe168 1.0 0.53446 0.43671 0.48955 1.0000 + Fe Fe169 1.0 0.11779 0.93671 0.48955 1.0000 + Fe Fe170 1.0 0.15946 0.97838 0.48955 1.0000 + Fe Fe171 1.0 0.20113 0.02005 0.48955 1.0000 + Fe Fe172 1.0 0.24279 0.06171 0.48955 1.0000 + Fe Fe173 1.0 0.28446 0.10338 0.48955 1.0000 + Fe Fe174 1.0 0.32613 0.14505 0.48955 1.0000 + Fe Fe175 1.0 0.36779 0.18671 0.48955 1.0000 + Fe Fe176 1.0 0.40946 0.22838 0.48955 1.0000 + Fe Fe177 1.0 0.45113 0.27005 0.48955 1.0000 + Fe Fe178 1.0 0.49279 0.31171 0.48955 1.0000 + Fe Fe179 1.0 0.53446 0.35338 0.48955 1.0000 + Fe Fe180 1.0 0.57613 0.39505 0.48955 1.0000 + Fe Fe181 1.0 0.15946 0.89505 0.48955 1.0000 + Fe Fe182 1.0 0.20113 0.93671 0.48955 1.0000 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0.48955 1.0000 + Fe Fe205 1.0 0.24279 0.81171 0.48955 1.0000 + Fe Fe206 1.0 0.28446 0.85338 0.48955 1.0000 + Fe Fe207 1.0 0.32613 0.89505 0.48955 1.0000 + Fe Fe208 1.0 0.36779 0.93671 0.48955 1.0000 + Fe Fe209 1.0 0.40946 0.97838 0.48955 1.0000 + Fe Fe210 1.0 0.45113 0.02005 0.48955 1.0000 + Fe Fe211 1.0 0.49279 0.06171 0.48955 1.0000 + Fe Fe212 1.0 0.53446 0.10338 0.48955 1.0000 + Fe Fe213 1.0 0.57613 0.14505 0.48955 1.0000 + Fe Fe214 1.0 0.61779 0.18671 0.48955 1.0000 + Fe Fe215 1.0 0.65946 0.22838 0.48955 1.0000 + Fe Fe216 1.0 0.70113 0.27005 0.48955 1.0000 + Fe Fe217 1.0 0.28446 0.77005 0.48955 1.0000 + Fe Fe218 1.0 0.32613 0.81171 0.48955 1.0000 + Fe Fe219 1.0 0.36779 0.85338 0.48955 1.0000 + Fe Fe220 1.0 0.40946 0.89505 0.48955 1.0000 + Fe Fe221 1.0 0.45113 0.93671 0.48955 1.0000 + Fe Fe222 1.0 0.49279 0.97838 0.48955 1.0000 + Fe Fe223 1.0 0.53446 0.02005 0.48955 1.0000 + Fe Fe224 1.0 0.57613 0.06171 0.48955 1.0000 + Fe Fe225 1.0 0.61779 0.10338 0.48955 1.0000 + Fe Fe226 1.0 0.65946 0.14505 0.48955 1.0000 + Fe Fe227 1.0 0.70113 0.18671 0.48955 1.0000 + Fe Fe228 1.0 0.74279 0.22838 0.48955 1.0000 + Fe Fe229 1.0 0.32613 0.72838 0.48955 1.0000 + Fe Fe230 1.0 0.36779 0.77005 0.48955 1.0000 + Fe Fe231 1.0 0.40946 0.81171 0.48955 1.0000 + Fe Fe232 1.0 0.45113 0.85338 0.48955 1.0000 + Fe Fe233 1.0 0.49279 0.89505 0.48955 1.0000 + Fe Fe234 1.0 0.53446 0.93671 0.48955 1.0000 + Fe Fe235 1.0 0.57613 0.97838 0.48955 1.0000 + Fe Fe236 1.0 0.61779 0.02005 0.48955 1.0000 + Fe Fe237 1.0 0.65946 0.06171 0.48955 1.0000 + Fe Fe238 1.0 0.70113 0.10338 0.48955 1.0000 + Fe Fe239 1.0 0.74279 0.14505 0.48955 1.0000 + Fe Fe240 1.0 0.78446 0.18671 0.48955 1.0000 + Fe Fe241 1.0 0.36779 0.68671 0.48955 1.0000 + Fe Fe242 1.0 0.40946 0.72838 0.48955 1.0000 + Fe Fe243 1.0 0.45113 0.77005 0.48955 1.0000 + Fe Fe244 1.0 0.49279 0.81171 0.48955 1.0000 + Fe Fe245 1.0 0.53446 0.85338 0.48955 1.0000 + Fe Fe246 1.0 0.57613 0.89505 0.48955 1.0000 + Fe Fe247 1.0 0.61779 0.93671 0.48955 1.0000 + Fe Fe248 1.0 0.65946 0.97838 0.48955 1.0000 + Fe Fe249 1.0 0.70113 0.02005 0.48955 1.0000 + Fe Fe250 1.0 0.74279 0.06171 0.48955 1.0000 + Fe Fe251 1.0 0.78446 0.10338 0.48955 1.0000 + Fe Fe252 1.0 0.82613 0.14505 0.48955 1.0000 + Fe Fe253 1.0 0.40946 0.64505 0.48955 1.0000 + Fe Fe254 1.0 0.45113 0.68671 0.48955 1.0000 + Fe Fe255 1.0 0.49279 0.72838 0.48955 1.0000 + Fe Fe256 1.0 0.53446 0.77005 0.48955 1.0000 + Fe Fe257 1.0 0.57613 0.81171 0.48955 1.0000 + Fe Fe258 1.0 0.61779 0.85338 0.48955 1.0000 + Fe Fe259 1.0 0.65946 0.89505 0.48955 1.0000 + Fe Fe260 1.0 0.70113 0.93671 0.48955 1.0000 + Fe Fe261 1.0 0.74279 0.97838 0.48955 1.0000 + Fe Fe262 1.0 0.78446 0.02005 0.48955 1.0000 + Fe Fe263 1.0 0.82613 0.06171 0.48955 1.0000 + Fe Fe264 1.0 0.86779 0.10338 0.48955 1.0000 + Fe Fe265 1.0 0.45113 0.60338 0.48955 1.0000 + Fe Fe266 1.0 0.49279 0.64505 0.48955 1.0000 + Fe Fe267 1.0 0.53446 0.68671 0.48955 1.0000 + Fe Fe268 1.0 0.57613 0.72838 0.48955 1.0000 + Fe Fe269 1.0 0.61779 0.77005 0.48955 1.0000 + Fe Fe270 1.0 0.65946 0.81171 0.48955 1.0000 + Fe Fe271 1.0 0.70113 0.85338 0.48955 1.0000 + Fe Fe272 1.0 0.74279 0.89505 0.48955 1.0000 + Fe Fe273 1.0 0.78446 0.93671 0.48955 1.0000 + Fe Fe274 1.0 0.82613 0.97838 0.48955 1.0000 + Fe Fe275 1.0 0.86779 0.02005 0.48955 1.0000 + Fe Fe276 1.0 0.90946 0.06171 0.48955 1.0000 + Fe Fe277 1.0 0.49279 0.56171 0.48955 1.0000 + Fe Fe278 1.0 0.53446 0.60338 0.48955 1.0000 + Fe Fe279 1.0 0.57613 0.64505 0.48955 1.0000 + Fe Fe280 1.0 0.61779 0.68671 0.48955 1.0000 + Fe Fe281 1.0 0.65946 0.72838 0.48955 1.0000 + Fe Fe282 1.0 0.70113 0.77005 0.48955 1.0000 + Fe Fe283 1.0 0.74279 0.81171 0.48955 1.0000 + Fe Fe284 1.0 0.78446 0.85338 0.48955 1.0000 + Fe Fe285 1.0 0.82613 0.89505 0.48955 1.0000 + Fe Fe286 1.0 0.86779 0.93671 0.48955 1.0000 + Fe Fe287 1.0 0.90946 0.97838 0.48955 1.0000 + Fe Fe288 1.0 0.95113 0.02005 0.48955 1.0000 + Fe Fe289 1.0 0.03446 0.97995 0.48955 1.0000 + Fe Fe290 1.0 0.07613 0.02162 0.48955 1.0000 + Fe Fe291 1.0 0.11779 0.06329 0.48955 1.0000 + Fe Fe292 1.0 0.15946 0.10495 0.48955 1.0000 + Fe Fe293 1.0 0.20113 0.14662 0.48955 1.0000 + Fe Fe294 1.0 0.24279 0.18829 0.48955 1.0000 + Fe Fe295 1.0 0.28446 0.22995 0.48955 1.0000 + Fe Fe296 1.0 0.32613 0.27162 0.48955 1.0000 + Fe Fe297 1.0 0.36779 0.31329 0.48955 1.0000 + Fe Fe298 1.0 0.40946 0.35495 0.48955 1.0000 + Fe Fe299 1.0 0.45113 0.39662 0.48955 1.0000 + Fe Fe300 1.0 0.49279 0.43829 0.48955 1.0000 + Fe Fe301 1.0 0.07613 0.93829 0.48955 1.0000 + Fe Fe302 1.0 0.11779 0.97995 0.48955 1.0000 + Fe Fe303 1.0 0.15946 0.02162 0.48955 1.0000 + Fe Fe304 1.0 0.20113 0.06329 0.48955 1.0000 + Fe Fe305 1.0 0.24279 0.10495 0.48955 1.0000 + Fe Fe306 1.0 0.28446 0.14662 0.48955 1.0000 + Fe Fe307 1.0 0.32613 0.18829 0.48955 1.0000 + Fe Fe308 1.0 0.36779 0.22995 0.48955 1.0000 + Fe Fe309 1.0 0.40946 0.27162 0.48955 1.0000 + Fe Fe310 1.0 0.45113 0.31329 0.48955 1.0000 + Fe Fe311 1.0 0.49279 0.35495 0.48955 1.0000 + Fe Fe312 1.0 0.53446 0.39662 0.48955 1.0000 + Fe Fe313 1.0 0.11779 0.89662 0.48955 1.0000 + Fe Fe314 1.0 0.15946 0.93829 0.48955 1.0000 + Fe Fe315 1.0 0.20113 0.97995 0.48955 1.0000 + Fe Fe316 1.0 0.24279 0.02162 0.48955 1.0000 + Fe Fe317 1.0 0.28446 0.06329 0.48955 1.0000 + Fe Fe318 1.0 0.32613 0.10495 0.48955 1.0000 + Fe Fe319 1.0 0.36779 0.14662 0.48955 1.0000 + Fe Fe320 1.0 0.40946 0.18829 0.48955 1.0000 + Fe Fe321 1.0 0.45113 0.22995 0.48955 1.0000 + Fe Fe322 1.0 0.49279 0.27162 0.48955 1.0000 + Fe Fe323 1.0 0.53446 0.31329 0.48955 1.0000 + Fe Fe324 1.0 0.57613 0.35495 0.48955 1.0000 + Fe Fe325 1.0 0.15946 0.85495 0.48955 1.0000 + Fe Fe326 1.0 0.20113 0.89662 0.48955 1.0000 + Fe Fe327 1.0 0.24279 0.93829 0.48955 1.0000 + Fe Fe328 1.0 0.28446 0.97995 0.48955 1.0000 + Fe Fe329 1.0 0.32613 0.02162 0.48955 1.0000 + Fe Fe330 1.0 0.36779 0.06329 0.48955 1.0000 + Fe Fe331 1.0 0.40946 0.10495 0.48955 1.0000 + Fe Fe332 1.0 0.45113 0.14662 0.48955 1.0000 + Fe Fe333 1.0 0.49279 0.18829 0.48955 1.0000 + Fe Fe334 1.0 0.53446 0.22995 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1.0 0.80608 0.54167 0.48955 1.0000 + Fe Fe474 1.0 0.84775 0.58333 0.48955 1.0000 + Fe Fe475 1.0 0.88941 0.62500 0.48955 1.0000 + Fe Fe476 1.0 0.93108 0.66667 0.48955 1.0000 + Fe Fe477 1.0 0.97275 0.70833 0.48955 1.0000 + Fe Fe478 1.0 0.01441 0.75000 0.48955 1.0000 + Fe Fe479 1.0 0.05608 0.79167 0.48955 1.0000 + Fe Fe480 1.0 0.09775 0.83333 0.48955 1.0000 + Fe Fe481 1.0 0.68108 0.33333 0.48955 1.0000 + Fe Fe482 1.0 0.72275 0.37500 0.48955 1.0000 + Fe Fe483 1.0 0.76441 0.41667 0.48955 1.0000 + Fe Fe484 1.0 0.80608 0.45833 0.48955 1.0000 + Fe Fe485 1.0 0.84775 0.50000 0.48955 1.0000 + Fe Fe486 1.0 0.88941 0.54167 0.48955 1.0000 + Fe Fe487 1.0 0.93108 0.58333 0.48955 1.0000 + Fe Fe488 1.0 0.97275 0.62500 0.48955 1.0000 + Fe Fe489 1.0 0.01441 0.66667 0.48955 1.0000 + Fe Fe490 1.0 0.05608 0.70833 0.48955 1.0000 + Fe Fe491 1.0 0.09775 0.75000 0.48955 1.0000 + Fe Fe492 1.0 0.13941 0.79167 0.48955 1.0000 + Fe Fe493 1.0 0.72275 0.29167 0.48955 1.0000 + Fe Fe494 1.0 0.76441 0.33333 0.48955 1.0000 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Fe Fe560 1.0 0.22275 0.37500 0.48955 1.0000 + Fe Fe561 1.0 0.26441 0.41667 0.48955 1.0000 + Fe Fe562 1.0 0.30608 0.45833 0.48955 1.0000 + Fe Fe563 1.0 0.34775 0.50000 0.48955 1.0000 + Fe Fe564 1.0 0.38941 0.54167 0.48955 1.0000 + Fe Fe565 1.0 0.97275 0.04167 0.48955 1.0000 + Fe Fe566 1.0 0.01441 0.08333 0.48955 1.0000 + Fe Fe567 1.0 0.05608 0.12500 0.48955 1.0000 + Fe Fe568 1.0 0.09775 0.16667 0.48955 1.0000 + Fe Fe569 1.0 0.13941 0.20833 0.48955 1.0000 + Fe Fe570 1.0 0.18108 0.25000 0.48955 1.0000 + Fe Fe571 1.0 0.22275 0.29167 0.48955 1.0000 + Fe Fe572 1.0 0.26441 0.33333 0.48955 1.0000 + Fe Fe573 1.0 0.30608 0.37500 0.48955 1.0000 + Fe Fe574 1.0 0.34775 0.41667 0.48955 1.0000 + Fe Fe575 1.0 0.38941 0.45833 0.48955 1.0000 + Fe Fe576 1.0 0.43108 0.50000 0.48955 1.0000 + Fe Fe577 1.0 0.53446 0.52005 0.48955 1.0000 + Fe Fe578 1.0 0.57613 0.56171 0.48955 1.0000 + Fe Fe579 1.0 0.61779 0.60338 0.48955 1.0000 + Fe Fe580 1.0 0.65946 0.64505 0.48955 1.0000 + Fe Fe581 1.0 0.70113 0.68671 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0.70113 0.52005 0.48955 1.0000 + Fe Fe604 1.0 0.74279 0.56171 0.48955 1.0000 + Fe Fe605 1.0 0.78446 0.60338 0.48955 1.0000 + Fe Fe606 1.0 0.82613 0.64505 0.48955 1.0000 + Fe Fe607 1.0 0.86779 0.68671 0.48955 1.0000 + Fe Fe608 1.0 0.90946 0.72838 0.48955 1.0000 + Fe Fe609 1.0 0.95113 0.77005 0.48955 1.0000 + Fe Fe610 1.0 0.99279 0.81171 0.48955 1.0000 + Fe Fe611 1.0 0.03446 0.85338 0.48955 1.0000 + Fe Fe612 1.0 0.07613 0.89505 0.48955 1.0000 + Fe Fe613 1.0 0.65946 0.39505 0.48955 1.0000 + Fe Fe614 1.0 0.70113 0.43671 0.48955 1.0000 + Fe Fe615 1.0 0.74279 0.47838 0.48955 1.0000 + Fe Fe616 1.0 0.78446 0.52005 0.48955 1.0000 + Fe Fe617 1.0 0.82613 0.56171 0.48955 1.0000 + Fe Fe618 1.0 0.86779 0.60338 0.48955 1.0000 + Fe Fe619 1.0 0.90946 0.64505 0.48955 1.0000 + Fe Fe620 1.0 0.95113 0.68671 0.48955 1.0000 + Fe Fe621 1.0 0.99279 0.72838 0.48955 1.0000 + Fe Fe622 1.0 0.03446 0.77005 0.48955 1.0000 + Fe Fe623 1.0 0.07613 0.81171 0.48955 1.0000 + Fe Fe624 1.0 0.11779 0.85338 0.48955 1.0000 + Fe Fe625 1.0 0.70113 0.35338 0.48955 1.0000 + Fe Fe626 1.0 0.74279 0.39505 0.48955 1.0000 + Fe Fe627 1.0 0.78446 0.43671 0.48955 1.0000 + Fe Fe628 1.0 0.82613 0.47838 0.48955 1.0000 + Fe Fe629 1.0 0.86779 0.52005 0.48955 1.0000 + Fe Fe630 1.0 0.90946 0.56171 0.48955 1.0000 + Fe Fe631 1.0 0.95113 0.60338 0.48955 1.0000 + Fe Fe632 1.0 0.99279 0.64505 0.48955 1.0000 + Fe Fe633 1.0 0.03446 0.68671 0.48955 1.0000 + Fe Fe634 1.0 0.07613 0.72838 0.48955 1.0000 + Fe Fe635 1.0 0.11779 0.77005 0.48955 1.0000 + Fe Fe636 1.0 0.15946 0.81171 0.48955 1.0000 + Fe Fe637 1.0 0.74279 0.31171 0.48955 1.0000 + Fe Fe638 1.0 0.78446 0.35338 0.48955 1.0000 + Fe Fe639 1.0 0.82613 0.39505 0.48955 1.0000 + Fe Fe640 1.0 0.86779 0.43671 0.48955 1.0000 + Fe Fe641 1.0 0.90946 0.47838 0.48955 1.0000 + Fe Fe642 1.0 0.95113 0.52005 0.48955 1.0000 + Fe Fe643 1.0 0.99279 0.56171 0.48955 1.0000 + Fe Fe644 1.0 0.03446 0.60338 0.48955 1.0000 + Fe Fe645 1.0 0.07613 0.64505 0.48955 1.0000 + Fe Fe646 1.0 0.11779 0.68671 0.48955 1.0000 + Fe Fe647 1.0 0.15946 0.72838 0.48955 1.0000 + Fe Fe648 1.0 0.20113 0.77005 0.48955 1.0000 + Fe Fe649 1.0 0.78446 0.27005 0.48955 1.0000 + Fe Fe650 1.0 0.82613 0.31171 0.48955 1.0000 + Fe Fe651 1.0 0.86779 0.35338 0.48955 1.0000 + Fe Fe652 1.0 0.90946 0.39505 0.48955 1.0000 + Fe Fe653 1.0 0.95113 0.43671 0.48955 1.0000 + Fe Fe654 1.0 0.99279 0.47838 0.48955 1.0000 + Fe Fe655 1.0 0.03446 0.52005 0.48955 1.0000 + Fe Fe656 1.0 0.07613 0.56171 0.48955 1.0000 + Fe Fe657 1.0 0.11779 0.60338 0.48955 1.0000 + Fe Fe658 1.0 0.15946 0.64505 0.48955 1.0000 + Fe Fe659 1.0 0.20113 0.68671 0.48955 1.0000 + Fe Fe660 1.0 0.24279 0.72838 0.48955 1.0000 + Fe Fe661 1.0 0.82613 0.22838 0.48955 1.0000 + Fe Fe662 1.0 0.86779 0.27005 0.48955 1.0000 + Fe Fe663 1.0 0.90946 0.31171 0.48955 1.0000 + Fe Fe664 1.0 0.95113 0.35338 0.48955 1.0000 + Fe Fe665 1.0 0.99279 0.39505 0.48955 1.0000 + Fe Fe666 1.0 0.03446 0.43671 0.48955 1.0000 + Fe Fe667 1.0 0.07613 0.47838 0.48955 1.0000 + Fe Fe668 1.0 0.11779 0.52005 0.48955 1.0000 + Fe Fe669 1.0 0.15946 0.56171 0.48955 1.0000 + Fe Fe670 1.0 0.20113 0.60338 0.48955 1.0000 + Fe Fe671 1.0 0.24279 0.64505 0.48955 1.0000 + Fe Fe672 1.0 0.28446 0.68671 0.48955 1.0000 + Fe Fe673 1.0 0.86779 0.18671 0.48955 1.0000 + Fe Fe674 1.0 0.90946 0.22838 0.48955 1.0000 + Fe Fe675 1.0 0.95113 0.27005 0.48955 1.0000 + Fe Fe676 1.0 0.99279 0.31171 0.48955 1.0000 + Fe Fe677 1.0 0.03446 0.35338 0.48955 1.0000 + Fe Fe678 1.0 0.07613 0.39505 0.48955 1.0000 + Fe Fe679 1.0 0.11779 0.43671 0.48955 1.0000 + Fe Fe680 1.0 0.15946 0.47838 0.48955 1.0000 + Fe Fe681 1.0 0.20113 0.52005 0.48955 1.0000 + Fe Fe682 1.0 0.24279 0.56171 0.48955 1.0000 + Fe Fe683 1.0 0.28446 0.60338 0.48955 1.0000 + Fe Fe684 1.0 0.32613 0.64505 0.48955 1.0000 + Fe Fe685 1.0 0.90946 0.14505 0.48955 1.0000 + Fe Fe686 1.0 0.95113 0.18671 0.48955 1.0000 + Fe Fe687 1.0 0.99279 0.22838 0.48955 1.0000 + Fe Fe688 1.0 0.03446 0.27005 0.48955 1.0000 + Fe Fe689 1.0 0.07613 0.31171 0.48955 1.0000 + Fe Fe690 1.0 0.11779 0.35338 0.48955 1.0000 + Fe Fe691 1.0 0.15946 0.39505 0.48955 1.0000 + Fe Fe692 1.0 0.20113 0.43671 0.48955 1.0000 + Fe Fe693 1.0 0.24279 0.47838 0.48955 1.0000 + Fe Fe694 1.0 0.28446 0.52005 0.48955 1.0000 + Fe Fe695 1.0 0.32613 0.56171 0.48955 1.0000 + Fe Fe696 1.0 0.36779 0.60338 0.48955 1.0000 + Fe Fe697 1.0 0.95113 0.10338 0.48955 1.0000 + Fe Fe698 1.0 0.99279 0.14505 0.48955 1.0000 + Fe Fe699 1.0 0.03446 0.18671 0.48955 1.0000 + Fe Fe700 1.0 0.07613 0.22838 0.48955 1.0000 + Fe Fe701 1.0 0.11779 0.27005 0.48955 1.0000 + Fe Fe702 1.0 0.15946 0.31171 0.48955 1.0000 + Fe Fe703 1.0 0.20113 0.35338 0.48955 1.0000 + Fe Fe704 1.0 0.24279 0.39505 0.48955 1.0000 + Fe Fe705 1.0 0.28446 0.43671 0.48955 1.0000 + Fe Fe706 1.0 0.32613 0.47838 0.48955 1.0000 + Fe Fe707 1.0 0.36779 0.52005 0.48955 1.0000 + Fe Fe708 1.0 0.40946 0.56171 0.48955 1.0000 + Fe Fe709 1.0 0.99279 0.06171 0.48955 1.0000 + Fe Fe710 1.0 0.03446 0.10338 0.48955 1.0000 + Fe Fe711 1.0 0.07613 0.14505 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0.57613 0.43829 0.48955 1.0000 + Fe Fe734 1.0 0.61779 0.47995 0.48955 1.0000 + Fe Fe735 1.0 0.65946 0.52162 0.48955 1.0000 + Fe Fe736 1.0 0.70113 0.56329 0.48955 1.0000 + Fe Fe737 1.0 0.74279 0.60495 0.48955 1.0000 + Fe Fe738 1.0 0.78446 0.64662 0.48955 1.0000 + Fe Fe739 1.0 0.82613 0.68829 0.48955 1.0000 + Fe Fe740 1.0 0.86779 0.72995 0.48955 1.0000 + Fe Fe741 1.0 0.90946 0.77162 0.48955 1.0000 + Fe Fe742 1.0 0.95113 0.81329 0.48955 1.0000 + Fe Fe743 1.0 0.99279 0.85495 0.48955 1.0000 + Fe Fe744 1.0 0.03446 0.89662 0.48955 1.0000 + Fe Fe745 1.0 0.61779 0.39662 0.48955 1.0000 + Fe Fe746 1.0 0.65946 0.43829 0.48955 1.0000 + Fe Fe747 1.0 0.70113 0.47995 0.48955 1.0000 + Fe Fe748 1.0 0.74279 0.52162 0.48955 1.0000 + Fe Fe749 1.0 0.78446 0.56329 0.48955 1.0000 + Fe Fe750 1.0 0.82613 0.60495 0.48955 1.0000 + Fe Fe751 1.0 0.86779 0.64662 0.48955 1.0000 + Fe Fe752 1.0 0.90946 0.68829 0.48955 1.0000 + Fe Fe753 1.0 0.95113 0.72995 0.48955 1.0000 + Fe Fe754 1.0 0.99279 0.77162 0.48955 1.0000 + Fe Fe755 1.0 0.03446 0.81329 0.48955 1.0000 + Fe Fe756 1.0 0.07613 0.85495 0.48955 1.0000 + Fe Fe757 1.0 0.65946 0.35495 0.48955 1.0000 + Fe Fe758 1.0 0.70113 0.39662 0.48955 1.0000 + Fe Fe759 1.0 0.74279 0.43829 0.48955 1.0000 + Fe Fe760 1.0 0.78446 0.47995 0.48955 1.0000 + Fe Fe761 1.0 0.82613 0.52162 0.48955 1.0000 + Fe Fe762 1.0 0.86779 0.56329 0.48955 1.0000 + Fe Fe763 1.0 0.90946 0.60495 0.48955 1.0000 + Fe Fe764 1.0 0.95113 0.64662 0.48955 1.0000 + Fe Fe765 1.0 0.99279 0.68829 0.48955 1.0000 + Fe Fe766 1.0 0.03446 0.72995 0.48955 1.0000 + Fe Fe767 1.0 0.07613 0.77162 0.48955 1.0000 + Fe Fe768 1.0 0.11779 0.81329 0.48955 1.0000 + Fe Fe769 1.0 0.70113 0.31329 0.48955 1.0000 + Fe Fe770 1.0 0.74279 0.35495 0.48955 1.0000 + Fe Fe771 1.0 0.78446 0.39662 0.48955 1.0000 + Fe Fe772 1.0 0.82613 0.43829 0.48955 1.0000 + Fe Fe773 1.0 0.86779 0.47995 0.48955 1.0000 + Fe Fe774 1.0 0.90946 0.52162 0.48955 1.0000 + Fe Fe775 1.0 0.95113 0.56329 0.48955 1.0000 + Fe Fe776 1.0 0.99279 0.60495 0.48955 1.0000 + Fe Fe777 1.0 0.03446 0.64662 0.48955 1.0000 + Fe Fe778 1.0 0.07613 0.68829 0.48955 1.0000 + Fe Fe779 1.0 0.11779 0.72995 0.48955 1.0000 + Fe Fe780 1.0 0.15946 0.77162 0.48955 1.0000 + Fe Fe781 1.0 0.74279 0.27162 0.48955 1.0000 + Fe Fe782 1.0 0.78446 0.31329 0.48955 1.0000 + Fe Fe783 1.0 0.82613 0.35495 0.48955 1.0000 + Fe Fe784 1.0 0.86779 0.39662 0.48955 1.0000 + Fe Fe785 1.0 0.90946 0.43829 0.48955 1.0000 + Fe Fe786 1.0 0.95113 0.47995 0.48955 1.0000 + Fe Fe787 1.0 0.99279 0.52162 0.48955 1.0000 + Fe Fe788 1.0 0.03446 0.56329 0.48955 1.0000 + Fe Fe789 1.0 0.07613 0.60495 0.48955 1.0000 + Fe Fe790 1.0 0.11779 0.64662 0.48955 1.0000 + Fe Fe791 1.0 0.15946 0.68829 0.48955 1.0000 + Fe Fe792 1.0 0.20113 0.72995 0.48955 1.0000 + Fe Fe793 1.0 0.78446 0.22995 0.48955 1.0000 + Fe Fe794 1.0 0.82613 0.27162 0.48955 1.0000 + Fe Fe795 1.0 0.86779 0.31329 0.48955 1.0000 + Fe Fe796 1.0 0.90946 0.35495 0.48955 1.0000 + Fe Fe797 1.0 0.95113 0.39662 0.48955 1.0000 + Fe Fe798 1.0 0.99279 0.43829 0.48955 1.0000 + Fe Fe799 1.0 0.03446 0.47995 0.48955 1.0000 + Fe Fe800 1.0 0.07613 0.52162 0.48955 1.0000 + Fe Fe801 1.0 0.11779 0.56329 0.48955 1.0000 + Fe Fe802 1.0 0.15946 0.60495 0.48955 1.0000 + Fe Fe803 1.0 0.20113 0.64662 0.48955 1.0000 + Fe Fe804 1.0 0.24279 0.68829 0.48955 1.0000 + Fe Fe805 1.0 0.82613 0.18829 0.48955 1.0000 + Fe Fe806 1.0 0.86779 0.22995 0.48955 1.0000 + Fe Fe807 1.0 0.90946 0.27162 0.48955 1.0000 + Fe Fe808 1.0 0.95113 0.31329 0.48955 1.0000 + Fe Fe809 1.0 0.99279 0.35495 0.48955 1.0000 + Fe Fe810 1.0 0.03446 0.39662 0.48955 1.0000 + Fe Fe811 1.0 0.07613 0.43829 0.48955 1.0000 + Fe Fe812 1.0 0.11779 0.47995 0.48955 1.0000 + Fe Fe813 1.0 0.15946 0.52162 0.48955 1.0000 + Fe Fe814 1.0 0.20113 0.56329 0.48955 1.0000 + Fe Fe815 1.0 0.24279 0.60495 0.48955 1.0000 + Fe Fe816 1.0 0.28446 0.64662 0.48955 1.0000 + Fe Fe817 1.0 0.86779 0.14662 0.48955 1.0000 + Fe Fe818 1.0 0.90946 0.18829 0.48955 1.0000 + Fe Fe819 1.0 0.95113 0.22995 0.48955 1.0000 + Fe Fe820 1.0 0.99279 0.27162 0.48955 1.0000 + Fe Fe821 1.0 0.03446 0.31329 0.48955 1.0000 + Fe Fe822 1.0 0.07613 0.35495 0.48955 1.0000 + Fe Fe823 1.0 0.11779 0.39662 0.48955 1.0000 + Fe Fe824 1.0 0.15946 0.43829 0.48955 1.0000 + Fe Fe825 1.0 0.20113 0.47995 0.48955 1.0000 + Fe Fe826 1.0 0.24279 0.52162 0.48955 1.0000 + Fe Fe827 1.0 0.28446 0.56329 0.48955 1.0000 + Fe Fe828 1.0 0.32613 0.60495 0.48955 1.0000 + Fe Fe829 1.0 0.90946 0.10495 0.48955 1.0000 + Fe Fe830 1.0 0.95113 0.14662 0.48955 1.0000 + Fe Fe831 1.0 0.99279 0.18829 0.48955 1.0000 + Fe Fe832 1.0 0.03446 0.22995 0.48955 1.0000 + Fe Fe833 1.0 0.07613 0.27162 0.48955 1.0000 + Fe Fe834 1.0 0.11779 0.31329 0.48955 1.0000 + Fe Fe835 1.0 0.15946 0.35495 0.48955 1.0000 + Fe Fe836 1.0 0.20113 0.39662 0.48955 1.0000 + Fe Fe837 1.0 0.24279 0.43829 0.48955 1.0000 + Fe Fe838 1.0 0.28446 0.47995 0.48955 1.0000 + Fe Fe839 1.0 0.32613 0.52162 0.48955 1.0000 + Fe Fe840 1.0 0.36779 0.56329 0.48955 1.0000 + Fe Fe841 1.0 0.95113 0.06329 0.48955 1.0000 + Fe Fe842 1.0 0.99279 0.10495 0.48955 1.0000 + Fe Fe843 1.0 0.03446 0.14662 0.48955 1.0000 + Fe Fe844 1.0 0.07613 0.18829 0.48955 1.0000 + Fe Fe845 1.0 0.11779 0.22995 0.48955 1.0000 + Fe Fe846 1.0 0.15946 0.27162 0.48955 1.0000 + Fe Fe847 1.0 0.20113 0.31329 0.48955 1.0000 + Fe Fe848 1.0 0.24279 0.35495 0.48955 1.0000 + Fe Fe849 1.0 0.28446 0.39662 0.48955 1.0000 + Fe Fe850 1.0 0.32613 0.43829 0.48955 1.0000 + Fe Fe851 1.0 0.36779 0.47995 0.48955 1.0000 + Fe Fe852 1.0 0.40946 0.52162 0.48955 1.0000 + Fe Fe853 1.0 0.99279 0.02162 0.48955 1.0000 + Fe Fe854 1.0 0.03446 0.06329 0.48955 1.0000 + Fe Fe855 1.0 0.07613 0.10495 0.48955 1.0000 + Fe Fe856 1.0 0.11779 0.14662 0.48955 1.0000 + Fe Fe857 1.0 0.15946 0.18829 0.48955 1.0000 + Fe Fe858 1.0 0.20113 0.22995 0.48955 1.0000 + Fe Fe859 1.0 0.24279 0.27162 0.48955 1.0000 + Fe Fe860 1.0 0.28446 0.31329 0.48955 1.0000 + Fe Fe861 1.0 0.32613 0.35495 0.48955 1.0000 + Fe Fe862 1.0 0.36779 0.39662 0.48955 1.0000 + Fe Fe863 1.0 0.40946 0.43829 0.48955 1.0000 + Fe Fe864 1.0 0.45113 0.47995 0.48955 1.0000 + O O145 1.0 0.52778 0.50000 0.33094 1.0000 + O O146 1.0 0.56944 0.54167 0.33094 1.0000 + O O147 1.0 0.61111 0.58333 0.33094 1.0000 + O O148 1.0 0.65278 0.62500 0.33094 1.0000 + O O149 1.0 0.69444 0.66667 0.33094 1.0000 + O O150 1.0 0.73611 0.70833 0.33094 1.0000 + O O151 1.0 0.77778 0.75000 0.33094 1.0000 + O O152 1.0 0.81944 0.79167 0.33094 1.0000 + O O153 1.0 0.86111 0.83333 0.33094 1.0000 + O O154 1.0 0.90278 0.87500 0.33094 1.0000 + O O155 1.0 0.94444 0.91667 0.33094 1.0000 + O O156 1.0 0.98611 0.95833 0.33094 1.0000 + O O157 1.0 0.56944 0.45833 0.33094 1.0000 + O O158 1.0 0.61111 0.50000 0.33094 1.0000 + O O159 1.0 0.65278 0.54167 0.33094 1.0000 + O O160 1.0 0.69444 0.58333 0.33094 1.0000 + O O161 1.0 0.73611 0.62500 0.33094 1.0000 + O O162 1.0 0.77778 0.66667 0.33094 1.0000 + O O163 1.0 0.81944 0.70833 0.33094 1.0000 + O O164 1.0 0.86111 0.75000 0.33094 1.0000 + O O165 1.0 0.90278 0.79167 0.33094 1.0000 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O O234 1.0 0.02778 0.41667 0.33094 1.0000 + O O235 1.0 0.06944 0.45833 0.33094 1.0000 + O O236 1.0 0.11111 0.50000 0.33094 1.0000 + O O237 1.0 0.15278 0.54167 0.33094 1.0000 + O O238 1.0 0.19444 0.58333 0.33094 1.0000 + O O239 1.0 0.23611 0.62500 0.33094 1.0000 + O O240 1.0 0.27778 0.66667 0.33094 1.0000 + O O241 1.0 0.86111 0.16667 0.33094 1.0000 + O O242 1.0 0.90278 0.20833 0.33094 1.0000 + O O243 1.0 0.94444 0.25000 0.33094 1.0000 + O O244 1.0 0.98611 0.29167 0.33094 1.0000 + O O245 1.0 0.02778 0.33333 0.33094 1.0000 + O O246 1.0 0.06944 0.37500 0.33094 1.0000 + O O247 1.0 0.11111 0.41667 0.33094 1.0000 + O O248 1.0 0.15278 0.45833 0.33094 1.0000 + O O249 1.0 0.19444 0.50000 0.33094 1.0000 + O O250 1.0 0.23611 0.54167 0.33094 1.0000 + O O251 1.0 0.27778 0.58333 0.33094 1.0000 + O O252 1.0 0.31944 0.62500 0.33094 1.0000 + O O253 1.0 0.90278 0.12500 0.33094 1.0000 + O O254 1.0 0.94444 0.16667 0.33094 1.0000 + O O255 1.0 0.98611 0.20833 0.33094 1.0000 + O O256 1.0 0.02778 0.25000 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1.0000 + Au Au26 1.0 0.09375 0.56250 0.50000 1.0000 + Au Au27 1.0 0.09375 0.62500 0.50000 1.0000 + Au Au28 1.0 0.09375 0.68750 0.50000 1.0000 + Au Au29 1.0 0.09375 0.75000 0.50000 1.0000 + Au Au30 1.0 0.09375 0.81250 0.50000 1.0000 + Au Au31 1.0 0.09375 0.87500 0.50000 1.0000 + Au Au32 1.0 0.09375 0.93750 0.50000 1.0000 + Au Au33 1.0 0.15625 0.00000 0.50000 1.0000 + Au Au34 1.0 0.15625 0.06250 0.50000 1.0000 + Au Au35 1.0 0.15625 0.12500 0.50000 1.0000 + Au Au36 1.0 0.15625 0.18750 0.50000 1.0000 + Au Au37 1.0 0.15625 0.25000 0.50000 1.0000 + Au Au38 1.0 0.15625 0.31250 0.50000 1.0000 + Au Au39 1.0 0.15625 0.37500 0.50000 1.0000 + Au Au40 1.0 0.15625 0.43750 0.50000 1.0000 + Au Au41 1.0 0.15625 0.50000 0.50000 1.0000 + Au Au42 1.0 0.15625 0.56250 0.50000 1.0000 + Au Au43 1.0 0.15625 0.62500 0.50000 1.0000 + Au Au44 1.0 0.15625 0.68750 0.50000 1.0000 + Au Au45 1.0 0.15625 0.75000 0.50000 1.0000 + Au Au46 1.0 0.15625 0.81250 0.50000 1.0000 + Au Au47 1.0 0.15625 0.87500 0.50000 1.0000 + Au Au48 1.0 0.15625 0.93750 0.50000 1.0000 + Au Au49 1.0 0.21875 0.00000 0.50000 1.0000 + Au Au50 1.0 0.21875 0.06250 0.50000 1.0000 + Au Au51 1.0 0.21875 0.12500 0.50000 1.0000 + Au Au52 1.0 0.21875 0.18750 0.50000 1.0000 + Au Au53 1.0 0.21875 0.25000 0.50000 1.0000 + Au Au54 1.0 0.21875 0.31250 0.50000 1.0000 + Au Au55 1.0 0.21875 0.37500 0.50000 1.0000 + Au Au56 1.0 0.21875 0.43750 0.50000 1.0000 + Au Au57 1.0 0.21875 0.50000 0.50000 1.0000 + Au Au58 1.0 0.21875 0.56250 0.50000 1.0000 + Au Au59 1.0 0.21875 0.62500 0.50000 1.0000 + Au Au60 1.0 0.21875 0.68750 0.50000 1.0000 + Au Au61 1.0 0.21875 0.75000 0.50000 1.0000 + Au Au62 1.0 0.21875 0.81250 0.50000 1.0000 + Au Au63 1.0 0.21875 0.87500 0.50000 1.0000 + Au Au64 1.0 0.21875 0.93750 0.50000 1.0000 + Au Au65 1.0 0.28125 0.00000 0.50000 1.0000 + Au Au66 1.0 0.28125 0.06250 0.50000 1.0000 + Au Au67 1.0 0.28125 0.12500 0.50000 1.0000 + Au Au68 1.0 0.28125 0.18750 0.50000 1.0000 + Au Au69 1.0 0.28125 0.25000 0.50000 1.0000 + Au Au70 1.0 0.28125 0.31250 0.50000 1.0000 + Au Au71 1.0 0.28125 0.37500 0.50000 1.0000 + Au Au72 1.0 0.28125 0.43750 0.50000 1.0000 + Au Au73 1.0 0.28125 0.50000 0.50000 1.0000 + Au Au74 1.0 0.28125 0.56250 0.50000 1.0000 + Au Au75 1.0 0.28125 0.62500 0.50000 1.0000 + Au Au76 1.0 0.28125 0.68750 0.50000 1.0000 + Au Au77 1.0 0.28125 0.75000 0.50000 1.0000 + Au Au78 1.0 0.28125 0.81250 0.50000 1.0000 + Au Au79 1.0 0.28125 0.87500 0.50000 1.0000 + Au Au80 1.0 0.28125 0.93750 0.50000 1.0000 + Au Au81 1.0 0.34375 0.00000 0.50000 1.0000 + Au Au82 1.0 0.34375 0.06250 0.50000 1.0000 + Au Au83 1.0 0.34375 0.12500 0.50000 1.0000 + Au Au84 1.0 0.34375 0.18750 0.50000 1.0000 + Au Au85 1.0 0.34375 0.25000 0.50000 1.0000 + Au Au86 1.0 0.34375 0.31250 0.50000 1.0000 + Au Au87 1.0 0.34375 0.37500 0.50000 1.0000 + Au Au88 1.0 0.34375 0.43750 0.50000 1.0000 + Au Au89 1.0 0.34375 0.50000 0.50000 1.0000 + Au Au90 1.0 0.34375 0.56250 0.50000 1.0000 + Au Au91 1.0 0.34375 0.62500 0.50000 1.0000 + Au Au92 1.0 0.34375 0.68750 0.50000 1.0000 + Au Au93 1.0 0.34375 0.75000 0.50000 1.0000 + Au Au94 1.0 0.34375 0.81250 0.50000 1.0000 + Au Au95 1.0 0.34375 0.87500 0.50000 1.0000 + Au Au96 1.0 0.34375 0.93750 0.50000 1.0000 + Au Au97 1.0 0.40625 0.00000 0.50000 1.0000 + Au Au98 1.0 0.40625 0.06250 0.50000 1.0000 + Au Au99 1.0 0.40625 0.12500 0.50000 1.0000 + Au Au100 1.0 0.40625 0.18750 0.50000 1.0000 + Au Au101 1.0 0.40625 0.25000 0.50000 1.0000 + Au Au102 1.0 0.40625 0.31250 0.50000 1.0000 + Au Au103 1.0 0.40625 0.37500 0.50000 1.0000 + Au Au104 1.0 0.40625 0.43750 0.50000 1.0000 + Au Au105 1.0 0.40625 0.50000 0.50000 1.0000 + Au Au106 1.0 0.40625 0.56250 0.50000 1.0000 + Au Au107 1.0 0.40625 0.62500 0.50000 1.0000 + Au Au108 1.0 0.40625 0.68750 0.50000 1.0000 + Au Au109 1.0 0.40625 0.75000 0.50000 1.0000 + Au Au110 1.0 0.40625 0.81250 0.50000 1.0000 + Au Au111 1.0 0.40625 0.87500 0.50000 1.0000 + Au Au112 1.0 0.40625 0.93750 0.50000 1.0000 + Au Au113 1.0 0.46875 0.00000 0.50000 1.0000 + Au Au114 1.0 0.46875 0.06250 0.50000 1.0000 + Au Au115 1.0 0.46875 0.12500 0.50000 1.0000 + Au Au116 1.0 0.46875 0.18750 0.50000 1.0000 + Au Au117 1.0 0.46875 0.25000 0.50000 1.0000 + Au Au118 1.0 0.46875 0.31250 0.50000 1.0000 + Au Au119 1.0 0.46875 0.37500 0.50000 1.0000 + Au Au120 1.0 0.46875 0.43750 0.50000 1.0000 + Au Au121 1.0 0.46875 0.50000 0.50000 1.0000 + Au Au122 1.0 0.46875 0.56250 0.50000 1.0000 + Au Au123 1.0 0.46875 0.62500 0.50000 1.0000 + Au Au124 1.0 0.46875 0.68750 0.50000 1.0000 + Au Au125 1.0 0.46875 0.75000 0.50000 1.0000 + Au Au126 1.0 0.46875 0.81250 0.50000 1.0000 + Au Au127 1.0 0.46875 0.87500 0.50000 1.0000 + Au Au128 1.0 0.46875 0.93750 0.50000 1.0000 + Au Au129 1.0 0.53125 0.00000 0.50000 1.0000 + Au Au130 1.0 0.53125 0.06250 0.50000 1.0000 + Au Au131 1.0 0.53125 0.12500 0.50000 1.0000 + Au Au132 1.0 0.53125 0.18750 0.50000 1.0000 + Au Au133 1.0 0.53125 0.25000 0.50000 1.0000 + Au Au134 1.0 0.53125 0.31250 0.50000 1.0000 + Au Au135 1.0 0.53125 0.37500 0.50000 1.0000 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0.50000 1.0000 + Au Au158 1.0 0.59375 0.81250 0.50000 1.0000 + Au Au159 1.0 0.59375 0.87500 0.50000 1.0000 + Au Au160 1.0 0.59375 0.93750 0.50000 1.0000 + Au Au161 1.0 0.65625 0.00000 0.50000 1.0000 + Au Au162 1.0 0.65625 0.06250 0.50000 1.0000 + Au Au163 1.0 0.65625 0.12500 0.50000 1.0000 + Au Au164 1.0 0.65625 0.18750 0.50000 1.0000 + Au Au165 1.0 0.65625 0.25000 0.50000 1.0000 + Au Au166 1.0 0.65625 0.31250 0.50000 1.0000 + Au Au167 1.0 0.65625 0.37500 0.50000 1.0000 + Au Au168 1.0 0.65625 0.43750 0.50000 1.0000 + Au Au169 1.0 0.65625 0.50000 0.50000 1.0000 + Au Au170 1.0 0.65625 0.56250 0.50000 1.0000 + Au Au171 1.0 0.65625 0.62500 0.50000 1.0000 + Au Au172 1.0 0.65625 0.68750 0.50000 1.0000 + Au Au173 1.0 0.65625 0.75000 0.50000 1.0000 + Au Au174 1.0 0.65625 0.81250 0.50000 1.0000 + Au Au175 1.0 0.65625 0.87500 0.50000 1.0000 + Au Au176 1.0 0.65625 0.93750 0.50000 1.0000 + Au Au177 1.0 0.71875 0.00000 0.50000 1.0000 + Au Au178 1.0 0.71875 0.06250 0.50000 1.0000 + Au Au179 1.0 0.71875 0.12500 0.50000 1.0000 + Au Au180 1.0 0.71875 0.18750 0.50000 1.0000 + Au Au181 1.0 0.71875 0.25000 0.50000 1.0000 + Au Au182 1.0 0.71875 0.31250 0.50000 1.0000 + Au Au183 1.0 0.71875 0.37500 0.50000 1.0000 + Au Au184 1.0 0.71875 0.43750 0.50000 1.0000 + Au Au185 1.0 0.71875 0.50000 0.50000 1.0000 + Au Au186 1.0 0.71875 0.56250 0.50000 1.0000 + Au Au187 1.0 0.71875 0.62500 0.50000 1.0000 + Au Au188 1.0 0.71875 0.68750 0.50000 1.0000 + Au Au189 1.0 0.71875 0.75000 0.50000 1.0000 + Au Au190 1.0 0.71875 0.81250 0.50000 1.0000 + Au Au191 1.0 0.71875 0.87500 0.50000 1.0000 + Au Au192 1.0 0.71875 0.93750 0.50000 1.0000 + Au Au193 1.0 0.78125 0.00000 0.50000 1.0000 + Au Au194 1.0 0.78125 0.06250 0.50000 1.0000 + Au Au195 1.0 0.78125 0.12500 0.50000 1.0000 + Au Au196 1.0 0.78125 0.18750 0.50000 1.0000 + Au Au197 1.0 0.78125 0.25000 0.50000 1.0000 + Au Au198 1.0 0.78125 0.31250 0.50000 1.0000 + Au Au199 1.0 0.78125 0.37500 0.50000 1.0000 + Au Au200 1.0 0.78125 0.43750 0.50000 1.0000 + Au Au201 1.0 0.78125 0.50000 0.50000 1.0000 + Au Au202 1.0 0.78125 0.56250 0.50000 1.0000 + Au Au203 1.0 0.78125 0.62500 0.50000 1.0000 + Au Au204 1.0 0.78125 0.68750 0.50000 1.0000 + Au Au205 1.0 0.78125 0.75000 0.50000 1.0000 + Au Au206 1.0 0.78125 0.81250 0.50000 1.0000 + Au Au207 1.0 0.78125 0.87500 0.50000 1.0000 + Au Au208 1.0 0.78125 0.93750 0.50000 1.0000 + Au Au209 1.0 0.84375 0.00000 0.50000 1.0000 + Au Au210 1.0 0.84375 0.06250 0.50000 1.0000 + Au Au211 1.0 0.84375 0.12500 0.50000 1.0000 + Au Au212 1.0 0.84375 0.18750 0.50000 1.0000 + Au Au213 1.0 0.84375 0.25000 0.50000 1.0000 + Au Au214 1.0 0.84375 0.31250 0.50000 1.0000 + Au Au215 1.0 0.84375 0.37500 0.50000 1.0000 + Au Au216 1.0 0.84375 0.43750 0.50000 1.0000 + Au Au217 1.0 0.84375 0.50000 0.50000 1.0000 + Au Au218 1.0 0.84375 0.56250 0.50000 1.0000 + Au Au219 1.0 0.84375 0.62500 0.50000 1.0000 + Au Au220 1.0 0.84375 0.68750 0.50000 1.0000 + Au Au221 1.0 0.84375 0.75000 0.50000 1.0000 + Au Au222 1.0 0.84375 0.81250 0.50000 1.0000 + Au Au223 1.0 0.84375 0.87500 0.50000 1.0000 + Au Au224 1.0 0.84375 0.93750 0.50000 1.0000 + Au Au225 1.0 0.90625 0.00000 0.50000 1.0000 + Au Au226 1.0 0.90625 0.06250 0.50000 1.0000 + Au Au227 1.0 0.90625 0.12500 0.50000 1.0000 + Au Au228 1.0 0.90625 0.18750 0.50000 1.0000 + Au Au229 1.0 0.90625 0.25000 0.50000 1.0000 + Au Au230 1.0 0.90625 0.31250 0.50000 1.0000 + Au Au231 1.0 0.90625 0.37500 0.50000 1.0000 + Au Au232 1.0 0.90625 0.43750 0.50000 1.0000 + Au Au233 1.0 0.90625 0.50000 0.50000 1.0000 + Au Au234 1.0 0.90625 0.56250 0.50000 1.0000 + Au Au235 1.0 0.90625 0.62500 0.50000 1.0000 + Au Au236 1.0 0.90625 0.68750 0.50000 1.0000 + Au Au237 1.0 0.90625 0.75000 0.50000 1.0000 + Au Au238 1.0 0.90625 0.81250 0.50000 1.0000 + Au Au239 1.0 0.90625 0.87500 0.50000 1.0000 + Au Au240 1.0 0.90625 0.93750 0.50000 1.0000 + Au Au241 1.0 0.96875 0.00000 0.50000 1.0000 + Au Au242 1.0 0.96875 0.06250 0.50000 1.0000 + Au Au243 1.0 0.96875 0.12500 0.50000 1.0000 + Au Au244 1.0 0.96875 0.18750 0.50000 1.0000 + Au Au245 1.0 0.96875 0.25000 0.50000 1.0000 + Au Au246 1.0 0.96875 0.31250 0.50000 1.0000 + Au Au247 1.0 0.96875 0.37500 0.50000 1.0000 + Au Au248 1.0 0.96875 0.43750 0.50000 1.0000 + Au Au249 1.0 0.96875 0.50000 0.50000 1.0000 + Au Au250 1.0 0.96875 0.56250 0.50000 1.0000 + Au Au251 1.0 0.96875 0.62500 0.50000 1.0000 + Au Au252 1.0 0.96875 0.68750 0.50000 1.0000 + Au Au253 1.0 0.96875 0.75000 0.50000 1.0000 + Au Au254 1.0 0.96875 0.81250 0.50000 1.0000 + Au Au255 1.0 0.96875 0.87500 0.50000 1.0000 + Au Au256 1.0 0.96875 0.93750 0.50000 1.0000 + O O1 1.0 0.00000 0.04610 0.60949 1.0000 + O O2 1.0 0.00000 0.10860 0.60949 1.0000 + O O3 1.0 0.00000 0.17110 0.60949 1.0000 + O O4 1.0 0.00000 0.23360 0.60949 1.0000 + O O5 1.0 0.00000 0.29610 0.60949 1.0000 + O O6 1.0 0.00000 0.35860 0.60949 1.0000 + O O7 1.0 0.00000 0.42110 0.60949 1.0000 + O O8 1.0 0.00000 0.48360 0.60949 1.0000 + O O9 1.0 0.00000 0.54610 0.60949 1.0000 + O O10 1.0 0.00000 0.60860 0.60949 1.0000 + O O11 1.0 0.00000 0.67110 0.60949 1.0000 + O O12 1.0 0.00000 0.73360 0.60949 1.0000 + O O13 1.0 0.00000 0.79610 0.60949 1.0000 + O O14 1.0 0.00000 0.85860 0.60949 1.0000 + O O15 1.0 0.00000 0.92110 0.60949 1.0000 + O O16 1.0 0.00000 0.98360 0.60949 1.0000 + O O17 1.0 0.06250 0.04610 0.60949 1.0000 + O O18 1.0 0.06250 0.10860 0.60949 1.0000 + O O19 1.0 0.06250 0.17110 0.60949 1.0000 + O O20 1.0 0.06250 0.23360 0.60949 1.0000 + O O21 1.0 0.06250 0.29610 0.60949 1.0000 + O O22 1.0 0.06250 0.35860 0.60949 1.0000 + O O23 1.0 0.06250 0.42110 0.60949 1.0000 + O O24 1.0 0.06250 0.48360 0.60949 1.0000 + O O25 1.0 0.06250 0.54610 0.60949 1.0000 + O O26 1.0 0.06250 0.60860 0.60949 1.0000 + O O27 1.0 0.06250 0.67110 0.60949 1.0000 + O O28 1.0 0.06250 0.73360 0.60949 1.0000 + O O29 1.0 0.06250 0.79610 0.60949 1.0000 + O O30 1.0 0.06250 0.85860 0.60949 1.0000 + O O31 1.0 0.06250 0.92110 0.60949 1.0000 + O O32 1.0 0.06250 0.98360 0.60949 1.0000 + O O33 1.0 0.12500 0.04610 0.60949 1.0000 + O 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0.39051 1.0000 + O O512 1.0 0.93750 0.95390 0.39051 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-4334_supercell_16x16x1.cif b/tier3/cif_file/orthogonal_2dm-4334_supercell_16x16x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..8c4f91007d891e7777879a5c10debe82bc2d39df --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-4334_supercell_16x16x1.cif @@ -0,0 +1,1049 @@ +data_image0 +_chemical_formula_structural Cu256Ag256O512 +_chemical_formula_sum "Cu256 Ag256 O512" +_cell_length_a 44.6485 +_cell_length_b 98.1754 +_cell_length_c 5.07227 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Cu Cu1 1.0 0.00000 0.05369 0.50000 1.0000 + Cu Cu2 1.0 0.00000 0.11619 0.50000 1.0000 + Cu Cu3 1.0 0.00000 0.17869 0.50000 1.0000 + Cu Cu4 1.0 0.00000 0.24119 0.50000 1.0000 + Cu Cu5 1.0 0.00000 0.30369 0.50000 1.0000 + Cu Cu6 1.0 0.00000 0.36619 0.50000 1.0000 + Cu Cu7 1.0 0.00000 0.42869 0.50000 1.0000 + Cu Cu8 1.0 0.00000 0.49119 0.50000 1.0000 + Cu Cu9 1.0 0.00000 0.55369 0.50000 1.0000 + Cu Cu10 1.0 0.00000 0.61619 0.50000 1.0000 + Cu Cu11 1.0 0.00000 0.67869 0.50000 1.0000 + Cu Cu12 1.0 0.00000 0.74119 0.50000 1.0000 + Cu Cu13 1.0 0.00000 0.80369 0.50000 1.0000 + Cu Cu14 1.0 0.00000 0.86619 0.50000 1.0000 + Cu Cu15 1.0 0.00000 0.92869 0.50000 1.0000 + Cu Cu16 1.0 0.00000 0.99119 0.50000 1.0000 + Cu Cu17 1.0 0.06250 0.05369 0.50000 1.0000 + Cu Cu18 1.0 0.06250 0.11619 0.50000 1.0000 + Cu Cu19 1.0 0.06250 0.17869 0.50000 1.0000 + Cu Cu20 1.0 0.06250 0.24119 0.50000 1.0000 + Cu Cu21 1.0 0.06250 0.30369 0.50000 1.0000 + Cu Cu22 1.0 0.06250 0.36619 0.50000 1.0000 + Cu Cu23 1.0 0.06250 0.42869 0.50000 1.0000 + Cu Cu24 1.0 0.06250 0.49119 0.50000 1.0000 + Cu Cu25 1.0 0.06250 0.55369 0.50000 1.0000 + Cu Cu26 1.0 0.06250 0.61619 0.50000 1.0000 + Cu Cu27 1.0 0.06250 0.67869 0.50000 1.0000 + Cu Cu28 1.0 0.06250 0.74119 0.50000 1.0000 + Cu Cu29 1.0 0.06250 0.80369 0.50000 1.0000 + Cu Cu30 1.0 0.06250 0.86619 0.50000 1.0000 + Cu Cu31 1.0 0.06250 0.92869 0.50000 1.0000 + Cu Cu32 1.0 0.06250 0.99119 0.50000 1.0000 + Cu Cu33 1.0 0.12500 0.05369 0.50000 1.0000 + Cu Cu34 1.0 0.12500 0.11619 0.50000 1.0000 + Cu Cu35 1.0 0.12500 0.17869 0.50000 1.0000 + Cu Cu36 1.0 0.12500 0.24119 0.50000 1.0000 + Cu Cu37 1.0 0.12500 0.30369 0.50000 1.0000 + Cu Cu38 1.0 0.12500 0.36619 0.50000 1.0000 + Cu Cu39 1.0 0.12500 0.42869 0.50000 1.0000 + Cu Cu40 1.0 0.12500 0.49119 0.50000 1.0000 + Cu Cu41 1.0 0.12500 0.55369 0.50000 1.0000 + Cu Cu42 1.0 0.12500 0.61619 0.50000 1.0000 + Cu Cu43 1.0 0.12500 0.67869 0.50000 1.0000 + Cu Cu44 1.0 0.12500 0.74119 0.50000 1.0000 + Cu Cu45 1.0 0.12500 0.80369 0.50000 1.0000 + Cu Cu46 1.0 0.12500 0.86619 0.50000 1.0000 + Cu Cu47 1.0 0.12500 0.92869 0.50000 1.0000 + Cu Cu48 1.0 0.12500 0.99119 0.50000 1.0000 + Cu Cu49 1.0 0.18750 0.05369 0.50000 1.0000 + Cu Cu50 1.0 0.18750 0.11619 0.50000 1.0000 + Cu Cu51 1.0 0.18750 0.17869 0.50000 1.0000 + Cu Cu52 1.0 0.18750 0.24119 0.50000 1.0000 + Cu Cu53 1.0 0.18750 0.30369 0.50000 1.0000 + Cu Cu54 1.0 0.18750 0.36619 0.50000 1.0000 + Cu Cu55 1.0 0.18750 0.42869 0.50000 1.0000 + Cu Cu56 1.0 0.18750 0.49119 0.50000 1.0000 + Cu Cu57 1.0 0.18750 0.55369 0.50000 1.0000 + Cu Cu58 1.0 0.18750 0.61619 0.50000 1.0000 + Cu Cu59 1.0 0.18750 0.67869 0.50000 1.0000 + Cu Cu60 1.0 0.18750 0.74119 0.50000 1.0000 + Cu Cu61 1.0 0.18750 0.80369 0.50000 1.0000 + Cu Cu62 1.0 0.18750 0.86619 0.50000 1.0000 + Cu Cu63 1.0 0.18750 0.92869 0.50000 1.0000 + Cu Cu64 1.0 0.18750 0.99119 0.50000 1.0000 + Cu Cu65 1.0 0.25000 0.05369 0.50000 1.0000 + Cu Cu66 1.0 0.25000 0.11619 0.50000 1.0000 + Cu Cu67 1.0 0.25000 0.17869 0.50000 1.0000 + Cu Cu68 1.0 0.25000 0.24119 0.50000 1.0000 + Cu Cu69 1.0 0.25000 0.30369 0.50000 1.0000 + Cu Cu70 1.0 0.25000 0.36619 0.50000 1.0000 + Cu Cu71 1.0 0.25000 0.42869 0.50000 1.0000 + Cu Cu72 1.0 0.25000 0.49119 0.50000 1.0000 + Cu Cu73 1.0 0.25000 0.55369 0.50000 1.0000 + Cu Cu74 1.0 0.25000 0.61619 0.50000 1.0000 + Cu Cu75 1.0 0.25000 0.67869 0.50000 1.0000 + Cu Cu76 1.0 0.25000 0.74119 0.50000 1.0000 + Cu Cu77 1.0 0.25000 0.80369 0.50000 1.0000 + Cu Cu78 1.0 0.25000 0.86619 0.50000 1.0000 + Cu Cu79 1.0 0.25000 0.92869 0.50000 1.0000 + Cu Cu80 1.0 0.25000 0.99119 0.50000 1.0000 + Cu Cu81 1.0 0.31250 0.05369 0.50000 1.0000 + Cu Cu82 1.0 0.31250 0.11619 0.50000 1.0000 + Cu Cu83 1.0 0.31250 0.17869 0.50000 1.0000 + Cu Cu84 1.0 0.31250 0.24119 0.50000 1.0000 + Cu Cu85 1.0 0.31250 0.30369 0.50000 1.0000 + Cu Cu86 1.0 0.31250 0.36619 0.50000 1.0000 + Cu Cu87 1.0 0.31250 0.42869 0.50000 1.0000 + Cu Cu88 1.0 0.31250 0.49119 0.50000 1.0000 + Cu Cu89 1.0 0.31250 0.55369 0.50000 1.0000 + Cu Cu90 1.0 0.31250 0.61619 0.50000 1.0000 + Cu Cu91 1.0 0.31250 0.67869 0.50000 1.0000 + Cu Cu92 1.0 0.31250 0.74119 0.50000 1.0000 + Cu Cu93 1.0 0.31250 0.80369 0.50000 1.0000 + Cu Cu94 1.0 0.31250 0.86619 0.50000 1.0000 + Cu Cu95 1.0 0.31250 0.92869 0.50000 1.0000 + Cu Cu96 1.0 0.31250 0.99119 0.50000 1.0000 + Cu Cu97 1.0 0.37500 0.05369 0.50000 1.0000 + Cu Cu98 1.0 0.37500 0.11619 0.50000 1.0000 + Cu Cu99 1.0 0.37500 0.17869 0.50000 1.0000 + Cu Cu100 1.0 0.37500 0.24119 0.50000 1.0000 + Cu Cu101 1.0 0.37500 0.30369 0.50000 1.0000 + Cu Cu102 1.0 0.37500 0.36619 0.50000 1.0000 + Cu Cu103 1.0 0.37500 0.42869 0.50000 1.0000 + Cu Cu104 1.0 0.37500 0.49119 0.50000 1.0000 + Cu Cu105 1.0 0.37500 0.55369 0.50000 1.0000 + Cu Cu106 1.0 0.37500 0.61619 0.50000 1.0000 + Cu Cu107 1.0 0.37500 0.67869 0.50000 1.0000 + Cu Cu108 1.0 0.37500 0.74119 0.50000 1.0000 + Cu Cu109 1.0 0.37500 0.80369 0.50000 1.0000 + Cu Cu110 1.0 0.37500 0.86619 0.50000 1.0000 + Cu Cu111 1.0 0.37500 0.92869 0.50000 1.0000 + Cu Cu112 1.0 0.37500 0.99119 0.50000 1.0000 + Cu Cu113 1.0 0.43750 0.05369 0.50000 1.0000 + Cu Cu114 1.0 0.43750 0.11619 0.50000 1.0000 + Cu Cu115 1.0 0.43750 0.17869 0.50000 1.0000 + Cu Cu116 1.0 0.43750 0.24119 0.50000 1.0000 + Cu Cu117 1.0 0.43750 0.30369 0.50000 1.0000 + Cu Cu118 1.0 0.43750 0.36619 0.50000 1.0000 + Cu Cu119 1.0 0.43750 0.42869 0.50000 1.0000 + Cu Cu120 1.0 0.43750 0.49119 0.50000 1.0000 + Cu Cu121 1.0 0.43750 0.55369 0.50000 1.0000 + Cu Cu122 1.0 0.43750 0.61619 0.50000 1.0000 + Cu Cu123 1.0 0.43750 0.67869 0.50000 1.0000 + Cu Cu124 1.0 0.43750 0.74119 0.50000 1.0000 + Cu Cu125 1.0 0.43750 0.80369 0.50000 1.0000 + Cu Cu126 1.0 0.43750 0.86619 0.50000 1.0000 + Cu Cu127 1.0 0.43750 0.92869 0.50000 1.0000 + Cu Cu128 1.0 0.43750 0.99119 0.50000 1.0000 + Cu Cu129 1.0 0.50000 0.05369 0.50000 1.0000 + Cu Cu130 1.0 0.50000 0.11619 0.50000 1.0000 + Cu Cu131 1.0 0.50000 0.17869 0.50000 1.0000 + Cu Cu132 1.0 0.50000 0.24119 0.50000 1.0000 + Cu Cu133 1.0 0.50000 0.30369 0.50000 1.0000 + Cu Cu134 1.0 0.50000 0.36619 0.50000 1.0000 + 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0000000000000000000000000000000000000000..691fd5ce10f126999ad82715fb6424984e0856c4 --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-4352_supercell_12x12x1.cif @@ -0,0 +1,3481 @@ +data_image0 +_chemical_formula_structural Ti144Mn432O1152Ti144Mn432O1152 +_chemical_formula_sum "Ti288 Mn864 O2304" +_cell_length_a 122.12 +_cell_length_b 70.5061 +_cell_length_c 5.92215 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Ti Ti1 1.0 0.04167 1.00000 0.50000 1.0000 + Ti Ti2 1.0 0.08333 0.04167 0.50000 1.0000 + Ti Ti3 1.0 0.12500 0.08333 0.50000 1.0000 + Ti Ti4 1.0 0.16667 0.12500 0.50000 1.0000 + Ti Ti5 1.0 0.20833 0.16667 0.50000 1.0000 + Ti Ti6 1.0 0.25000 0.20833 0.50000 1.0000 + Ti Ti7 1.0 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0.08333 0.50000 1.0000 + Ti Ti30 1.0 0.33333 0.12500 0.50000 1.0000 + Ti Ti31 1.0 0.37500 0.16667 0.50000 1.0000 + Ti Ti32 1.0 0.41667 0.20833 0.50000 1.0000 + Ti Ti33 1.0 0.45833 0.25000 0.50000 1.0000 + Ti Ti34 1.0 0.50000 0.29167 0.50000 1.0000 + Ti Ti35 1.0 0.54167 0.33333 0.50000 1.0000 + Ti Ti36 1.0 0.58333 0.37500 0.50000 1.0000 + Ti Ti37 1.0 0.16667 0.87500 0.50000 1.0000 + Ti Ti38 1.0 0.20833 0.91667 0.50000 1.0000 + Ti Ti39 1.0 0.25000 0.95833 0.50000 1.0000 + Ti Ti40 1.0 0.29167 1.00000 0.50000 1.0000 + Ti Ti41 1.0 0.33333 0.04167 0.50000 1.0000 + Ti Ti42 1.0 0.37500 0.08333 0.50000 1.0000 + Ti Ti43 1.0 0.41667 0.12500 0.50000 1.0000 + Ti Ti44 1.0 0.45833 0.16667 0.50000 1.0000 + Ti Ti45 1.0 0.50000 0.20833 0.50000 1.0000 + Ti Ti46 1.0 0.54167 0.25000 0.50000 1.0000 + Ti Ti47 1.0 0.58333 0.29167 0.50000 1.0000 + Ti Ti48 1.0 0.62500 0.33333 0.50000 1.0000 + Ti Ti49 1.0 0.20833 0.83333 0.50000 1.0000 + Ti Ti50 1.0 0.25000 0.87500 0.50000 1.0000 + Ti Ti51 1.0 0.29167 0.91667 0.50000 1.0000 + Ti Ti52 1.0 0.33333 0.95833 0.50000 1.0000 + Ti Ti53 1.0 0.37500 1.00000 0.50000 1.0000 + Ti Ti54 1.0 0.41667 0.04167 0.50000 1.0000 + Ti Ti55 1.0 0.45833 0.08333 0.50000 1.0000 + Ti Ti56 1.0 0.50000 0.12500 0.50000 1.0000 + Ti Ti57 1.0 0.54167 0.16667 0.50000 1.0000 + Ti Ti58 1.0 0.58333 0.20833 0.50000 1.0000 + Ti Ti59 1.0 0.62500 0.25000 0.50000 1.0000 + Ti Ti60 1.0 0.66667 0.29167 0.50000 1.0000 + Ti Ti61 1.0 0.25000 0.79167 0.50000 1.0000 + Ti Ti62 1.0 0.29167 0.83333 0.50000 1.0000 + Ti Ti63 1.0 0.33333 0.87500 0.50000 1.0000 + Ti Ti64 1.0 0.37500 0.91667 0.50000 1.0000 + Ti Ti65 1.0 0.41667 0.95833 0.50000 1.0000 + Ti Ti66 1.0 0.45833 1.00000 0.50000 1.0000 + Ti Ti67 1.0 0.50000 0.04167 0.50000 1.0000 + Ti Ti68 1.0 0.54167 0.08333 0.50000 1.0000 + Ti Ti69 1.0 0.58333 0.12500 0.50000 1.0000 + Ti Ti70 1.0 0.62500 0.16667 0.50000 1.0000 + Ti Ti71 1.0 0.66667 0.20833 0.50000 1.0000 + Ti Ti72 1.0 0.70833 0.25000 0.50000 1.0000 + Ti Ti73 1.0 0.29167 0.75000 0.50000 1.0000 + Ti Ti74 1.0 0.33333 0.79167 0.50000 1.0000 + Ti Ti75 1.0 0.37500 0.83333 0.50000 1.0000 + Ti Ti76 1.0 0.41667 0.87500 0.50000 1.0000 + Ti Ti77 1.0 0.45833 0.91667 0.50000 1.0000 + Ti Ti78 1.0 0.50000 0.95833 0.50000 1.0000 + Ti Ti79 1.0 0.54167 1.00000 0.50000 1.0000 + Ti Ti80 1.0 0.58333 0.04167 0.50000 1.0000 + Ti Ti81 1.0 0.62500 0.08333 0.50000 1.0000 + Ti Ti82 1.0 0.66667 0.12500 0.50000 1.0000 + Ti Ti83 1.0 0.70833 0.16667 0.50000 1.0000 + Ti Ti84 1.0 0.75000 0.20833 0.50000 1.0000 + Ti Ti85 1.0 0.33333 0.70833 0.50000 1.0000 + Ti Ti86 1.0 0.37500 0.75000 0.50000 1.0000 + Ti Ti87 1.0 0.41667 0.79167 0.50000 1.0000 + Ti Ti88 1.0 0.45833 0.83333 0.50000 1.0000 + Ti Ti89 1.0 0.50000 0.87500 0.50000 1.0000 + Ti Ti90 1.0 0.54167 0.91667 0.50000 1.0000 + Ti Ti91 1.0 0.58333 0.95833 0.50000 1.0000 + Ti Ti92 1.0 0.62500 1.00000 0.50000 1.0000 + Ti Ti93 1.0 0.66667 0.04167 0.50000 1.0000 + Ti Ti94 1.0 0.70833 0.08333 0.50000 1.0000 + Ti Ti95 1.0 0.75000 0.12500 0.50000 1.0000 + Ti Ti96 1.0 0.79167 0.16667 0.50000 1.0000 + Ti Ti97 1.0 0.37500 0.66667 0.50000 1.0000 + Ti Ti98 1.0 0.41667 0.70833 0.50000 1.0000 + Ti Ti99 1.0 0.45833 0.75000 0.50000 1.0000 + Ti Ti100 1.0 0.50000 0.79167 0.50000 1.0000 + Ti Ti101 1.0 0.54167 0.83333 0.50000 1.0000 + Ti Ti102 1.0 0.58333 0.87500 0.50000 1.0000 + Ti Ti103 1.0 0.62500 0.91667 0.50000 1.0000 + Ti Ti104 1.0 0.66667 0.95833 0.50000 1.0000 + Ti Ti105 1.0 0.70833 1.00000 0.50000 1.0000 + Ti Ti106 1.0 0.75000 0.04167 0.50000 1.0000 + Ti Ti107 1.0 0.79167 0.08333 0.50000 1.0000 + Ti Ti108 1.0 0.83333 0.12500 0.50000 1.0000 + Ti Ti109 1.0 0.41667 0.62500 0.50000 1.0000 + Ti Ti110 1.0 0.45833 0.66667 0.50000 1.0000 + Ti Ti111 1.0 0.50000 0.70833 0.50000 1.0000 + Ti Ti112 1.0 0.54167 0.75000 0.50000 1.0000 + Ti Ti113 1.0 0.58333 0.79167 0.50000 1.0000 + Ti Ti114 1.0 0.62500 0.83333 0.50000 1.0000 + Ti Ti115 1.0 0.66667 0.87500 0.50000 1.0000 + Ti Ti116 1.0 0.70833 0.91667 0.50000 1.0000 + Ti Ti117 1.0 0.75000 0.95833 0.50000 1.0000 + Ti Ti118 1.0 0.79167 1.00000 0.50000 1.0000 + Ti Ti119 1.0 0.83333 0.04167 0.50000 1.0000 + Ti Ti120 1.0 0.87500 0.08333 0.50000 1.0000 + Ti Ti121 1.0 0.45833 0.58333 0.50000 1.0000 + Ti Ti122 1.0 0.50000 0.62500 0.50000 1.0000 + Ti Ti123 1.0 0.54167 0.66667 0.50000 1.0000 + Ti Ti124 1.0 0.58333 0.70833 0.50000 1.0000 + Ti Ti125 1.0 0.62500 0.75000 0.50000 1.0000 + Ti Ti126 1.0 0.66667 0.79167 0.50000 1.0000 + Ti Ti127 1.0 0.70833 0.83333 0.50000 1.0000 + Ti Ti128 1.0 0.75000 0.87500 0.50000 1.0000 + Ti Ti129 1.0 0.79167 0.91667 0.50000 1.0000 + Ti Ti130 1.0 0.83333 0.95833 0.50000 1.0000 + Ti Ti131 1.0 0.87500 1.00000 0.50000 1.0000 + Ti Ti132 1.0 0.91667 0.04167 0.50000 1.0000 + Ti Ti133 1.0 0.50000 0.54167 0.50000 1.0000 + Ti Ti134 1.0 0.54167 0.58333 0.50000 1.0000 + Ti Ti135 1.0 0.58333 0.62500 0.50000 1.0000 + Ti Ti136 1.0 0.62500 0.66667 0.50000 1.0000 + Ti Ti137 1.0 0.66667 0.70833 0.50000 1.0000 + Ti Ti138 1.0 0.70833 0.75000 0.50000 1.0000 + Ti Ti139 1.0 0.75000 0.79167 0.50000 1.0000 + Ti Ti140 1.0 0.79167 0.83333 0.50000 1.0000 + Ti Ti141 1.0 0.83333 0.87500 0.50000 1.0000 + Ti Ti142 1.0 0.87500 0.91667 0.50000 1.0000 + Ti Ti143 1.0 0.91667 0.95833 0.50000 1.0000 + Ti Ti144 1.0 0.95833 1.00000 0.50000 1.0000 + Mn Mn1 1.0 0.02083 0.97917 0.50000 1.0000 + Mn Mn2 1.0 0.06250 0.02083 0.50000 1.0000 + Mn Mn3 1.0 0.10417 0.06250 0.50000 1.0000 + Mn Mn4 1.0 0.14583 0.10417 0.50000 1.0000 + Mn Mn5 1.0 0.18750 0.14583 0.50000 1.0000 + Mn Mn6 1.0 0.22917 0.18750 0.50000 1.0000 + Mn Mn7 1.0 0.27083 0.22917 0.50000 1.0000 + Mn Mn8 1.0 0.31250 0.27083 0.50000 1.0000 + Mn Mn9 1.0 0.35417 0.31250 0.50000 1.0000 + Mn Mn10 1.0 0.39583 0.35417 0.50000 1.0000 + Mn Mn11 1.0 0.43750 0.39583 0.50000 1.0000 + Mn Mn12 1.0 0.47917 0.43750 0.50000 1.0000 + Mn Mn13 1.0 0.06250 0.93750 0.50000 1.0000 + Mn Mn14 1.0 0.10417 0.97917 0.50000 1.0000 + Mn Mn15 1.0 0.14583 0.02083 0.50000 1.0000 + Mn Mn16 1.0 0.18750 0.06250 0.50000 1.0000 + Mn Mn17 1.0 0.22917 0.10417 0.50000 1.0000 + Mn Mn18 1.0 0.27083 0.14583 0.50000 1.0000 + Mn Mn19 1.0 0.31250 0.18750 0.50000 1.0000 + Mn Mn20 1.0 0.35417 0.22917 0.50000 1.0000 + Mn Mn21 1.0 0.39583 0.27083 0.50000 1.0000 + Mn Mn22 1.0 0.43750 0.31250 0.50000 1.0000 + Mn Mn23 1.0 0.47917 0.35417 0.50000 1.0000 + Mn Mn24 1.0 0.52083 0.39583 0.50000 1.0000 + Mn Mn25 1.0 0.10417 0.89583 0.50000 1.0000 + Mn Mn26 1.0 0.14583 0.93750 0.50000 1.0000 + Mn Mn27 1.0 0.18750 0.97917 0.50000 1.0000 + Mn Mn28 1.0 0.22917 0.02083 0.50000 1.0000 + Mn Mn29 1.0 0.27083 0.06250 0.50000 1.0000 + Mn Mn30 1.0 0.31250 0.10417 0.50000 1.0000 + Mn Mn31 1.0 0.35417 0.14583 0.50000 1.0000 + Mn Mn32 1.0 0.39583 0.18750 0.50000 1.0000 + Mn Mn33 1.0 0.43750 0.22917 0.50000 1.0000 + Mn Mn34 1.0 0.47917 0.27083 0.50000 1.0000 + Mn Mn35 1.0 0.52083 0.31250 0.50000 1.0000 + Mn Mn36 1.0 0.56250 0.35417 0.50000 1.0000 + Mn Mn37 1.0 0.14583 0.85417 0.50000 1.0000 + Mn Mn38 1.0 0.18750 0.89583 0.50000 1.0000 + Mn Mn39 1.0 0.22917 0.93750 0.50000 1.0000 + Mn Mn40 1.0 0.27083 0.97917 0.50000 1.0000 + Mn Mn41 1.0 0.31250 0.02083 0.50000 1.0000 + Mn Mn42 1.0 0.35417 0.06250 0.50000 1.0000 + Mn Mn43 1.0 0.39583 0.10417 0.50000 1.0000 + Mn Mn44 1.0 0.43750 0.14583 0.50000 1.0000 + Mn Mn45 1.0 0.47917 0.18750 0.50000 1.0000 + Mn Mn46 1.0 0.52083 0.22917 0.50000 1.0000 + Mn Mn47 1.0 0.56250 0.27083 0.50000 1.0000 + Mn Mn48 1.0 0.60417 0.31250 0.50000 1.0000 + Mn Mn49 1.0 0.18750 0.81250 0.50000 1.0000 + Mn Mn50 1.0 0.22917 0.85417 0.50000 1.0000 + Mn Mn51 1.0 0.27083 0.89583 0.50000 1.0000 + Mn Mn52 1.0 0.31250 0.93750 0.50000 1.0000 + Mn Mn53 1.0 0.35417 0.97917 0.50000 1.0000 + Mn Mn54 1.0 0.39583 0.02083 0.50000 1.0000 + Mn Mn55 1.0 0.43750 0.06250 0.50000 1.0000 + Mn Mn56 1.0 0.47917 0.10417 0.50000 1.0000 + Mn Mn57 1.0 0.52083 0.14583 0.50000 1.0000 + Mn Mn58 1.0 0.56250 0.18750 0.50000 1.0000 + Mn Mn59 1.0 0.60417 0.22917 0.50000 1.0000 + Mn Mn60 1.0 0.64583 0.27083 0.50000 1.0000 + Mn Mn61 1.0 0.22917 0.77083 0.50000 1.0000 + Mn Mn62 1.0 0.27083 0.81250 0.50000 1.0000 + Mn Mn63 1.0 0.31250 0.85417 0.50000 1.0000 + Mn Mn64 1.0 0.35417 0.89583 0.50000 1.0000 + Mn Mn65 1.0 0.39583 0.93750 0.50000 1.0000 + Mn Mn66 1.0 0.43750 0.97917 0.50000 1.0000 + Mn Mn67 1.0 0.47917 0.02083 0.50000 1.0000 + Mn Mn68 1.0 0.52083 0.06250 0.50000 1.0000 + Mn Mn69 1.0 0.56250 0.10417 0.50000 1.0000 + Mn Mn70 1.0 0.60417 0.14583 0.50000 1.0000 + Mn Mn71 1.0 0.64583 0.18750 0.50000 1.0000 + Mn Mn72 1.0 0.68750 0.22917 0.50000 1.0000 + Mn Mn73 1.0 0.27083 0.72917 0.50000 1.0000 + Mn Mn74 1.0 0.31250 0.77083 0.50000 1.0000 + Mn Mn75 1.0 0.35417 0.81250 0.50000 1.0000 + Mn Mn76 1.0 0.39583 0.85417 0.50000 1.0000 + Mn Mn77 1.0 0.43750 0.89583 0.50000 1.0000 + Mn Mn78 1.0 0.47917 0.93750 0.50000 1.0000 + Mn Mn79 1.0 0.52083 0.97917 0.50000 1.0000 + Mn Mn80 1.0 0.56250 0.02083 0.50000 1.0000 + Mn Mn81 1.0 0.60417 0.06250 0.50000 1.0000 + Mn Mn82 1.0 0.64583 0.10417 0.50000 1.0000 + Mn Mn83 1.0 0.68750 0.14583 0.50000 1.0000 + Mn Mn84 1.0 0.72917 0.18750 0.50000 1.0000 + Mn Mn85 1.0 0.31250 0.68750 0.50000 1.0000 + Mn Mn86 1.0 0.35417 0.72917 0.50000 1.0000 + Mn Mn87 1.0 0.39583 0.77083 0.50000 1.0000 + Mn Mn88 1.0 0.43750 0.81250 0.50000 1.0000 + Mn Mn89 1.0 0.47917 0.85417 0.50000 1.0000 + Mn Mn90 1.0 0.52083 0.89583 0.50000 1.0000 + Mn Mn91 1.0 0.56250 0.93750 0.50000 1.0000 + Mn Mn92 1.0 0.60417 0.97917 0.50000 1.0000 + Mn Mn93 1.0 0.64583 0.02083 0.50000 1.0000 + Mn Mn94 1.0 0.68750 0.06250 0.50000 1.0000 + Mn Mn95 1.0 0.72917 0.10417 0.50000 1.0000 + Mn Mn96 1.0 0.77083 0.14583 0.50000 1.0000 + Mn Mn97 1.0 0.35417 0.64583 0.50000 1.0000 + Mn Mn98 1.0 0.39583 0.68750 0.50000 1.0000 + Mn Mn99 1.0 0.43750 0.72917 0.50000 1.0000 + Mn Mn100 1.0 0.47917 0.77083 0.50000 1.0000 + Mn Mn101 1.0 0.52083 0.81250 0.50000 1.0000 + Mn Mn102 1.0 0.56250 0.85417 0.50000 1.0000 + Mn Mn103 1.0 0.60417 0.89583 0.50000 1.0000 + Mn Mn104 1.0 0.64583 0.93750 0.50000 1.0000 + Mn Mn105 1.0 0.68750 0.97917 0.50000 1.0000 + Mn Mn106 1.0 0.72917 0.02083 0.50000 1.0000 + Mn Mn107 1.0 0.77083 0.06250 0.50000 1.0000 + Mn Mn108 1.0 0.81250 0.10417 0.50000 1.0000 + Mn Mn109 1.0 0.39583 0.60417 0.50000 1.0000 + Mn Mn110 1.0 0.43750 0.64583 0.50000 1.0000 + Mn Mn111 1.0 0.47917 0.68750 0.50000 1.0000 + Mn Mn112 1.0 0.52083 0.72917 0.50000 1.0000 + Mn Mn113 1.0 0.56250 0.77083 0.50000 1.0000 + Mn Mn114 1.0 0.60417 0.81250 0.50000 1.0000 + Mn Mn115 1.0 0.64583 0.85417 0.50000 1.0000 + Mn Mn116 1.0 0.68750 0.89583 0.50000 1.0000 + Mn Mn117 1.0 0.72917 0.93750 0.50000 1.0000 + Mn Mn118 1.0 0.77083 0.97917 0.50000 1.0000 + Mn Mn119 1.0 0.81250 0.02083 0.50000 1.0000 + Mn Mn120 1.0 0.85417 0.06250 0.50000 1.0000 + Mn Mn121 1.0 0.43750 0.56250 0.50000 1.0000 + Mn Mn122 1.0 0.47917 0.60417 0.50000 1.0000 + Mn Mn123 1.0 0.52083 0.64583 0.50000 1.0000 + Mn Mn124 1.0 0.56250 0.68750 0.50000 1.0000 + Mn Mn125 1.0 0.60417 0.72917 0.50000 1.0000 + Mn Mn126 1.0 0.64583 0.77083 0.50000 1.0000 + Mn Mn127 1.0 0.68750 0.81250 0.50000 1.0000 + Mn Mn128 1.0 0.72917 0.85417 0.50000 1.0000 + Mn Mn129 1.0 0.77083 0.89583 0.50000 1.0000 + Mn Mn130 1.0 0.81250 0.93750 0.50000 1.0000 + Mn Mn131 1.0 0.85417 0.97917 0.50000 1.0000 + Mn Mn132 1.0 0.89583 0.02083 0.50000 1.0000 + Mn Mn133 1.0 0.47917 0.52083 0.50000 1.0000 + Mn Mn134 1.0 0.52083 0.56250 0.50000 1.0000 + Mn Mn135 1.0 0.56250 0.60417 0.50000 1.0000 + Mn Mn136 1.0 0.60417 0.64583 0.50000 1.0000 + Mn Mn137 1.0 0.64583 0.68750 0.50000 1.0000 + Mn Mn138 1.0 0.68750 0.72917 0.50000 1.0000 + Mn Mn139 1.0 0.72917 0.77083 0.50000 1.0000 + Mn Mn140 1.0 0.77083 0.81250 0.50000 1.0000 + Mn Mn141 1.0 0.81250 0.85417 0.50000 1.0000 + Mn Mn142 1.0 0.85417 0.89583 0.50000 1.0000 + Mn Mn143 1.0 0.89583 0.93750 0.50000 1.0000 + Mn Mn144 1.0 0.93750 0.97917 0.50000 1.0000 + Mn Mn145 1.0 0.06250 0.97917 0.50000 1.0000 + Mn Mn146 1.0 0.10417 0.02083 0.50000 1.0000 + Mn Mn147 1.0 0.14583 0.06250 0.50000 1.0000 + Mn Mn148 1.0 0.18750 0.10417 0.50000 1.0000 + Mn Mn149 1.0 0.22917 0.14583 0.50000 1.0000 + Mn Mn150 1.0 0.27083 0.18750 0.50000 1.0000 + Mn Mn151 1.0 0.31250 0.22917 0.50000 1.0000 + Mn Mn152 1.0 0.35417 0.27083 0.50000 1.0000 + Mn Mn153 1.0 0.39583 0.31250 0.50000 1.0000 + Mn Mn154 1.0 0.43750 0.35417 0.50000 1.0000 + Mn Mn155 1.0 0.47917 0.39583 0.50000 1.0000 + Mn Mn156 1.0 0.52083 0.43750 0.50000 1.0000 + Mn Mn157 1.0 0.10417 0.93750 0.50000 1.0000 + Mn Mn158 1.0 0.14583 0.97917 0.50000 1.0000 + Mn Mn159 1.0 0.18750 0.02083 0.50000 1.0000 + Mn Mn160 1.0 0.22917 0.06250 0.50000 1.0000 + Mn Mn161 1.0 0.27083 0.10417 0.50000 1.0000 + Mn Mn162 1.0 0.31250 0.14583 0.50000 1.0000 + Mn Mn163 1.0 0.35417 0.18750 0.50000 1.0000 + Mn Mn164 1.0 0.39583 0.22917 0.50000 1.0000 + Mn Mn165 1.0 0.43750 0.27083 0.50000 1.0000 + Mn Mn166 1.0 0.47917 0.31250 0.50000 1.0000 + Mn Mn167 1.0 0.52083 0.35417 0.50000 1.0000 + Mn Mn168 1.0 0.56250 0.39583 0.50000 1.0000 + Mn Mn169 1.0 0.14583 0.89583 0.50000 1.0000 + Mn Mn170 1.0 0.18750 0.93750 0.50000 1.0000 + Mn Mn171 1.0 0.22917 0.97917 0.50000 1.0000 + Mn Mn172 1.0 0.27083 0.02083 0.50000 1.0000 + Mn Mn173 1.0 0.31250 0.06250 0.50000 1.0000 + Mn Mn174 1.0 0.35417 0.10417 0.50000 1.0000 + Mn Mn175 1.0 0.39583 0.14583 0.50000 1.0000 + Mn Mn176 1.0 0.43750 0.18750 0.50000 1.0000 + Mn Mn177 1.0 0.47917 0.22917 0.50000 1.0000 + Mn Mn178 1.0 0.52083 0.27083 0.50000 1.0000 + Mn Mn179 1.0 0.56250 0.31250 0.50000 1.0000 + Mn Mn180 1.0 0.60417 0.35417 0.50000 1.0000 + Mn Mn181 1.0 0.18750 0.85417 0.50000 1.0000 + Mn Mn182 1.0 0.22917 0.89583 0.50000 1.0000 + Mn Mn183 1.0 0.27083 0.93750 0.50000 1.0000 + Mn Mn184 1.0 0.31250 0.97917 0.50000 1.0000 + Mn Mn185 1.0 0.35417 0.02083 0.50000 1.0000 + Mn Mn186 1.0 0.39583 0.06250 0.50000 1.0000 + Mn Mn187 1.0 0.43750 0.10417 0.50000 1.0000 + Mn Mn188 1.0 0.47917 0.14583 0.50000 1.0000 + Mn Mn189 1.0 0.52083 0.18750 0.50000 1.0000 + Mn Mn190 1.0 0.56250 0.22917 0.50000 1.0000 + Mn Mn191 1.0 0.60417 0.27083 0.50000 1.0000 + Mn Mn192 1.0 0.64583 0.31250 0.50000 1.0000 + Mn Mn193 1.0 0.22917 0.81250 0.50000 1.0000 + Mn Mn194 1.0 0.27083 0.85417 0.50000 1.0000 + Mn Mn195 1.0 0.31250 0.89583 0.50000 1.0000 + Mn Mn196 1.0 0.35417 0.93750 0.50000 1.0000 + Mn Mn197 1.0 0.39583 0.97917 0.50000 1.0000 + Mn Mn198 1.0 0.43750 0.02083 0.50000 1.0000 + Mn Mn199 1.0 0.47917 0.06250 0.50000 1.0000 + Mn Mn200 1.0 0.52083 0.10417 0.50000 1.0000 + Mn Mn201 1.0 0.56250 0.14583 0.50000 1.0000 + Mn Mn202 1.0 0.60417 0.18750 0.50000 1.0000 + Mn Mn203 1.0 0.64583 0.22917 0.50000 1.0000 + Mn Mn204 1.0 0.68750 0.27083 0.50000 1.0000 + Mn Mn205 1.0 0.27083 0.77083 0.50000 1.0000 + Mn Mn206 1.0 0.31250 0.81250 0.50000 1.0000 + Mn Mn207 1.0 0.35417 0.85417 0.50000 1.0000 + Mn Mn208 1.0 0.39583 0.89583 0.50000 1.0000 + Mn Mn209 1.0 0.43750 0.93750 0.50000 1.0000 + Mn Mn210 1.0 0.47917 0.97917 0.50000 1.0000 + Mn Mn211 1.0 0.52083 0.02083 0.50000 1.0000 + Mn Mn212 1.0 0.56250 0.06250 0.50000 1.0000 + Mn Mn213 1.0 0.60417 0.10417 0.50000 1.0000 + Mn Mn214 1.0 0.64583 0.14583 0.50000 1.0000 + Mn Mn215 1.0 0.68750 0.18750 0.50000 1.0000 + Mn Mn216 1.0 0.72917 0.22917 0.50000 1.0000 + Mn Mn217 1.0 0.31250 0.72917 0.50000 1.0000 + Mn Mn218 1.0 0.35417 0.77083 0.50000 1.0000 + Mn Mn219 1.0 0.39583 0.81250 0.50000 1.0000 + Mn Mn220 1.0 0.43750 0.85417 0.50000 1.0000 + Mn Mn221 1.0 0.47917 0.89583 0.50000 1.0000 + Mn Mn222 1.0 0.52083 0.93750 0.50000 1.0000 + Mn Mn223 1.0 0.56250 0.97917 0.50000 1.0000 + Mn Mn224 1.0 0.60417 0.02083 0.50000 1.0000 + Mn Mn225 1.0 0.64583 0.06250 0.50000 1.0000 + Mn Mn226 1.0 0.68750 0.10417 0.50000 1.0000 + Mn Mn227 1.0 0.72917 0.14583 0.50000 1.0000 + Mn Mn228 1.0 0.77083 0.18750 0.50000 1.0000 + Mn Mn229 1.0 0.35417 0.68750 0.50000 1.0000 + Mn Mn230 1.0 0.39583 0.72917 0.50000 1.0000 + Mn Mn231 1.0 0.43750 0.77083 0.50000 1.0000 + Mn Mn232 1.0 0.47917 0.81250 0.50000 1.0000 + Mn Mn233 1.0 0.52083 0.85417 0.50000 1.0000 + Mn Mn234 1.0 0.56250 0.89583 0.50000 1.0000 + Mn Mn235 1.0 0.60417 0.93750 0.50000 1.0000 + Mn Mn236 1.0 0.64583 0.97917 0.50000 1.0000 + Mn Mn237 1.0 0.68750 0.02083 0.50000 1.0000 + Mn Mn238 1.0 0.72917 0.06250 0.50000 1.0000 + Mn Mn239 1.0 0.77083 0.10417 0.50000 1.0000 + Mn Mn240 1.0 0.81250 0.14583 0.50000 1.0000 + Mn Mn241 1.0 0.39583 0.64583 0.50000 1.0000 + Mn Mn242 1.0 0.43750 0.68750 0.50000 1.0000 + Mn Mn243 1.0 0.47917 0.72917 0.50000 1.0000 + Mn Mn244 1.0 0.52083 0.77083 0.50000 1.0000 + Mn Mn245 1.0 0.56250 0.81250 0.50000 1.0000 + Mn Mn246 1.0 0.60417 0.85417 0.50000 1.0000 + Mn Mn247 1.0 0.64583 0.89583 0.50000 1.0000 + Mn Mn248 1.0 0.68750 0.93750 0.50000 1.0000 + Mn Mn249 1.0 0.72917 0.97917 0.50000 1.0000 + Mn Mn250 1.0 0.77083 0.02083 0.50000 1.0000 + Mn Mn251 1.0 0.81250 0.06250 0.50000 1.0000 + Mn Mn252 1.0 0.85417 0.10417 0.50000 1.0000 + Mn Mn253 1.0 0.43750 0.60417 0.50000 1.0000 + Mn Mn254 1.0 0.47917 0.64583 0.50000 1.0000 + Mn Mn255 1.0 0.52083 0.68750 0.50000 1.0000 + Mn Mn256 1.0 0.56250 0.72917 0.50000 1.0000 + Mn Mn257 1.0 0.60417 0.77083 0.50000 1.0000 + Mn Mn258 1.0 0.64583 0.81250 0.50000 1.0000 + Mn Mn259 1.0 0.68750 0.85417 0.50000 1.0000 + Mn Mn260 1.0 0.72917 0.89583 0.50000 1.0000 + Mn Mn261 1.0 0.77083 0.93750 0.50000 1.0000 + Mn Mn262 1.0 0.81250 0.97917 0.50000 1.0000 + Mn Mn263 1.0 0.85417 0.02083 0.50000 1.0000 + Mn Mn264 1.0 0.89583 0.06250 0.50000 1.0000 + Mn Mn265 1.0 0.47917 0.56250 0.50000 1.0000 + Mn Mn266 1.0 0.52083 0.60417 0.50000 1.0000 + Mn Mn267 1.0 0.56250 0.64583 0.50000 1.0000 + Mn Mn268 1.0 0.60417 0.68750 0.50000 1.0000 + Mn Mn269 1.0 0.64583 0.72917 0.50000 1.0000 + Mn Mn270 1.0 0.68750 0.77083 0.50000 1.0000 + Mn Mn271 1.0 0.72917 0.81250 0.50000 1.0000 + Mn Mn272 1.0 0.77083 0.85417 0.50000 1.0000 + Mn Mn273 1.0 0.81250 0.89583 0.50000 1.0000 + Mn Mn274 1.0 0.85417 0.93750 0.50000 1.0000 + Mn Mn275 1.0 0.89583 0.97917 0.50000 1.0000 + Mn Mn276 1.0 0.93750 0.02083 0.50000 1.0000 + Mn Mn277 1.0 0.52083 0.52083 0.50000 1.0000 + Mn Mn278 1.0 0.56250 0.56250 0.50000 1.0000 + Mn Mn279 1.0 0.60417 0.60417 0.50000 1.0000 + Mn Mn280 1.0 0.64583 0.64583 0.50000 1.0000 + Mn Mn281 1.0 0.68750 0.68750 0.50000 1.0000 + Mn Mn282 1.0 0.72917 0.72917 0.50000 1.0000 + Mn Mn283 1.0 0.77083 0.77083 0.50000 1.0000 + Mn Mn284 1.0 0.81250 0.81250 0.50000 1.0000 + Mn Mn285 1.0 0.85417 0.85417 0.50000 1.0000 + Mn Mn286 1.0 0.89583 0.89583 0.50000 1.0000 + Mn Mn287 1.0 0.93750 0.93750 0.50000 1.0000 + Mn Mn288 1.0 0.97917 0.97917 0.50000 1.0000 + Mn Mn289 1.0 0.04167 0.95833 0.50000 1.0000 + Mn Mn290 1.0 0.08333 0.00000 0.50000 1.0000 + Mn Mn291 1.0 0.12500 0.04167 0.50000 1.0000 + Mn Mn292 1.0 0.16667 0.08333 0.50000 1.0000 + Mn Mn293 1.0 0.20833 0.12500 0.50000 1.0000 + Mn Mn294 1.0 0.25000 0.16667 0.50000 1.0000 + Mn Mn295 1.0 0.29167 0.20833 0.50000 1.0000 + Mn Mn296 1.0 0.33333 0.25000 0.50000 1.0000 + Mn Mn297 1.0 0.37500 0.29167 0.50000 1.0000 + Mn Mn298 1.0 0.41667 0.33333 0.50000 1.0000 + Mn Mn299 1.0 0.45833 0.37500 0.50000 1.0000 + Mn Mn300 1.0 0.50000 0.41667 0.50000 1.0000 + Mn Mn301 1.0 0.08333 0.91667 0.50000 1.0000 + Mn Mn302 1.0 0.12500 0.95833 0.50000 1.0000 + Mn Mn303 1.0 0.16667 0.00000 0.50000 1.0000 + Mn Mn304 1.0 0.20833 0.04167 0.50000 1.0000 + Mn Mn305 1.0 0.25000 0.08333 0.50000 1.0000 + Mn Mn306 1.0 0.29167 0.12500 0.50000 1.0000 + Mn Mn307 1.0 0.33333 0.16667 0.50000 1.0000 + Mn Mn308 1.0 0.37500 0.20833 0.50000 1.0000 + Mn Mn309 1.0 0.41667 0.25000 0.50000 1.0000 + Mn Mn310 1.0 0.45833 0.29167 0.50000 1.0000 + Mn Mn311 1.0 0.50000 0.33333 0.50000 1.0000 + Mn Mn312 1.0 0.54167 0.37500 0.50000 1.0000 + Mn Mn313 1.0 0.12500 0.87500 0.50000 1.0000 + Mn Mn314 1.0 0.16667 0.91667 0.50000 1.0000 + Mn Mn315 1.0 0.20833 0.95833 0.50000 1.0000 + Mn Mn316 1.0 0.25000 0.00000 0.50000 1.0000 + Mn Mn317 1.0 0.29167 0.04167 0.50000 1.0000 + Mn Mn318 1.0 0.33333 0.08333 0.50000 1.0000 + Mn Mn319 1.0 0.37500 0.12500 0.50000 1.0000 + Mn Mn320 1.0 0.41667 0.16667 0.50000 1.0000 + Mn Mn321 1.0 0.45833 0.20833 0.50000 1.0000 + Mn Mn322 1.0 0.50000 0.25000 0.50000 1.0000 + Mn Mn323 1.0 0.54167 0.29167 0.50000 1.0000 + Mn Mn324 1.0 0.58333 0.33333 0.50000 1.0000 + Mn Mn325 1.0 0.16667 0.83333 0.50000 1.0000 + Mn Mn326 1.0 0.20833 0.87500 0.50000 1.0000 + Mn Mn327 1.0 0.25000 0.91667 0.50000 1.0000 + Mn Mn328 1.0 0.29167 0.95833 0.50000 1.0000 + Mn Mn329 1.0 0.33333 0.00000 0.50000 1.0000 + Mn Mn330 1.0 0.37500 0.04167 0.50000 1.0000 + Mn Mn331 1.0 0.41667 0.08333 0.50000 1.0000 + Mn Mn332 1.0 0.45833 0.12500 0.50000 1.0000 + Mn Mn333 1.0 0.50000 0.16667 0.50000 1.0000 + Mn Mn334 1.0 0.54167 0.20833 0.50000 1.0000 + Mn Mn335 1.0 0.58333 0.25000 0.50000 1.0000 + Mn Mn336 1.0 0.62500 0.29167 0.50000 1.0000 + Mn Mn337 1.0 0.20833 0.79167 0.50000 1.0000 + Mn Mn338 1.0 0.25000 0.83333 0.50000 1.0000 + Mn Mn339 1.0 0.29167 0.87500 0.50000 1.0000 + Mn Mn340 1.0 0.33333 0.91667 0.50000 1.0000 + Mn Mn341 1.0 0.37500 0.95833 0.50000 1.0000 + Mn Mn342 1.0 0.41667 0.00000 0.50000 1.0000 + Mn Mn343 1.0 0.45833 0.04167 0.50000 1.0000 + Mn Mn344 1.0 0.50000 0.08333 0.50000 1.0000 + Mn Mn345 1.0 0.54167 0.12500 0.50000 1.0000 + Mn Mn346 1.0 0.58333 0.16667 0.50000 1.0000 + Mn Mn347 1.0 0.62500 0.20833 0.50000 1.0000 + Mn Mn348 1.0 0.66667 0.25000 0.50000 1.0000 + Mn Mn349 1.0 0.25000 0.75000 0.50000 1.0000 + Mn Mn350 1.0 0.29167 0.79167 0.50000 1.0000 + Mn Mn351 1.0 0.33333 0.83333 0.50000 1.0000 + Mn Mn352 1.0 0.37500 0.87500 0.50000 1.0000 + Mn Mn353 1.0 0.41667 0.91667 0.50000 1.0000 + Mn Mn354 1.0 0.45833 0.95833 0.50000 1.0000 + Mn Mn355 1.0 0.50000 0.00000 0.50000 1.0000 + Mn Mn356 1.0 0.54167 0.04167 0.50000 1.0000 + Mn Mn357 1.0 0.58333 0.08333 0.50000 1.0000 + Mn Mn358 1.0 0.62500 0.12500 0.50000 1.0000 + Mn Mn359 1.0 0.66667 0.16667 0.50000 1.0000 + Mn Mn360 1.0 0.70833 0.20833 0.50000 1.0000 + Mn Mn361 1.0 0.29167 0.70833 0.50000 1.0000 + Mn Mn362 1.0 0.33333 0.75000 0.50000 1.0000 + Mn Mn363 1.0 0.37500 0.79167 0.50000 1.0000 + Mn Mn364 1.0 0.41667 0.83333 0.50000 1.0000 + Mn Mn365 1.0 0.45833 0.87500 0.50000 1.0000 + Mn Mn366 1.0 0.50000 0.91667 0.50000 1.0000 + Mn Mn367 1.0 0.54167 0.95833 0.50000 1.0000 + Mn Mn368 1.0 0.58333 0.00000 0.50000 1.0000 + Mn Mn369 1.0 0.62500 0.04167 0.50000 1.0000 + Mn Mn370 1.0 0.66667 0.08333 0.50000 1.0000 + Mn Mn371 1.0 0.70833 0.12500 0.50000 1.0000 + Mn Mn372 1.0 0.75000 0.16667 0.50000 1.0000 + Mn Mn373 1.0 0.33333 0.66667 0.50000 1.0000 + Mn Mn374 1.0 0.37500 0.70833 0.50000 1.0000 + Mn Mn375 1.0 0.41667 0.75000 0.50000 1.0000 + Mn Mn376 1.0 0.45833 0.79167 0.50000 1.0000 + Mn Mn377 1.0 0.50000 0.83333 0.50000 1.0000 + Mn Mn378 1.0 0.54167 0.87500 0.50000 1.0000 + Mn Mn379 1.0 0.58333 0.91667 0.50000 1.0000 + Mn Mn380 1.0 0.62500 0.95833 0.50000 1.0000 + Mn Mn381 1.0 0.66667 0.00000 0.50000 1.0000 + Mn Mn382 1.0 0.70833 0.04167 0.50000 1.0000 + Mn Mn383 1.0 0.75000 0.08333 0.50000 1.0000 + Mn Mn384 1.0 0.79167 0.12500 0.50000 1.0000 + Mn Mn385 1.0 0.37500 0.62500 0.50000 1.0000 + Mn Mn386 1.0 0.41667 0.66667 0.50000 1.0000 + Mn Mn387 1.0 0.45833 0.70833 0.50000 1.0000 + Mn Mn388 1.0 0.50000 0.75000 0.50000 1.0000 + Mn Mn389 1.0 0.54167 0.79167 0.50000 1.0000 + Mn Mn390 1.0 0.58333 0.83333 0.50000 1.0000 + Mn Mn391 1.0 0.62500 0.87500 0.50000 1.0000 + Mn Mn392 1.0 0.66667 0.91667 0.50000 1.0000 + Mn Mn393 1.0 0.70833 0.95833 0.50000 1.0000 + Mn Mn394 1.0 0.75000 0.00000 0.50000 1.0000 + Mn Mn395 1.0 0.79167 0.04167 0.50000 1.0000 + Mn Mn396 1.0 0.83333 0.08333 0.50000 1.0000 + Mn Mn397 1.0 0.41667 0.58333 0.50000 1.0000 + Mn Mn398 1.0 0.45833 0.62500 0.50000 1.0000 + Mn Mn399 1.0 0.50000 0.66667 0.50000 1.0000 + Mn Mn400 1.0 0.54167 0.70833 0.50000 1.0000 + Mn Mn401 1.0 0.58333 0.75000 0.50000 1.0000 + Mn Mn402 1.0 0.62500 0.79167 0.50000 1.0000 + Mn Mn403 1.0 0.66667 0.83333 0.50000 1.0000 + Mn Mn404 1.0 0.70833 0.87500 0.50000 1.0000 + Mn Mn405 1.0 0.75000 0.91667 0.50000 1.0000 + Mn Mn406 1.0 0.79167 0.95833 0.50000 1.0000 + Mn Mn407 1.0 0.83333 0.00000 0.50000 1.0000 + Mn Mn408 1.0 0.87500 0.04167 0.50000 1.0000 + Mn Mn409 1.0 0.45833 0.54167 0.50000 1.0000 + Mn Mn410 1.0 0.50000 0.58333 0.50000 1.0000 + Mn Mn411 1.0 0.54167 0.62500 0.50000 1.0000 + Mn Mn412 1.0 0.58333 0.66667 0.50000 1.0000 + Mn Mn413 1.0 0.62500 0.70833 0.50000 1.0000 + Mn Mn414 1.0 0.66667 0.75000 0.50000 1.0000 + Mn Mn415 1.0 0.70833 0.79167 0.50000 1.0000 + Mn Mn416 1.0 0.75000 0.83333 0.50000 1.0000 + Mn Mn417 1.0 0.79167 0.87500 0.50000 1.0000 + Mn Mn418 1.0 0.83333 0.91667 0.50000 1.0000 + Mn Mn419 1.0 0.87500 0.95833 0.50000 1.0000 + Mn Mn420 1.0 0.91667 0.00000 0.50000 1.0000 + Mn Mn421 1.0 0.50000 0.50000 0.50000 1.0000 + Mn Mn422 1.0 0.54167 0.54167 0.50000 1.0000 + Mn Mn423 1.0 0.58333 0.58333 0.50000 1.0000 + Mn Mn424 1.0 0.62500 0.62500 0.50000 1.0000 + Mn Mn425 1.0 0.66667 0.66667 0.50000 1.0000 + Mn Mn426 1.0 0.70833 0.70833 0.50000 1.0000 + Mn Mn427 1.0 0.75000 0.75000 0.50000 1.0000 + Mn Mn428 1.0 0.79167 0.79167 0.50000 1.0000 + Mn Mn429 1.0 0.83333 0.83333 0.50000 1.0000 + Mn Mn430 1.0 0.87500 0.87500 0.50000 1.0000 + Mn Mn431 1.0 0.91667 0.91667 0.50000 1.0000 + Mn Mn432 1.0 0.95833 0.95833 0.50000 1.0000 + O O1 1.0 0.06944 0.00000 0.66161 1.0000 + O O2 1.0 0.11111 0.04167 0.66161 1.0000 + O O3 1.0 0.15278 0.08333 0.66161 1.0000 + O O4 1.0 0.19444 0.12500 0.66161 1.0000 + O O5 1.0 0.23611 0.16667 0.66161 1.0000 + O O6 1.0 0.27778 0.20833 0.66161 1.0000 + O O7 1.0 0.31944 0.25000 0.66161 1.0000 + O O8 1.0 0.36111 0.29167 0.66161 1.0000 + O O9 1.0 0.40278 0.33333 0.66161 1.0000 + O O10 1.0 0.44444 0.37500 0.66161 1.0000 + O O11 1.0 0.48611 0.41667 0.66161 1.0000 + O O12 1.0 0.52778 0.45833 0.66161 1.0000 + O O13 1.0 0.11111 0.95833 0.66161 1.0000 + O O14 1.0 0.15278 0.00000 0.66161 1.0000 + O O15 1.0 0.19444 0.04167 0.66161 1.0000 + O O16 1.0 0.23611 0.08333 0.66161 1.0000 + O O17 1.0 0.27778 0.12500 0.66161 1.0000 + O O18 1.0 0.31944 0.16667 0.66161 1.0000 + O O19 1.0 0.36111 0.20833 0.66161 1.0000 + O O20 1.0 0.40278 0.25000 0.66161 1.0000 + O O21 1.0 0.44444 0.29167 0.66161 1.0000 + O O22 1.0 0.48611 0.33333 0.66161 1.0000 + O O23 1.0 0.52778 0.37500 0.66161 1.0000 + O O24 1.0 0.56944 0.41667 0.66161 1.0000 + O O25 1.0 0.15278 0.91667 0.66161 1.0000 + O O26 1.0 0.19444 0.95833 0.66161 1.0000 + O O27 1.0 0.23611 0.00000 0.66161 1.0000 + O O28 1.0 0.27778 0.04167 0.66161 1.0000 + O O29 1.0 0.31944 0.08333 0.66161 1.0000 + O O30 1.0 0.36111 0.12500 0.66161 1.0000 + O O31 1.0 0.40278 0.16667 0.66161 1.0000 + O O32 1.0 0.44444 0.20833 0.66161 1.0000 + O O33 1.0 0.48611 0.25000 0.66161 1.0000 + O O34 1.0 0.52778 0.29167 0.66161 1.0000 + O O35 1.0 0.56944 0.33333 0.66161 1.0000 + O O36 1.0 0.61111 0.37500 0.66161 1.0000 + O O37 1.0 0.19444 0.87500 0.66161 1.0000 + O O38 1.0 0.23611 0.91667 0.66161 1.0000 + O O39 1.0 0.27778 0.95833 0.66161 1.0000 + O O40 1.0 0.31944 0.00000 0.66161 1.0000 + O O41 1.0 0.36111 0.04167 0.66161 1.0000 + O O42 1.0 0.40278 0.08333 0.66161 1.0000 + O O43 1.0 0.44444 0.12500 0.66161 1.0000 + O O44 1.0 0.48611 0.16667 0.66161 1.0000 + O O45 1.0 0.52778 0.20833 0.66161 1.0000 + O O46 1.0 0.56944 0.25000 0.66161 1.0000 + O O47 1.0 0.61111 0.29167 0.66161 1.0000 + O O48 1.0 0.65278 0.33333 0.66161 1.0000 + O O49 1.0 0.23611 0.83333 0.66161 1.0000 + O O50 1.0 0.27778 0.87500 0.66161 1.0000 + O O51 1.0 0.31944 0.91667 0.66161 1.0000 + O O52 1.0 0.36111 0.95833 0.66161 1.0000 + O O53 1.0 0.40278 0.00000 0.66161 1.0000 + O O54 1.0 0.44444 0.04167 0.66161 1.0000 + O O55 1.0 0.48611 0.08333 0.66161 1.0000 + O O56 1.0 0.52778 0.12500 0.66161 1.0000 + O O57 1.0 0.56944 0.16667 0.66161 1.0000 + O O58 1.0 0.61111 0.20833 0.66161 1.0000 + O O59 1.0 0.65278 0.25000 0.66161 1.0000 + O O60 1.0 0.69444 0.29167 0.66161 1.0000 + O O61 1.0 0.27778 0.79167 0.66161 1.0000 + O O62 1.0 0.31944 0.83333 0.66161 1.0000 + O O63 1.0 0.36111 0.87500 0.66161 1.0000 + O O64 1.0 0.40278 0.91667 0.66161 1.0000 + O O65 1.0 0.44444 0.95833 0.66161 1.0000 + O O66 1.0 0.48611 0.00000 0.66161 1.0000 + O O67 1.0 0.52778 0.04167 0.66161 1.0000 + O O68 1.0 0.56944 0.08333 0.66161 1.0000 + O 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0.33772 1.0000 + O O1066 1.0 0.59746 0.20833 0.33772 1.0000 + O O1067 1.0 0.63913 0.25000 0.33772 1.0000 + O O1068 1.0 0.68080 0.29167 0.33772 1.0000 + O O1069 1.0 0.26413 0.79167 0.33772 1.0000 + O O1070 1.0 0.30580 0.83333 0.33772 1.0000 + O O1071 1.0 0.34746 0.87500 0.33772 1.0000 + O O1072 1.0 0.38913 0.91667 0.33772 1.0000 + O O1073 1.0 0.43080 0.95833 0.33772 1.0000 + O O1074 1.0 0.47246 0.00000 0.33772 1.0000 + O O1075 1.0 0.51413 0.04167 0.33772 1.0000 + O O1076 1.0 0.55580 0.08333 0.33772 1.0000 + O O1077 1.0 0.59746 0.12500 0.33772 1.0000 + O O1078 1.0 0.63913 0.16667 0.33772 1.0000 + O O1079 1.0 0.68080 0.20833 0.33772 1.0000 + O O1080 1.0 0.72246 0.25000 0.33772 1.0000 + O O1081 1.0 0.30580 0.75000 0.33772 1.0000 + O O1082 1.0 0.34746 0.79167 0.33772 1.0000 + O O1083 1.0 0.38913 0.83333 0.33772 1.0000 + O O1084 1.0 0.43080 0.87500 0.33772 1.0000 + O O1085 1.0 0.47246 0.91667 0.33772 1.0000 + O O1086 1.0 0.51413 0.95833 0.33772 1.0000 + O O1087 1.0 0.55580 0.00000 0.33772 1.0000 + O O1088 1.0 0.59746 0.04167 0.33772 1.0000 + O O1089 1.0 0.63913 0.08333 0.33772 1.0000 + O O1090 1.0 0.68080 0.12500 0.33772 1.0000 + O O1091 1.0 0.72246 0.16667 0.33772 1.0000 + O O1092 1.0 0.76413 0.20833 0.33772 1.0000 + O O1093 1.0 0.34746 0.70833 0.33772 1.0000 + O O1094 1.0 0.38913 0.75000 0.33772 1.0000 + O O1095 1.0 0.43080 0.79167 0.33772 1.0000 + O O1096 1.0 0.47246 0.83333 0.33772 1.0000 + O O1097 1.0 0.51413 0.87500 0.33772 1.0000 + O O1098 1.0 0.55580 0.91667 0.33772 1.0000 + O O1099 1.0 0.59746 0.95833 0.33772 1.0000 + O O1100 1.0 0.63913 0.00000 0.33772 1.0000 + O O1101 1.0 0.68080 0.04167 0.33772 1.0000 + O O1102 1.0 0.72246 0.08333 0.33772 1.0000 + O O1103 1.0 0.76413 0.12500 0.33772 1.0000 + O O1104 1.0 0.80580 0.16667 0.33772 1.0000 + O O1105 1.0 0.38913 0.66667 0.33772 1.0000 + O O1106 1.0 0.43080 0.70833 0.33772 1.0000 + O O1107 1.0 0.47246 0.75000 0.33772 1.0000 + O O1108 1.0 0.51413 0.79167 0.33772 1.0000 + O O1109 1.0 0.55580 0.83333 0.33772 1.0000 + O O1110 1.0 0.59746 0.87500 0.33772 1.0000 + O O1111 1.0 0.63913 0.91667 0.33772 1.0000 + O O1112 1.0 0.68080 0.95833 0.33772 1.0000 + O O1113 1.0 0.72246 0.00000 0.33772 1.0000 + O O1114 1.0 0.76413 0.04167 0.33772 1.0000 + O O1115 1.0 0.80580 0.08333 0.33772 1.0000 + O O1116 1.0 0.84746 0.12500 0.33772 1.0000 + O O1117 1.0 0.43080 0.62500 0.33772 1.0000 + O O1118 1.0 0.47246 0.66667 0.33772 1.0000 + O O1119 1.0 0.51413 0.70833 0.33772 1.0000 + O O1120 1.0 0.55580 0.75000 0.33772 1.0000 + O O1121 1.0 0.59746 0.79167 0.33772 1.0000 + O O1122 1.0 0.63913 0.83333 0.33772 1.0000 + O O1123 1.0 0.68080 0.87500 0.33772 1.0000 + O O1124 1.0 0.72246 0.91667 0.33772 1.0000 + O O1125 1.0 0.76413 0.95833 0.33772 1.0000 + O O1126 1.0 0.80580 0.00000 0.33772 1.0000 + O O1127 1.0 0.84746 0.04167 0.33772 1.0000 + O O1128 1.0 0.88913 0.08333 0.33772 1.0000 + O O1129 1.0 0.47246 0.58333 0.33772 1.0000 + O O1130 1.0 0.51413 0.62500 0.33772 1.0000 + O O1131 1.0 0.55580 0.66667 0.33772 1.0000 + O O1132 1.0 0.59746 0.70833 0.33772 1.0000 + O O1133 1.0 0.63913 0.75000 0.33772 1.0000 + O O1134 1.0 0.68080 0.79167 0.33772 1.0000 + O O1135 1.0 0.72246 0.83333 0.33772 1.0000 + O O1136 1.0 0.76413 0.87500 0.33772 1.0000 + O O1137 1.0 0.80580 0.91667 0.33772 1.0000 + O O1138 1.0 0.84746 0.95833 0.33772 1.0000 + O O1139 1.0 0.88913 0.00000 0.33772 1.0000 + O O1140 1.0 0.93080 0.04167 0.33772 1.0000 + O O1141 1.0 0.51413 0.54167 0.33772 1.0000 + O O1142 1.0 0.55580 0.58333 0.33772 1.0000 + O O1143 1.0 0.59746 0.62500 0.33772 1.0000 + O O1144 1.0 0.63913 0.66667 0.33772 1.0000 + O O1145 1.0 0.68080 0.70833 0.33772 1.0000 + O O1146 1.0 0.72246 0.75000 0.33772 1.0000 + O O1147 1.0 0.76413 0.79167 0.33772 1.0000 + O O1148 1.0 0.80580 0.83333 0.33772 1.0000 + O O1149 1.0 0.84746 0.87500 0.33772 1.0000 + O O1150 1.0 0.88913 0.91667 0.33772 1.0000 + O O1151 1.0 0.93080 0.95833 0.33772 1.0000 + O O1152 1.0 0.97246 0.00000 0.33772 1.0000 + Ti Ti145 1.0 0.54167 0.50000 0.50000 1.0000 + Ti Ti146 1.0 0.58333 0.54167 0.50000 1.0000 + Ti Ti147 1.0 0.62500 0.58333 0.50000 1.0000 + Ti Ti148 1.0 0.66667 0.62500 0.50000 1.0000 + Ti Ti149 1.0 0.70833 0.66667 0.50000 1.0000 + Ti Ti150 1.0 0.75000 0.70833 0.50000 1.0000 + Ti Ti151 1.0 0.79167 0.75000 0.50000 1.0000 + Ti Ti152 1.0 0.83333 0.79167 0.50000 1.0000 + Ti Ti153 1.0 0.87500 0.83333 0.50000 1.0000 + Ti Ti154 1.0 0.91667 0.87500 0.50000 1.0000 + Ti Ti155 1.0 0.95833 0.91667 0.50000 1.0000 + Ti Ti156 1.0 0.00000 0.95833 0.50000 1.0000 + Ti Ti157 1.0 0.58333 0.45833 0.50000 1.0000 + Ti Ti158 1.0 0.62500 0.50000 0.50000 1.0000 + Ti Ti159 1.0 0.66667 0.54167 0.50000 1.0000 + Ti Ti160 1.0 0.70833 0.58333 0.50000 1.0000 + Ti Ti161 1.0 0.75000 0.62500 0.50000 1.0000 + Ti Ti162 1.0 0.79167 0.66667 0.50000 1.0000 + Ti Ti163 1.0 0.83333 0.70833 0.50000 1.0000 + Ti Ti164 1.0 0.87500 0.75000 0.50000 1.0000 + Ti Ti165 1.0 0.91667 0.79167 0.50000 1.0000 + Ti Ti166 1.0 0.95833 0.83333 0.50000 1.0000 + Ti Ti167 1.0 0.00000 0.87500 0.50000 1.0000 + Ti Ti168 1.0 0.04167 0.91667 0.50000 1.0000 + Ti Ti169 1.0 0.62500 0.41667 0.50000 1.0000 + Ti Ti170 1.0 0.66667 0.45833 0.50000 1.0000 + Ti Ti171 1.0 0.70833 0.50000 0.50000 1.0000 + Ti Ti172 1.0 0.75000 0.54167 0.50000 1.0000 + Ti Ti173 1.0 0.79167 0.58333 0.50000 1.0000 + Ti Ti174 1.0 0.83333 0.62500 0.50000 1.0000 + Ti Ti175 1.0 0.87500 0.66667 0.50000 1.0000 + Ti Ti176 1.0 0.91667 0.70833 0.50000 1.0000 + Ti Ti177 1.0 0.95833 0.75000 0.50000 1.0000 + Ti Ti178 1.0 0.00000 0.79167 0.50000 1.0000 + Ti Ti179 1.0 0.04167 0.83333 0.50000 1.0000 + Ti Ti180 1.0 0.08333 0.87500 0.50000 1.0000 + Ti Ti181 1.0 0.66667 0.37500 0.50000 1.0000 + Ti Ti182 1.0 0.70833 0.41667 0.50000 1.0000 + Ti Ti183 1.0 0.75000 0.45833 0.50000 1.0000 + Ti Ti184 1.0 0.79167 0.50000 0.50000 1.0000 + Ti Ti185 1.0 0.83333 0.54167 0.50000 1.0000 + Ti Ti186 1.0 0.87500 0.58333 0.50000 1.0000 + Ti Ti187 1.0 0.91667 0.62500 0.50000 1.0000 + Ti Ti188 1.0 0.95833 0.66667 0.50000 1.0000 + Ti Ti189 1.0 0.00000 0.70833 0.50000 1.0000 + Ti Ti190 1.0 0.04167 0.75000 0.50000 1.0000 + Ti Ti191 1.0 0.08333 0.79167 0.50000 1.0000 + Ti Ti192 1.0 0.12500 0.83333 0.50000 1.0000 + Ti Ti193 1.0 0.70833 0.33333 0.50000 1.0000 + Ti Ti194 1.0 0.75000 0.37500 0.50000 1.0000 + Ti Ti195 1.0 0.79167 0.41667 0.50000 1.0000 + Ti Ti196 1.0 0.83333 0.45833 0.50000 1.0000 + Ti Ti197 1.0 0.87500 0.50000 0.50000 1.0000 + Ti Ti198 1.0 0.91667 0.54167 0.50000 1.0000 + Ti Ti199 1.0 0.95833 0.58333 0.50000 1.0000 + Ti Ti200 1.0 0.00000 0.62500 0.50000 1.0000 + Ti Ti201 1.0 0.04167 0.66667 0.50000 1.0000 + Ti Ti202 1.0 0.08333 0.70833 0.50000 1.0000 + Ti Ti203 1.0 0.12500 0.75000 0.50000 1.0000 + Ti Ti204 1.0 0.16667 0.79167 0.50000 1.0000 + Ti Ti205 1.0 0.75000 0.29167 0.50000 1.0000 + Ti Ti206 1.0 0.79167 0.33333 0.50000 1.0000 + Ti Ti207 1.0 0.83333 0.37500 0.50000 1.0000 + Ti Ti208 1.0 0.87500 0.41667 0.50000 1.0000 + Ti Ti209 1.0 0.91667 0.45833 0.50000 1.0000 + Ti Ti210 1.0 0.95833 0.50000 0.50000 1.0000 + Ti Ti211 1.0 0.00000 0.54167 0.50000 1.0000 + Ti Ti212 1.0 0.04167 0.58333 0.50000 1.0000 + Ti Ti213 1.0 0.08333 0.62500 0.50000 1.0000 + Ti Ti214 1.0 0.12500 0.66667 0.50000 1.0000 + Ti Ti215 1.0 0.16667 0.70833 0.50000 1.0000 + Ti Ti216 1.0 0.20833 0.75000 0.50000 1.0000 + Ti Ti217 1.0 0.79167 0.25000 0.50000 1.0000 + Ti Ti218 1.0 0.83333 0.29167 0.50000 1.0000 + Ti Ti219 1.0 0.87500 0.33333 0.50000 1.0000 + Ti Ti220 1.0 0.91667 0.37500 0.50000 1.0000 + Ti Ti221 1.0 0.95833 0.41667 0.50000 1.0000 + Ti Ti222 1.0 0.00000 0.45833 0.50000 1.0000 + Ti Ti223 1.0 0.04167 0.50000 0.50000 1.0000 + Ti Ti224 1.0 0.08333 0.54167 0.50000 1.0000 + Ti Ti225 1.0 0.12500 0.58333 0.50000 1.0000 + Ti Ti226 1.0 0.16667 0.62500 0.50000 1.0000 + Ti Ti227 1.0 0.20833 0.66667 0.50000 1.0000 + Ti Ti228 1.0 0.25000 0.70833 0.50000 1.0000 + Ti Ti229 1.0 0.83333 0.20833 0.50000 1.0000 + Ti Ti230 1.0 0.87500 0.25000 0.50000 1.0000 + Ti Ti231 1.0 0.91667 0.29167 0.50000 1.0000 + Ti Ti232 1.0 0.95833 0.33333 0.50000 1.0000 + Ti Ti233 1.0 0.00000 0.37500 0.50000 1.0000 + Ti Ti234 1.0 0.04167 0.41667 0.50000 1.0000 + Ti Ti235 1.0 0.08333 0.45833 0.50000 1.0000 + Ti Ti236 1.0 0.12500 0.50000 0.50000 1.0000 + Ti Ti237 1.0 0.16667 0.54167 0.50000 1.0000 + Ti Ti238 1.0 0.20833 0.58333 0.50000 1.0000 + Ti Ti239 1.0 0.25000 0.62500 0.50000 1.0000 + Ti Ti240 1.0 0.29167 0.66667 0.50000 1.0000 + Ti Ti241 1.0 0.87500 0.16667 0.50000 1.0000 + Ti Ti242 1.0 0.91667 0.20833 0.50000 1.0000 + Ti Ti243 1.0 0.95833 0.25000 0.50000 1.0000 + Ti Ti244 1.0 0.00000 0.29167 0.50000 1.0000 + Ti Ti245 1.0 0.04167 0.33333 0.50000 1.0000 + Ti Ti246 1.0 0.08333 0.37500 0.50000 1.0000 + Ti Ti247 1.0 0.12500 0.41667 0.50000 1.0000 + Ti Ti248 1.0 0.16667 0.45833 0.50000 1.0000 + Ti Ti249 1.0 0.20833 0.50000 0.50000 1.0000 + Ti Ti250 1.0 0.25000 0.54167 0.50000 1.0000 + Ti Ti251 1.0 0.29167 0.58333 0.50000 1.0000 + Ti Ti252 1.0 0.33333 0.62500 0.50000 1.0000 + Ti Ti253 1.0 0.91667 0.12500 0.50000 1.0000 + Ti Ti254 1.0 0.95833 0.16667 0.50000 1.0000 + Ti Ti255 1.0 0.00000 0.20833 0.50000 1.0000 + Ti Ti256 1.0 0.04167 0.25000 0.50000 1.0000 + Ti Ti257 1.0 0.08333 0.29167 0.50000 1.0000 + Ti Ti258 1.0 0.12500 0.33333 0.50000 1.0000 + Ti Ti259 1.0 0.16667 0.37500 0.50000 1.0000 + Ti Ti260 1.0 0.20833 0.41667 0.50000 1.0000 + Ti Ti261 1.0 0.25000 0.45833 0.50000 1.0000 + Ti Ti262 1.0 0.29167 0.50000 0.50000 1.0000 + Ti Ti263 1.0 0.33333 0.54167 0.50000 1.0000 + Ti Ti264 1.0 0.37500 0.58333 0.50000 1.0000 + Ti Ti265 1.0 0.95833 0.08333 0.50000 1.0000 + Ti Ti266 1.0 0.00000 0.12500 0.50000 1.0000 + Ti Ti267 1.0 0.04167 0.16667 0.50000 1.0000 + Ti Ti268 1.0 0.08333 0.20833 0.50000 1.0000 + Ti Ti269 1.0 0.12500 0.25000 0.50000 1.0000 + Ti Ti270 1.0 0.16667 0.29167 0.50000 1.0000 + Ti Ti271 1.0 0.20833 0.33333 0.50000 1.0000 + Ti Ti272 1.0 0.25000 0.37500 0.50000 1.0000 + Ti Ti273 1.0 0.29167 0.41667 0.50000 1.0000 + Ti Ti274 1.0 0.33333 0.45833 0.50000 1.0000 + Ti Ti275 1.0 0.37500 0.50000 0.50000 1.0000 + Ti Ti276 1.0 0.41667 0.54167 0.50000 1.0000 + Ti Ti277 1.0 0.00000 0.04167 0.50000 1.0000 + Ti Ti278 1.0 0.04167 0.08333 0.50000 1.0000 + Ti Ti279 1.0 0.08333 0.12500 0.50000 1.0000 + Ti Ti280 1.0 0.12500 0.16667 0.50000 1.0000 + Ti Ti281 1.0 0.16667 0.20833 0.50000 1.0000 + Ti Ti282 1.0 0.20833 0.25000 0.50000 1.0000 + Ti Ti283 1.0 0.25000 0.29167 0.50000 1.0000 + Ti Ti284 1.0 0.29167 0.33333 0.50000 1.0000 + Ti Ti285 1.0 0.33333 0.37500 0.50000 1.0000 + Ti Ti286 1.0 0.37500 0.41667 0.50000 1.0000 + Ti Ti287 1.0 0.41667 0.45833 0.50000 1.0000 + Ti Ti288 1.0 0.45833 0.50000 0.50000 1.0000 + Mn Mn433 1.0 0.52083 0.47917 0.50000 1.0000 + Mn Mn434 1.0 0.56250 0.52083 0.50000 1.0000 + Mn Mn435 1.0 0.60417 0.56250 0.50000 1.0000 + Mn Mn436 1.0 0.64583 0.60417 0.50000 1.0000 + Mn Mn437 1.0 0.68750 0.64583 0.50000 1.0000 + Mn Mn438 1.0 0.72917 0.68750 0.50000 1.0000 + Mn Mn439 1.0 0.77083 0.72917 0.50000 1.0000 + Mn Mn440 1.0 0.81250 0.77083 0.50000 1.0000 + Mn Mn441 1.0 0.85417 0.81250 0.50000 1.0000 + Mn Mn442 1.0 0.89583 0.85417 0.50000 1.0000 + Mn Mn443 1.0 0.93750 0.89583 0.50000 1.0000 + Mn Mn444 1.0 0.97917 0.93750 0.50000 1.0000 + Mn Mn445 1.0 0.56250 0.43750 0.50000 1.0000 + Mn Mn446 1.0 0.60417 0.47917 0.50000 1.0000 + Mn Mn447 1.0 0.64583 0.52083 0.50000 1.0000 + Mn Mn448 1.0 0.68750 0.56250 0.50000 1.0000 + Mn Mn449 1.0 0.72917 0.60417 0.50000 1.0000 + Mn Mn450 1.0 0.77083 0.64583 0.50000 1.0000 + Mn Mn451 1.0 0.81250 0.68750 0.50000 1.0000 + Mn Mn452 1.0 0.85417 0.72917 0.50000 1.0000 + Mn Mn453 1.0 0.89583 0.77083 0.50000 1.0000 + Mn Mn454 1.0 0.93750 0.81250 0.50000 1.0000 + Mn Mn455 1.0 0.97917 0.85417 0.50000 1.0000 + Mn Mn456 1.0 0.02083 0.89583 0.50000 1.0000 + Mn Mn457 1.0 0.60417 0.39583 0.50000 1.0000 + Mn Mn458 1.0 0.64583 0.43750 0.50000 1.0000 + Mn Mn459 1.0 0.68750 0.47917 0.50000 1.0000 + Mn Mn460 1.0 0.72917 0.52083 0.50000 1.0000 + Mn Mn461 1.0 0.77083 0.56250 0.50000 1.0000 + Mn Mn462 1.0 0.81250 0.60417 0.50000 1.0000 + Mn Mn463 1.0 0.85417 0.64583 0.50000 1.0000 + Mn Mn464 1.0 0.89583 0.68750 0.50000 1.0000 + Mn Mn465 1.0 0.93750 0.72917 0.50000 1.0000 + Mn Mn466 1.0 0.97917 0.77083 0.50000 1.0000 + Mn Mn467 1.0 0.02083 0.81250 0.50000 1.0000 + Mn Mn468 1.0 0.06250 0.85417 0.50000 1.0000 + Mn Mn469 1.0 0.64583 0.35417 0.50000 1.0000 + Mn Mn470 1.0 0.68750 0.39583 0.50000 1.0000 + Mn Mn471 1.0 0.72917 0.43750 0.50000 1.0000 + Mn Mn472 1.0 0.77083 0.47917 0.50000 1.0000 + Mn Mn473 1.0 0.81250 0.52083 0.50000 1.0000 + Mn Mn474 1.0 0.85417 0.56250 0.50000 1.0000 + Mn Mn475 1.0 0.89583 0.60417 0.50000 1.0000 + Mn Mn476 1.0 0.93750 0.64583 0.50000 1.0000 + Mn Mn477 1.0 0.97917 0.68750 0.50000 1.0000 + Mn Mn478 1.0 0.02083 0.72917 0.50000 1.0000 + Mn Mn479 1.0 0.06250 0.77083 0.50000 1.0000 + Mn Mn480 1.0 0.10417 0.81250 0.50000 1.0000 + Mn Mn481 1.0 0.68750 0.31250 0.50000 1.0000 + Mn Mn482 1.0 0.72917 0.35417 0.50000 1.0000 + Mn Mn483 1.0 0.77083 0.39583 0.50000 1.0000 + Mn Mn484 1.0 0.81250 0.43750 0.50000 1.0000 + Mn Mn485 1.0 0.85417 0.47917 0.50000 1.0000 + Mn Mn486 1.0 0.89583 0.52083 0.50000 1.0000 + Mn Mn487 1.0 0.93750 0.56250 0.50000 1.0000 + Mn Mn488 1.0 0.97917 0.60417 0.50000 1.0000 + Mn Mn489 1.0 0.02083 0.64583 0.50000 1.0000 + Mn Mn490 1.0 0.06250 0.68750 0.50000 1.0000 + Mn Mn491 1.0 0.10417 0.72917 0.50000 1.0000 + Mn Mn492 1.0 0.14583 0.77083 0.50000 1.0000 + Mn Mn493 1.0 0.72917 0.27083 0.50000 1.0000 + Mn Mn494 1.0 0.77083 0.31250 0.50000 1.0000 + Mn Mn495 1.0 0.81250 0.35417 0.50000 1.0000 + Mn Mn496 1.0 0.85417 0.39583 0.50000 1.0000 + Mn Mn497 1.0 0.89583 0.43750 0.50000 1.0000 + Mn Mn498 1.0 0.93750 0.47917 0.50000 1.0000 + Mn Mn499 1.0 0.97917 0.52083 0.50000 1.0000 + Mn Mn500 1.0 0.02083 0.56250 0.50000 1.0000 + Mn Mn501 1.0 0.06250 0.60417 0.50000 1.0000 + Mn Mn502 1.0 0.10417 0.64583 0.50000 1.0000 + Mn Mn503 1.0 0.14583 0.68750 0.50000 1.0000 + Mn Mn504 1.0 0.18750 0.72917 0.50000 1.0000 + Mn Mn505 1.0 0.77083 0.22917 0.50000 1.0000 + Mn Mn506 1.0 0.81250 0.27083 0.50000 1.0000 + Mn Mn507 1.0 0.85417 0.31250 0.50000 1.0000 + Mn Mn508 1.0 0.89583 0.35417 0.50000 1.0000 + Mn Mn509 1.0 0.93750 0.39583 0.50000 1.0000 + Mn Mn510 1.0 0.97917 0.43750 0.50000 1.0000 + Mn Mn511 1.0 0.02083 0.47917 0.50000 1.0000 + Mn Mn512 1.0 0.06250 0.52083 0.50000 1.0000 + Mn Mn513 1.0 0.10417 0.56250 0.50000 1.0000 + Mn Mn514 1.0 0.14583 0.60417 0.50000 1.0000 + Mn Mn515 1.0 0.18750 0.64583 0.50000 1.0000 + Mn Mn516 1.0 0.22917 0.68750 0.50000 1.0000 + Mn Mn517 1.0 0.81250 0.18750 0.50000 1.0000 + Mn Mn518 1.0 0.85417 0.22917 0.50000 1.0000 + Mn Mn519 1.0 0.89583 0.27083 0.50000 1.0000 + Mn Mn520 1.0 0.93750 0.31250 0.50000 1.0000 + Mn Mn521 1.0 0.97917 0.35417 0.50000 1.0000 + Mn Mn522 1.0 0.02083 0.39583 0.50000 1.0000 + Mn Mn523 1.0 0.06250 0.43750 0.50000 1.0000 + Mn Mn524 1.0 0.10417 0.47917 0.50000 1.0000 + Mn Mn525 1.0 0.14583 0.52083 0.50000 1.0000 + Mn Mn526 1.0 0.18750 0.56250 0.50000 1.0000 + Mn Mn527 1.0 0.22917 0.60417 0.50000 1.0000 + Mn Mn528 1.0 0.27083 0.64583 0.50000 1.0000 + Mn Mn529 1.0 0.85417 0.14583 0.50000 1.0000 + Mn Mn530 1.0 0.89583 0.18750 0.50000 1.0000 + Mn Mn531 1.0 0.93750 0.22917 0.50000 1.0000 + Mn Mn532 1.0 0.97917 0.27083 0.50000 1.0000 + Mn Mn533 1.0 0.02083 0.31250 0.50000 1.0000 + Mn Mn534 1.0 0.06250 0.35417 0.50000 1.0000 + Mn Mn535 1.0 0.10417 0.39583 0.50000 1.0000 + Mn Mn536 1.0 0.14583 0.43750 0.50000 1.0000 + Mn Mn537 1.0 0.18750 0.47917 0.50000 1.0000 + Mn Mn538 1.0 0.22917 0.52083 0.50000 1.0000 + Mn Mn539 1.0 0.27083 0.56250 0.50000 1.0000 + Mn Mn540 1.0 0.31250 0.60417 0.50000 1.0000 + Mn Mn541 1.0 0.89583 0.10417 0.50000 1.0000 + Mn Mn542 1.0 0.93750 0.14583 0.50000 1.0000 + Mn Mn543 1.0 0.97917 0.18750 0.50000 1.0000 + Mn Mn544 1.0 0.02083 0.22917 0.50000 1.0000 + Mn Mn545 1.0 0.06250 0.27083 0.50000 1.0000 + Mn Mn546 1.0 0.10417 0.31250 0.50000 1.0000 + Mn Mn547 1.0 0.14583 0.35417 0.50000 1.0000 + Mn Mn548 1.0 0.18750 0.39583 0.50000 1.0000 + Mn Mn549 1.0 0.22917 0.43750 0.50000 1.0000 + Mn Mn550 1.0 0.27083 0.47917 0.50000 1.0000 + Mn Mn551 1.0 0.31250 0.52083 0.50000 1.0000 + Mn Mn552 1.0 0.35417 0.56250 0.50000 1.0000 + Mn Mn553 1.0 0.93750 0.06250 0.50000 1.0000 + Mn Mn554 1.0 0.97917 0.10417 0.50000 1.0000 + Mn Mn555 1.0 0.02083 0.14583 0.50000 1.0000 + Mn Mn556 1.0 0.06250 0.18750 0.50000 1.0000 + Mn Mn557 1.0 0.10417 0.22917 0.50000 1.0000 + Mn Mn558 1.0 0.14583 0.27083 0.50000 1.0000 + Mn Mn559 1.0 0.18750 0.31250 0.50000 1.0000 + Mn Mn560 1.0 0.22917 0.35417 0.50000 1.0000 + Mn Mn561 1.0 0.27083 0.39583 0.50000 1.0000 + Mn Mn562 1.0 0.31250 0.43750 0.50000 1.0000 + Mn Mn563 1.0 0.35417 0.47917 0.50000 1.0000 + Mn Mn564 1.0 0.39583 0.52083 0.50000 1.0000 + Mn Mn565 1.0 0.97917 0.02083 0.50000 1.0000 + Mn Mn566 1.0 0.02083 0.06250 0.50000 1.0000 + Mn Mn567 1.0 0.06250 0.10417 0.50000 1.0000 + Mn Mn568 1.0 0.10417 0.14583 0.50000 1.0000 + Mn Mn569 1.0 0.14583 0.18750 0.50000 1.0000 + Mn Mn570 1.0 0.18750 0.22917 0.50000 1.0000 + Mn Mn571 1.0 0.22917 0.27083 0.50000 1.0000 + Mn Mn572 1.0 0.27083 0.31250 0.50000 1.0000 + Mn Mn573 1.0 0.31250 0.35417 0.50000 1.0000 + Mn Mn574 1.0 0.35417 0.39583 0.50000 1.0000 + Mn Mn575 1.0 0.39583 0.43750 0.50000 1.0000 + Mn Mn576 1.0 0.43750 0.47917 0.50000 1.0000 + Mn Mn577 1.0 0.56250 0.47917 0.50000 1.0000 + Mn Mn578 1.0 0.60417 0.52083 0.50000 1.0000 + Mn Mn579 1.0 0.64583 0.56250 0.50000 1.0000 + Mn Mn580 1.0 0.68750 0.60417 0.50000 1.0000 + Mn Mn581 1.0 0.72917 0.64583 0.50000 1.0000 + Mn Mn582 1.0 0.77083 0.68750 0.50000 1.0000 + Mn Mn583 1.0 0.81250 0.72917 0.50000 1.0000 + Mn Mn584 1.0 0.85417 0.77083 0.50000 1.0000 + Mn Mn585 1.0 0.89583 0.81250 0.50000 1.0000 + Mn Mn586 1.0 0.93750 0.85417 0.50000 1.0000 + Mn Mn587 1.0 0.97917 0.89583 0.50000 1.0000 + Mn Mn588 1.0 0.02083 0.93750 0.50000 1.0000 + Mn Mn589 1.0 0.60417 0.43750 0.50000 1.0000 + Mn Mn590 1.0 0.64583 0.47917 0.50000 1.0000 + Mn Mn591 1.0 0.68750 0.52083 0.50000 1.0000 + Mn Mn592 1.0 0.72917 0.56250 0.50000 1.0000 + Mn Mn593 1.0 0.77083 0.60417 0.50000 1.0000 + Mn Mn594 1.0 0.81250 0.64583 0.50000 1.0000 + Mn Mn595 1.0 0.85417 0.68750 0.50000 1.0000 + Mn Mn596 1.0 0.89583 0.72917 0.50000 1.0000 + Mn Mn597 1.0 0.93750 0.77083 0.50000 1.0000 + Mn Mn598 1.0 0.97917 0.81250 0.50000 1.0000 + Mn Mn599 1.0 0.02083 0.85417 0.50000 1.0000 + Mn Mn600 1.0 0.06250 0.89583 0.50000 1.0000 + Mn Mn601 1.0 0.64583 0.39583 0.50000 1.0000 + Mn Mn602 1.0 0.68750 0.43750 0.50000 1.0000 + Mn Mn603 1.0 0.72917 0.47917 0.50000 1.0000 + Mn Mn604 1.0 0.77083 0.52083 0.50000 1.0000 + Mn Mn605 1.0 0.81250 0.56250 0.50000 1.0000 + Mn Mn606 1.0 0.85417 0.60417 0.50000 1.0000 + Mn Mn607 1.0 0.89583 0.64583 0.50000 1.0000 + Mn Mn608 1.0 0.93750 0.68750 0.50000 1.0000 + Mn Mn609 1.0 0.97917 0.72917 0.50000 1.0000 + Mn Mn610 1.0 0.02083 0.77083 0.50000 1.0000 + Mn Mn611 1.0 0.06250 0.81250 0.50000 1.0000 + Mn Mn612 1.0 0.10417 0.85417 0.50000 1.0000 + Mn Mn613 1.0 0.68750 0.35417 0.50000 1.0000 + Mn Mn614 1.0 0.72917 0.39583 0.50000 1.0000 + Mn Mn615 1.0 0.77083 0.43750 0.50000 1.0000 + Mn Mn616 1.0 0.81250 0.47917 0.50000 1.0000 + Mn Mn617 1.0 0.85417 0.52083 0.50000 1.0000 + Mn Mn618 1.0 0.89583 0.56250 0.50000 1.0000 + Mn Mn619 1.0 0.93750 0.60417 0.50000 1.0000 + Mn Mn620 1.0 0.97917 0.64583 0.50000 1.0000 + Mn Mn621 1.0 0.02083 0.68750 0.50000 1.0000 + Mn Mn622 1.0 0.06250 0.72917 0.50000 1.0000 + Mn Mn623 1.0 0.10417 0.77083 0.50000 1.0000 + Mn Mn624 1.0 0.14583 0.81250 0.50000 1.0000 + Mn Mn625 1.0 0.72917 0.31250 0.50000 1.0000 + Mn Mn626 1.0 0.77083 0.35417 0.50000 1.0000 + Mn Mn627 1.0 0.81250 0.39583 0.50000 1.0000 + Mn Mn628 1.0 0.85417 0.43750 0.50000 1.0000 + Mn Mn629 1.0 0.89583 0.47917 0.50000 1.0000 + Mn Mn630 1.0 0.93750 0.52083 0.50000 1.0000 + Mn Mn631 1.0 0.97917 0.56250 0.50000 1.0000 + Mn Mn632 1.0 0.02083 0.60417 0.50000 1.0000 + Mn Mn633 1.0 0.06250 0.64583 0.50000 1.0000 + Mn Mn634 1.0 0.10417 0.68750 0.50000 1.0000 + Mn Mn635 1.0 0.14583 0.72917 0.50000 1.0000 + Mn Mn636 1.0 0.18750 0.77083 0.50000 1.0000 + Mn Mn637 1.0 0.77083 0.27083 0.50000 1.0000 + Mn Mn638 1.0 0.81250 0.31250 0.50000 1.0000 + Mn Mn639 1.0 0.85417 0.35417 0.50000 1.0000 + Mn Mn640 1.0 0.89583 0.39583 0.50000 1.0000 + Mn Mn641 1.0 0.93750 0.43750 0.50000 1.0000 + Mn Mn642 1.0 0.97917 0.47917 0.50000 1.0000 + Mn Mn643 1.0 0.02083 0.52083 0.50000 1.0000 + Mn Mn644 1.0 0.06250 0.56250 0.50000 1.0000 + Mn Mn645 1.0 0.10417 0.60417 0.50000 1.0000 + Mn Mn646 1.0 0.14583 0.64583 0.50000 1.0000 + Mn Mn647 1.0 0.18750 0.68750 0.50000 1.0000 + Mn Mn648 1.0 0.22917 0.72917 0.50000 1.0000 + Mn Mn649 1.0 0.81250 0.22917 0.50000 1.0000 + Mn Mn650 1.0 0.85417 0.27083 0.50000 1.0000 + Mn Mn651 1.0 0.89583 0.31250 0.50000 1.0000 + Mn Mn652 1.0 0.93750 0.35417 0.50000 1.0000 + Mn Mn653 1.0 0.97917 0.39583 0.50000 1.0000 + Mn Mn654 1.0 0.02083 0.43750 0.50000 1.0000 + Mn Mn655 1.0 0.06250 0.47917 0.50000 1.0000 + Mn Mn656 1.0 0.10417 0.52083 0.50000 1.0000 + Mn Mn657 1.0 0.14583 0.56250 0.50000 1.0000 + Mn Mn658 1.0 0.18750 0.60417 0.50000 1.0000 + Mn Mn659 1.0 0.22917 0.64583 0.50000 1.0000 + Mn Mn660 1.0 0.27083 0.68750 0.50000 1.0000 + Mn Mn661 1.0 0.85417 0.18750 0.50000 1.0000 + Mn Mn662 1.0 0.89583 0.22917 0.50000 1.0000 + Mn Mn663 1.0 0.93750 0.27083 0.50000 1.0000 + Mn Mn664 1.0 0.97917 0.31250 0.50000 1.0000 + Mn Mn665 1.0 0.02083 0.35417 0.50000 1.0000 + Mn Mn666 1.0 0.06250 0.39583 0.50000 1.0000 + Mn Mn667 1.0 0.10417 0.43750 0.50000 1.0000 + Mn Mn668 1.0 0.14583 0.47917 0.50000 1.0000 + Mn Mn669 1.0 0.18750 0.52083 0.50000 1.0000 + Mn Mn670 1.0 0.22917 0.56250 0.50000 1.0000 + Mn Mn671 1.0 0.27083 0.60417 0.50000 1.0000 + Mn Mn672 1.0 0.31250 0.64583 0.50000 1.0000 + Mn Mn673 1.0 0.89583 0.14583 0.50000 1.0000 + Mn Mn674 1.0 0.93750 0.18750 0.50000 1.0000 + Mn Mn675 1.0 0.97917 0.22917 0.50000 1.0000 + Mn Mn676 1.0 0.02083 0.27083 0.50000 1.0000 + Mn Mn677 1.0 0.06250 0.31250 0.50000 1.0000 + Mn Mn678 1.0 0.10417 0.35417 0.50000 1.0000 + Mn Mn679 1.0 0.14583 0.39583 0.50000 1.0000 + Mn Mn680 1.0 0.18750 0.43750 0.50000 1.0000 + Mn Mn681 1.0 0.22917 0.47917 0.50000 1.0000 + Mn Mn682 1.0 0.27083 0.52083 0.50000 1.0000 + Mn Mn683 1.0 0.31250 0.56250 0.50000 1.0000 + Mn Mn684 1.0 0.35417 0.60417 0.50000 1.0000 + Mn Mn685 1.0 0.93750 0.10417 0.50000 1.0000 + Mn Mn686 1.0 0.97917 0.14583 0.50000 1.0000 + Mn Mn687 1.0 0.02083 0.18750 0.50000 1.0000 + Mn Mn688 1.0 0.06250 0.22917 0.50000 1.0000 + Mn Mn689 1.0 0.10417 0.27083 0.50000 1.0000 + Mn Mn690 1.0 0.14583 0.31250 0.50000 1.0000 + Mn Mn691 1.0 0.18750 0.35417 0.50000 1.0000 + Mn Mn692 1.0 0.22917 0.39583 0.50000 1.0000 + Mn Mn693 1.0 0.27083 0.43750 0.50000 1.0000 + Mn Mn694 1.0 0.31250 0.47917 0.50000 1.0000 + Mn Mn695 1.0 0.35417 0.52083 0.50000 1.0000 + Mn Mn696 1.0 0.39583 0.56250 0.50000 1.0000 + Mn Mn697 1.0 0.97917 0.06250 0.50000 1.0000 + Mn Mn698 1.0 0.02083 0.10417 0.50000 1.0000 + Mn Mn699 1.0 0.06250 0.14583 0.50000 1.0000 + Mn Mn700 1.0 0.10417 0.18750 0.50000 1.0000 + Mn Mn701 1.0 0.14583 0.22917 0.50000 1.0000 + Mn Mn702 1.0 0.18750 0.27083 0.50000 1.0000 + Mn Mn703 1.0 0.22917 0.31250 0.50000 1.0000 + Mn Mn704 1.0 0.27083 0.35417 0.50000 1.0000 + Mn Mn705 1.0 0.31250 0.39583 0.50000 1.0000 + Mn Mn706 1.0 0.35417 0.43750 0.50000 1.0000 + Mn Mn707 1.0 0.39583 0.47917 0.50000 1.0000 + Mn Mn708 1.0 0.43750 0.52083 0.50000 1.0000 + Mn Mn709 1.0 0.02083 0.02083 0.50000 1.0000 + Mn Mn710 1.0 0.06250 0.06250 0.50000 1.0000 + Mn Mn711 1.0 0.10417 0.10417 0.50000 1.0000 + Mn Mn712 1.0 0.14583 0.14583 0.50000 1.0000 + Mn Mn713 1.0 0.18750 0.18750 0.50000 1.0000 + Mn Mn714 1.0 0.22917 0.22917 0.50000 1.0000 + Mn Mn715 1.0 0.27083 0.27083 0.50000 1.0000 + Mn Mn716 1.0 0.31250 0.31250 0.50000 1.0000 + Mn Mn717 1.0 0.35417 0.35417 0.50000 1.0000 + Mn Mn718 1.0 0.39583 0.39583 0.50000 1.0000 + Mn Mn719 1.0 0.43750 0.43750 0.50000 1.0000 + Mn Mn720 1.0 0.47917 0.47917 0.50000 1.0000 + Mn Mn721 1.0 0.54167 0.45833 0.50000 1.0000 + Mn Mn722 1.0 0.58333 0.50000 0.50000 1.0000 + Mn Mn723 1.0 0.62500 0.54167 0.50000 1.0000 + Mn Mn724 1.0 0.66667 0.58333 0.50000 1.0000 + Mn Mn725 1.0 0.70833 0.62500 0.50000 1.0000 + Mn Mn726 1.0 0.75000 0.66667 0.50000 1.0000 + Mn Mn727 1.0 0.79167 0.70833 0.50000 1.0000 + Mn Mn728 1.0 0.83333 0.75000 0.50000 1.0000 + Mn Mn729 1.0 0.87500 0.79167 0.50000 1.0000 + Mn Mn730 1.0 0.91667 0.83333 0.50000 1.0000 + Mn Mn731 1.0 0.95833 0.87500 0.50000 1.0000 + Mn Mn732 1.0 1.00000 0.91667 0.50000 1.0000 + Mn Mn733 1.0 0.58333 0.41667 0.50000 1.0000 + Mn Mn734 1.0 0.62500 0.45833 0.50000 1.0000 + Mn Mn735 1.0 0.66667 0.50000 0.50000 1.0000 + Mn Mn736 1.0 0.70833 0.54167 0.50000 1.0000 + Mn Mn737 1.0 0.75000 0.58333 0.50000 1.0000 + Mn Mn738 1.0 0.79167 0.62500 0.50000 1.0000 + Mn Mn739 1.0 0.83333 0.66667 0.50000 1.0000 + Mn Mn740 1.0 0.87500 0.70833 0.50000 1.0000 + Mn Mn741 1.0 0.91667 0.75000 0.50000 1.0000 + Mn Mn742 1.0 0.95833 0.79167 0.50000 1.0000 + Mn Mn743 1.0 1.00000 0.83333 0.50000 1.0000 + Mn Mn744 1.0 0.04167 0.87500 0.50000 1.0000 + Mn Mn745 1.0 0.62500 0.37500 0.50000 1.0000 + Mn Mn746 1.0 0.66667 0.41667 0.50000 1.0000 + Mn Mn747 1.0 0.70833 0.45833 0.50000 1.0000 + Mn Mn748 1.0 0.75000 0.50000 0.50000 1.0000 + Mn Mn749 1.0 0.79167 0.54167 0.50000 1.0000 + Mn Mn750 1.0 0.83333 0.58333 0.50000 1.0000 + Mn Mn751 1.0 0.87500 0.62500 0.50000 1.0000 + Mn Mn752 1.0 0.91667 0.66667 0.50000 1.0000 + Mn Mn753 1.0 0.95833 0.70833 0.50000 1.0000 + Mn Mn754 1.0 1.00000 0.75000 0.50000 1.0000 + Mn Mn755 1.0 0.04167 0.79167 0.50000 1.0000 + Mn Mn756 1.0 0.08333 0.83333 0.50000 1.0000 + Mn Mn757 1.0 0.66667 0.33333 0.50000 1.0000 + Mn Mn758 1.0 0.70833 0.37500 0.50000 1.0000 + Mn Mn759 1.0 0.75000 0.41667 0.50000 1.0000 + Mn Mn760 1.0 0.79167 0.45833 0.50000 1.0000 + Mn Mn761 1.0 0.83333 0.50000 0.50000 1.0000 + Mn Mn762 1.0 0.87500 0.54167 0.50000 1.0000 + Mn Mn763 1.0 0.91667 0.58333 0.50000 1.0000 + Mn Mn764 1.0 0.95833 0.62500 0.50000 1.0000 + Mn Mn765 1.0 1.00000 0.66667 0.50000 1.0000 + Mn Mn766 1.0 0.04167 0.70833 0.50000 1.0000 + Mn Mn767 1.0 0.08333 0.75000 0.50000 1.0000 + Mn Mn768 1.0 0.12500 0.79167 0.50000 1.0000 + Mn Mn769 1.0 0.70833 0.29167 0.50000 1.0000 + Mn Mn770 1.0 0.75000 0.33333 0.50000 1.0000 + Mn Mn771 1.0 0.79167 0.37500 0.50000 1.0000 + Mn Mn772 1.0 0.83333 0.41667 0.50000 1.0000 + Mn Mn773 1.0 0.87500 0.45833 0.50000 1.0000 + Mn Mn774 1.0 0.91667 0.50000 0.50000 1.0000 + Mn Mn775 1.0 0.95833 0.54167 0.50000 1.0000 + Mn Mn776 1.0 1.00000 0.58333 0.50000 1.0000 + Mn Mn777 1.0 0.04167 0.62500 0.50000 1.0000 + Mn Mn778 1.0 0.08333 0.66667 0.50000 1.0000 + Mn Mn779 1.0 0.12500 0.70833 0.50000 1.0000 + Mn Mn780 1.0 0.16667 0.75000 0.50000 1.0000 + Mn Mn781 1.0 0.75000 0.25000 0.50000 1.0000 + Mn Mn782 1.0 0.79167 0.29167 0.50000 1.0000 + Mn Mn783 1.0 0.83333 0.33333 0.50000 1.0000 + Mn Mn784 1.0 0.87500 0.37500 0.50000 1.0000 + Mn Mn785 1.0 0.91667 0.41667 0.50000 1.0000 + Mn Mn786 1.0 0.95833 0.45833 0.50000 1.0000 + Mn Mn787 1.0 1.00000 0.50000 0.50000 1.0000 + Mn Mn788 1.0 0.04167 0.54167 0.50000 1.0000 + Mn Mn789 1.0 0.08333 0.58333 0.50000 1.0000 + Mn Mn790 1.0 0.12500 0.62500 0.50000 1.0000 + Mn Mn791 1.0 0.16667 0.66667 0.50000 1.0000 + Mn Mn792 1.0 0.20833 0.70833 0.50000 1.0000 + Mn Mn793 1.0 0.79167 0.20833 0.50000 1.0000 + Mn Mn794 1.0 0.83333 0.25000 0.50000 1.0000 + Mn Mn795 1.0 0.87500 0.29167 0.50000 1.0000 + Mn Mn796 1.0 0.91667 0.33333 0.50000 1.0000 + Mn Mn797 1.0 0.95833 0.37500 0.50000 1.0000 + Mn Mn798 1.0 1.00000 0.41667 0.50000 1.0000 + Mn Mn799 1.0 0.04167 0.45833 0.50000 1.0000 + Mn Mn800 1.0 0.08333 0.50000 0.50000 1.0000 + Mn Mn801 1.0 0.12500 0.54167 0.50000 1.0000 + Mn Mn802 1.0 0.16667 0.58333 0.50000 1.0000 + Mn Mn803 1.0 0.20833 0.62500 0.50000 1.0000 + Mn Mn804 1.0 0.25000 0.66667 0.50000 1.0000 + Mn Mn805 1.0 0.83333 0.16667 0.50000 1.0000 + Mn Mn806 1.0 0.87500 0.20833 0.50000 1.0000 + Mn Mn807 1.0 0.91667 0.25000 0.50000 1.0000 + Mn Mn808 1.0 0.95833 0.29167 0.50000 1.0000 + Mn Mn809 1.0 1.00000 0.33333 0.50000 1.0000 + Mn Mn810 1.0 0.04167 0.37500 0.50000 1.0000 + Mn Mn811 1.0 0.08333 0.41667 0.50000 1.0000 + Mn Mn812 1.0 0.12500 0.45833 0.50000 1.0000 + Mn Mn813 1.0 0.16667 0.50000 0.50000 1.0000 + Mn Mn814 1.0 0.20833 0.54167 0.50000 1.0000 + Mn Mn815 1.0 0.25000 0.58333 0.50000 1.0000 + Mn Mn816 1.0 0.29167 0.62500 0.50000 1.0000 + Mn Mn817 1.0 0.87500 0.12500 0.50000 1.0000 + Mn Mn818 1.0 0.91667 0.16667 0.50000 1.0000 + Mn Mn819 1.0 0.95833 0.20833 0.50000 1.0000 + Mn Mn820 1.0 1.00000 0.25000 0.50000 1.0000 + Mn Mn821 1.0 0.04167 0.29167 0.50000 1.0000 + Mn Mn822 1.0 0.08333 0.33333 0.50000 1.0000 + Mn Mn823 1.0 0.12500 0.37500 0.50000 1.0000 + Mn Mn824 1.0 0.16667 0.41667 0.50000 1.0000 + Mn Mn825 1.0 0.20833 0.45833 0.50000 1.0000 + Mn Mn826 1.0 0.25000 0.50000 0.50000 1.0000 + Mn Mn827 1.0 0.29167 0.54167 0.50000 1.0000 + Mn Mn828 1.0 0.33333 0.58333 0.50000 1.0000 + Mn Mn829 1.0 0.91667 0.08333 0.50000 1.0000 + Mn Mn830 1.0 0.95833 0.12500 0.50000 1.0000 + Mn Mn831 1.0 1.00000 0.16667 0.50000 1.0000 + Mn Mn832 1.0 0.04167 0.20833 0.50000 1.0000 + Mn Mn833 1.0 0.08333 0.25000 0.50000 1.0000 + Mn Mn834 1.0 0.12500 0.29167 0.50000 1.0000 + Mn Mn835 1.0 0.16667 0.33333 0.50000 1.0000 + Mn Mn836 1.0 0.20833 0.37500 0.50000 1.0000 + Mn Mn837 1.0 0.25000 0.41667 0.50000 1.0000 + Mn Mn838 1.0 0.29167 0.45833 0.50000 1.0000 + Mn Mn839 1.0 0.33333 0.50000 0.50000 1.0000 + Mn Mn840 1.0 0.37500 0.54167 0.50000 1.0000 + Mn Mn841 1.0 0.95833 0.04167 0.50000 1.0000 + Mn Mn842 1.0 1.00000 0.08333 0.50000 1.0000 + Mn Mn843 1.0 0.04167 0.12500 0.50000 1.0000 + Mn Mn844 1.0 0.08333 0.16667 0.50000 1.0000 + Mn Mn845 1.0 0.12500 0.20833 0.50000 1.0000 + Mn Mn846 1.0 0.16667 0.25000 0.50000 1.0000 + Mn Mn847 1.0 0.20833 0.29167 0.50000 1.0000 + Mn Mn848 1.0 0.25000 0.33333 0.50000 1.0000 + Mn Mn849 1.0 0.29167 0.37500 0.50000 1.0000 + Mn Mn850 1.0 0.33333 0.41667 0.50000 1.0000 + Mn Mn851 1.0 0.37500 0.45833 0.50000 1.0000 + Mn Mn852 1.0 0.41667 0.50000 0.50000 1.0000 + Mn Mn853 1.0 1.00000 0.00000 0.50000 1.0000 + Mn Mn854 1.0 0.04167 0.04167 0.50000 1.0000 + Mn Mn855 1.0 0.08333 0.08333 0.50000 1.0000 + Mn Mn856 1.0 0.12500 0.12500 0.50000 1.0000 + Mn Mn857 1.0 0.16667 0.16667 0.50000 1.0000 + Mn Mn858 1.0 0.20833 0.20833 0.50000 1.0000 + Mn Mn859 1.0 0.25000 0.25000 0.50000 1.0000 + Mn Mn860 1.0 0.29167 0.29167 0.50000 1.0000 + Mn Mn861 1.0 0.33333 0.33333 0.50000 1.0000 + Mn Mn862 1.0 0.37500 0.37500 0.50000 1.0000 + Mn Mn863 1.0 0.41667 0.41667 0.50000 1.0000 + Mn Mn864 1.0 0.45833 0.45833 0.50000 1.0000 + O O1153 1.0 0.56944 0.50000 0.66161 1.0000 + O O1154 1.0 0.61111 0.54167 0.66161 1.0000 + O O1155 1.0 0.65278 0.58333 0.66161 1.0000 + O O1156 1.0 0.69444 0.62500 0.66161 1.0000 + O O1157 1.0 0.73611 0.66667 0.66161 1.0000 + O O1158 1.0 0.77778 0.70833 0.66161 1.0000 + O O1159 1.0 0.81944 0.75000 0.66161 1.0000 + O O1160 1.0 0.86111 0.79167 0.66161 1.0000 + O O1161 1.0 0.90278 0.83333 0.66161 1.0000 + O O1162 1.0 0.94444 0.87500 0.66161 1.0000 + O O1163 1.0 0.98611 0.91667 0.66161 1.0000 + O O1164 1.0 0.02778 0.95833 0.66161 1.0000 + O O1165 1.0 0.61111 0.45833 0.66161 1.0000 + O O1166 1.0 0.65278 0.50000 0.66161 1.0000 + O O1167 1.0 0.69444 0.54167 0.66161 1.0000 + O O1168 1.0 0.73611 0.58333 0.66161 1.0000 + O O1169 1.0 0.77778 0.62500 0.66161 1.0000 + O O1170 1.0 0.81944 0.66667 0.66161 1.0000 + O O1171 1.0 0.86111 0.70833 0.66161 1.0000 + O O1172 1.0 0.90278 0.75000 0.66161 1.0000 + O O1173 1.0 0.94444 0.79167 0.66161 1.0000 + O O1174 1.0 0.98611 0.83333 0.66161 1.0000 + O O1175 1.0 0.02778 0.87500 0.66161 1.0000 + O O1176 1.0 0.06944 0.91667 0.66161 1.0000 + O O1177 1.0 0.65278 0.41667 0.66161 1.0000 + O O1178 1.0 0.69444 0.45833 0.66161 1.0000 + O O1179 1.0 0.73611 0.50000 0.66161 1.0000 + O O1180 1.0 0.77778 0.54167 0.66161 1.0000 + O O1181 1.0 0.81944 0.58333 0.66161 1.0000 + O O1182 1.0 0.86111 0.62500 0.66161 1.0000 + O O1183 1.0 0.90278 0.66667 0.66161 1.0000 + O O1184 1.0 0.94444 0.70833 0.66161 1.0000 + O O1185 1.0 0.98611 0.75000 0.66161 1.0000 + O O1186 1.0 0.02778 0.79167 0.66161 1.0000 + O O1187 1.0 0.06944 0.83333 0.66161 1.0000 + O O1188 1.0 0.11111 0.87500 0.66161 1.0000 + O O1189 1.0 0.69444 0.37500 0.66161 1.0000 + O O1190 1.0 0.73611 0.41667 0.66161 1.0000 + O O1191 1.0 0.77778 0.45833 0.66161 1.0000 + O O1192 1.0 0.81944 0.50000 0.66161 1.0000 + O O1193 1.0 0.86111 0.54167 0.66161 1.0000 + O O1194 1.0 0.90278 0.58333 0.66161 1.0000 + O O1195 1.0 0.94444 0.62500 0.66161 1.0000 + O O1196 1.0 0.98611 0.66667 0.66161 1.0000 + O O1197 1.0 0.02778 0.70833 0.66161 1.0000 + O O1198 1.0 0.06944 0.75000 0.66161 1.0000 + O O1199 1.0 0.11111 0.79167 0.66161 1.0000 + O O1200 1.0 0.15278 0.83333 0.66161 1.0000 + O O1201 1.0 0.73611 0.33333 0.66161 1.0000 + O O1202 1.0 0.77778 0.37500 0.66161 1.0000 + O O1203 1.0 0.81944 0.41667 0.66161 1.0000 + O O1204 1.0 0.86111 0.45833 0.66161 1.0000 + O O1205 1.0 0.90278 0.50000 0.66161 1.0000 + O O1206 1.0 0.94444 0.54167 0.66161 1.0000 + O O1207 1.0 0.98611 0.58333 0.66161 1.0000 + O O1208 1.0 0.02778 0.62500 0.66161 1.0000 + O O1209 1.0 0.06944 0.66667 0.66161 1.0000 + O O1210 1.0 0.11111 0.70833 0.66161 1.0000 + O O1211 1.0 0.15278 0.75000 0.66161 1.0000 + O O1212 1.0 0.19444 0.79167 0.66161 1.0000 + O O1213 1.0 0.77778 0.29167 0.66161 1.0000 + O O1214 1.0 0.81944 0.33333 0.66161 1.0000 + O O1215 1.0 0.86111 0.37500 0.66161 1.0000 + O O1216 1.0 0.90278 0.41667 0.66161 1.0000 + O O1217 1.0 0.94444 0.45833 0.66161 1.0000 + O O1218 1.0 0.98611 0.50000 0.66161 1.0000 + O O1219 1.0 0.02778 0.54167 0.66161 1.0000 + O O1220 1.0 0.06944 0.58333 0.66161 1.0000 + O O1221 1.0 0.11111 0.62500 0.66161 1.0000 + O O1222 1.0 0.15278 0.66667 0.66161 1.0000 + O O1223 1.0 0.19444 0.70833 0.66161 1.0000 + O O1224 1.0 0.23611 0.75000 0.66161 1.0000 + O O1225 1.0 0.81944 0.25000 0.66161 1.0000 + O O1226 1.0 0.86111 0.29167 0.66161 1.0000 + O O1227 1.0 0.90278 0.33333 0.66161 1.0000 + O O1228 1.0 0.94444 0.37500 0.66161 1.0000 + O O1229 1.0 0.98611 0.41667 0.66161 1.0000 + O O1230 1.0 0.02778 0.45833 0.66161 1.0000 + O O1231 1.0 0.06944 0.50000 0.66161 1.0000 + O O1232 1.0 0.11111 0.54167 0.66161 1.0000 + O O1233 1.0 0.15278 0.58333 0.66161 1.0000 + O O1234 1.0 0.19444 0.62500 0.66161 1.0000 + O O1235 1.0 0.23611 0.66667 0.66161 1.0000 + O O1236 1.0 0.27778 0.70833 0.66161 1.0000 + O O1237 1.0 0.86111 0.20833 0.66161 1.0000 + O O1238 1.0 0.90278 0.25000 0.66161 1.0000 + O O1239 1.0 0.94444 0.29167 0.66161 1.0000 + O O1240 1.0 0.98611 0.33333 0.66161 1.0000 + O O1241 1.0 0.02778 0.37500 0.66161 1.0000 + O O1242 1.0 0.06944 0.41667 0.66161 1.0000 + O O1243 1.0 0.11111 0.45833 0.66161 1.0000 + O O1244 1.0 0.15278 0.50000 0.66161 1.0000 + O O1245 1.0 0.19444 0.54167 0.66161 1.0000 + O O1246 1.0 0.23611 0.58333 0.66161 1.0000 + O O1247 1.0 0.27778 0.62500 0.66161 1.0000 + O O1248 1.0 0.31944 0.66667 0.66161 1.0000 + O O1249 1.0 0.90278 0.16667 0.66161 1.0000 + O O1250 1.0 0.94444 0.20833 0.66161 1.0000 + O O1251 1.0 0.98611 0.25000 0.66161 1.0000 + O O1252 1.0 0.02778 0.29167 0.66161 1.0000 + O O1253 1.0 0.06944 0.33333 0.66161 1.0000 + O O1254 1.0 0.11111 0.37500 0.66161 1.0000 + O O1255 1.0 0.15278 0.41667 0.66161 1.0000 + O O1256 1.0 0.19444 0.45833 0.66161 1.0000 + O O1257 1.0 0.23611 0.50000 0.66161 1.0000 + O O1258 1.0 0.27778 0.54167 0.66161 1.0000 + O O1259 1.0 0.31944 0.58333 0.66161 1.0000 + O O1260 1.0 0.36111 0.62500 0.66161 1.0000 + O O1261 1.0 0.94444 0.12500 0.66161 1.0000 + O O1262 1.0 0.98611 0.16667 0.66161 1.0000 + O O1263 1.0 0.02778 0.20833 0.66161 1.0000 + O O1264 1.0 0.06944 0.25000 0.66161 1.0000 + O O1265 1.0 0.11111 0.29167 0.66161 1.0000 + O O1266 1.0 0.15278 0.33333 0.66161 1.0000 + O O1267 1.0 0.19444 0.37500 0.66161 1.0000 + O O1268 1.0 0.23611 0.41667 0.66161 1.0000 + O O1269 1.0 0.27778 0.45833 0.66161 1.0000 + O O1270 1.0 0.31944 0.50000 0.66161 1.0000 + O O1271 1.0 0.36111 0.54167 0.66161 1.0000 + O O1272 1.0 0.40278 0.58333 0.66161 1.0000 + O O1273 1.0 0.98611 0.08333 0.66161 1.0000 + O O1274 1.0 0.02778 0.12500 0.66161 1.0000 + O O1275 1.0 0.06944 0.16667 0.66161 1.0000 + O O1276 1.0 0.11111 0.20833 0.66161 1.0000 + O O1277 1.0 0.15278 0.25000 0.66161 1.0000 + O O1278 1.0 0.19444 0.29167 0.66161 1.0000 + O O1279 1.0 0.23611 0.33333 0.66161 1.0000 + O O1280 1.0 0.27778 0.37500 0.66161 1.0000 + O O1281 1.0 0.31944 0.41667 0.66161 1.0000 + O O1282 1.0 0.36111 0.45833 0.66161 1.0000 + O O1283 1.0 0.40278 0.50000 0.66161 1.0000 + O O1284 1.0 0.44444 0.54167 0.66161 1.0000 + O O1285 1.0 0.02778 0.04167 0.66161 1.0000 + O O1286 1.0 0.06944 0.08333 0.66161 1.0000 + O O1287 1.0 0.11111 0.12500 0.66161 1.0000 + O O1288 1.0 0.15278 0.16667 0.66161 1.0000 + O O1289 1.0 0.19444 0.20833 0.66161 1.0000 + O O1290 1.0 0.23611 0.25000 0.66161 1.0000 + O O1291 1.0 0.27778 0.29167 0.66161 1.0000 + O O1292 1.0 0.31944 0.33333 0.66161 1.0000 + O O1293 1.0 0.36111 0.37500 0.66161 1.0000 + O O1294 1.0 0.40278 0.41667 0.66161 1.0000 + O O1295 1.0 0.44444 0.45833 0.66161 1.0000 + O O1296 1.0 0.48611 0.50000 0.66161 1.0000 + O O1297 1.0 0.54873 0.47880 0.66229 1.0000 + O O1298 1.0 0.59040 0.52047 0.66229 1.0000 + O O1299 1.0 0.63207 0.56214 0.66229 1.0000 + O O1300 1.0 0.67373 0.60380 0.66229 1.0000 + O O1301 1.0 0.71540 0.64547 0.66229 1.0000 + O O1302 1.0 0.75707 0.68714 0.66229 1.0000 + O O1303 1.0 0.79873 0.72880 0.66229 1.0000 + O O1304 1.0 0.84040 0.77047 0.66229 1.0000 + O O1305 1.0 0.88207 0.81214 0.66229 1.0000 + O O1306 1.0 0.92373 0.85380 0.66229 1.0000 + O O1307 1.0 0.96540 0.89547 0.66229 1.0000 + O O1308 1.0 0.00707 0.93714 0.66229 1.0000 + O O1309 1.0 0.59040 0.43714 0.66229 1.0000 + O O1310 1.0 0.63207 0.47880 0.66229 1.0000 + O O1311 1.0 0.67373 0.52047 0.66229 1.0000 + O O1312 1.0 0.71540 0.56214 0.66229 1.0000 + O O1313 1.0 0.75707 0.60380 0.66229 1.0000 + O O1314 1.0 0.79873 0.64547 0.66229 1.0000 + O O1315 1.0 0.84040 0.68714 0.66229 1.0000 + O O1316 1.0 0.88207 0.72880 0.66229 1.0000 + O O1317 1.0 0.92373 0.77047 0.66229 1.0000 + O O1318 1.0 0.96540 0.81214 0.66229 1.0000 + O O1319 1.0 0.00707 0.85380 0.66229 1.0000 + O O1320 1.0 0.04873 0.89547 0.66229 1.0000 + O O1321 1.0 0.63207 0.39547 0.66229 1.0000 + O O1322 1.0 0.67373 0.43714 0.66229 1.0000 + O O1323 1.0 0.71540 0.47880 0.66229 1.0000 + O O1324 1.0 0.75707 0.52047 0.66229 1.0000 + O O1325 1.0 0.79873 0.56214 0.66229 1.0000 + O O1326 1.0 0.84040 0.60380 0.66229 1.0000 + O O1327 1.0 0.88207 0.64547 0.66229 1.0000 + O O1328 1.0 0.92373 0.68714 0.66229 1.0000 + O O1329 1.0 0.96540 0.72880 0.66229 1.0000 + O O1330 1.0 0.00707 0.77047 0.66229 1.0000 + O O1331 1.0 0.04873 0.81214 0.66229 1.0000 + O O1332 1.0 0.09040 0.85380 0.66229 1.0000 + O O1333 1.0 0.67373 0.35380 0.66229 1.0000 + O O1334 1.0 0.71540 0.39547 0.66229 1.0000 + O O1335 1.0 0.75707 0.43714 0.66229 1.0000 + O O1336 1.0 0.79873 0.47880 0.66229 1.0000 + O O1337 1.0 0.84040 0.52047 0.66229 1.0000 + O O1338 1.0 0.88207 0.56214 0.66229 1.0000 + O O1339 1.0 0.92373 0.60380 0.66229 1.0000 + O O1340 1.0 0.96540 0.64547 0.66229 1.0000 + O O1341 1.0 0.00707 0.68714 0.66229 1.0000 + O O1342 1.0 0.04873 0.72880 0.66229 1.0000 + O O1343 1.0 0.09040 0.77047 0.66229 1.0000 + O O1344 1.0 0.13207 0.81214 0.66229 1.0000 + O O1345 1.0 0.71540 0.31214 0.66229 1.0000 + O O1346 1.0 0.75707 0.35380 0.66229 1.0000 + O O1347 1.0 0.79873 0.39547 0.66229 1.0000 + O O1348 1.0 0.84040 0.43714 0.66229 1.0000 + O O1349 1.0 0.88207 0.47880 0.66229 1.0000 + O O1350 1.0 0.92373 0.52047 0.66229 1.0000 + O O1351 1.0 0.96540 0.56214 0.66229 1.0000 + O O1352 1.0 0.00707 0.60380 0.66229 1.0000 + O O1353 1.0 0.04873 0.64547 0.66229 1.0000 + O O1354 1.0 0.09040 0.68714 0.66229 1.0000 + O O1355 1.0 0.13207 0.72880 0.66229 1.0000 + O O1356 1.0 0.17373 0.77047 0.66229 1.0000 + O O1357 1.0 0.75707 0.27047 0.66229 1.0000 + O O1358 1.0 0.79873 0.31214 0.66229 1.0000 + O O1359 1.0 0.84040 0.35380 0.66229 1.0000 + O O1360 1.0 0.88207 0.39547 0.66229 1.0000 + O O1361 1.0 0.92373 0.43714 0.66229 1.0000 + O O1362 1.0 0.96540 0.47880 0.66229 1.0000 + O O1363 1.0 0.00707 0.52047 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O2296 1.0 0.13913 0.16667 0.33772 1.0000 + O O2297 1.0 0.18080 0.20833 0.33772 1.0000 + O O2298 1.0 0.22246 0.25000 0.33772 1.0000 + O O2299 1.0 0.26413 0.29167 0.33772 1.0000 + O O2300 1.0 0.30580 0.33333 0.33772 1.0000 + O O2301 1.0 0.34746 0.37500 0.33772 1.0000 + O O2302 1.0 0.38913 0.41667 0.33772 1.0000 + O O2303 1.0 0.43080 0.45833 0.33772 1.0000 + O O2304 1.0 0.47246 0.50000 0.33772 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-4367_supercell_12x12x1.cif b/tier3/cif_file/orthogonal_2dm-4367_supercell_12x12x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..3c45a7a957764d8765a61f5ba16d5470d3f2a53f --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-4367_supercell_12x12x1.cif @@ -0,0 +1,3481 @@ +data_image0 +_chemical_formula_structural Mn432Cr144O1152Mn432Cr144O1152 +_chemical_formula_sum "Mn864 Cr288 O2304" +_cell_length_a 121.491 +_cell_length_b 70.1401 +_cell_length_c 5.91708 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Mn Mn1 1.0 0.99288 0.06266 0.50020 1.0000 + Mn Mn2 1.0 0.95121 0.10433 0.50020 1.0000 + Mn Mn3 1.0 0.90954 0.14600 0.50020 1.0000 + Mn Mn4 1.0 0.86788 0.18766 0.50020 1.0000 + Mn Mn5 1.0 0.82621 0.22933 0.50020 1.0000 + Mn Mn6 1.0 0.78454 0.27100 0.50020 1.0000 + Mn Mn7 1.0 0.74288 0.31266 0.50020 1.0000 + Mn Mn8 1.0 0.70121 0.35433 0.50020 1.0000 + Mn Mn9 1.0 0.65954 0.39600 0.50020 1.0000 + Mn Mn10 1.0 0.61788 0.43766 0.50020 1.0000 + Mn Mn11 1.0 0.57621 0.47933 0.50020 1.0000 + Mn Mn12 1.0 0.53454 0.52100 0.50020 1.0000 + Mn Mn13 1.0 0.03454 0.10433 0.50020 1.0000 + Mn Mn14 1.0 0.99288 0.14600 0.50020 1.0000 + Mn Mn15 1.0 0.95121 0.18766 0.50020 1.0000 + Mn Mn16 1.0 0.90954 0.22933 0.50020 1.0000 + Mn Mn17 1.0 0.86788 0.27100 0.50020 1.0000 + Mn Mn18 1.0 0.82621 0.31266 0.50020 1.0000 + Mn Mn19 1.0 0.78454 0.35433 0.50020 1.0000 + Mn Mn20 1.0 0.74288 0.39600 0.50020 1.0000 + Mn Mn21 1.0 0.70121 0.43766 0.50020 1.0000 + Mn Mn22 1.0 0.65954 0.47933 0.50020 1.0000 + Mn Mn23 1.0 0.61788 0.52100 0.50020 1.0000 + Mn Mn24 1.0 0.57621 0.56266 0.50020 1.0000 + Mn Mn25 1.0 0.07621 0.14600 0.50020 1.0000 + Mn Mn26 1.0 0.03454 0.18766 0.50020 1.0000 + Mn Mn27 1.0 0.99288 0.22933 0.50020 1.0000 + Mn Mn28 1.0 0.95121 0.27100 0.50020 1.0000 + Mn Mn29 1.0 0.90954 0.31266 0.50020 1.0000 + Mn Mn30 1.0 0.86788 0.35433 0.50020 1.0000 + Mn Mn31 1.0 0.82621 0.39600 0.50020 1.0000 + Mn Mn32 1.0 0.78454 0.43766 0.50020 1.0000 + Mn Mn33 1.0 0.74288 0.47933 0.50020 1.0000 + Mn Mn34 1.0 0.70121 0.52100 0.50020 1.0000 + Mn Mn35 1.0 0.65954 0.56266 0.50020 1.0000 + Mn Mn36 1.0 0.61788 0.60433 0.50020 1.0000 + Mn Mn37 1.0 0.11788 0.18766 0.50020 1.0000 + Mn Mn38 1.0 0.07621 0.22933 0.50020 1.0000 + Mn Mn39 1.0 0.03454 0.27100 0.50020 1.0000 + Mn Mn40 1.0 0.99288 0.31266 0.50020 1.0000 + Mn Mn41 1.0 0.95121 0.35433 0.50020 1.0000 + Mn Mn42 1.0 0.90954 0.39600 0.50020 1.0000 + Mn Mn43 1.0 0.86788 0.43766 0.50020 1.0000 + Mn Mn44 1.0 0.82621 0.47933 0.50020 1.0000 + Mn Mn45 1.0 0.78454 0.52100 0.50020 1.0000 + Mn Mn46 1.0 0.74288 0.56266 0.50020 1.0000 + Mn Mn47 1.0 0.70121 0.60433 0.50020 1.0000 + Mn Mn48 1.0 0.65954 0.64600 0.50020 1.0000 + Mn Mn49 1.0 0.15954 0.22933 0.50020 1.0000 + Mn Mn50 1.0 0.11788 0.27100 0.50020 1.0000 + Mn Mn51 1.0 0.07621 0.31266 0.50020 1.0000 + Mn Mn52 1.0 0.03454 0.35433 0.50020 1.0000 + Mn Mn53 1.0 0.99288 0.39600 0.50020 1.0000 + Mn Mn54 1.0 0.95121 0.43766 0.50020 1.0000 + Mn Mn55 1.0 0.90954 0.47933 0.50020 1.0000 + Mn Mn56 1.0 0.86788 0.52100 0.50020 1.0000 + Mn Mn57 1.0 0.82621 0.56266 0.50020 1.0000 + Mn Mn58 1.0 0.78454 0.60433 0.50020 1.0000 + Mn Mn59 1.0 0.74288 0.64600 0.50020 1.0000 + Mn Mn60 1.0 0.70121 0.68766 0.50020 1.0000 + Mn Mn61 1.0 0.20121 0.27100 0.50020 1.0000 + Mn Mn62 1.0 0.15954 0.31266 0.50020 1.0000 + Mn Mn63 1.0 0.11788 0.35433 0.50020 1.0000 + Mn Mn64 1.0 0.07621 0.39600 0.50020 1.0000 + Mn Mn65 1.0 0.03454 0.43766 0.50020 1.0000 + Mn Mn66 1.0 0.99288 0.47933 0.50020 1.0000 + Mn Mn67 1.0 0.95121 0.52100 0.50020 1.0000 + Mn Mn68 1.0 0.90954 0.56266 0.50020 1.0000 + Mn Mn69 1.0 0.86788 0.60433 0.50020 1.0000 + Mn Mn70 1.0 0.82621 0.64600 0.50020 1.0000 + Mn Mn71 1.0 0.78454 0.68766 0.50020 1.0000 + Mn Mn72 1.0 0.74288 0.72933 0.50020 1.0000 + Mn Mn73 1.0 0.24288 0.31266 0.50020 1.0000 + Mn Mn74 1.0 0.20121 0.35433 0.50020 1.0000 + Mn Mn75 1.0 0.15954 0.39600 0.50020 1.0000 + Mn Mn76 1.0 0.11788 0.43766 0.50020 1.0000 + Mn Mn77 1.0 0.07621 0.47933 0.50020 1.0000 + Mn Mn78 1.0 0.03454 0.52100 0.50020 1.0000 + Mn Mn79 1.0 0.99288 0.56266 0.50020 1.0000 + Mn Mn80 1.0 0.95121 0.60433 0.50020 1.0000 + Mn Mn81 1.0 0.90954 0.64600 0.50020 1.0000 + Mn Mn82 1.0 0.86788 0.68766 0.50020 1.0000 + Mn Mn83 1.0 0.82621 0.72933 0.50020 1.0000 + Mn Mn84 1.0 0.78454 0.77100 0.50020 1.0000 + Mn Mn85 1.0 0.28454 0.35433 0.50020 1.0000 + Mn Mn86 1.0 0.24288 0.39600 0.50020 1.0000 + Mn Mn87 1.0 0.20121 0.43766 0.50020 1.0000 + Mn Mn88 1.0 0.15954 0.47933 0.50020 1.0000 + Mn Mn89 1.0 0.11788 0.52100 0.50020 1.0000 + Mn Mn90 1.0 0.07621 0.56266 0.50020 1.0000 + Mn Mn91 1.0 0.03454 0.60433 0.50020 1.0000 + Mn Mn92 1.0 0.99288 0.64600 0.50020 1.0000 + Mn Mn93 1.0 0.95121 0.68766 0.50020 1.0000 + Mn Mn94 1.0 0.90954 0.72933 0.50020 1.0000 + Mn Mn95 1.0 0.86788 0.77100 0.50020 1.0000 + Mn Mn96 1.0 0.82621 0.81266 0.50020 1.0000 + Mn Mn97 1.0 0.32621 0.39600 0.50020 1.0000 + Mn Mn98 1.0 0.28454 0.43766 0.50020 1.0000 + Mn Mn99 1.0 0.24288 0.47933 0.50020 1.0000 + Mn Mn100 1.0 0.20121 0.52100 0.50020 1.0000 + Mn Mn101 1.0 0.15954 0.56266 0.50020 1.0000 + Mn Mn102 1.0 0.11788 0.60433 0.50020 1.0000 + Mn Mn103 1.0 0.07621 0.64600 0.50020 1.0000 + Mn Mn104 1.0 0.03454 0.68766 0.50020 1.0000 + Mn Mn105 1.0 0.99288 0.72933 0.50020 1.0000 + Mn Mn106 1.0 0.95121 0.77100 0.50020 1.0000 + Mn Mn107 1.0 0.90954 0.81266 0.50020 1.0000 + Mn Mn108 1.0 0.86788 0.85433 0.50020 1.0000 + Mn Mn109 1.0 0.36788 0.43766 0.50020 1.0000 + Mn Mn110 1.0 0.32621 0.47933 0.50020 1.0000 + Mn Mn111 1.0 0.28454 0.52100 0.50020 1.0000 + Mn Mn112 1.0 0.24288 0.56266 0.50020 1.0000 + Mn Mn113 1.0 0.20121 0.60433 0.50020 1.0000 + Mn Mn114 1.0 0.15954 0.64600 0.50020 1.0000 + Mn Mn115 1.0 0.11788 0.68766 0.50020 1.0000 + Mn Mn116 1.0 0.07621 0.72933 0.50020 1.0000 + Mn Mn117 1.0 0.03454 0.77100 0.50020 1.0000 + Mn Mn118 1.0 0.99288 0.81266 0.50020 1.0000 + Mn Mn119 1.0 0.95121 0.85433 0.50020 1.0000 + Mn Mn120 1.0 0.90954 0.89600 0.50020 1.0000 + Mn Mn121 1.0 0.40954 0.47933 0.50020 1.0000 + Mn Mn122 1.0 0.36788 0.52100 0.50020 1.0000 + Mn Mn123 1.0 0.32621 0.56266 0.50020 1.0000 + Mn Mn124 1.0 0.28454 0.60433 0.50020 1.0000 + Mn Mn125 1.0 0.24288 0.64600 0.50020 1.0000 + Mn Mn126 1.0 0.20121 0.68766 0.50020 1.0000 + Mn Mn127 1.0 0.15954 0.72933 0.50020 1.0000 + Mn Mn128 1.0 0.11788 0.77100 0.50020 1.0000 + Mn Mn129 1.0 0.07621 0.81266 0.50020 1.0000 + Mn Mn130 1.0 0.03454 0.85433 0.50020 1.0000 + Mn Mn131 1.0 0.99288 0.89600 0.50020 1.0000 + Mn Mn132 1.0 0.95121 0.93766 0.50020 1.0000 + Mn Mn133 1.0 0.45121 0.52100 0.50020 1.0000 + Mn Mn134 1.0 0.40954 0.56266 0.50020 1.0000 + Mn Mn135 1.0 0.36788 0.60433 0.50020 1.0000 + Mn Mn136 1.0 0.32621 0.64600 0.50020 1.0000 + Mn Mn137 1.0 0.28454 0.68766 0.50020 1.0000 + Mn Mn138 1.0 0.24288 0.72933 0.50020 1.0000 + Mn Mn139 1.0 0.20121 0.77100 0.50020 1.0000 + Mn Mn140 1.0 0.15954 0.81266 0.50020 1.0000 + Mn Mn141 1.0 0.11788 0.85433 0.50020 1.0000 + Mn Mn142 1.0 0.07621 0.89600 0.50020 1.0000 + Mn Mn143 1.0 0.03454 0.93766 0.50020 1.0000 + Mn Mn144 1.0 0.99288 0.97933 0.50020 1.0000 + Mn Mn145 1.0 0.99287 0.02099 0.50009 1.0000 + Mn Mn146 1.0 0.95120 0.06266 0.50009 1.0000 + Mn Mn147 1.0 0.90954 0.10432 0.50009 1.0000 + Mn Mn148 1.0 0.86787 0.14599 0.50009 1.0000 + Mn Mn149 1.0 0.82620 0.18766 0.50009 1.0000 + Mn Mn150 1.0 0.78454 0.22932 0.50009 1.0000 + Mn Mn151 1.0 0.74287 0.27099 0.50009 1.0000 + Mn Mn152 1.0 0.70120 0.31266 0.50009 1.0000 + Mn Mn153 1.0 0.65954 0.35432 0.50009 1.0000 + Mn Mn154 1.0 0.61787 0.39599 0.50009 1.0000 + Mn Mn155 1.0 0.57620 0.43766 0.50009 1.0000 + Mn Mn156 1.0 0.53454 0.47932 0.50009 1.0000 + Mn Mn157 1.0 0.03454 0.06266 0.50009 1.0000 + Mn Mn158 1.0 0.99287 0.10432 0.50009 1.0000 + Mn Mn159 1.0 0.95120 0.14599 0.50009 1.0000 + Mn Mn160 1.0 0.90954 0.18766 0.50009 1.0000 + Mn Mn161 1.0 0.86787 0.22932 0.50009 1.0000 + Mn Mn162 1.0 0.82620 0.27099 0.50009 1.0000 + Mn Mn163 1.0 0.78454 0.31266 0.50009 1.0000 + Mn Mn164 1.0 0.74287 0.35432 0.50009 1.0000 + Mn Mn165 1.0 0.70120 0.39599 0.50009 1.0000 + Mn Mn166 1.0 0.65954 0.43766 0.50009 1.0000 + Mn Mn167 1.0 0.61787 0.47932 0.50009 1.0000 + Mn Mn168 1.0 0.57620 0.52099 0.50009 1.0000 + Mn Mn169 1.0 0.07620 0.10432 0.50009 1.0000 + Mn Mn170 1.0 0.03454 0.14599 0.50009 1.0000 + Mn Mn171 1.0 0.99287 0.18766 0.50009 1.0000 + Mn Mn172 1.0 0.95120 0.22932 0.50009 1.0000 + Mn Mn173 1.0 0.90954 0.27099 0.50009 1.0000 + Mn Mn174 1.0 0.86787 0.31266 0.50009 1.0000 + Mn Mn175 1.0 0.82620 0.35432 0.50009 1.0000 + Mn Mn176 1.0 0.78454 0.39599 0.50009 1.0000 + Mn Mn177 1.0 0.74287 0.43766 0.50009 1.0000 + Mn Mn178 1.0 0.70120 0.47932 0.50009 1.0000 + Mn Mn179 1.0 0.65954 0.52099 0.50009 1.0000 + Mn Mn180 1.0 0.61787 0.56266 0.50009 1.0000 + Mn Mn181 1.0 0.11787 0.14599 0.50009 1.0000 + Mn Mn182 1.0 0.07620 0.18766 0.50009 1.0000 + Mn Mn183 1.0 0.03454 0.22932 0.50009 1.0000 + Mn Mn184 1.0 0.99287 0.27099 0.50009 1.0000 + Mn Mn185 1.0 0.95120 0.31266 0.50009 1.0000 + Mn Mn186 1.0 0.90954 0.35432 0.50009 1.0000 + Mn Mn187 1.0 0.86787 0.39599 0.50009 1.0000 + Mn Mn188 1.0 0.82620 0.43766 0.50009 1.0000 + Mn Mn189 1.0 0.78454 0.47932 0.50009 1.0000 + Mn Mn190 1.0 0.74287 0.52099 0.50009 1.0000 + Mn Mn191 1.0 0.70120 0.56266 0.50009 1.0000 + Mn Mn192 1.0 0.65954 0.60432 0.50009 1.0000 + Mn Mn193 1.0 0.15954 0.18766 0.50009 1.0000 + Mn Mn194 1.0 0.11787 0.22932 0.50009 1.0000 + Mn Mn195 1.0 0.07620 0.27099 0.50009 1.0000 + Mn Mn196 1.0 0.03454 0.31266 0.50009 1.0000 + Mn Mn197 1.0 0.99287 0.35432 0.50009 1.0000 + Mn Mn198 1.0 0.95120 0.39599 0.50009 1.0000 + Mn Mn199 1.0 0.90954 0.43766 0.50009 1.0000 + Mn Mn200 1.0 0.86787 0.47932 0.50009 1.0000 + Mn Mn201 1.0 0.82620 0.52099 0.50009 1.0000 + Mn Mn202 1.0 0.78454 0.56266 0.50009 1.0000 + Mn Mn203 1.0 0.74287 0.60432 0.50009 1.0000 + Mn Mn204 1.0 0.70120 0.64599 0.50009 1.0000 + Mn Mn205 1.0 0.20120 0.22932 0.50009 1.0000 + Mn Mn206 1.0 0.15954 0.27099 0.50009 1.0000 + Mn Mn207 1.0 0.11787 0.31266 0.50009 1.0000 + Mn Mn208 1.0 0.07620 0.35432 0.50009 1.0000 + Mn Mn209 1.0 0.03454 0.39599 0.50009 1.0000 + Mn Mn210 1.0 0.99287 0.43766 0.50009 1.0000 + Mn Mn211 1.0 0.95120 0.47932 0.50009 1.0000 + Mn Mn212 1.0 0.90954 0.52099 0.50009 1.0000 + Mn Mn213 1.0 0.86787 0.56266 0.50009 1.0000 + Mn Mn214 1.0 0.82620 0.60432 0.50009 1.0000 + Mn Mn215 1.0 0.78454 0.64599 0.50009 1.0000 + Mn Mn216 1.0 0.74287 0.68766 0.50009 1.0000 + Mn Mn217 1.0 0.24287 0.27099 0.50009 1.0000 + Mn Mn218 1.0 0.20120 0.31266 0.50009 1.0000 + Mn Mn219 1.0 0.15954 0.35432 0.50009 1.0000 + Mn Mn220 1.0 0.11787 0.39599 0.50009 1.0000 + Mn Mn221 1.0 0.07620 0.43766 0.50009 1.0000 + Mn Mn222 1.0 0.03454 0.47932 0.50009 1.0000 + Mn Mn223 1.0 0.99287 0.52099 0.50009 1.0000 + Mn Mn224 1.0 0.95120 0.56266 0.50009 1.0000 + Mn Mn225 1.0 0.90954 0.60432 0.50009 1.0000 + Mn Mn226 1.0 0.86787 0.64599 0.50009 1.0000 + Mn Mn227 1.0 0.82620 0.68766 0.50009 1.0000 + Mn Mn228 1.0 0.78454 0.72932 0.50009 1.0000 + Mn Mn229 1.0 0.28454 0.31266 0.50009 1.0000 + Mn Mn230 1.0 0.24287 0.35432 0.50009 1.0000 + Mn Mn231 1.0 0.20120 0.39599 0.50009 1.0000 + Mn Mn232 1.0 0.15954 0.43766 0.50009 1.0000 + Mn Mn233 1.0 0.11787 0.47932 0.50009 1.0000 + Mn Mn234 1.0 0.07620 0.52099 0.50009 1.0000 + Mn Mn235 1.0 0.03454 0.56266 0.50009 1.0000 + Mn Mn236 1.0 0.99287 0.60432 0.50009 1.0000 + Mn Mn237 1.0 0.95120 0.64599 0.50009 1.0000 + Mn Mn238 1.0 0.90954 0.68766 0.50009 1.0000 + Mn Mn239 1.0 0.86787 0.72932 0.50009 1.0000 + Mn Mn240 1.0 0.82620 0.77099 0.50009 1.0000 + Mn Mn241 1.0 0.32620 0.35432 0.50009 1.0000 + Mn Mn242 1.0 0.28454 0.39599 0.50009 1.0000 + Mn Mn243 1.0 0.24287 0.43766 0.50009 1.0000 + Mn Mn244 1.0 0.20120 0.47932 0.50009 1.0000 + Mn Mn245 1.0 0.15954 0.52099 0.50009 1.0000 + Mn Mn246 1.0 0.11787 0.56266 0.50009 1.0000 + Mn Mn247 1.0 0.07620 0.60432 0.50009 1.0000 + Mn Mn248 1.0 0.03454 0.64599 0.50009 1.0000 + Mn Mn249 1.0 0.99287 0.68766 0.50009 1.0000 + Mn Mn250 1.0 0.95120 0.72932 0.50009 1.0000 + Mn Mn251 1.0 0.90954 0.77099 0.50009 1.0000 + Mn Mn252 1.0 0.86787 0.81266 0.50009 1.0000 + Mn Mn253 1.0 0.36787 0.39599 0.50009 1.0000 + Mn Mn254 1.0 0.32620 0.43766 0.50009 1.0000 + Mn Mn255 1.0 0.28454 0.47932 0.50009 1.0000 + Mn Mn256 1.0 0.24287 0.52099 0.50009 1.0000 + Mn Mn257 1.0 0.20120 0.56266 0.50009 1.0000 + Mn Mn258 1.0 0.15954 0.60432 0.50009 1.0000 + Mn Mn259 1.0 0.11787 0.64599 0.50009 1.0000 + Mn Mn260 1.0 0.07620 0.68766 0.50009 1.0000 + Mn Mn261 1.0 0.03454 0.72932 0.50009 1.0000 + Mn Mn262 1.0 0.99287 0.77099 0.50009 1.0000 + Mn Mn263 1.0 0.95120 0.81266 0.50009 1.0000 + Mn Mn264 1.0 0.90954 0.85432 0.50009 1.0000 + Mn Mn265 1.0 0.40954 0.43766 0.50009 1.0000 + Mn Mn266 1.0 0.36787 0.47932 0.50009 1.0000 + Mn Mn267 1.0 0.32620 0.52099 0.50009 1.0000 + Mn Mn268 1.0 0.28454 0.56266 0.50009 1.0000 + Mn Mn269 1.0 0.24287 0.60432 0.50009 1.0000 + Mn Mn270 1.0 0.20120 0.64599 0.50009 1.0000 + Mn Mn271 1.0 0.15954 0.68766 0.50009 1.0000 + Mn Mn272 1.0 0.11787 0.72932 0.50009 1.0000 + Mn Mn273 1.0 0.07620 0.77099 0.50009 1.0000 + Mn Mn274 1.0 0.03454 0.81266 0.50009 1.0000 + Mn Mn275 1.0 0.99287 0.85432 0.50009 1.0000 + Mn Mn276 1.0 0.95120 0.89599 0.50009 1.0000 + Mn Mn277 1.0 0.45120 0.47932 0.50009 1.0000 + Mn Mn278 1.0 0.40954 0.52099 0.50009 1.0000 + Mn Mn279 1.0 0.36787 0.56266 0.50009 1.0000 + Mn Mn280 1.0 0.32620 0.60432 0.50009 1.0000 + Mn Mn281 1.0 0.28454 0.64599 0.50009 1.0000 + Mn Mn282 1.0 0.24287 0.68766 0.50009 1.0000 + Mn Mn283 1.0 0.20120 0.72932 0.50009 1.0000 + Mn Mn284 1.0 0.15954 0.77099 0.50009 1.0000 + Mn Mn285 1.0 0.11787 0.81266 0.50009 1.0000 + Mn Mn286 1.0 0.07620 0.85432 0.50009 1.0000 + Mn Mn287 1.0 0.03454 0.89599 0.50009 1.0000 + Mn Mn288 1.0 0.99287 0.93766 0.50009 1.0000 + Mn Mn289 1.0 0.97204 0.04183 0.49980 1.0000 + Mn Mn290 1.0 0.93037 0.08349 0.49980 1.0000 + Mn Mn291 1.0 0.88871 0.12516 0.49980 1.0000 + Mn Mn292 1.0 0.84704 0.16683 0.49980 1.0000 + Mn Mn293 1.0 0.80537 0.20849 0.49980 1.0000 + Mn Mn294 1.0 0.76371 0.25016 0.49980 1.0000 + Mn Mn295 1.0 0.72204 0.29183 0.49980 1.0000 + Mn Mn296 1.0 0.68037 0.33349 0.49980 1.0000 + Mn Mn297 1.0 0.63871 0.37516 0.49980 1.0000 + Mn Mn298 1.0 0.59704 0.41683 0.49980 1.0000 + Mn Mn299 1.0 0.55537 0.45849 0.49980 1.0000 + Mn Mn300 1.0 0.51371 0.50016 0.49980 1.0000 + Mn Mn301 1.0 0.01371 0.08349 0.49980 1.0000 + Mn Mn302 1.0 0.97204 0.12516 0.49980 1.0000 + Mn Mn303 1.0 0.93037 0.16683 0.49980 1.0000 + Mn Mn304 1.0 0.88871 0.20849 0.49980 1.0000 + Mn Mn305 1.0 0.84704 0.25016 0.49980 1.0000 + Mn Mn306 1.0 0.80537 0.29183 0.49980 1.0000 + Mn Mn307 1.0 0.76371 0.33349 0.49980 1.0000 + Mn Mn308 1.0 0.72204 0.37516 0.49980 1.0000 + Mn Mn309 1.0 0.68037 0.41683 0.49980 1.0000 + Mn Mn310 1.0 0.63871 0.45849 0.49980 1.0000 + Mn Mn311 1.0 0.59704 0.50016 0.49980 1.0000 + Mn Mn312 1.0 0.55537 0.54183 0.49980 1.0000 + Mn Mn313 1.0 0.05537 0.12516 0.49980 1.0000 + Mn Mn314 1.0 0.01371 0.16683 0.49980 1.0000 + Mn Mn315 1.0 0.97204 0.20849 0.49980 1.0000 + Mn Mn316 1.0 0.93037 0.25016 0.49980 1.0000 + Mn Mn317 1.0 0.88871 0.29183 0.49980 1.0000 + Mn Mn318 1.0 0.84704 0.33349 0.49980 1.0000 + Mn Mn319 1.0 0.80537 0.37516 0.49980 1.0000 + Mn Mn320 1.0 0.76371 0.41683 0.49980 1.0000 + Mn Mn321 1.0 0.72204 0.45849 0.49980 1.0000 + Mn Mn322 1.0 0.68037 0.50016 0.49980 1.0000 + Mn Mn323 1.0 0.63871 0.54183 0.49980 1.0000 + Mn Mn324 1.0 0.59704 0.58349 0.49980 1.0000 + Mn Mn325 1.0 0.09704 0.16683 0.49980 1.0000 + Mn Mn326 1.0 0.05537 0.20849 0.49980 1.0000 + Mn Mn327 1.0 0.01371 0.25016 0.49980 1.0000 + Mn Mn328 1.0 0.97204 0.29183 0.49980 1.0000 + Mn Mn329 1.0 0.93037 0.33349 0.49980 1.0000 + Mn Mn330 1.0 0.88871 0.37516 0.49980 1.0000 + Mn Mn331 1.0 0.84704 0.41683 0.49980 1.0000 + Mn Mn332 1.0 0.80537 0.45849 0.49980 1.0000 + Mn Mn333 1.0 0.76371 0.50016 0.49980 1.0000 + Mn Mn334 1.0 0.72204 0.54183 0.49980 1.0000 + Mn Mn335 1.0 0.68037 0.58349 0.49980 1.0000 + Mn Mn336 1.0 0.63871 0.62516 0.49980 1.0000 + Mn Mn337 1.0 0.13871 0.20849 0.49980 1.0000 + Mn Mn338 1.0 0.09704 0.25016 0.49980 1.0000 + Mn Mn339 1.0 0.05537 0.29183 0.49980 1.0000 + Mn Mn340 1.0 0.01371 0.33349 0.49980 1.0000 + Mn Mn341 1.0 0.97204 0.37516 0.49980 1.0000 + Mn Mn342 1.0 0.93037 0.41683 0.49980 1.0000 + Mn Mn343 1.0 0.88871 0.45849 0.49980 1.0000 + Mn Mn344 1.0 0.84704 0.50016 0.49980 1.0000 + Mn Mn345 1.0 0.80537 0.54183 0.49980 1.0000 + Mn Mn346 1.0 0.76371 0.58349 0.49980 1.0000 + Mn Mn347 1.0 0.72204 0.62516 0.49980 1.0000 + Mn Mn348 1.0 0.68037 0.66683 0.49980 1.0000 + Mn Mn349 1.0 0.18037 0.25016 0.49980 1.0000 + Mn Mn350 1.0 0.13871 0.29183 0.49980 1.0000 + Mn Mn351 1.0 0.09704 0.33349 0.49980 1.0000 + Mn Mn352 1.0 0.05537 0.37516 0.49980 1.0000 + Mn Mn353 1.0 0.01371 0.41683 0.49980 1.0000 + Mn Mn354 1.0 0.97204 0.45849 0.49980 1.0000 + Mn Mn355 1.0 0.93037 0.50016 0.49980 1.0000 + Mn Mn356 1.0 0.88871 0.54183 0.49980 1.0000 + Mn Mn357 1.0 0.84704 0.58349 0.49980 1.0000 + Mn Mn358 1.0 0.80537 0.62516 0.49980 1.0000 + Mn Mn359 1.0 0.76371 0.66683 0.49980 1.0000 + Mn Mn360 1.0 0.72204 0.70849 0.49980 1.0000 + Mn Mn361 1.0 0.22204 0.29183 0.49980 1.0000 + Mn Mn362 1.0 0.18037 0.33349 0.49980 1.0000 + Mn Mn363 1.0 0.13871 0.37516 0.49980 1.0000 + Mn Mn364 1.0 0.09704 0.41683 0.49980 1.0000 + Mn Mn365 1.0 0.05537 0.45849 0.49980 1.0000 + Mn Mn366 1.0 0.01371 0.50016 0.49980 1.0000 + Mn Mn367 1.0 0.97204 0.54183 0.49980 1.0000 + Mn Mn368 1.0 0.93037 0.58349 0.49980 1.0000 + Mn Mn369 1.0 0.88871 0.62516 0.49980 1.0000 + Mn Mn370 1.0 0.84704 0.66683 0.49980 1.0000 + Mn Mn371 1.0 0.80537 0.70849 0.49980 1.0000 + Mn Mn372 1.0 0.76371 0.75016 0.49980 1.0000 + Mn Mn373 1.0 0.26371 0.33349 0.49980 1.0000 + Mn Mn374 1.0 0.22204 0.37516 0.49980 1.0000 + Mn Mn375 1.0 0.18037 0.41683 0.49980 1.0000 + Mn Mn376 1.0 0.13871 0.45849 0.49980 1.0000 + Mn Mn377 1.0 0.09704 0.50016 0.49980 1.0000 + Mn Mn378 1.0 0.05537 0.54183 0.49980 1.0000 + Mn Mn379 1.0 0.01371 0.58349 0.49980 1.0000 + Mn Mn380 1.0 0.97204 0.62516 0.49980 1.0000 + Mn Mn381 1.0 0.93037 0.66683 0.49980 1.0000 + Mn Mn382 1.0 0.88871 0.70849 0.49980 1.0000 + Mn Mn383 1.0 0.84704 0.75016 0.49980 1.0000 + Mn Mn384 1.0 0.80537 0.79183 0.49980 1.0000 + Mn Mn385 1.0 0.30537 0.37516 0.49980 1.0000 + Mn Mn386 1.0 0.26371 0.41683 0.49980 1.0000 + Mn Mn387 1.0 0.22204 0.45849 0.49980 1.0000 + Mn Mn388 1.0 0.18037 0.50016 0.49980 1.0000 + Mn Mn389 1.0 0.13871 0.54183 0.49980 1.0000 + Mn Mn390 1.0 0.09704 0.58349 0.49980 1.0000 + Mn Mn391 1.0 0.05537 0.62516 0.49980 1.0000 + Mn Mn392 1.0 0.01371 0.66683 0.49980 1.0000 + Mn Mn393 1.0 0.97204 0.70849 0.49980 1.0000 + Mn Mn394 1.0 0.93037 0.75016 0.49980 1.0000 + Mn Mn395 1.0 0.88871 0.79183 0.49980 1.0000 + Mn Mn396 1.0 0.84704 0.83349 0.49980 1.0000 + Mn Mn397 1.0 0.34704 0.41683 0.49980 1.0000 + Mn Mn398 1.0 0.30537 0.45849 0.49980 1.0000 + Mn Mn399 1.0 0.26371 0.50016 0.49980 1.0000 + Mn Mn400 1.0 0.22204 0.54183 0.49980 1.0000 + Mn Mn401 1.0 0.18037 0.58349 0.49980 1.0000 + Mn Mn402 1.0 0.13871 0.62516 0.49980 1.0000 + Mn Mn403 1.0 0.09704 0.66683 0.49980 1.0000 + Mn Mn404 1.0 0.05537 0.70849 0.49980 1.0000 + Mn Mn405 1.0 0.01371 0.75016 0.49980 1.0000 + Mn Mn406 1.0 0.97204 0.79183 0.49980 1.0000 + Mn Mn407 1.0 0.93037 0.83349 0.49980 1.0000 + Mn Mn408 1.0 0.88871 0.87516 0.49980 1.0000 + Mn Mn409 1.0 0.38871 0.45849 0.49980 1.0000 + Mn Mn410 1.0 0.34704 0.50016 0.49980 1.0000 + Mn Mn411 1.0 0.30537 0.54183 0.49980 1.0000 + Mn Mn412 1.0 0.26371 0.58349 0.49980 1.0000 + Mn Mn413 1.0 0.22204 0.62516 0.49980 1.0000 + Mn Mn414 1.0 0.18037 0.66683 0.49980 1.0000 + Mn Mn415 1.0 0.13871 0.70849 0.49980 1.0000 + Mn Mn416 1.0 0.09704 0.75016 0.49980 1.0000 + Mn Mn417 1.0 0.05537 0.79183 0.49980 1.0000 + Mn Mn418 1.0 0.01371 0.83349 0.49980 1.0000 + Mn Mn419 1.0 0.97204 0.87516 0.49980 1.0000 + Mn Mn420 1.0 0.93037 0.91683 0.49980 1.0000 + Mn Mn421 1.0 0.43037 0.50016 0.49980 1.0000 + Mn Mn422 1.0 0.38871 0.54183 0.49980 1.0000 + Mn Mn423 1.0 0.34704 0.58349 0.49980 1.0000 + Mn Mn424 1.0 0.30537 0.62516 0.49980 1.0000 + Mn Mn425 1.0 0.26371 0.66683 0.49980 1.0000 + Mn Mn426 1.0 0.22204 0.70849 0.49980 1.0000 + Mn Mn427 1.0 0.18037 0.75016 0.49980 1.0000 + Mn Mn428 1.0 0.13871 0.79183 0.49980 1.0000 + Mn Mn429 1.0 0.09704 0.83349 0.49980 1.0000 + Mn Mn430 1.0 0.05537 0.87516 0.49980 1.0000 + Mn Mn431 1.0 0.01371 0.91683 0.49980 1.0000 + Mn Mn432 1.0 0.97204 0.95849 0.49980 1.0000 + Cr Cr1 1.0 0.01372 0.04183 0.49851 1.0000 + Cr Cr2 1.0 0.97205 0.08350 0.49851 1.0000 + Cr Cr3 1.0 0.93038 0.12516 0.49851 1.0000 + Cr Cr4 1.0 0.88872 0.16683 0.49851 1.0000 + Cr Cr5 1.0 0.84705 0.20850 0.49851 1.0000 + Cr Cr6 1.0 0.80538 0.25016 0.49851 1.0000 + Cr Cr7 1.0 0.76372 0.29183 0.49851 1.0000 + Cr Cr8 1.0 0.72205 0.33350 0.49851 1.0000 + Cr Cr9 1.0 0.68038 0.37516 0.49851 1.0000 + Cr Cr10 1.0 0.63872 0.41683 0.49851 1.0000 + Cr Cr11 1.0 0.59705 0.45850 0.49851 1.0000 + Cr Cr12 1.0 0.55538 0.50016 0.49851 1.0000 + Cr Cr13 1.0 0.05538 0.08350 0.49851 1.0000 + Cr Cr14 1.0 0.01372 0.12516 0.49851 1.0000 + Cr Cr15 1.0 0.97205 0.16683 0.49851 1.0000 + Cr Cr16 1.0 0.93038 0.20850 0.49851 1.0000 + Cr Cr17 1.0 0.88872 0.25016 0.49851 1.0000 + Cr Cr18 1.0 0.84705 0.29183 0.49851 1.0000 + Cr Cr19 1.0 0.80538 0.33350 0.49851 1.0000 + Cr Cr20 1.0 0.76372 0.37516 0.49851 1.0000 + Cr Cr21 1.0 0.72205 0.41683 0.49851 1.0000 + Cr Cr22 1.0 0.68038 0.45850 0.49851 1.0000 + Cr Cr23 1.0 0.63872 0.50016 0.49851 1.0000 + Cr Cr24 1.0 0.59705 0.54183 0.49851 1.0000 + Cr Cr25 1.0 0.09705 0.12516 0.49851 1.0000 + Cr Cr26 1.0 0.05538 0.16683 0.49851 1.0000 + Cr Cr27 1.0 0.01372 0.20850 0.49851 1.0000 + Cr Cr28 1.0 0.97205 0.25016 0.49851 1.0000 + Cr Cr29 1.0 0.93038 0.29183 0.49851 1.0000 + Cr Cr30 1.0 0.88872 0.33350 0.49851 1.0000 + Cr Cr31 1.0 0.84705 0.37516 0.49851 1.0000 + Cr Cr32 1.0 0.80538 0.41683 0.49851 1.0000 + Cr Cr33 1.0 0.76372 0.45850 0.49851 1.0000 + Cr Cr34 1.0 0.72205 0.50016 0.49851 1.0000 + Cr Cr35 1.0 0.68038 0.54183 0.49851 1.0000 + Cr Cr36 1.0 0.63872 0.58350 0.49851 1.0000 + Cr Cr37 1.0 0.13872 0.16683 0.49851 1.0000 + Cr Cr38 1.0 0.09705 0.20850 0.49851 1.0000 + Cr Cr39 1.0 0.05538 0.25016 0.49851 1.0000 + Cr Cr40 1.0 0.01372 0.29183 0.49851 1.0000 + Cr Cr41 1.0 0.97205 0.33350 0.49851 1.0000 + Cr Cr42 1.0 0.93038 0.37516 0.49851 1.0000 + Cr Cr43 1.0 0.88872 0.41683 0.49851 1.0000 + Cr Cr44 1.0 0.84705 0.45850 0.49851 1.0000 + Cr Cr45 1.0 0.80538 0.50016 0.49851 1.0000 + Cr Cr46 1.0 0.76372 0.54183 0.49851 1.0000 + Cr Cr47 1.0 0.72205 0.58350 0.49851 1.0000 + Cr Cr48 1.0 0.68038 0.62516 0.49851 1.0000 + Cr Cr49 1.0 0.18038 0.20850 0.49851 1.0000 + Cr Cr50 1.0 0.13872 0.25016 0.49851 1.0000 + Cr Cr51 1.0 0.09705 0.29183 0.49851 1.0000 + Cr Cr52 1.0 0.05538 0.33350 0.49851 1.0000 + Cr Cr53 1.0 0.01372 0.37516 0.49851 1.0000 + Cr Cr54 1.0 0.97205 0.41683 0.49851 1.0000 + Cr Cr55 1.0 0.93038 0.45850 0.49851 1.0000 + Cr Cr56 1.0 0.88872 0.50016 0.49851 1.0000 + Cr Cr57 1.0 0.84705 0.54183 0.49851 1.0000 + Cr Cr58 1.0 0.80538 0.58350 0.49851 1.0000 + Cr Cr59 1.0 0.76372 0.62516 0.49851 1.0000 + Cr Cr60 1.0 0.72205 0.66683 0.49851 1.0000 + Cr Cr61 1.0 0.22205 0.25016 0.49851 1.0000 + Cr Cr62 1.0 0.18038 0.29183 0.49851 1.0000 + Cr Cr63 1.0 0.13872 0.33350 0.49851 1.0000 + Cr Cr64 1.0 0.09705 0.37516 0.49851 1.0000 + Cr Cr65 1.0 0.05538 0.41683 0.49851 1.0000 + Cr Cr66 1.0 0.01372 0.45850 0.49851 1.0000 + Cr Cr67 1.0 0.97205 0.50016 0.49851 1.0000 + Cr Cr68 1.0 0.93038 0.54183 0.49851 1.0000 + Cr Cr69 1.0 0.88872 0.58350 0.49851 1.0000 + Cr Cr70 1.0 0.84705 0.62516 0.49851 1.0000 + Cr Cr71 1.0 0.80538 0.66683 0.49851 1.0000 + Cr Cr72 1.0 0.76372 0.70850 0.49851 1.0000 + Cr Cr73 1.0 0.26372 0.29183 0.49851 1.0000 + Cr Cr74 1.0 0.22205 0.33350 0.49851 1.0000 + Cr Cr75 1.0 0.18038 0.37516 0.49851 1.0000 + Cr Cr76 1.0 0.13872 0.41683 0.49851 1.0000 + Cr Cr77 1.0 0.09705 0.45850 0.49851 1.0000 + Cr Cr78 1.0 0.05538 0.50016 0.49851 1.0000 + Cr Cr79 1.0 0.01372 0.54183 0.49851 1.0000 + Cr Cr80 1.0 0.97205 0.58350 0.49851 1.0000 + Cr Cr81 1.0 0.93038 0.62516 0.49851 1.0000 + Cr Cr82 1.0 0.88872 0.66683 0.49851 1.0000 + Cr Cr83 1.0 0.84705 0.70850 0.49851 1.0000 + Cr Cr84 1.0 0.80538 0.75016 0.49851 1.0000 + Cr Cr85 1.0 0.30538 0.33350 0.49851 1.0000 + Cr Cr86 1.0 0.26372 0.37516 0.49851 1.0000 + Cr Cr87 1.0 0.22205 0.41683 0.49851 1.0000 + Cr Cr88 1.0 0.18038 0.45850 0.49851 1.0000 + Cr Cr89 1.0 0.13872 0.50016 0.49851 1.0000 + Cr Cr90 1.0 0.09705 0.54183 0.49851 1.0000 + Cr Cr91 1.0 0.05538 0.58350 0.49851 1.0000 + Cr Cr92 1.0 0.01372 0.62516 0.49851 1.0000 + Cr Cr93 1.0 0.97205 0.66683 0.49851 1.0000 + Cr Cr94 1.0 0.93038 0.70850 0.49851 1.0000 + Cr Cr95 1.0 0.88872 0.75016 0.49851 1.0000 + Cr Cr96 1.0 0.84705 0.79183 0.49851 1.0000 + Cr Cr97 1.0 0.34705 0.37516 0.49851 1.0000 + Cr Cr98 1.0 0.30538 0.41683 0.49851 1.0000 + Cr Cr99 1.0 0.26372 0.45850 0.49851 1.0000 + Cr Cr100 1.0 0.22205 0.50016 0.49851 1.0000 + Cr Cr101 1.0 0.18038 0.54183 0.49851 1.0000 + Cr Cr102 1.0 0.13872 0.58350 0.49851 1.0000 + Cr Cr103 1.0 0.09705 0.62516 0.49851 1.0000 + Cr Cr104 1.0 0.05538 0.66683 0.49851 1.0000 + Cr Cr105 1.0 0.01372 0.70850 0.49851 1.0000 + Cr Cr106 1.0 0.97205 0.75016 0.49851 1.0000 + Cr Cr107 1.0 0.93038 0.79183 0.49851 1.0000 + Cr Cr108 1.0 0.88872 0.83350 0.49851 1.0000 + Cr Cr109 1.0 0.38872 0.41683 0.49851 1.0000 + Cr Cr110 1.0 0.34705 0.45850 0.49851 1.0000 + Cr Cr111 1.0 0.30538 0.50016 0.49851 1.0000 + Cr Cr112 1.0 0.26372 0.54183 0.49851 1.0000 + Cr Cr113 1.0 0.22205 0.58350 0.49851 1.0000 + Cr Cr114 1.0 0.18038 0.62516 0.49851 1.0000 + Cr Cr115 1.0 0.13872 0.66683 0.49851 1.0000 + Cr Cr116 1.0 0.09705 0.70850 0.49851 1.0000 + Cr Cr117 1.0 0.05538 0.75016 0.49851 1.0000 + Cr Cr118 1.0 0.01372 0.79183 0.49851 1.0000 + Cr Cr119 1.0 0.97205 0.83350 0.49851 1.0000 + Cr Cr120 1.0 0.93038 0.87516 0.49851 1.0000 + Cr Cr121 1.0 0.43038 0.45850 0.49851 1.0000 + Cr Cr122 1.0 0.38872 0.50016 0.49851 1.0000 + Cr Cr123 1.0 0.34705 0.54183 0.49851 1.0000 + Cr Cr124 1.0 0.30538 0.58350 0.49851 1.0000 + Cr Cr125 1.0 0.26372 0.62516 0.49851 1.0000 + Cr Cr126 1.0 0.22205 0.66683 0.49851 1.0000 + Cr Cr127 1.0 0.18038 0.70850 0.49851 1.0000 + Cr Cr128 1.0 0.13872 0.75016 0.49851 1.0000 + Cr Cr129 1.0 0.09705 0.79183 0.49851 1.0000 + Cr Cr130 1.0 0.05538 0.83350 0.49851 1.0000 + Cr Cr131 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0.52105 0.66075 1.0000 + O O987 1.0 0.34009 0.56272 0.66075 1.0000 + O O988 1.0 0.29842 0.60438 0.66075 1.0000 + O O989 1.0 0.25675 0.64605 0.66075 1.0000 + O O990 1.0 0.21509 0.68772 0.66075 1.0000 + O O991 1.0 0.17342 0.72938 0.66075 1.0000 + O O992 1.0 0.13175 0.77105 0.66075 1.0000 + O O993 1.0 0.09009 0.81272 0.66075 1.0000 + O O994 1.0 0.04842 0.85438 0.66075 1.0000 + O O995 1.0 0.00675 0.89605 0.66075 1.0000 + O O996 1.0 0.96509 0.93772 0.66075 1.0000 + O O997 1.0 0.46509 0.52105 0.66075 1.0000 + O O998 1.0 0.42342 0.56272 0.66075 1.0000 + O O999 1.0 0.38175 0.60438 0.66075 1.0000 + O O1000 1.0 0.34009 0.64605 0.66075 1.0000 + O O1001 1.0 0.29842 0.68772 0.66075 1.0000 + O O1002 1.0 0.25675 0.72938 0.66075 1.0000 + O O1003 1.0 0.21509 0.77105 0.66075 1.0000 + O O1004 1.0 0.17342 0.81272 0.66075 1.0000 + O O1005 1.0 0.13175 0.85438 0.66075 1.0000 + O O1006 1.0 0.09009 0.89605 0.66075 1.0000 + O O1007 1.0 0.04842 0.93772 0.66075 1.0000 + O O1008 1.0 0.00675 0.97938 0.66075 1.0000 + O O1009 1.0 0.02762 0.04182 0.66073 1.0000 + O O1010 1.0 0.98596 0.08349 0.66073 1.0000 + O O1011 1.0 0.94429 0.12515 0.66073 1.0000 + O O1012 1.0 0.90262 0.16682 0.66073 1.0000 + O O1013 1.0 0.86096 0.20849 0.66073 1.0000 + O O1014 1.0 0.81929 0.25015 0.66073 1.0000 + O O1015 1.0 0.77762 0.29182 0.66073 1.0000 + O O1016 1.0 0.73596 0.33349 0.66073 1.0000 + O O1017 1.0 0.69429 0.37515 0.66073 1.0000 + O O1018 1.0 0.65262 0.41682 0.66073 1.0000 + O O1019 1.0 0.61096 0.45849 0.66073 1.0000 + O O1020 1.0 0.56929 0.50015 0.66073 1.0000 + O O1021 1.0 0.06929 0.08349 0.66073 1.0000 + O O1022 1.0 0.02762 0.12515 0.66073 1.0000 + O O1023 1.0 0.98596 0.16682 0.66073 1.0000 + O O1024 1.0 0.94429 0.20849 0.66073 1.0000 + O O1025 1.0 0.90262 0.25015 0.66073 1.0000 + O O1026 1.0 0.86096 0.29182 0.66073 1.0000 + O O1027 1.0 0.81929 0.33349 0.66073 1.0000 + O O1028 1.0 0.77762 0.37515 0.66073 1.0000 + O O1029 1.0 0.73596 0.41682 0.66073 1.0000 + O O1030 1.0 0.69429 0.45849 0.66073 1.0000 + O O1031 1.0 0.65262 0.50015 0.66073 1.0000 + O O1032 1.0 0.61096 0.54182 0.66073 1.0000 + O O1033 1.0 0.11096 0.12515 0.66073 1.0000 + O O1034 1.0 0.06929 0.16682 0.66073 1.0000 + O O1035 1.0 0.02762 0.20849 0.66073 1.0000 + O O1036 1.0 0.98596 0.25015 0.66073 1.0000 + O O1037 1.0 0.94429 0.29182 0.66073 1.0000 + O O1038 1.0 0.90262 0.33349 0.66073 1.0000 + O O1039 1.0 0.86096 0.37515 0.66073 1.0000 + O O1040 1.0 0.81929 0.41682 0.66073 1.0000 + O O1041 1.0 0.77762 0.45849 0.66073 1.0000 + O O1042 1.0 0.73596 0.50015 0.66073 1.0000 + O O1043 1.0 0.69429 0.54182 0.66073 1.0000 + O O1044 1.0 0.65262 0.58349 0.66073 1.0000 + O O1045 1.0 0.15262 0.16682 0.66073 1.0000 + O O1046 1.0 0.11096 0.20849 0.66073 1.0000 + O O1047 1.0 0.06929 0.25015 0.66073 1.0000 + O O1048 1.0 0.02762 0.29182 0.66073 1.0000 + O O1049 1.0 0.98596 0.33349 0.66073 1.0000 + O O1050 1.0 0.94429 0.37515 0.66073 1.0000 + O O1051 1.0 0.90262 0.41682 0.66073 1.0000 + O O1052 1.0 0.86096 0.45849 0.66073 1.0000 + O O1053 1.0 0.81929 0.50015 0.66073 1.0000 + O O1054 1.0 0.77762 0.54182 0.66073 1.0000 + O O1055 1.0 0.73596 0.58349 0.66073 1.0000 + O O1056 1.0 0.69429 0.62515 0.66073 1.0000 + O O1057 1.0 0.19429 0.20849 0.66073 1.0000 + O O1058 1.0 0.15262 0.25015 0.66073 1.0000 + O O1059 1.0 0.11096 0.29182 0.66073 1.0000 + O O1060 1.0 0.06929 0.33349 0.66073 1.0000 + O O1061 1.0 0.02762 0.37515 0.66073 1.0000 + O O1062 1.0 0.98596 0.41682 0.66073 1.0000 + O O1063 1.0 0.94429 0.45849 0.66073 1.0000 + O O1064 1.0 0.90262 0.50015 0.66073 1.0000 + O O1065 1.0 0.86096 0.54182 0.66073 1.0000 + O O1066 1.0 0.81929 0.58349 0.66073 1.0000 + O O1067 1.0 0.77762 0.62515 0.66073 1.0000 + O O1068 1.0 0.73596 0.66682 0.66073 1.0000 + O O1069 1.0 0.23596 0.25015 0.66073 1.0000 + O O1070 1.0 0.19429 0.29182 0.66073 1.0000 + O O1071 1.0 0.15262 0.33349 0.66073 1.0000 + O O1072 1.0 0.11096 0.37515 0.66073 1.0000 + O O1073 1.0 0.06929 0.41682 0.66073 1.0000 + O O1074 1.0 0.02762 0.45849 0.66073 1.0000 + O O1075 1.0 0.98596 0.50015 0.66073 1.0000 + O O1076 1.0 0.94429 0.54182 0.66073 1.0000 + O O1077 1.0 0.90262 0.58349 0.66073 1.0000 + O O1078 1.0 0.86096 0.62515 0.66073 1.0000 + O O1079 1.0 0.81929 0.66682 0.66073 1.0000 + O O1080 1.0 0.77762 0.70849 0.66073 1.0000 + O O1081 1.0 0.27762 0.29182 0.66073 1.0000 + O O1082 1.0 0.23596 0.33349 0.66073 1.0000 + O O1083 1.0 0.19429 0.37515 0.66073 1.0000 + O O1084 1.0 0.15262 0.41682 0.66073 1.0000 + O O1085 1.0 0.11096 0.45849 0.66073 1.0000 + O O1086 1.0 0.06929 0.50015 0.66073 1.0000 + O O1087 1.0 0.02762 0.54182 0.66073 1.0000 + O O1088 1.0 0.98596 0.58349 0.66073 1.0000 + O O1089 1.0 0.94429 0.62515 0.66073 1.0000 + O O1090 1.0 0.90262 0.66682 0.66073 1.0000 + O O1091 1.0 0.86096 0.70849 0.66073 1.0000 + O O1092 1.0 0.81929 0.75015 0.66073 1.0000 + O O1093 1.0 0.31929 0.33349 0.66073 1.0000 + O O1094 1.0 0.27762 0.37515 0.66073 1.0000 + O O1095 1.0 0.23596 0.41682 0.66073 1.0000 + O O1096 1.0 0.19429 0.45849 0.66073 1.0000 + O O1097 1.0 0.15262 0.50015 0.66073 1.0000 + O O1098 1.0 0.11096 0.54182 0.66073 1.0000 + O O1099 1.0 0.06929 0.58349 0.66073 1.0000 + O O1100 1.0 0.02762 0.62515 0.66073 1.0000 + O O1101 1.0 0.98596 0.66682 0.66073 1.0000 + O O1102 1.0 0.94429 0.70849 0.66073 1.0000 + O O1103 1.0 0.90262 0.75015 0.66073 1.0000 + O O1104 1.0 0.86096 0.79182 0.66073 1.0000 + O O1105 1.0 0.36096 0.37515 0.66073 1.0000 + O O1106 1.0 0.31929 0.41682 0.66073 1.0000 + O O1107 1.0 0.27762 0.45849 0.66073 1.0000 + O O1108 1.0 0.23596 0.50015 0.66073 1.0000 + O O1109 1.0 0.19429 0.54182 0.66073 1.0000 + O O1110 1.0 0.15262 0.58349 0.66073 1.0000 + O O1111 1.0 0.11096 0.62515 0.66073 1.0000 + O O1112 1.0 0.06929 0.66682 0.66073 1.0000 + O O1113 1.0 0.02762 0.70849 0.66073 1.0000 + O O1114 1.0 0.98596 0.75015 0.66073 1.0000 + O O1115 1.0 0.94429 0.79182 0.66073 1.0000 + O O1116 1.0 0.90262 0.83349 0.66073 1.0000 + O O1117 1.0 0.40262 0.41682 0.66073 1.0000 + O O1118 1.0 0.36096 0.45849 0.66073 1.0000 + O O1119 1.0 0.31929 0.50015 0.66073 1.0000 + O O1120 1.0 0.27762 0.54182 0.66073 1.0000 + O O1121 1.0 0.23596 0.58349 0.66073 1.0000 + O O1122 1.0 0.19429 0.62515 0.66073 1.0000 + O O1123 1.0 0.15262 0.66682 0.66073 1.0000 + O O1124 1.0 0.11096 0.70849 0.66073 1.0000 + O O1125 1.0 0.06929 0.75015 0.66073 1.0000 + O O1126 1.0 0.02762 0.79182 0.66073 1.0000 + O O1127 1.0 0.98596 0.83349 0.66073 1.0000 + O O1128 1.0 0.94429 0.87515 0.66073 1.0000 + O O1129 1.0 0.44429 0.45849 0.66073 1.0000 + O O1130 1.0 0.40262 0.50015 0.66073 1.0000 + O O1131 1.0 0.36096 0.54182 0.66073 1.0000 + O O1132 1.0 0.31929 0.58349 0.66073 1.0000 + O O1133 1.0 0.27762 0.62515 0.66073 1.0000 + O O1134 1.0 0.23596 0.66682 0.66073 1.0000 + O O1135 1.0 0.19429 0.70849 0.66073 1.0000 + O O1136 1.0 0.15262 0.75015 0.66073 1.0000 + O O1137 1.0 0.11096 0.79182 0.66073 1.0000 + O O1138 1.0 0.06929 0.83349 0.66073 1.0000 + O O1139 1.0 0.02762 0.87515 0.66073 1.0000 + O O1140 1.0 0.98596 0.91682 0.66073 1.0000 + O O1141 1.0 0.48596 0.50015 0.66073 1.0000 + O O1142 1.0 0.44429 0.54182 0.66073 1.0000 + O O1143 1.0 0.40262 0.58349 0.66073 1.0000 + O O1144 1.0 0.36096 0.62515 0.66073 1.0000 + O O1145 1.0 0.31929 0.66682 0.66073 1.0000 + O O1146 1.0 0.27762 0.70849 0.66073 1.0000 + O O1147 1.0 0.23596 0.75015 0.66073 1.0000 + O O1148 1.0 0.19429 0.79182 0.66073 1.0000 + O O1149 1.0 0.15262 0.83349 0.66073 1.0000 + O O1150 1.0 0.11096 0.87515 0.66073 1.0000 + O O1151 1.0 0.06929 0.91682 0.66073 1.0000 + O O1152 1.0 0.02762 0.95849 0.66073 1.0000 + Mn Mn433 1.0 0.49288 0.56266 0.50020 1.0000 + Mn Mn434 1.0 0.45121 0.60433 0.50020 1.0000 + Mn Mn435 1.0 0.40954 0.64600 0.50020 1.0000 + Mn Mn436 1.0 0.36788 0.68766 0.50020 1.0000 + Mn Mn437 1.0 0.32621 0.72933 0.50020 1.0000 + Mn Mn438 1.0 0.28454 0.77100 0.50020 1.0000 + Mn Mn439 1.0 0.24288 0.81266 0.50020 1.0000 + Mn Mn440 1.0 0.20121 0.85433 0.50020 1.0000 + Mn Mn441 1.0 0.15954 0.89600 0.50020 1.0000 + Mn Mn442 1.0 0.11788 0.93766 0.50020 1.0000 + Mn Mn443 1.0 0.07621 0.97933 0.50020 1.0000 + Mn Mn444 1.0 0.03454 0.02100 0.50020 1.0000 + Mn Mn445 1.0 0.53454 0.60433 0.50020 1.0000 + Mn Mn446 1.0 0.49288 0.64600 0.50020 1.0000 + Mn Mn447 1.0 0.45121 0.68766 0.50020 1.0000 + Mn Mn448 1.0 0.40954 0.72933 0.50020 1.0000 + Mn Mn449 1.0 0.36788 0.77100 0.50020 1.0000 + Mn Mn450 1.0 0.32621 0.81266 0.50020 1.0000 + Mn Mn451 1.0 0.28454 0.85433 0.50020 1.0000 + Mn Mn452 1.0 0.24288 0.89600 0.50020 1.0000 + Mn Mn453 1.0 0.20121 0.93766 0.50020 1.0000 + Mn Mn454 1.0 0.15954 0.97933 0.50020 1.0000 + Mn Mn455 1.0 0.11788 0.02100 0.50020 1.0000 + Mn Mn456 1.0 0.07621 0.06266 0.50020 1.0000 + Mn Mn457 1.0 0.57621 0.64600 0.50020 1.0000 + Mn Mn458 1.0 0.53454 0.68766 0.50020 1.0000 + Mn Mn459 1.0 0.49288 0.72933 0.50020 1.0000 + Mn Mn460 1.0 0.45121 0.77100 0.50020 1.0000 + Mn Mn461 1.0 0.40954 0.81266 0.50020 1.0000 + Mn Mn462 1.0 0.36788 0.85433 0.50020 1.0000 + Mn Mn463 1.0 0.32621 0.89600 0.50020 1.0000 + Mn Mn464 1.0 0.28454 0.93766 0.50020 1.0000 + Mn Mn465 1.0 0.24288 0.97933 0.50020 1.0000 + Mn Mn466 1.0 0.20121 0.02100 0.50020 1.0000 + Mn Mn467 1.0 0.15954 0.06266 0.50020 1.0000 + Mn Mn468 1.0 0.11788 0.10433 0.50020 1.0000 + Mn Mn469 1.0 0.61788 0.68766 0.50020 1.0000 + Mn Mn470 1.0 0.57621 0.72933 0.50020 1.0000 + Mn Mn471 1.0 0.53454 0.77100 0.50020 1.0000 + Mn Mn472 1.0 0.49288 0.81266 0.50020 1.0000 + Mn Mn473 1.0 0.45121 0.85433 0.50020 1.0000 + Mn Mn474 1.0 0.40954 0.89600 0.50020 1.0000 + Mn Mn475 1.0 0.36788 0.93766 0.50020 1.0000 + Mn Mn476 1.0 0.32621 0.97933 0.50020 1.0000 + Mn Mn477 1.0 0.28454 0.02100 0.50020 1.0000 + Mn Mn478 1.0 0.24288 0.06266 0.50020 1.0000 + Mn Mn479 1.0 0.20121 0.10433 0.50020 1.0000 + Mn Mn480 1.0 0.15954 0.14600 0.50020 1.0000 + Mn Mn481 1.0 0.65954 0.72933 0.50020 1.0000 + Mn Mn482 1.0 0.61788 0.77100 0.50020 1.0000 + Mn Mn483 1.0 0.57621 0.81266 0.50020 1.0000 + Mn Mn484 1.0 0.53454 0.85433 0.50020 1.0000 + Mn Mn485 1.0 0.49288 0.89600 0.50020 1.0000 + Mn Mn486 1.0 0.45121 0.93766 0.50020 1.0000 + Mn Mn487 1.0 0.40954 0.97933 0.50020 1.0000 + Mn Mn488 1.0 0.36788 0.02100 0.50020 1.0000 + Mn Mn489 1.0 0.32621 0.06266 0.50020 1.0000 + Mn Mn490 1.0 0.28454 0.10433 0.50020 1.0000 + Mn Mn491 1.0 0.24288 0.14600 0.50020 1.0000 + Mn Mn492 1.0 0.20121 0.18766 0.50020 1.0000 + Mn Mn493 1.0 0.70121 0.77100 0.50020 1.0000 + Mn Mn494 1.0 0.65954 0.81266 0.50020 1.0000 + Mn Mn495 1.0 0.61788 0.85433 0.50020 1.0000 + Mn Mn496 1.0 0.57621 0.89600 0.50020 1.0000 + Mn Mn497 1.0 0.53454 0.93766 0.50020 1.0000 + Mn Mn498 1.0 0.49288 0.97933 0.50020 1.0000 + Mn Mn499 1.0 0.45121 0.02100 0.50020 1.0000 + Mn Mn500 1.0 0.40954 0.06266 0.50020 1.0000 + Mn Mn501 1.0 0.36788 0.10433 0.50020 1.0000 + Mn Mn502 1.0 0.32621 0.14600 0.50020 1.0000 + Mn Mn503 1.0 0.28454 0.18766 0.50020 1.0000 + Mn Mn504 1.0 0.24288 0.22933 0.50020 1.0000 + Mn Mn505 1.0 0.74288 0.81266 0.50020 1.0000 + Mn Mn506 1.0 0.70121 0.85433 0.50020 1.0000 + Mn Mn507 1.0 0.65954 0.89600 0.50020 1.0000 + Mn Mn508 1.0 0.61788 0.93766 0.50020 1.0000 + Mn Mn509 1.0 0.57621 0.97933 0.50020 1.0000 + Mn Mn510 1.0 0.53454 0.02100 0.50020 1.0000 + Mn Mn511 1.0 0.49288 0.06266 0.50020 1.0000 + Mn Mn512 1.0 0.45121 0.10433 0.50020 1.0000 + Mn Mn513 1.0 0.40954 0.14600 0.50020 1.0000 + Mn Mn514 1.0 0.36788 0.18766 0.50020 1.0000 + Mn Mn515 1.0 0.32621 0.22933 0.50020 1.0000 + Mn Mn516 1.0 0.28454 0.27100 0.50020 1.0000 + Mn Mn517 1.0 0.78454 0.85433 0.50020 1.0000 + Mn Mn518 1.0 0.74288 0.89600 0.50020 1.0000 + Mn Mn519 1.0 0.70121 0.93766 0.50020 1.0000 + Mn Mn520 1.0 0.65954 0.97933 0.50020 1.0000 + Mn Mn521 1.0 0.61788 0.02100 0.50020 1.0000 + Mn Mn522 1.0 0.57621 0.06266 0.50020 1.0000 + Mn Mn523 1.0 0.53454 0.10433 0.50020 1.0000 + Mn Mn524 1.0 0.49288 0.14600 0.50020 1.0000 + Mn Mn525 1.0 0.45121 0.18766 0.50020 1.0000 + Mn Mn526 1.0 0.40954 0.22933 0.50020 1.0000 + Mn Mn527 1.0 0.36788 0.27100 0.50020 1.0000 + Mn Mn528 1.0 0.32621 0.31266 0.50020 1.0000 + Mn Mn529 1.0 0.82621 0.89600 0.50020 1.0000 + Mn Mn530 1.0 0.78454 0.93766 0.50020 1.0000 + Mn Mn531 1.0 0.74288 0.97933 0.50020 1.0000 + Mn Mn532 1.0 0.70121 0.02100 0.50020 1.0000 + Mn Mn533 1.0 0.65954 0.06266 0.50020 1.0000 + Mn Mn534 1.0 0.61788 0.10433 0.50020 1.0000 + Mn Mn535 1.0 0.57621 0.14600 0.50020 1.0000 + Mn Mn536 1.0 0.53454 0.18766 0.50020 1.0000 + Mn Mn537 1.0 0.49288 0.22933 0.50020 1.0000 + Mn Mn538 1.0 0.45121 0.27100 0.50020 1.0000 + Mn Mn539 1.0 0.40954 0.31266 0.50020 1.0000 + Mn Mn540 1.0 0.36788 0.35433 0.50020 1.0000 + Mn Mn541 1.0 0.86788 0.93766 0.50020 1.0000 + Mn Mn542 1.0 0.82621 0.97933 0.50020 1.0000 + Mn Mn543 1.0 0.78454 0.02100 0.50020 1.0000 + Mn Mn544 1.0 0.74288 0.06266 0.50020 1.0000 + Mn Mn545 1.0 0.70121 0.10433 0.50020 1.0000 + Mn Mn546 1.0 0.65954 0.14600 0.50020 1.0000 + Mn Mn547 1.0 0.61788 0.18766 0.50020 1.0000 + Mn Mn548 1.0 0.57621 0.22933 0.50020 1.0000 + Mn Mn549 1.0 0.53454 0.27100 0.50020 1.0000 + Mn Mn550 1.0 0.49288 0.31266 0.50020 1.0000 + Mn Mn551 1.0 0.45121 0.35433 0.50020 1.0000 + Mn Mn552 1.0 0.40954 0.39600 0.50020 1.0000 + Mn Mn553 1.0 0.90954 0.97933 0.50020 1.0000 + Mn Mn554 1.0 0.86788 0.02100 0.50020 1.0000 + Mn Mn555 1.0 0.82621 0.06266 0.50020 1.0000 + Mn Mn556 1.0 0.78454 0.10433 0.50020 1.0000 + Mn Mn557 1.0 0.74288 0.14600 0.50020 1.0000 + Mn Mn558 1.0 0.70121 0.18766 0.50020 1.0000 + Mn Mn559 1.0 0.65954 0.22933 0.50020 1.0000 + Mn Mn560 1.0 0.61788 0.27100 0.50020 1.0000 + Mn Mn561 1.0 0.57621 0.31266 0.50020 1.0000 + Mn Mn562 1.0 0.53454 0.35433 0.50020 1.0000 + Mn Mn563 1.0 0.49288 0.39600 0.50020 1.0000 + Mn Mn564 1.0 0.45121 0.43766 0.50020 1.0000 + Mn Mn565 1.0 0.95121 0.02100 0.50020 1.0000 + Mn Mn566 1.0 0.90954 0.06266 0.50020 1.0000 + Mn Mn567 1.0 0.86788 0.10433 0.50020 1.0000 + Mn Mn568 1.0 0.82621 0.14600 0.50020 1.0000 + Mn Mn569 1.0 0.78454 0.18766 0.50020 1.0000 + Mn Mn570 1.0 0.74288 0.22933 0.50020 1.0000 + Mn Mn571 1.0 0.70121 0.27100 0.50020 1.0000 + Mn Mn572 1.0 0.65954 0.31266 0.50020 1.0000 + Mn Mn573 1.0 0.61788 0.35433 0.50020 1.0000 + Mn Mn574 1.0 0.57621 0.39600 0.50020 1.0000 + Mn Mn575 1.0 0.53454 0.43766 0.50020 1.0000 + Mn Mn576 1.0 0.49288 0.47933 0.50020 1.0000 + Mn Mn577 1.0 0.49287 0.52099 0.50009 1.0000 + Mn Mn578 1.0 0.45120 0.56266 0.50009 1.0000 + Mn Mn579 1.0 0.40954 0.60432 0.50009 1.0000 + Mn Mn580 1.0 0.36787 0.64599 0.50009 1.0000 + Mn Mn581 1.0 0.32620 0.68766 0.50009 1.0000 + Mn Mn582 1.0 0.28454 0.72932 0.50009 1.0000 + Mn Mn583 1.0 0.24287 0.77099 0.50009 1.0000 + Mn Mn584 1.0 0.20120 0.81266 0.50009 1.0000 + Mn Mn585 1.0 0.15954 0.85432 0.50009 1.0000 + Mn Mn586 1.0 0.11787 0.89599 0.50009 1.0000 + Mn Mn587 1.0 0.07620 0.93766 0.50009 1.0000 + Mn Mn588 1.0 0.03454 0.97932 0.50009 1.0000 + Mn Mn589 1.0 0.53454 0.56266 0.50009 1.0000 + Mn Mn590 1.0 0.49287 0.60432 0.50009 1.0000 + Mn Mn591 1.0 0.45120 0.64599 0.50009 1.0000 + Mn Mn592 1.0 0.40954 0.68766 0.50009 1.0000 + Mn Mn593 1.0 0.36787 0.72932 0.50009 1.0000 + Mn Mn594 1.0 0.32620 0.77099 0.50009 1.0000 + Mn Mn595 1.0 0.28454 0.81266 0.50009 1.0000 + Mn Mn596 1.0 0.24287 0.85432 0.50009 1.0000 + Mn Mn597 1.0 0.20120 0.89599 0.50009 1.0000 + Mn Mn598 1.0 0.15954 0.93766 0.50009 1.0000 + Mn Mn599 1.0 0.11787 0.97932 0.50009 1.0000 + Mn Mn600 1.0 0.07620 0.02099 0.50009 1.0000 + Mn Mn601 1.0 0.57620 0.60432 0.50009 1.0000 + Mn Mn602 1.0 0.53454 0.64599 0.50009 1.0000 + Mn Mn603 1.0 0.49287 0.68766 0.50009 1.0000 + Mn Mn604 1.0 0.45120 0.72932 0.50009 1.0000 + Mn Mn605 1.0 0.40954 0.77099 0.50009 1.0000 + Mn Mn606 1.0 0.36787 0.81266 0.50009 1.0000 + Mn Mn607 1.0 0.32620 0.85432 0.50009 1.0000 + Mn Mn608 1.0 0.28454 0.89599 0.50009 1.0000 + Mn Mn609 1.0 0.24287 0.93766 0.50009 1.0000 + Mn Mn610 1.0 0.20120 0.97932 0.50009 1.0000 + Mn Mn611 1.0 0.15954 0.02099 0.50009 1.0000 + Mn Mn612 1.0 0.11787 0.06266 0.50009 1.0000 + Mn Mn613 1.0 0.61787 0.64599 0.50009 1.0000 + Mn Mn614 1.0 0.57620 0.68766 0.50009 1.0000 + Mn Mn615 1.0 0.53454 0.72932 0.50009 1.0000 + Mn Mn616 1.0 0.49287 0.77099 0.50009 1.0000 + Mn Mn617 1.0 0.45120 0.81266 0.50009 1.0000 + Mn Mn618 1.0 0.40954 0.85432 0.50009 1.0000 + Mn Mn619 1.0 0.36787 0.89599 0.50009 1.0000 + Mn Mn620 1.0 0.32620 0.93766 0.50009 1.0000 + Mn Mn621 1.0 0.28454 0.97932 0.50009 1.0000 + Mn Mn622 1.0 0.24287 0.02099 0.50009 1.0000 + Mn Mn623 1.0 0.20120 0.06266 0.50009 1.0000 + Mn Mn624 1.0 0.15954 0.10432 0.50009 1.0000 + Mn Mn625 1.0 0.65954 0.68766 0.50009 1.0000 + Mn Mn626 1.0 0.61787 0.72932 0.50009 1.0000 + Mn Mn627 1.0 0.57620 0.77099 0.50009 1.0000 + Mn Mn628 1.0 0.53454 0.81266 0.50009 1.0000 + Mn Mn629 1.0 0.49287 0.85432 0.50009 1.0000 + Mn Mn630 1.0 0.45120 0.89599 0.50009 1.0000 + Mn Mn631 1.0 0.40954 0.93766 0.50009 1.0000 + Mn Mn632 1.0 0.36787 0.97932 0.50009 1.0000 + Mn Mn633 1.0 0.32620 0.02099 0.50009 1.0000 + Mn Mn634 1.0 0.28454 0.06266 0.50009 1.0000 + Mn Mn635 1.0 0.24287 0.10432 0.50009 1.0000 + Mn Mn636 1.0 0.20120 0.14599 0.50009 1.0000 + Mn Mn637 1.0 0.70120 0.72932 0.50009 1.0000 + Mn Mn638 1.0 0.65954 0.77099 0.50009 1.0000 + Mn Mn639 1.0 0.61787 0.81266 0.50009 1.0000 + Mn Mn640 1.0 0.57620 0.85432 0.50009 1.0000 + Mn Mn641 1.0 0.53454 0.89599 0.50009 1.0000 + Mn Mn642 1.0 0.49287 0.93766 0.50009 1.0000 + Mn Mn643 1.0 0.45120 0.97932 0.50009 1.0000 + Mn Mn644 1.0 0.40954 0.02099 0.50009 1.0000 + Mn Mn645 1.0 0.36787 0.06266 0.50009 1.0000 + Mn Mn646 1.0 0.32620 0.10432 0.50009 1.0000 + Mn Mn647 1.0 0.28454 0.14599 0.50009 1.0000 + Mn Mn648 1.0 0.24287 0.18766 0.50009 1.0000 + Mn Mn649 1.0 0.74287 0.77099 0.50009 1.0000 + Mn Mn650 1.0 0.70120 0.81266 0.50009 1.0000 + Mn Mn651 1.0 0.65954 0.85432 0.50009 1.0000 + Mn Mn652 1.0 0.61787 0.89599 0.50009 1.0000 + Mn Mn653 1.0 0.57620 0.93766 0.50009 1.0000 + Mn Mn654 1.0 0.53454 0.97932 0.50009 1.0000 + Mn Mn655 1.0 0.49287 0.02099 0.50009 1.0000 + Mn Mn656 1.0 0.45120 0.06266 0.50009 1.0000 + Mn Mn657 1.0 0.40954 0.10432 0.50009 1.0000 + Mn Mn658 1.0 0.36787 0.14599 0.50009 1.0000 + Mn Mn659 1.0 0.32620 0.18766 0.50009 1.0000 + Mn Mn660 1.0 0.28454 0.22932 0.50009 1.0000 + Mn Mn661 1.0 0.78454 0.81266 0.50009 1.0000 + Mn Mn662 1.0 0.74287 0.85432 0.50009 1.0000 + Mn Mn663 1.0 0.70120 0.89599 0.50009 1.0000 + Mn Mn664 1.0 0.65954 0.93766 0.50009 1.0000 + Mn Mn665 1.0 0.61787 0.97932 0.50009 1.0000 + Mn Mn666 1.0 0.57620 0.02099 0.50009 1.0000 + Mn Mn667 1.0 0.53454 0.06266 0.50009 1.0000 + Mn Mn668 1.0 0.49287 0.10432 0.50009 1.0000 + Mn Mn669 1.0 0.45120 0.14599 0.50009 1.0000 + Mn Mn670 1.0 0.40954 0.18766 0.50009 1.0000 + Mn Mn671 1.0 0.36787 0.22932 0.50009 1.0000 + Mn Mn672 1.0 0.32620 0.27099 0.50009 1.0000 + Mn Mn673 1.0 0.82620 0.85432 0.50009 1.0000 + Mn Mn674 1.0 0.78454 0.89599 0.50009 1.0000 + Mn Mn675 1.0 0.74287 0.93766 0.50009 1.0000 + Mn Mn676 1.0 0.70120 0.97932 0.50009 1.0000 + Mn Mn677 1.0 0.65954 0.02099 0.50009 1.0000 + Mn Mn678 1.0 0.61787 0.06266 0.50009 1.0000 + Mn Mn679 1.0 0.57620 0.10432 0.50009 1.0000 + Mn Mn680 1.0 0.53454 0.14599 0.50009 1.0000 + Mn Mn681 1.0 0.49287 0.18766 0.50009 1.0000 + Mn Mn682 1.0 0.45120 0.22932 0.50009 1.0000 + Mn Mn683 1.0 0.40954 0.27099 0.50009 1.0000 + Mn Mn684 1.0 0.36787 0.31266 0.50009 1.0000 + Mn Mn685 1.0 0.86787 0.89599 0.50009 1.0000 + Mn Mn686 1.0 0.82620 0.93766 0.50009 1.0000 + Mn Mn687 1.0 0.78454 0.97932 0.50009 1.0000 + Mn Mn688 1.0 0.74287 0.02099 0.50009 1.0000 + Mn Mn689 1.0 0.70120 0.06266 0.50009 1.0000 + Mn Mn690 1.0 0.65954 0.10432 0.50009 1.0000 + Mn Mn691 1.0 0.61787 0.14599 0.50009 1.0000 + Mn Mn692 1.0 0.57620 0.18766 0.50009 1.0000 + Mn Mn693 1.0 0.53454 0.22932 0.50009 1.0000 + Mn Mn694 1.0 0.49287 0.27099 0.50009 1.0000 + Mn Mn695 1.0 0.45120 0.31266 0.50009 1.0000 + Mn Mn696 1.0 0.40954 0.35432 0.50009 1.0000 + Mn Mn697 1.0 0.90954 0.93766 0.50009 1.0000 + Mn Mn698 1.0 0.86787 0.97932 0.50009 1.0000 + Mn Mn699 1.0 0.82620 0.02099 0.50009 1.0000 + Mn Mn700 1.0 0.78454 0.06266 0.50009 1.0000 + Mn Mn701 1.0 0.74287 0.10432 0.50009 1.0000 + Mn Mn702 1.0 0.70120 0.14599 0.50009 1.0000 + Mn Mn703 1.0 0.65954 0.18766 0.50009 1.0000 + Mn Mn704 1.0 0.61787 0.22932 0.50009 1.0000 + Mn Mn705 1.0 0.57620 0.27099 0.50009 1.0000 + Mn Mn706 1.0 0.53454 0.31266 0.50009 1.0000 + Mn Mn707 1.0 0.49287 0.35432 0.50009 1.0000 + Mn Mn708 1.0 0.45120 0.39599 0.50009 1.0000 + Mn Mn709 1.0 0.95120 0.97932 0.50009 1.0000 + Mn Mn710 1.0 0.90954 0.02099 0.50009 1.0000 + Mn Mn711 1.0 0.86787 0.06266 0.50009 1.0000 + Mn Mn712 1.0 0.82620 0.10432 0.50009 1.0000 + Mn Mn713 1.0 0.78454 0.14599 0.50009 1.0000 + Mn Mn714 1.0 0.74287 0.18766 0.50009 1.0000 + Mn Mn715 1.0 0.70120 0.22932 0.50009 1.0000 + Mn Mn716 1.0 0.65954 0.27099 0.50009 1.0000 + Mn Mn717 1.0 0.61787 0.31266 0.50009 1.0000 + Mn Mn718 1.0 0.57620 0.35432 0.50009 1.0000 + Mn Mn719 1.0 0.53454 0.39599 0.50009 1.0000 + Mn Mn720 1.0 0.49287 0.43766 0.50009 1.0000 + Mn Mn721 1.0 0.47204 0.54183 0.49980 1.0000 + Mn Mn722 1.0 0.43037 0.58349 0.49980 1.0000 + Mn Mn723 1.0 0.38871 0.62516 0.49980 1.0000 + Mn Mn724 1.0 0.34704 0.66683 0.49980 1.0000 + Mn Mn725 1.0 0.30537 0.70849 0.49980 1.0000 + Mn Mn726 1.0 0.26371 0.75016 0.49980 1.0000 + Mn Mn727 1.0 0.22204 0.79183 0.49980 1.0000 + Mn Mn728 1.0 0.18037 0.83349 0.49980 1.0000 + Mn Mn729 1.0 0.13871 0.87516 0.49980 1.0000 + Mn Mn730 1.0 0.09704 0.91683 0.49980 1.0000 + Mn Mn731 1.0 0.05537 0.95849 0.49980 1.0000 + Mn Mn732 1.0 0.01371 0.00016 0.49980 1.0000 + Mn Mn733 1.0 0.51371 0.58349 0.49980 1.0000 + Mn Mn734 1.0 0.47204 0.62516 0.49980 1.0000 + Mn Mn735 1.0 0.43037 0.66683 0.49980 1.0000 + Mn Mn736 1.0 0.38871 0.70849 0.49980 1.0000 + Mn Mn737 1.0 0.34704 0.75016 0.49980 1.0000 + Mn Mn738 1.0 0.30537 0.79183 0.49980 1.0000 + Mn Mn739 1.0 0.26371 0.83349 0.49980 1.0000 + Mn Mn740 1.0 0.22204 0.87516 0.49980 1.0000 + Mn Mn741 1.0 0.18037 0.91683 0.49980 1.0000 + Mn Mn742 1.0 0.13871 0.95849 0.49980 1.0000 + Mn Mn743 1.0 0.09704 0.00016 0.49980 1.0000 + Mn Mn744 1.0 0.05537 0.04183 0.49980 1.0000 + Mn Mn745 1.0 0.55537 0.62516 0.49980 1.0000 + Mn Mn746 1.0 0.51371 0.66683 0.49980 1.0000 + Mn Mn747 1.0 0.47204 0.70849 0.49980 1.0000 + Mn Mn748 1.0 0.43037 0.75016 0.49980 1.0000 + Mn Mn749 1.0 0.38871 0.79183 0.49980 1.0000 + Mn Mn750 1.0 0.34704 0.83349 0.49980 1.0000 + Mn Mn751 1.0 0.30537 0.87516 0.49980 1.0000 + Mn Mn752 1.0 0.26371 0.91683 0.49980 1.0000 + Mn Mn753 1.0 0.22204 0.95849 0.49980 1.0000 + Mn Mn754 1.0 0.18037 0.00016 0.49980 1.0000 + Mn Mn755 1.0 0.13871 0.04183 0.49980 1.0000 + Mn Mn756 1.0 0.09704 0.08349 0.49980 1.0000 + Mn Mn757 1.0 0.59704 0.66683 0.49980 1.0000 + Mn Mn758 1.0 0.55537 0.70849 0.49980 1.0000 + Mn Mn759 1.0 0.51371 0.75016 0.49980 1.0000 + Mn Mn760 1.0 0.47204 0.79183 0.49980 1.0000 + Mn Mn761 1.0 0.43037 0.83349 0.49980 1.0000 + Mn Mn762 1.0 0.38871 0.87516 0.49980 1.0000 + Mn Mn763 1.0 0.34704 0.91683 0.49980 1.0000 + Mn Mn764 1.0 0.30537 0.95849 0.49980 1.0000 + Mn Mn765 1.0 0.26371 0.00016 0.49980 1.0000 + Mn Mn766 1.0 0.22204 0.04183 0.49980 1.0000 + Mn Mn767 1.0 0.18037 0.08349 0.49980 1.0000 + Mn Mn768 1.0 0.13871 0.12516 0.49980 1.0000 + Mn Mn769 1.0 0.63871 0.70849 0.49980 1.0000 + Mn Mn770 1.0 0.59704 0.75016 0.49980 1.0000 + Mn Mn771 1.0 0.55537 0.79183 0.49980 1.0000 + Mn Mn772 1.0 0.51371 0.83349 0.49980 1.0000 + Mn Mn773 1.0 0.47204 0.87516 0.49980 1.0000 + Mn Mn774 1.0 0.43037 0.91683 0.49980 1.0000 + Mn Mn775 1.0 0.38871 0.95849 0.49980 1.0000 + Mn Mn776 1.0 0.34704 0.00016 0.49980 1.0000 + Mn Mn777 1.0 0.30537 0.04183 0.49980 1.0000 + Mn Mn778 1.0 0.26371 0.08349 0.49980 1.0000 + Mn Mn779 1.0 0.22204 0.12516 0.49980 1.0000 + Mn Mn780 1.0 0.18037 0.16683 0.49980 1.0000 + Mn Mn781 1.0 0.68037 0.75016 0.49980 1.0000 + Mn Mn782 1.0 0.63871 0.79183 0.49980 1.0000 + Mn Mn783 1.0 0.59704 0.83349 0.49980 1.0000 + Mn Mn784 1.0 0.55537 0.87516 0.49980 1.0000 + Mn Mn785 1.0 0.51371 0.91683 0.49980 1.0000 + Mn Mn786 1.0 0.47204 0.95849 0.49980 1.0000 + Mn Mn787 1.0 0.43037 0.00016 0.49980 1.0000 + Mn Mn788 1.0 0.38871 0.04183 0.49980 1.0000 + Mn Mn789 1.0 0.34704 0.08349 0.49980 1.0000 + Mn Mn790 1.0 0.30537 0.12516 0.49980 1.0000 + Mn Mn791 1.0 0.26371 0.16683 0.49980 1.0000 + Mn Mn792 1.0 0.22204 0.20849 0.49980 1.0000 + Mn Mn793 1.0 0.72204 0.79183 0.49980 1.0000 + Mn Mn794 1.0 0.68037 0.83349 0.49980 1.0000 + Mn Mn795 1.0 0.63871 0.87516 0.49980 1.0000 + Mn Mn796 1.0 0.59704 0.91683 0.49980 1.0000 + Mn Mn797 1.0 0.55537 0.95849 0.49980 1.0000 + Mn Mn798 1.0 0.51371 0.00016 0.49980 1.0000 + Mn Mn799 1.0 0.47204 0.04183 0.49980 1.0000 + Mn Mn800 1.0 0.43037 0.08349 0.49980 1.0000 + Mn Mn801 1.0 0.38871 0.12516 0.49980 1.0000 + Mn Mn802 1.0 0.34704 0.16683 0.49980 1.0000 + Mn Mn803 1.0 0.30537 0.20849 0.49980 1.0000 + Mn Mn804 1.0 0.26371 0.25016 0.49980 1.0000 + Mn Mn805 1.0 0.76371 0.83349 0.49980 1.0000 + Mn Mn806 1.0 0.72204 0.87516 0.49980 1.0000 + Mn Mn807 1.0 0.68037 0.91683 0.49980 1.0000 + Mn Mn808 1.0 0.63871 0.95849 0.49980 1.0000 + Mn Mn809 1.0 0.59704 0.00016 0.49980 1.0000 + Mn Mn810 1.0 0.55537 0.04183 0.49980 1.0000 + Mn Mn811 1.0 0.51371 0.08349 0.49980 1.0000 + Mn Mn812 1.0 0.47204 0.12516 0.49980 1.0000 + Mn Mn813 1.0 0.43037 0.16683 0.49980 1.0000 + Mn Mn814 1.0 0.38871 0.20849 0.49980 1.0000 + Mn Mn815 1.0 0.34704 0.25016 0.49980 1.0000 + Mn Mn816 1.0 0.30537 0.29183 0.49980 1.0000 + Mn Mn817 1.0 0.80537 0.87516 0.49980 1.0000 + Mn Mn818 1.0 0.76371 0.91683 0.49980 1.0000 + Mn Mn819 1.0 0.72204 0.95849 0.49980 1.0000 + Mn Mn820 1.0 0.68037 0.00016 0.49980 1.0000 + Mn Mn821 1.0 0.63871 0.04183 0.49980 1.0000 + Mn Mn822 1.0 0.59704 0.08349 0.49980 1.0000 + Mn Mn823 1.0 0.55537 0.12516 0.49980 1.0000 + Mn Mn824 1.0 0.51371 0.16683 0.49980 1.0000 + Mn Mn825 1.0 0.47204 0.20849 0.49980 1.0000 + Mn Mn826 1.0 0.43037 0.25016 0.49980 1.0000 + Mn Mn827 1.0 0.38871 0.29183 0.49980 1.0000 + Mn Mn828 1.0 0.34704 0.33349 0.49980 1.0000 + Mn Mn829 1.0 0.84704 0.91683 0.49980 1.0000 + Mn Mn830 1.0 0.80537 0.95849 0.49980 1.0000 + Mn Mn831 1.0 0.76371 0.00016 0.49980 1.0000 + Mn Mn832 1.0 0.72204 0.04183 0.49980 1.0000 + Mn Mn833 1.0 0.68037 0.08349 0.49980 1.0000 + Mn Mn834 1.0 0.63871 0.12516 0.49980 1.0000 + Mn Mn835 1.0 0.59704 0.16683 0.49980 1.0000 + Mn Mn836 1.0 0.55537 0.20849 0.49980 1.0000 + Mn Mn837 1.0 0.51371 0.25016 0.49980 1.0000 + Mn Mn838 1.0 0.47204 0.29183 0.49980 1.0000 + Mn Mn839 1.0 0.43037 0.33349 0.49980 1.0000 + Mn Mn840 1.0 0.38871 0.37516 0.49980 1.0000 + Mn Mn841 1.0 0.88871 0.95849 0.49980 1.0000 + Mn Mn842 1.0 0.84704 0.00016 0.49980 1.0000 + Mn Mn843 1.0 0.80537 0.04183 0.49980 1.0000 + Mn Mn844 1.0 0.76371 0.08349 0.49980 1.0000 + Mn Mn845 1.0 0.72204 0.12516 0.49980 1.0000 + Mn Mn846 1.0 0.68037 0.16683 0.49980 1.0000 + Mn Mn847 1.0 0.63871 0.20849 0.49980 1.0000 + Mn Mn848 1.0 0.59704 0.25016 0.49980 1.0000 + Mn Mn849 1.0 0.55537 0.29183 0.49980 1.0000 + Mn Mn850 1.0 0.51371 0.33349 0.49980 1.0000 + Mn Mn851 1.0 0.47204 0.37516 0.49980 1.0000 + Mn Mn852 1.0 0.43037 0.41683 0.49980 1.0000 + Mn Mn853 1.0 0.93037 0.00016 0.49980 1.0000 + Mn Mn854 1.0 0.88871 0.04183 0.49980 1.0000 + Mn Mn855 1.0 0.84704 0.08349 0.49980 1.0000 + Mn Mn856 1.0 0.80537 0.12516 0.49980 1.0000 + Mn Mn857 1.0 0.76371 0.16683 0.49980 1.0000 + Mn Mn858 1.0 0.72204 0.20849 0.49980 1.0000 + Mn Mn859 1.0 0.68037 0.25016 0.49980 1.0000 + Mn Mn860 1.0 0.63871 0.29183 0.49980 1.0000 + Mn Mn861 1.0 0.59704 0.33349 0.49980 1.0000 + Mn Mn862 1.0 0.55537 0.37516 0.49980 1.0000 + Mn Mn863 1.0 0.51371 0.41683 0.49980 1.0000 + Mn Mn864 1.0 0.47204 0.45849 0.49980 1.0000 + Cr Cr145 1.0 0.51372 0.54183 0.49851 1.0000 + Cr Cr146 1.0 0.47205 0.58350 0.49851 1.0000 + Cr Cr147 1.0 0.43038 0.62516 0.49851 1.0000 + Cr Cr148 1.0 0.38872 0.66683 0.49851 1.0000 + Cr Cr149 1.0 0.34705 0.70850 0.49851 1.0000 + Cr Cr150 1.0 0.30538 0.75016 0.49851 1.0000 + Cr Cr151 1.0 0.26372 0.79183 0.49851 1.0000 + Cr Cr152 1.0 0.22205 0.83350 0.49851 1.0000 + Cr Cr153 1.0 0.18038 0.87516 0.49851 1.0000 + Cr Cr154 1.0 0.13872 0.91683 0.49851 1.0000 + Cr Cr155 1.0 0.09705 0.95850 0.49851 1.0000 + Cr Cr156 1.0 0.05538 0.00016 0.49851 1.0000 + Cr Cr157 1.0 0.55538 0.58350 0.49851 1.0000 + Cr Cr158 1.0 0.51372 0.62516 0.49851 1.0000 + Cr Cr159 1.0 0.47205 0.66683 0.49851 1.0000 + Cr Cr160 1.0 0.43038 0.70850 0.49851 1.0000 + Cr Cr161 1.0 0.38872 0.75016 0.49851 1.0000 + Cr Cr162 1.0 0.34705 0.79183 0.49851 1.0000 + Cr Cr163 1.0 0.30538 0.83350 0.49851 1.0000 + Cr Cr164 1.0 0.26372 0.87516 0.49851 1.0000 + Cr Cr165 1.0 0.22205 0.91683 0.49851 1.0000 + Cr Cr166 1.0 0.18038 0.95850 0.49851 1.0000 + Cr Cr167 1.0 0.13872 0.00016 0.49851 1.0000 + Cr Cr168 1.0 0.09705 0.04183 0.49851 1.0000 + Cr Cr169 1.0 0.59705 0.62516 0.49851 1.0000 + Cr Cr170 1.0 0.55538 0.66683 0.49851 1.0000 + Cr Cr171 1.0 0.51372 0.70850 0.49851 1.0000 + Cr Cr172 1.0 0.47205 0.75016 0.49851 1.0000 + Cr Cr173 1.0 0.43038 0.79183 0.49851 1.0000 + Cr Cr174 1.0 0.38872 0.83350 0.49851 1.0000 + Cr Cr175 1.0 0.34705 0.87516 0.49851 1.0000 + Cr Cr176 1.0 0.30538 0.91683 0.49851 1.0000 + Cr Cr177 1.0 0.26372 0.95850 0.49851 1.0000 + Cr Cr178 1.0 0.22205 0.00016 0.49851 1.0000 + Cr Cr179 1.0 0.18038 0.04183 0.49851 1.0000 + Cr Cr180 1.0 0.13872 0.08350 0.49851 1.0000 + Cr Cr181 1.0 0.63872 0.66683 0.49851 1.0000 + Cr Cr182 1.0 0.59705 0.70850 0.49851 1.0000 + Cr Cr183 1.0 0.55538 0.75016 0.49851 1.0000 + Cr Cr184 1.0 0.51372 0.79183 0.49851 1.0000 + Cr Cr185 1.0 0.47205 0.83350 0.49851 1.0000 + Cr Cr186 1.0 0.43038 0.87516 0.49851 1.0000 + Cr Cr187 1.0 0.38872 0.91683 0.49851 1.0000 + Cr Cr188 1.0 0.34705 0.95850 0.49851 1.0000 + Cr Cr189 1.0 0.30538 0.00016 0.49851 1.0000 + Cr Cr190 1.0 0.26372 0.04183 0.49851 1.0000 + Cr Cr191 1.0 0.22205 0.08350 0.49851 1.0000 + Cr Cr192 1.0 0.18038 0.12516 0.49851 1.0000 + Cr Cr193 1.0 0.68038 0.70850 0.49851 1.0000 + Cr Cr194 1.0 0.63872 0.75016 0.49851 1.0000 + Cr Cr195 1.0 0.59705 0.79183 0.49851 1.0000 + Cr Cr196 1.0 0.55538 0.83350 0.49851 1.0000 + Cr Cr197 1.0 0.51372 0.87516 0.49851 1.0000 + Cr Cr198 1.0 0.47205 0.91683 0.49851 1.0000 + Cr Cr199 1.0 0.43038 0.95850 0.49851 1.0000 + Cr Cr200 1.0 0.38872 0.00016 0.49851 1.0000 + Cr Cr201 1.0 0.34705 0.04183 0.49851 1.0000 + Cr Cr202 1.0 0.30538 0.08350 0.49851 1.0000 + Cr Cr203 1.0 0.26372 0.12516 0.49851 1.0000 + Cr Cr204 1.0 0.22205 0.16683 0.49851 1.0000 + Cr Cr205 1.0 0.72205 0.75016 0.49851 1.0000 + Cr Cr206 1.0 0.68038 0.79183 0.49851 1.0000 + Cr Cr207 1.0 0.63872 0.83350 0.49851 1.0000 + Cr Cr208 1.0 0.59705 0.87516 0.49851 1.0000 + Cr Cr209 1.0 0.55538 0.91683 0.49851 1.0000 + Cr Cr210 1.0 0.51372 0.95850 0.49851 1.0000 + Cr Cr211 1.0 0.47205 0.00016 0.49851 1.0000 + Cr Cr212 1.0 0.43038 0.04183 0.49851 1.0000 + Cr Cr213 1.0 0.38872 0.08350 0.49851 1.0000 + Cr Cr214 1.0 0.34705 0.12516 0.49851 1.0000 + Cr Cr215 1.0 0.30538 0.16683 0.49851 1.0000 + Cr Cr216 1.0 0.26372 0.20850 0.49851 1.0000 + Cr Cr217 1.0 0.76372 0.79183 0.49851 1.0000 + Cr Cr218 1.0 0.72205 0.83350 0.49851 1.0000 + Cr Cr219 1.0 0.68038 0.87516 0.49851 1.0000 + Cr Cr220 1.0 0.63872 0.91683 0.49851 1.0000 + Cr Cr221 1.0 0.59705 0.95850 0.49851 1.0000 + Cr Cr222 1.0 0.55538 0.00016 0.49851 1.0000 + Cr Cr223 1.0 0.51372 0.04183 0.49851 1.0000 + Cr Cr224 1.0 0.47205 0.08350 0.49851 1.0000 + Cr Cr225 1.0 0.43038 0.12516 0.49851 1.0000 + Cr Cr226 1.0 0.38872 0.16683 0.49851 1.0000 + Cr Cr227 1.0 0.34705 0.20850 0.49851 1.0000 + Cr Cr228 1.0 0.30538 0.25016 0.49851 1.0000 + Cr Cr229 1.0 0.80538 0.83350 0.49851 1.0000 + Cr Cr230 1.0 0.76372 0.87516 0.49851 1.0000 + Cr Cr231 1.0 0.72205 0.91683 0.49851 1.0000 + Cr Cr232 1.0 0.68038 0.95850 0.49851 1.0000 + Cr Cr233 1.0 0.63872 0.00016 0.49851 1.0000 + Cr Cr234 1.0 0.59705 0.04183 0.49851 1.0000 + Cr Cr235 1.0 0.55538 0.08350 0.49851 1.0000 + Cr Cr236 1.0 0.51372 0.12516 0.49851 1.0000 + Cr Cr237 1.0 0.47205 0.16683 0.49851 1.0000 + Cr Cr238 1.0 0.43038 0.20850 0.49851 1.0000 + Cr Cr239 1.0 0.38872 0.25016 0.49851 1.0000 + Cr Cr240 1.0 0.34705 0.29183 0.49851 1.0000 + Cr Cr241 1.0 0.84705 0.87516 0.49851 1.0000 + Cr Cr242 1.0 0.80538 0.91683 0.49851 1.0000 + Cr Cr243 1.0 0.76372 0.95850 0.49851 1.0000 + Cr Cr244 1.0 0.72205 0.00016 0.49851 1.0000 + Cr Cr245 1.0 0.68038 0.04183 0.49851 1.0000 + Cr Cr246 1.0 0.63872 0.08350 0.49851 1.0000 + Cr Cr247 1.0 0.59705 0.12516 0.49851 1.0000 + Cr Cr248 1.0 0.55538 0.16683 0.49851 1.0000 + Cr Cr249 1.0 0.51372 0.20850 0.49851 1.0000 + Cr Cr250 1.0 0.47205 0.25016 0.49851 1.0000 + Cr Cr251 1.0 0.43038 0.29183 0.49851 1.0000 + Cr Cr252 1.0 0.38872 0.33350 0.49851 1.0000 + Cr Cr253 1.0 0.88872 0.91683 0.49851 1.0000 + Cr Cr254 1.0 0.84705 0.95850 0.49851 1.0000 + Cr Cr255 1.0 0.80538 0.00016 0.49851 1.0000 + Cr Cr256 1.0 0.76372 0.04183 0.49851 1.0000 + Cr Cr257 1.0 0.72205 0.08350 0.49851 1.0000 + Cr Cr258 1.0 0.68038 0.12516 0.49851 1.0000 + Cr Cr259 1.0 0.63872 0.16683 0.49851 1.0000 + Cr Cr260 1.0 0.59705 0.20850 0.49851 1.0000 + Cr Cr261 1.0 0.55538 0.25016 0.49851 1.0000 + Cr Cr262 1.0 0.51372 0.29183 0.49851 1.0000 + Cr Cr263 1.0 0.47205 0.33350 0.49851 1.0000 + Cr Cr264 1.0 0.43038 0.37516 0.49851 1.0000 + Cr Cr265 1.0 0.93038 0.95850 0.49851 1.0000 + Cr Cr266 1.0 0.88872 0.00016 0.49851 1.0000 + Cr Cr267 1.0 0.84705 0.04183 0.49851 1.0000 + Cr Cr268 1.0 0.80538 0.08350 0.49851 1.0000 + Cr Cr269 1.0 0.76372 0.12516 0.49851 1.0000 + Cr Cr270 1.0 0.72205 0.16683 0.49851 1.0000 + Cr Cr271 1.0 0.68038 0.20850 0.49851 1.0000 + Cr Cr272 1.0 0.63872 0.25016 0.49851 1.0000 + Cr Cr273 1.0 0.59705 0.29183 0.49851 1.0000 + Cr Cr274 1.0 0.55538 0.33350 0.49851 1.0000 + Cr Cr275 1.0 0.51372 0.37516 0.49851 1.0000 + Cr Cr276 1.0 0.47205 0.41683 0.49851 1.0000 + Cr Cr277 1.0 0.97205 0.00016 0.49851 1.0000 + Cr Cr278 1.0 0.93038 0.04183 0.49851 1.0000 + Cr Cr279 1.0 0.88872 0.08350 0.49851 1.0000 + Cr Cr280 1.0 0.84705 0.12516 0.49851 1.0000 + Cr Cr281 1.0 0.80538 0.16683 0.49851 1.0000 + Cr Cr282 1.0 0.76372 0.20850 0.49851 1.0000 + Cr Cr283 1.0 0.72205 0.25016 0.49851 1.0000 + Cr Cr284 1.0 0.68038 0.29183 0.49851 1.0000 + Cr Cr285 1.0 0.63872 0.33350 0.49851 1.0000 + Cr Cr286 1.0 0.59705 0.37516 0.49851 1.0000 + Cr Cr287 1.0 0.55538 0.41683 0.49851 1.0000 + Cr Cr288 1.0 0.51372 0.45850 0.49851 1.0000 + O O1153 1.0 0.54148 0.54183 0.33800 1.0000 + O O1154 1.0 0.49981 0.58350 0.33800 1.0000 + O O1155 1.0 0.45814 0.62517 0.33800 1.0000 + O O1156 1.0 0.41648 0.66683 0.33800 1.0000 + O O1157 1.0 0.37481 0.70850 0.33800 1.0000 + O O1158 1.0 0.33314 0.75017 0.33800 1.0000 + O O1159 1.0 0.29148 0.79183 0.33800 1.0000 + O O1160 1.0 0.24981 0.83350 0.33800 1.0000 + O O1161 1.0 0.20814 0.87517 0.33800 1.0000 + O O1162 1.0 0.16648 0.91683 0.33800 1.0000 + O O1163 1.0 0.12481 0.95850 0.33800 1.0000 + O O1164 1.0 0.08314 0.00017 0.33800 1.0000 + O O1165 1.0 0.58314 0.58350 0.33800 1.0000 + O O1166 1.0 0.54148 0.62517 0.33800 1.0000 + O O1167 1.0 0.49981 0.66683 0.33800 1.0000 + O O1168 1.0 0.45814 0.70850 0.33800 1.0000 + O O1169 1.0 0.41648 0.75017 0.33800 1.0000 + O O1170 1.0 0.37481 0.79183 0.33800 1.0000 + O O1171 1.0 0.33314 0.83350 0.33800 1.0000 + O O1172 1.0 0.29148 0.87517 0.33800 1.0000 + O O1173 1.0 0.24981 0.91683 0.33800 1.0000 + O O1174 1.0 0.20814 0.95850 0.33800 1.0000 + O O1175 1.0 0.16648 0.00017 0.33800 1.0000 + O O1176 1.0 0.12481 0.04183 0.33800 1.0000 + O O1177 1.0 0.62481 0.62517 0.33800 1.0000 + O O1178 1.0 0.58314 0.66683 0.33800 1.0000 + O O1179 1.0 0.54148 0.70850 0.33800 1.0000 + O O1180 1.0 0.49981 0.75017 0.33800 1.0000 + O O1181 1.0 0.45814 0.79183 0.33800 1.0000 + O O1182 1.0 0.41648 0.83350 0.33800 1.0000 + O O1183 1.0 0.37481 0.87517 0.33800 1.0000 + O O1184 1.0 0.33314 0.91683 0.33800 1.0000 + O O1185 1.0 0.29148 0.95850 0.33800 1.0000 + O O1186 1.0 0.24981 0.00017 0.33800 1.0000 + O O1187 1.0 0.20814 0.04183 0.33800 1.0000 + O O1188 1.0 0.16648 0.08350 0.33800 1.0000 + O O1189 1.0 0.66648 0.66683 0.33800 1.0000 + O O1190 1.0 0.62481 0.70850 0.33800 1.0000 + O O1191 1.0 0.58314 0.75017 0.33800 1.0000 + O O1192 1.0 0.54148 0.79183 0.33800 1.0000 + O O1193 1.0 0.49981 0.83350 0.33800 1.0000 + O O1194 1.0 0.45814 0.87517 0.33800 1.0000 + O O1195 1.0 0.41648 0.91683 0.33800 1.0000 + O O1196 1.0 0.37481 0.95850 0.33800 1.0000 + O O1197 1.0 0.33314 0.00017 0.33800 1.0000 + O O1198 1.0 0.29148 0.04183 0.33800 1.0000 + O O1199 1.0 0.24981 0.08350 0.33800 1.0000 + O O1200 1.0 0.20814 0.12517 0.33800 1.0000 + O O1201 1.0 0.70814 0.70850 0.33800 1.0000 + O O1202 1.0 0.66648 0.75017 0.33800 1.0000 + O O1203 1.0 0.62481 0.79183 0.33800 1.0000 + O O1204 1.0 0.58314 0.83350 0.33800 1.0000 + O O1205 1.0 0.54148 0.87517 0.33800 1.0000 + O O1206 1.0 0.49981 0.91683 0.33800 1.0000 + O O1207 1.0 0.45814 0.95850 0.33800 1.0000 + O O1208 1.0 0.41648 0.00017 0.33800 1.0000 + O O1209 1.0 0.37481 0.04183 0.33800 1.0000 + O O1210 1.0 0.33314 0.08350 0.33800 1.0000 + O O1211 1.0 0.29148 0.12517 0.33800 1.0000 + O O1212 1.0 0.24981 0.16683 0.33800 1.0000 + O O1213 1.0 0.74981 0.75017 0.33800 1.0000 + O O1214 1.0 0.70814 0.79183 0.33800 1.0000 + O O1215 1.0 0.66648 0.83350 0.33800 1.0000 + O O1216 1.0 0.62481 0.87517 0.33800 1.0000 + O O1217 1.0 0.58314 0.91683 0.33800 1.0000 + O O1218 1.0 0.54148 0.95850 0.33800 1.0000 + O O1219 1.0 0.49981 0.00017 0.33800 1.0000 + O O1220 1.0 0.45814 0.04183 0.33800 1.0000 + O O1221 1.0 0.41648 0.08350 0.33800 1.0000 + O O1222 1.0 0.37481 0.12517 0.33800 1.0000 + O O1223 1.0 0.33314 0.16683 0.33800 1.0000 + O O1224 1.0 0.29148 0.20850 0.33800 1.0000 + O O1225 1.0 0.79148 0.79183 0.33800 1.0000 + O O1226 1.0 0.74981 0.83350 0.33800 1.0000 + O O1227 1.0 0.70814 0.87517 0.33800 1.0000 + O O1228 1.0 0.66648 0.91683 0.33800 1.0000 + O O1229 1.0 0.62481 0.95850 0.33800 1.0000 + O O1230 1.0 0.58314 0.00017 0.33800 1.0000 + O O1231 1.0 0.54148 0.04183 0.33800 1.0000 + O O1232 1.0 0.49981 0.08350 0.33800 1.0000 + O O1233 1.0 0.45814 0.12517 0.33800 1.0000 + O O1234 1.0 0.41648 0.16683 0.33800 1.0000 + O O1235 1.0 0.37481 0.20850 0.33800 1.0000 + O O1236 1.0 0.33314 0.25017 0.33800 1.0000 + O O1237 1.0 0.83314 0.83350 0.33800 1.0000 + O O1238 1.0 0.79148 0.87517 0.33800 1.0000 + O O1239 1.0 0.74981 0.91683 0.33800 1.0000 + O O1240 1.0 0.70814 0.95850 0.33800 1.0000 + O O1241 1.0 0.66648 0.00017 0.33800 1.0000 + O O1242 1.0 0.62481 0.04183 0.33800 1.0000 + O O1243 1.0 0.58314 0.08350 0.33800 1.0000 + O O1244 1.0 0.54148 0.12517 0.33800 1.0000 + O O1245 1.0 0.49981 0.16683 0.33800 1.0000 + O O1246 1.0 0.45814 0.20850 0.33800 1.0000 + O O1247 1.0 0.41648 0.25017 0.33800 1.0000 + O O1248 1.0 0.37481 0.29183 0.33800 1.0000 + O O1249 1.0 0.87481 0.87517 0.33800 1.0000 + O O1250 1.0 0.83314 0.91683 0.33800 1.0000 + O O1251 1.0 0.79148 0.95850 0.33800 1.0000 + O O1252 1.0 0.74981 0.00017 0.33800 1.0000 + O O1253 1.0 0.70814 0.04183 0.33800 1.0000 + O O1254 1.0 0.66648 0.08350 0.33800 1.0000 + O O1255 1.0 0.62481 0.12517 0.33800 1.0000 + O O1256 1.0 0.58314 0.16683 0.33800 1.0000 + O O1257 1.0 0.54148 0.20850 0.33800 1.0000 + O O1258 1.0 0.49981 0.25017 0.33800 1.0000 + O O1259 1.0 0.45814 0.29183 0.33800 1.0000 + O O1260 1.0 0.41648 0.33350 0.33800 1.0000 + O O1261 1.0 0.91648 0.91683 0.33800 1.0000 + O O1262 1.0 0.87481 0.95850 0.33800 1.0000 + O O1263 1.0 0.83314 0.00017 0.33800 1.0000 + O O1264 1.0 0.79148 0.04183 0.33800 1.0000 + O O1265 1.0 0.74981 0.08350 0.33800 1.0000 + O O1266 1.0 0.70814 0.12517 0.33800 1.0000 + O O1267 1.0 0.66648 0.16683 0.33800 1.0000 + O O1268 1.0 0.62481 0.20850 0.33800 1.0000 + O O1269 1.0 0.58314 0.25017 0.33800 1.0000 + O O1270 1.0 0.54148 0.29183 0.33800 1.0000 + O O1271 1.0 0.49981 0.33350 0.33800 1.0000 + O O1272 1.0 0.45814 0.37517 0.33800 1.0000 + O O1273 1.0 0.95814 0.95850 0.33800 1.0000 + O O1274 1.0 0.91648 0.00017 0.33800 1.0000 + O O1275 1.0 0.87481 0.04183 0.33800 1.0000 + O O1276 1.0 0.83314 0.08350 0.33800 1.0000 + O O1277 1.0 0.79148 0.12517 0.33800 1.0000 + O O1278 1.0 0.74981 0.16683 0.33800 1.0000 + O O1279 1.0 0.70814 0.20850 0.33800 1.0000 + O O1280 1.0 0.66648 0.25017 0.33800 1.0000 + O O1281 1.0 0.62481 0.29183 0.33800 1.0000 + O O1282 1.0 0.58314 0.33350 0.33800 1.0000 + O O1283 1.0 0.54148 0.37517 0.33800 1.0000 + O O1284 1.0 0.49981 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a/tier3/cif_file/orthogonal_2dm-4393_supercell_12x12x1.cif b/tier3/cif_file/orthogonal_2dm-4393_supercell_12x12x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..5e5fe54ba38211b81aa1aba17f6e106cfd0c501d --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-4393_supercell_12x12x1.cif @@ -0,0 +1,2905 @@ +data_image0 +_chemical_formula_structural S576I1152N1152 +_chemical_formula_sum "S576 I1152 N1152" +_cell_length_a 145.679 +_cell_length_b 149.842 +_cell_length_c 4.4003 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + S S1 1.0 0.03204 0.07267 0.50749 1.0000 + S S2 1.0 0.03204 0.15600 0.50749 1.0000 + S S3 1.0 0.03204 0.23933 0.50749 1.0000 + S S4 1.0 0.03204 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N24 1.0 0.15764 0.97915 0.49446 1.0000 + N N25 1.0 0.24097 0.06248 0.49446 1.0000 + N N26 1.0 0.24097 0.14582 0.49446 1.0000 + N N27 1.0 0.24097 0.22915 0.49446 1.0000 + N N28 1.0 0.24097 0.31248 0.49446 1.0000 + N N29 1.0 0.24097 0.39582 0.49446 1.0000 + N N30 1.0 0.24097 0.47915 0.49446 1.0000 + N N31 1.0 0.24097 0.56248 0.49446 1.0000 + N N32 1.0 0.24097 0.64582 0.49446 1.0000 + N N33 1.0 0.24097 0.72915 0.49446 1.0000 + N N34 1.0 0.24097 0.81248 0.49446 1.0000 + N N35 1.0 0.24097 0.89582 0.49446 1.0000 + N N36 1.0 0.24097 0.97915 0.49446 1.0000 + N N37 1.0 0.32431 0.06248 0.49446 1.0000 + N N38 1.0 0.32431 0.14582 0.49446 1.0000 + N N39 1.0 0.32431 0.22915 0.49446 1.0000 + N N40 1.0 0.32431 0.31248 0.49446 1.0000 + N N41 1.0 0.32431 0.39582 0.49446 1.0000 + N N42 1.0 0.32431 0.47915 0.49446 1.0000 + N N43 1.0 0.32431 0.56248 0.49446 1.0000 + N N44 1.0 0.32431 0.64582 0.49446 1.0000 + N N45 1.0 0.32431 0.72915 0.49446 1.0000 + N N46 1.0 0.32431 0.81248 0.49446 1.0000 + N N47 1.0 0.32431 0.89582 0.49446 1.0000 + N N48 1.0 0.32431 0.97915 0.49446 1.0000 + N N49 1.0 0.40764 0.06248 0.49446 1.0000 + N N50 1.0 0.40764 0.14582 0.49446 1.0000 + N N51 1.0 0.40764 0.22915 0.49446 1.0000 + N N52 1.0 0.40764 0.31248 0.49446 1.0000 + N N53 1.0 0.40764 0.39582 0.49446 1.0000 + N N54 1.0 0.40764 0.47915 0.49446 1.0000 + N N55 1.0 0.40764 0.56248 0.49446 1.0000 + N N56 1.0 0.40764 0.64582 0.49446 1.0000 + N N57 1.0 0.40764 0.72915 0.49446 1.0000 + N N58 1.0 0.40764 0.81248 0.49446 1.0000 + N N59 1.0 0.40764 0.89582 0.49446 1.0000 + N N60 1.0 0.40764 0.97915 0.49446 1.0000 + N N61 1.0 0.49097 0.06248 0.49446 1.0000 + N N62 1.0 0.49097 0.14582 0.49446 1.0000 + N N63 1.0 0.49097 0.22915 0.49446 1.0000 + N N64 1.0 0.49097 0.31248 0.49446 1.0000 + N N65 1.0 0.49097 0.39582 0.49446 1.0000 + N N66 1.0 0.49097 0.47915 0.49446 1.0000 + N N67 1.0 0.49097 0.56248 0.49446 1.0000 + N N68 1.0 0.49097 0.64582 0.49446 1.0000 + N N69 1.0 0.49097 0.72915 0.49446 1.0000 + N N70 1.0 0.49097 0.81248 0.49446 1.0000 + N N71 1.0 0.49097 0.89582 0.49446 1.0000 + N N72 1.0 0.49097 0.97915 0.49446 1.0000 + N N73 1.0 0.57431 0.06248 0.49446 1.0000 + N N74 1.0 0.57431 0.14582 0.49446 1.0000 + N N75 1.0 0.57431 0.22915 0.49446 1.0000 + N N76 1.0 0.57431 0.31248 0.49446 1.0000 + N N77 1.0 0.57431 0.39582 0.49446 1.0000 + N N78 1.0 0.57431 0.47915 0.49446 1.0000 + N N79 1.0 0.57431 0.56248 0.49446 1.0000 + N N80 1.0 0.57431 0.64582 0.49446 1.0000 + N N81 1.0 0.57431 0.72915 0.49446 1.0000 + N N82 1.0 0.57431 0.81248 0.49446 1.0000 + N N83 1.0 0.57431 0.89582 0.49446 1.0000 + N N84 1.0 0.57431 0.97915 0.49446 1.0000 + N N85 1.0 0.65764 0.06248 0.49446 1.0000 + N N86 1.0 0.65764 0.14582 0.49446 1.0000 + N N87 1.0 0.65764 0.22915 0.49446 1.0000 + N N88 1.0 0.65764 0.31248 0.49446 1.0000 + N N89 1.0 0.65764 0.39582 0.49446 1.0000 + N N90 1.0 0.65764 0.47915 0.49446 1.0000 + N N91 1.0 0.65764 0.56248 0.49446 1.0000 + N N92 1.0 0.65764 0.64582 0.49446 1.0000 + N N93 1.0 0.65764 0.72915 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0.64582 0.49446 1.0000 + N N117 1.0 0.82431 0.72915 0.49446 1.0000 + N N118 1.0 0.82431 0.81248 0.49446 1.0000 + N N119 1.0 0.82431 0.89582 0.49446 1.0000 + N N120 1.0 0.82431 0.97915 0.49446 1.0000 + N N121 1.0 0.90764 0.06248 0.49446 1.0000 + N N122 1.0 0.90764 0.14582 0.49446 1.0000 + N N123 1.0 0.90764 0.22915 0.49446 1.0000 + N N124 1.0 0.90764 0.31248 0.49446 1.0000 + N N125 1.0 0.90764 0.39582 0.49446 1.0000 + N N126 1.0 0.90764 0.47915 0.49446 1.0000 + N N127 1.0 0.90764 0.56248 0.49446 1.0000 + N N128 1.0 0.90764 0.64582 0.49446 1.0000 + N N129 1.0 0.90764 0.72915 0.49446 1.0000 + N N130 1.0 0.90764 0.81248 0.49446 1.0000 + N N131 1.0 0.90764 0.89582 0.49446 1.0000 + N N132 1.0 0.90764 0.97915 0.49446 1.0000 + N N133 1.0 0.99097 0.06248 0.49446 1.0000 + N N134 1.0 0.99097 0.14582 0.49446 1.0000 + N N135 1.0 0.99097 0.22915 0.49446 1.0000 + N N136 1.0 0.99097 0.31248 0.49446 1.0000 + N N137 1.0 0.99097 0.39582 0.49446 1.0000 + N N138 1.0 0.99097 0.47915 0.49446 1.0000 + N N139 1.0 0.99097 0.56248 0.49446 1.0000 + N N140 1.0 0.99097 0.64582 0.49446 1.0000 + N N141 1.0 0.99097 0.72915 0.49446 1.0000 + N N142 1.0 0.99097 0.81248 0.49446 1.0000 + N N143 1.0 0.99097 0.89582 0.49446 1.0000 + N N144 1.0 0.99097 0.97915 0.49446 1.0000 + N N145 1.0 0.06174 0.00882 0.45681 1.0000 + N N146 1.0 0.06174 0.09215 0.45681 1.0000 + N N147 1.0 0.06174 0.17548 0.45681 1.0000 + N N148 1.0 0.06174 0.25882 0.45681 1.0000 + N N149 1.0 0.06174 0.34215 0.45681 1.0000 + N N150 1.0 0.06174 0.42548 0.45681 1.0000 + N N151 1.0 0.06174 0.50882 0.45681 1.0000 + N N152 1.0 0.06174 0.59215 0.45681 1.0000 + N N153 1.0 0.06174 0.67548 0.45681 1.0000 + N N154 1.0 0.06174 0.75882 0.45681 1.0000 + N N155 1.0 0.06174 0.84215 0.45681 1.0000 + N N156 1.0 0.06174 0.92548 0.45681 1.0000 + N N157 1.0 0.14508 0.00882 0.45681 1.0000 + N N158 1.0 0.14508 0.09215 0.45681 1.0000 + N N159 1.0 0.14508 0.17548 0.45681 1.0000 + N N160 1.0 0.14508 0.25882 0.45681 1.0000 + N N161 1.0 0.14508 0.34215 0.45681 1.0000 + N N162 1.0 0.14508 0.42548 0.45681 1.0000 + N N163 1.0 0.14508 0.50882 0.45681 1.0000 + N N164 1.0 0.14508 0.59215 0.45681 1.0000 + N N165 1.0 0.14508 0.67548 0.45681 1.0000 + N N166 1.0 0.14508 0.75882 0.45681 1.0000 + N N167 1.0 0.14508 0.84215 0.45681 1.0000 + N N168 1.0 0.14508 0.92548 0.45681 1.0000 + N N169 1.0 0.22841 0.00882 0.45681 1.0000 + N N170 1.0 0.22841 0.09215 0.45681 1.0000 + N N171 1.0 0.22841 0.17548 0.45681 1.0000 + N N172 1.0 0.22841 0.25882 0.45681 1.0000 + N N173 1.0 0.22841 0.34215 0.45681 1.0000 + N N174 1.0 0.22841 0.42548 0.45681 1.0000 + N N175 1.0 0.22841 0.50882 0.45681 1.0000 + N N176 1.0 0.22841 0.59215 0.45681 1.0000 + N N177 1.0 0.22841 0.67548 0.45681 1.0000 + N N178 1.0 0.22841 0.75882 0.45681 1.0000 + N N179 1.0 0.22841 0.84215 0.45681 1.0000 + N N180 1.0 0.22841 0.92548 0.45681 1.0000 + N N181 1.0 0.31174 0.00882 0.45681 1.0000 + N N182 1.0 0.31174 0.09215 0.45681 1.0000 + N N183 1.0 0.31174 0.17548 0.45681 1.0000 + N N184 1.0 0.31174 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1.0000 + N N230 1.0 0.64508 0.09215 0.45681 1.0000 + N N231 1.0 0.64508 0.17548 0.45681 1.0000 + N N232 1.0 0.64508 0.25882 0.45681 1.0000 + N N233 1.0 0.64508 0.34215 0.45681 1.0000 + N N234 1.0 0.64508 0.42548 0.45681 1.0000 + N N235 1.0 0.64508 0.50882 0.45681 1.0000 + N N236 1.0 0.64508 0.59215 0.45681 1.0000 + N N237 1.0 0.64508 0.67548 0.45681 1.0000 + N N238 1.0 0.64508 0.75882 0.45681 1.0000 + N N239 1.0 0.64508 0.84215 0.45681 1.0000 + N N240 1.0 0.64508 0.92548 0.45681 1.0000 + N N241 1.0 0.72841 0.00882 0.45681 1.0000 + N N242 1.0 0.72841 0.09215 0.45681 1.0000 + N N243 1.0 0.72841 0.17548 0.45681 1.0000 + N N244 1.0 0.72841 0.25882 0.45681 1.0000 + N N245 1.0 0.72841 0.34215 0.45681 1.0000 + N N246 1.0 0.72841 0.42548 0.45681 1.0000 + N N247 1.0 0.72841 0.50882 0.45681 1.0000 + N N248 1.0 0.72841 0.59215 0.45681 1.0000 + N N249 1.0 0.72841 0.67548 0.45681 1.0000 + N N250 1.0 0.72841 0.75882 0.45681 1.0000 + N N251 1.0 0.72841 0.84215 0.45681 1.0000 + N N252 1.0 0.72841 0.92548 0.45681 1.0000 + N N253 1.0 0.81174 0.00882 0.45681 1.0000 + N N254 1.0 0.81174 0.09215 0.45681 1.0000 + N N255 1.0 0.81174 0.17548 0.45681 1.0000 + N N256 1.0 0.81174 0.25882 0.45681 1.0000 + N N257 1.0 0.81174 0.34215 0.45681 1.0000 + N N258 1.0 0.81174 0.42548 0.45681 1.0000 + N N259 1.0 0.81174 0.50882 0.45681 1.0000 + N N260 1.0 0.81174 0.59215 0.45681 1.0000 + N N261 1.0 0.81174 0.67548 0.45681 1.0000 + N N262 1.0 0.81174 0.75882 0.45681 1.0000 + N N263 1.0 0.81174 0.84215 0.45681 1.0000 + N N264 1.0 0.81174 0.92548 0.45681 1.0000 + N N265 1.0 0.89508 0.00882 0.45681 1.0000 + N N266 1.0 0.89508 0.09215 0.45681 1.0000 + N N267 1.0 0.89508 0.17548 0.45681 1.0000 + N N268 1.0 0.89508 0.25882 0.45681 1.0000 + N N269 1.0 0.89508 0.34215 0.45681 1.0000 + N N270 1.0 0.89508 0.42548 0.45681 1.0000 + N N271 1.0 0.89508 0.50882 0.45681 1.0000 + N N272 1.0 0.89508 0.59215 0.45681 1.0000 + N N273 1.0 0.89508 0.67548 0.45681 1.0000 + N N274 1.0 0.89508 0.75882 0.45681 1.0000 + N N275 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1.0000 + N N298 1.0 0.02159 0.82452 0.54319 1.0000 + N N299 1.0 0.02159 0.90785 0.54319 1.0000 + N N300 1.0 0.02159 0.99118 0.54319 1.0000 + N N301 1.0 0.10492 0.07452 0.54319 1.0000 + N N302 1.0 0.10492 0.15785 0.54319 1.0000 + N N303 1.0 0.10492 0.24118 0.54319 1.0000 + N N304 1.0 0.10492 0.32452 0.54319 1.0000 + N N305 1.0 0.10492 0.40785 0.54319 1.0000 + N N306 1.0 0.10492 0.49118 0.54319 1.0000 + N N307 1.0 0.10492 0.57452 0.54319 1.0000 + N N308 1.0 0.10492 0.65785 0.54319 1.0000 + N N309 1.0 0.10492 0.74118 0.54319 1.0000 + N N310 1.0 0.10492 0.82452 0.54319 1.0000 + N N311 1.0 0.10492 0.90785 0.54319 1.0000 + N N312 1.0 0.10492 0.99118 0.54319 1.0000 + N N313 1.0 0.18826 0.07452 0.54319 1.0000 + N N314 1.0 0.18826 0.15785 0.54319 1.0000 + N N315 1.0 0.18826 0.24118 0.54319 1.0000 + N N316 1.0 0.18826 0.32452 0.54319 1.0000 + N N317 1.0 0.18826 0.40785 0.54319 1.0000 + N N318 1.0 0.18826 0.49118 0.54319 1.0000 + N N319 1.0 0.18826 0.57452 0.54319 1.0000 + N N320 1.0 0.18826 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Te Te809 1.0 0.33262 0.85140 0.60251 1.0000 + Te Te810 1.0 0.30137 0.88265 0.60251 1.0000 + Te Te811 1.0 0.27012 0.91390 0.60251 1.0000 + Te Te812 1.0 0.23887 0.94515 0.60251 1.0000 + Te Te813 1.0 0.20762 0.97640 0.60251 1.0000 + Te Te814 1.0 0.17637 0.00765 0.60251 1.0000 + Te Te815 1.0 0.14512 0.03890 0.60251 1.0000 + Te Te816 1.0 0.11387 0.07015 0.60251 1.0000 + Te Te817 1.0 0.61387 0.63265 0.60251 1.0000 + Te Te818 1.0 0.58262 0.66390 0.60251 1.0000 + Te Te819 1.0 0.55137 0.69515 0.60251 1.0000 + Te Te820 1.0 0.52012 0.72640 0.60251 1.0000 + Te Te821 1.0 0.48887 0.75765 0.60251 1.0000 + Te Te822 1.0 0.45762 0.78890 0.60251 1.0000 + Te Te823 1.0 0.42637 0.82015 0.60251 1.0000 + Te Te824 1.0 0.39512 0.85140 0.60251 1.0000 + Te Te825 1.0 0.36387 0.88265 0.60251 1.0000 + Te Te826 1.0 0.33262 0.91390 0.60251 1.0000 + Te Te827 1.0 0.30137 0.94515 0.60251 1.0000 + Te Te828 1.0 0.27012 0.97640 0.60251 1.0000 + Te Te829 1.0 0.23887 0.00765 0.60251 1.0000 + Te Te830 1.0 0.20762 0.03890 0.60251 1.0000 + Te Te831 1.0 0.17637 0.07015 0.60251 1.0000 + Te Te832 1.0 0.14512 0.10140 0.60251 1.0000 + Te Te833 1.0 0.64512 0.66390 0.60251 1.0000 + Te Te834 1.0 0.61387 0.69515 0.60251 1.0000 + Te Te835 1.0 0.58262 0.72640 0.60251 1.0000 + Te Te836 1.0 0.55137 0.75765 0.60251 1.0000 + Te Te837 1.0 0.52012 0.78890 0.60251 1.0000 + Te Te838 1.0 0.48887 0.82015 0.60251 1.0000 + Te Te839 1.0 0.45762 0.85140 0.60251 1.0000 + Te Te840 1.0 0.42637 0.88265 0.60251 1.0000 + Te Te841 1.0 0.39512 0.91390 0.60251 1.0000 + Te Te842 1.0 0.36387 0.94515 0.60251 1.0000 + Te Te843 1.0 0.33262 0.97640 0.60251 1.0000 + Te Te844 1.0 0.30137 0.00765 0.60251 1.0000 + Te Te845 1.0 0.27012 0.03890 0.60251 1.0000 + Te Te846 1.0 0.23887 0.07015 0.60251 1.0000 + Te Te847 1.0 0.20762 0.10140 0.60251 1.0000 + Te Te848 1.0 0.17637 0.13265 0.60251 1.0000 + Te Te849 1.0 0.67637 0.69515 0.60251 1.0000 + Te Te850 1.0 0.64512 0.72640 0.60251 1.0000 + Te Te851 1.0 0.61387 0.75765 0.60251 1.0000 + Te Te852 1.0 0.58262 0.78890 0.60251 1.0000 + Te Te853 1.0 0.55137 0.82015 0.60251 1.0000 + Te Te854 1.0 0.52012 0.85140 0.60251 1.0000 + Te Te855 1.0 0.48887 0.88265 0.60251 1.0000 + Te Te856 1.0 0.45762 0.91390 0.60251 1.0000 + Te Te857 1.0 0.42637 0.94515 0.60251 1.0000 + Te Te858 1.0 0.39512 0.97640 0.60251 1.0000 + Te Te859 1.0 0.36387 0.00765 0.60251 1.0000 + Te Te860 1.0 0.33262 0.03890 0.60251 1.0000 + Te Te861 1.0 0.30137 0.07015 0.60251 1.0000 + Te Te862 1.0 0.27012 0.10140 0.60251 1.0000 + Te Te863 1.0 0.23887 0.13265 0.60251 1.0000 + Te Te864 1.0 0.20762 0.16390 0.60251 1.0000 + Te Te865 1.0 0.70762 0.72640 0.60251 1.0000 + Te Te866 1.0 0.67637 0.75765 0.60251 1.0000 + Te Te867 1.0 0.64512 0.78890 0.60251 1.0000 + Te Te868 1.0 0.61387 0.82015 0.60251 1.0000 + Te Te869 1.0 0.58262 0.85140 0.60251 1.0000 + Te Te870 1.0 0.55137 0.88265 0.60251 1.0000 + Te Te871 1.0 0.52012 0.91390 0.60251 1.0000 + Te Te872 1.0 0.48887 0.94515 0.60251 1.0000 + Te Te873 1.0 0.45762 0.97640 0.60251 1.0000 + Te Te874 1.0 0.42637 0.00765 0.60251 1.0000 + Te Te875 1.0 0.39512 0.03890 0.60251 1.0000 + Te Te876 1.0 0.36387 0.07015 0.60251 1.0000 + Te Te877 1.0 0.33262 0.10140 0.60251 1.0000 + Te Te878 1.0 0.30137 0.13265 0.60251 1.0000 + Te Te879 1.0 0.27012 0.16390 0.60251 1.0000 + Te Te880 1.0 0.23887 0.19515 0.60251 1.0000 + Te Te881 1.0 0.73887 0.75765 0.60251 1.0000 + Te Te882 1.0 0.70762 0.78890 0.60251 1.0000 + Te Te883 1.0 0.67637 0.82015 0.60251 1.0000 + Te Te884 1.0 0.64512 0.85140 0.60251 1.0000 + Te Te885 1.0 0.61387 0.88265 0.60251 1.0000 + Te Te886 1.0 0.58262 0.91390 0.60251 1.0000 + Te Te887 1.0 0.55137 0.94515 0.60251 1.0000 + Te Te888 1.0 0.52012 0.97640 0.60251 1.0000 + Te Te889 1.0 0.48887 0.00765 0.60251 1.0000 + Te Te890 1.0 0.45762 0.03890 0.60251 1.0000 + Te Te891 1.0 0.42637 0.07015 0.60251 1.0000 + Te Te892 1.0 0.39512 0.10140 0.60251 1.0000 + Te Te893 1.0 0.36387 0.13265 0.60251 1.0000 + Te Te894 1.0 0.33262 0.16390 0.60251 1.0000 + Te Te895 1.0 0.30137 0.19515 0.60251 1.0000 + Te Te896 1.0 0.27012 0.22640 0.60251 1.0000 + Te Te897 1.0 0.77012 0.78890 0.60251 1.0000 + Te Te898 1.0 0.73887 0.82015 0.60251 1.0000 + Te Te899 1.0 0.70762 0.85140 0.60251 1.0000 + Te Te900 1.0 0.67637 0.88265 0.60251 1.0000 + Te Te901 1.0 0.64512 0.91390 0.60251 1.0000 + Te Te902 1.0 0.61387 0.94515 0.60251 1.0000 + Te Te903 1.0 0.58262 0.97640 0.60251 1.0000 + Te Te904 1.0 0.55137 0.00765 0.60251 1.0000 + Te Te905 1.0 0.52012 0.03890 0.60251 1.0000 + Te Te906 1.0 0.48887 0.07015 0.60251 1.0000 + Te Te907 1.0 0.45762 0.10140 0.60251 1.0000 + Te Te908 1.0 0.42637 0.13265 0.60251 1.0000 + Te Te909 1.0 0.39512 0.16390 0.60251 1.0000 + Te Te910 1.0 0.36387 0.19515 0.60251 1.0000 + Te Te911 1.0 0.33262 0.22640 0.60251 1.0000 + Te Te912 1.0 0.30137 0.25765 0.60251 1.0000 + Te Te913 1.0 0.80137 0.82015 0.60251 1.0000 + Te Te914 1.0 0.77012 0.85140 0.60251 1.0000 + Te Te915 1.0 0.73887 0.88265 0.60251 1.0000 + Te Te916 1.0 0.70762 0.91390 0.60251 1.0000 + Te Te917 1.0 0.67637 0.94515 0.60251 1.0000 + Te Te918 1.0 0.64512 0.97640 0.60251 1.0000 + Te Te919 1.0 0.61387 0.00765 0.60251 1.0000 + Te Te920 1.0 0.58262 0.03890 0.60251 1.0000 + Te Te921 1.0 0.55137 0.07015 0.60251 1.0000 + Te Te922 1.0 0.52012 0.10140 0.60251 1.0000 + Te Te923 1.0 0.48887 0.13265 0.60251 1.0000 + Te Te924 1.0 0.45762 0.16390 0.60251 1.0000 + Te Te925 1.0 0.42637 0.19515 0.60251 1.0000 + Te Te926 1.0 0.39512 0.22640 0.60251 1.0000 + Te Te927 1.0 0.36387 0.25765 0.60251 1.0000 + Te Te928 1.0 0.33262 0.28890 0.60251 1.0000 + Te Te929 1.0 0.83262 0.85140 0.60251 1.0000 + Te Te930 1.0 0.80137 0.88265 0.60251 1.0000 + Te Te931 1.0 0.77012 0.91390 0.60251 1.0000 + Te Te932 1.0 0.73887 0.94515 0.60251 1.0000 + Te Te933 1.0 0.70762 0.97640 0.60251 1.0000 + Te Te934 1.0 0.67637 0.00765 0.60251 1.0000 + Te Te935 1.0 0.64512 0.03890 0.60251 1.0000 + Te Te936 1.0 0.61387 0.07015 0.60251 1.0000 + Te Te937 1.0 0.58262 0.10140 0.60251 1.0000 + Te Te938 1.0 0.55137 0.13265 0.60251 1.0000 + Te Te939 1.0 0.52012 0.16390 0.60251 1.0000 + Te Te940 1.0 0.48887 0.19515 0.60251 1.0000 + Te Te941 1.0 0.45762 0.22640 0.60251 1.0000 + Te Te942 1.0 0.42637 0.25765 0.60251 1.0000 + Te Te943 1.0 0.39512 0.28890 0.60251 1.0000 + Te Te944 1.0 0.36387 0.32015 0.60251 1.0000 + Te Te945 1.0 0.86387 0.88265 0.60251 1.0000 + Te Te946 1.0 0.83262 0.91390 0.60251 1.0000 + Te Te947 1.0 0.80137 0.94515 0.60251 1.0000 + Te Te948 1.0 0.77012 0.97640 0.60251 1.0000 + Te Te949 1.0 0.73887 0.00765 0.60251 1.0000 + Te Te950 1.0 0.70762 0.03890 0.60251 1.0000 + Te Te951 1.0 0.67637 0.07015 0.60251 1.0000 + Te Te952 1.0 0.64512 0.10140 0.60251 1.0000 + Te Te953 1.0 0.61387 0.13265 0.60251 1.0000 + Te Te954 1.0 0.58262 0.16390 0.60251 1.0000 + Te Te955 1.0 0.55137 0.19515 0.60251 1.0000 + Te Te956 1.0 0.52012 0.22640 0.60251 1.0000 + Te Te957 1.0 0.48887 0.25765 0.60251 1.0000 + Te Te958 1.0 0.45762 0.28890 0.60251 1.0000 + Te Te959 1.0 0.42637 0.32015 0.60251 1.0000 + Te Te960 1.0 0.39512 0.35140 0.60251 1.0000 + Te Te961 1.0 0.89512 0.91390 0.60251 1.0000 + Te Te962 1.0 0.86387 0.94515 0.60251 1.0000 + Te Te963 1.0 0.83262 0.97640 0.60251 1.0000 + Te Te964 1.0 0.80137 0.00765 0.60251 1.0000 + Te Te965 1.0 0.77012 0.03890 0.60251 1.0000 + Te Te966 1.0 0.73887 0.07015 0.60251 1.0000 + Te Te967 1.0 0.70762 0.10140 0.60251 1.0000 + Te Te968 1.0 0.67637 0.13265 0.60251 1.0000 + Te Te969 1.0 0.64512 0.16390 0.60251 1.0000 + Te Te970 1.0 0.61387 0.19515 0.60251 1.0000 + Te Te971 1.0 0.58262 0.22640 0.60251 1.0000 + Te Te972 1.0 0.55137 0.25765 0.60251 1.0000 + Te Te973 1.0 0.52012 0.28890 0.60251 1.0000 + Te Te974 1.0 0.48887 0.32015 0.60251 1.0000 + Te Te975 1.0 0.45762 0.35140 0.60251 1.0000 + Te Te976 1.0 0.42637 0.38265 0.60251 1.0000 + Te Te977 1.0 0.92637 0.94515 0.60251 1.0000 + Te Te978 1.0 0.89512 0.97640 0.60251 1.0000 + Te Te979 1.0 0.86387 0.00765 0.60251 1.0000 + Te Te980 1.0 0.83262 0.03890 0.60251 1.0000 + Te Te981 1.0 0.80137 0.07015 0.60251 1.0000 + Te Te982 1.0 0.77012 0.10140 0.60251 1.0000 + Te Te983 1.0 0.73887 0.13265 0.60251 1.0000 + Te Te984 1.0 0.70762 0.16390 0.60251 1.0000 + Te Te985 1.0 0.67637 0.19515 0.60251 1.0000 + Te Te986 1.0 0.64512 0.22640 0.60251 1.0000 + Te Te987 1.0 0.61387 0.25765 0.60251 1.0000 + Te Te988 1.0 0.58262 0.28890 0.60251 1.0000 + Te Te989 1.0 0.55137 0.32015 0.60251 1.0000 + Te Te990 1.0 0.52012 0.35140 0.60251 1.0000 + Te Te991 1.0 0.48887 0.38265 0.60251 1.0000 + Te Te992 1.0 0.45762 0.41390 0.60251 1.0000 + Te Te993 1.0 0.95762 0.97640 0.60251 1.0000 + Te Te994 1.0 0.92637 0.00765 0.60251 1.0000 + Te Te995 1.0 0.89512 0.03890 0.60251 1.0000 + Te Te996 1.0 0.86387 0.07015 0.60251 1.0000 + Te Te997 1.0 0.83262 0.10140 0.60251 1.0000 + Te Te998 1.0 0.80137 0.13265 0.60251 1.0000 + Te Te999 1.0 0.77012 0.16390 0.60251 1.0000 + Te Te1000 1.0 0.73887 0.19515 0.60251 1.0000 + Te Te1001 1.0 0.70762 0.22640 0.60251 1.0000 + Te Te1002 1.0 0.67637 0.25765 0.60251 1.0000 + Te Te1003 1.0 0.64512 0.28890 0.60251 1.0000 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1.0 0.50939 0.51287 0.60251 1.0000 + Te Te1026 1.0 0.47814 0.54412 0.60251 1.0000 + Te Te1027 1.0 0.44689 0.57537 0.60251 1.0000 + Te Te1028 1.0 0.41564 0.60662 0.60251 1.0000 + Te Te1029 1.0 0.38439 0.63787 0.60251 1.0000 + Te Te1030 1.0 0.35314 0.66912 0.60251 1.0000 + Te Te1031 1.0 0.32189 0.70037 0.60251 1.0000 + Te Te1032 1.0 0.29064 0.73162 0.60251 1.0000 + Te Te1033 1.0 0.25939 0.76287 0.60251 1.0000 + Te Te1034 1.0 0.22814 0.79412 0.60251 1.0000 + Te Te1035 1.0 0.19689 0.82537 0.60251 1.0000 + Te Te1036 1.0 0.16564 0.85662 0.60251 1.0000 + Te Te1037 1.0 0.13439 0.88787 0.60251 1.0000 + Te Te1038 1.0 0.10314 0.91912 0.60251 1.0000 + Te Te1039 1.0 0.07189 0.95037 0.60251 1.0000 + Te Te1040 1.0 0.04064 0.98162 0.60251 1.0000 + Te Te1041 1.0 0.54064 0.54412 0.60251 1.0000 + Te Te1042 1.0 0.50939 0.57537 0.60251 1.0000 + Te Te1043 1.0 0.47814 0.60662 0.60251 1.0000 + Te Te1044 1.0 0.44689 0.63787 0.60251 1.0000 + Te Te1045 1.0 0.41564 0.66912 0.60251 1.0000 + Te Te1046 1.0 0.38439 0.70037 0.60251 1.0000 + Te Te1047 1.0 0.35314 0.73162 0.60251 1.0000 + Te Te1048 1.0 0.32189 0.76287 0.60251 1.0000 + Te Te1049 1.0 0.29064 0.79412 0.60251 1.0000 + Te Te1050 1.0 0.25939 0.82537 0.60251 1.0000 + Te Te1051 1.0 0.22814 0.85662 0.60251 1.0000 + Te Te1052 1.0 0.19689 0.88787 0.60251 1.0000 + Te Te1053 1.0 0.16564 0.91912 0.60251 1.0000 + Te Te1054 1.0 0.13439 0.95037 0.60251 1.0000 + Te Te1055 1.0 0.10314 0.98162 0.60251 1.0000 + Te Te1056 1.0 0.07189 0.01287 0.60251 1.0000 + Te Te1057 1.0 0.57189 0.57537 0.60251 1.0000 + Te Te1058 1.0 0.54064 0.60662 0.60251 1.0000 + Te Te1059 1.0 0.50939 0.63787 0.60251 1.0000 + Te Te1060 1.0 0.47814 0.66912 0.60251 1.0000 + Te Te1061 1.0 0.44689 0.70037 0.60251 1.0000 + Te Te1062 1.0 0.41564 0.73162 0.60251 1.0000 + Te Te1063 1.0 0.38439 0.76287 0.60251 1.0000 + Te Te1064 1.0 0.35314 0.79412 0.60251 1.0000 + Te Te1065 1.0 0.32189 0.82537 0.60251 1.0000 + Te Te1066 1.0 0.29064 0.85662 0.60251 1.0000 + Te Te1067 1.0 0.25939 0.88787 0.60251 1.0000 + Te Te1068 1.0 0.22814 0.91912 0.60251 1.0000 + Te Te1069 1.0 0.19689 0.95037 0.60251 1.0000 + Te Te1070 1.0 0.16564 0.98162 0.60251 1.0000 + Te Te1071 1.0 0.13439 0.01287 0.60251 1.0000 + Te Te1072 1.0 0.10314 0.04412 0.60251 1.0000 + Te Te1073 1.0 0.60314 0.60662 0.60251 1.0000 + Te Te1074 1.0 0.57189 0.63787 0.60251 1.0000 + Te Te1075 1.0 0.54064 0.66912 0.60251 1.0000 + Te Te1076 1.0 0.50939 0.70037 0.60251 1.0000 + Te Te1077 1.0 0.47814 0.73162 0.60251 1.0000 + Te Te1078 1.0 0.44689 0.76287 0.60251 1.0000 + Te Te1079 1.0 0.41564 0.79412 0.60251 1.0000 + Te Te1080 1.0 0.38439 0.82537 0.60251 1.0000 + Te Te1081 1.0 0.35314 0.85662 0.60251 1.0000 + Te Te1082 1.0 0.32189 0.88787 0.60251 1.0000 + Te Te1083 1.0 0.29064 0.91912 0.60251 1.0000 + Te Te1084 1.0 0.25939 0.95037 0.60251 1.0000 + Te Te1085 1.0 0.22814 0.98162 0.60251 1.0000 + Te Te1086 1.0 0.19689 0.01287 0.60251 1.0000 + Te Te1087 1.0 0.16564 0.04412 0.60251 1.0000 + Te Te1088 1.0 0.13439 0.07537 0.60251 1.0000 + Te Te1089 1.0 0.63439 0.63787 0.60251 1.0000 + Te Te1090 1.0 0.60314 0.66912 0.60251 1.0000 + Te Te1091 1.0 0.57189 0.70037 0.60251 1.0000 + Te Te1092 1.0 0.54064 0.73162 0.60251 1.0000 + Te Te1093 1.0 0.50939 0.76287 0.60251 1.0000 + Te Te1094 1.0 0.47814 0.79412 0.60251 1.0000 + Te Te1095 1.0 0.44689 0.82537 0.60251 1.0000 + Te Te1096 1.0 0.41564 0.85662 0.60251 1.0000 + Te Te1097 1.0 0.38439 0.88787 0.60251 1.0000 + Te Te1098 1.0 0.35314 0.91912 0.60251 1.0000 + Te Te1099 1.0 0.32189 0.95037 0.60251 1.0000 + Te Te1100 1.0 0.29064 0.98162 0.60251 1.0000 + Te Te1101 1.0 0.25939 0.01287 0.60251 1.0000 + Te Te1102 1.0 0.22814 0.04412 0.60251 1.0000 + Te Te1103 1.0 0.19689 0.07537 0.60251 1.0000 + Te Te1104 1.0 0.16564 0.10662 0.60251 1.0000 + Te Te1105 1.0 0.66564 0.66912 0.60251 1.0000 + Te Te1106 1.0 0.63439 0.70037 0.60251 1.0000 + Te Te1107 1.0 0.60314 0.73162 0.60251 1.0000 + Te Te1108 1.0 0.57189 0.76287 0.60251 1.0000 + Te Te1109 1.0 0.54064 0.79412 0.60251 1.0000 + Te Te1110 1.0 0.50939 0.82537 0.60251 1.0000 + Te Te1111 1.0 0.47814 0.85662 0.60251 1.0000 + Te Te1112 1.0 0.44689 0.88787 0.60251 1.0000 + Te Te1113 1.0 0.41564 0.91912 0.60251 1.0000 + Te Te1114 1.0 0.38439 0.95037 0.60251 1.0000 + Te Te1115 1.0 0.35314 0.98162 0.60251 1.0000 + Te Te1116 1.0 0.32189 0.01287 0.60251 1.0000 + Te Te1117 1.0 0.29064 0.04412 0.60251 1.0000 + Te Te1118 1.0 0.25939 0.07537 0.60251 1.0000 + Te Te1119 1.0 0.22814 0.10662 0.60251 1.0000 + Te Te1120 1.0 0.19689 0.13787 0.60251 1.0000 + Te Te1121 1.0 0.69689 0.70037 0.60251 1.0000 + Te Te1122 1.0 0.66564 0.73162 0.60251 1.0000 + Te Te1123 1.0 0.63439 0.76287 0.60251 1.0000 + Te Te1124 1.0 0.60314 0.79412 0.60251 1.0000 + Te Te1125 1.0 0.57189 0.82537 0.60251 1.0000 + Te Te1126 1.0 0.54064 0.85662 0.60251 1.0000 + Te Te1127 1.0 0.50939 0.88787 0.60251 1.0000 + Te Te1128 1.0 0.47814 0.91912 0.60251 1.0000 + Te Te1129 1.0 0.44689 0.95037 0.60251 1.0000 + Te Te1130 1.0 0.41564 0.98162 0.60251 1.0000 + Te Te1131 1.0 0.38439 0.01287 0.60251 1.0000 + Te Te1132 1.0 0.35314 0.04412 0.60251 1.0000 + Te Te1133 1.0 0.32189 0.07537 0.60251 1.0000 + Te Te1134 1.0 0.29064 0.10662 0.60251 1.0000 + Te Te1135 1.0 0.25939 0.13787 0.60251 1.0000 + Te Te1136 1.0 0.22814 0.16912 0.60251 1.0000 + Te Te1137 1.0 0.72814 0.73162 0.60251 1.0000 + Te Te1138 1.0 0.69689 0.76287 0.60251 1.0000 + Te Te1139 1.0 0.66564 0.79412 0.60251 1.0000 + Te Te1140 1.0 0.63439 0.82537 0.60251 1.0000 + Te Te1141 1.0 0.60314 0.85662 0.60251 1.0000 + Te Te1142 1.0 0.57189 0.88787 0.60251 1.0000 + Te Te1143 1.0 0.54064 0.91912 0.60251 1.0000 + Te Te1144 1.0 0.50939 0.95037 0.60251 1.0000 + Te Te1145 1.0 0.47814 0.98162 0.60251 1.0000 + Te Te1146 1.0 0.44689 0.01287 0.60251 1.0000 + Te Te1147 1.0 0.41564 0.04412 0.60251 1.0000 + Te Te1148 1.0 0.38439 0.07537 0.60251 1.0000 + Te Te1149 1.0 0.35314 0.10662 0.60251 1.0000 + Te Te1150 1.0 0.32189 0.13787 0.60251 1.0000 + Te Te1151 1.0 0.29064 0.16912 0.60251 1.0000 + Te Te1152 1.0 0.25939 0.20037 0.60251 1.0000 + Te Te1153 1.0 0.75939 0.76287 0.60251 1.0000 + Te Te1154 1.0 0.72814 0.79412 0.60251 1.0000 + Te Te1155 1.0 0.69689 0.82537 0.60251 1.0000 + Te Te1156 1.0 0.66564 0.85662 0.60251 1.0000 + Te Te1157 1.0 0.63439 0.88787 0.60251 1.0000 + Te Te1158 1.0 0.60314 0.91912 0.60251 1.0000 + Te Te1159 1.0 0.57189 0.95037 0.60251 1.0000 + Te Te1160 1.0 0.54064 0.98162 0.60251 1.0000 + Te Te1161 1.0 0.50939 0.01287 0.60251 1.0000 + Te Te1162 1.0 0.47814 0.04412 0.60251 1.0000 + Te Te1163 1.0 0.44689 0.07537 0.60251 1.0000 + Te Te1164 1.0 0.41564 0.10662 0.60251 1.0000 + Te Te1165 1.0 0.38439 0.13787 0.60251 1.0000 + Te Te1166 1.0 0.35314 0.16912 0.60251 1.0000 + Te Te1167 1.0 0.32189 0.20037 0.60251 1.0000 + Te Te1168 1.0 0.29064 0.23162 0.60251 1.0000 + Te Te1169 1.0 0.79064 0.79412 0.60251 1.0000 + Te Te1170 1.0 0.75939 0.82537 0.60251 1.0000 + Te Te1171 1.0 0.72814 0.85662 0.60251 1.0000 + Te Te1172 1.0 0.69689 0.88787 0.60251 1.0000 + Te Te1173 1.0 0.66564 0.91912 0.60251 1.0000 + Te Te1174 1.0 0.63439 0.95037 0.60251 1.0000 + Te Te1175 1.0 0.60314 0.98162 0.60251 1.0000 + Te Te1176 1.0 0.57189 0.01287 0.60251 1.0000 + Te Te1177 1.0 0.54064 0.04412 0.60251 1.0000 + Te Te1178 1.0 0.50939 0.07537 0.60251 1.0000 + Te Te1179 1.0 0.47814 0.10662 0.60251 1.0000 + Te Te1180 1.0 0.44689 0.13787 0.60251 1.0000 + Te Te1181 1.0 0.41564 0.16912 0.60251 1.0000 + Te Te1182 1.0 0.38439 0.20037 0.60251 1.0000 + Te Te1183 1.0 0.35314 0.23162 0.60251 1.0000 + Te Te1184 1.0 0.32189 0.26287 0.60251 1.0000 + Te Te1185 1.0 0.82189 0.82537 0.60251 1.0000 + Te Te1186 1.0 0.79064 0.85662 0.60251 1.0000 + Te Te1187 1.0 0.75939 0.88787 0.60251 1.0000 + Te Te1188 1.0 0.72814 0.91912 0.60251 1.0000 + Te Te1189 1.0 0.69689 0.95037 0.60251 1.0000 + Te Te1190 1.0 0.66564 0.98162 0.60251 1.0000 + Te Te1191 1.0 0.63439 0.01287 0.60251 1.0000 + Te Te1192 1.0 0.60314 0.04412 0.60251 1.0000 + Te Te1193 1.0 0.57189 0.07537 0.60251 1.0000 + Te Te1194 1.0 0.54064 0.10662 0.60251 1.0000 + Te Te1195 1.0 0.50939 0.13787 0.60251 1.0000 + Te Te1196 1.0 0.47814 0.16912 0.60251 1.0000 + Te Te1197 1.0 0.44689 0.20037 0.60251 1.0000 + Te Te1198 1.0 0.41564 0.23162 0.60251 1.0000 + Te Te1199 1.0 0.38439 0.26287 0.60251 1.0000 + Te Te1200 1.0 0.35314 0.29412 0.60251 1.0000 + Te Te1201 1.0 0.85314 0.85662 0.60251 1.0000 + Te Te1202 1.0 0.82189 0.88787 0.60251 1.0000 + Te Te1203 1.0 0.79064 0.91912 0.60251 1.0000 + Te Te1204 1.0 0.75939 0.95037 0.60251 1.0000 + Te Te1205 1.0 0.72814 0.98162 0.60251 1.0000 + Te Te1206 1.0 0.69689 0.01287 0.60251 1.0000 + Te Te1207 1.0 0.66564 0.04412 0.60251 1.0000 + Te Te1208 1.0 0.63439 0.07537 0.60251 1.0000 + Te Te1209 1.0 0.60314 0.10662 0.60251 1.0000 + Te Te1210 1.0 0.57189 0.13787 0.60251 1.0000 + Te Te1211 1.0 0.54064 0.16912 0.60251 1.0000 + Te Te1212 1.0 0.50939 0.20037 0.60251 1.0000 + Te Te1213 1.0 0.47814 0.23162 0.60251 1.0000 + Te Te1214 1.0 0.44689 0.26287 0.60251 1.0000 + Te Te1215 1.0 0.41564 0.29412 0.60251 1.0000 + Te Te1216 1.0 0.38439 0.32537 0.60251 1.0000 + Te Te1217 1.0 0.88439 0.88787 0.60251 1.0000 + Te Te1218 1.0 0.85314 0.91912 0.60251 1.0000 + Te Te1219 1.0 0.82189 0.95037 0.60251 1.0000 + Te Te1220 1.0 0.79064 0.98162 0.60251 1.0000 + Te Te1221 1.0 0.75939 0.01287 0.60251 1.0000 + Te Te1222 1.0 0.72814 0.04412 0.60251 1.0000 + Te Te1223 1.0 0.69689 0.07537 0.60251 1.0000 + Te Te1224 1.0 0.66564 0.10662 0.60251 1.0000 + Te Te1225 1.0 0.63439 0.13787 0.60251 1.0000 + Te Te1226 1.0 0.60314 0.16912 0.60251 1.0000 + Te Te1227 1.0 0.57189 0.20037 0.60251 1.0000 + Te Te1228 1.0 0.54064 0.23162 0.60251 1.0000 + Te Te1229 1.0 0.50939 0.26287 0.60251 1.0000 + Te Te1230 1.0 0.47814 0.29412 0.60251 1.0000 + Te Te1231 1.0 0.44689 0.32537 0.60251 1.0000 + Te Te1232 1.0 0.41564 0.35662 0.60251 1.0000 + Te Te1233 1.0 0.91564 0.91912 0.60251 1.0000 + Te Te1234 1.0 0.88439 0.95037 0.60251 1.0000 + Te Te1235 1.0 0.85314 0.98162 0.60251 1.0000 + Te Te1236 1.0 0.82189 0.01287 0.60251 1.0000 + Te Te1237 1.0 0.79064 0.04412 0.60251 1.0000 + Te Te1238 1.0 0.75939 0.07537 0.60251 1.0000 + Te Te1239 1.0 0.72814 0.10662 0.60251 1.0000 + Te Te1240 1.0 0.69689 0.13787 0.60251 1.0000 + Te Te1241 1.0 0.66564 0.16912 0.60251 1.0000 + Te Te1242 1.0 0.63439 0.20037 0.60251 1.0000 + Te Te1243 1.0 0.60314 0.23162 0.60251 1.0000 + Te Te1244 1.0 0.57189 0.26287 0.60251 1.0000 + Te Te1245 1.0 0.54064 0.29412 0.60251 1.0000 + Te Te1246 1.0 0.50939 0.32537 0.60251 1.0000 + Te Te1247 1.0 0.47814 0.35662 0.60251 1.0000 + Te Te1248 1.0 0.44689 0.38787 0.60251 1.0000 + Te Te1249 1.0 0.94689 0.95037 0.60251 1.0000 + Te Te1250 1.0 0.91564 0.98162 0.60251 1.0000 + Te Te1251 1.0 0.88439 0.01287 0.60251 1.0000 + Te Te1252 1.0 0.85314 0.04412 0.60251 1.0000 + Te Te1253 1.0 0.82189 0.07537 0.60251 1.0000 + Te Te1254 1.0 0.79064 0.10662 0.60251 1.0000 + Te Te1255 1.0 0.75939 0.13787 0.60251 1.0000 + Te Te1256 1.0 0.72814 0.16912 0.60251 1.0000 + Te Te1257 1.0 0.69689 0.20037 0.60251 1.0000 + Te Te1258 1.0 0.66564 0.23162 0.60251 1.0000 + Te Te1259 1.0 0.63439 0.26287 0.60251 1.0000 + Te Te1260 1.0 0.60314 0.29412 0.60251 1.0000 + Te Te1261 1.0 0.57189 0.32537 0.60251 1.0000 + Te Te1262 1.0 0.54064 0.35662 0.60251 1.0000 + Te Te1263 1.0 0.50939 0.38787 0.60251 1.0000 + Te Te1264 1.0 0.47814 0.41912 0.60251 1.0000 + Te Te1265 1.0 0.97814 0.98162 0.60251 1.0000 + Te Te1266 1.0 0.94689 0.01287 0.60251 1.0000 + Te Te1267 1.0 0.91564 0.04412 0.60251 1.0000 + Te Te1268 1.0 0.88439 0.07537 0.60251 1.0000 + Te Te1269 1.0 0.85314 0.10662 0.60251 1.0000 + Te Te1270 1.0 0.82189 0.13787 0.60251 1.0000 + Te Te1271 1.0 0.79064 0.16912 0.60251 1.0000 + Te Te1272 1.0 0.75939 0.20037 0.60251 1.0000 + Te Te1273 1.0 0.72814 0.23162 0.60251 1.0000 + Te Te1274 1.0 0.69689 0.26287 0.60251 1.0000 + Te Te1275 1.0 0.66564 0.29412 0.60251 1.0000 + Te Te1276 1.0 0.63439 0.32537 0.60251 1.0000 + Te Te1277 1.0 0.60314 0.35662 0.60251 1.0000 + Te Te1278 1.0 0.57189 0.38787 0.60251 1.0000 + Te Te1279 1.0 0.54064 0.41912 0.60251 1.0000 + Te Te1280 1.0 0.50939 0.45037 0.60251 1.0000 + Te Te1281 1.0 0.50174 0.54199 0.60251 1.0000 + Te Te1282 1.0 0.47049 0.57324 0.60251 1.0000 + Te Te1283 1.0 0.43924 0.60449 0.60251 1.0000 + Te Te1284 1.0 0.40799 0.63574 0.60251 1.0000 + Te Te1285 1.0 0.37674 0.66699 0.60251 1.0000 + Te Te1286 1.0 0.34549 0.69824 0.60251 1.0000 + Te Te1287 1.0 0.31424 0.72949 0.60251 1.0000 + Te Te1288 1.0 0.28299 0.76074 0.60251 1.0000 + Te Te1289 1.0 0.25174 0.79199 0.60251 1.0000 + Te Te1290 1.0 0.22049 0.82324 0.60251 1.0000 + Te Te1291 1.0 0.18924 0.85449 0.60251 1.0000 + Te Te1292 1.0 0.15799 0.88574 0.60251 1.0000 + Te Te1293 1.0 0.12674 0.91699 0.60251 1.0000 + Te Te1294 1.0 0.09549 0.94824 0.60251 1.0000 + Te Te1295 1.0 0.06424 0.97949 0.60251 1.0000 + Te Te1296 1.0 0.03299 0.01074 0.60251 1.0000 + Te Te1297 1.0 0.53299 0.57324 0.60251 1.0000 + Te Te1298 1.0 0.50174 0.60449 0.60251 1.0000 + Te Te1299 1.0 0.47049 0.63574 0.60251 1.0000 + Te Te1300 1.0 0.43924 0.66699 0.60251 1.0000 + Te Te1301 1.0 0.40799 0.69824 0.60251 1.0000 + Te Te1302 1.0 0.37674 0.72949 0.60251 1.0000 + Te Te1303 1.0 0.34549 0.76074 0.60251 1.0000 + Te Te1304 1.0 0.31424 0.79199 0.60251 1.0000 + Te Te1305 1.0 0.28299 0.82324 0.60251 1.0000 + Te Te1306 1.0 0.25174 0.85449 0.60251 1.0000 + Te Te1307 1.0 0.22049 0.88574 0.60251 1.0000 + Te Te1308 1.0 0.18924 0.91699 0.60251 1.0000 + Te Te1309 1.0 0.15799 0.94824 0.60251 1.0000 + Te Te1310 1.0 0.12674 0.97949 0.60251 1.0000 + Te Te1311 1.0 0.09549 0.01074 0.60251 1.0000 + Te Te1312 1.0 0.06424 0.04199 0.60251 1.0000 + Te Te1313 1.0 0.56424 0.60449 0.60251 1.0000 + Te Te1314 1.0 0.53299 0.63574 0.60251 1.0000 + Te Te1315 1.0 0.50174 0.66699 0.60251 1.0000 + Te Te1316 1.0 0.47049 0.69824 0.60251 1.0000 + Te Te1317 1.0 0.43924 0.72949 0.60251 1.0000 + Te Te1318 1.0 0.40799 0.76074 0.60251 1.0000 + Te Te1319 1.0 0.37674 0.79199 0.60251 1.0000 + Te Te1320 1.0 0.34549 0.82324 0.60251 1.0000 + Te Te1321 1.0 0.31424 0.85449 0.60251 1.0000 + Te Te1322 1.0 0.28299 0.88574 0.60251 1.0000 + Te Te1323 1.0 0.25174 0.91699 0.60251 1.0000 + Te Te1324 1.0 0.22049 0.94824 0.60251 1.0000 + Te Te1325 1.0 0.18924 0.97949 0.60251 1.0000 + Te Te1326 1.0 0.15799 0.01074 0.60251 1.0000 + Te Te1327 1.0 0.12674 0.04199 0.60251 1.0000 + Te Te1328 1.0 0.09549 0.07324 0.60251 1.0000 + Te Te1329 1.0 0.59549 0.63574 0.60251 1.0000 + Te Te1330 1.0 0.56424 0.66699 0.60251 1.0000 + Te Te1331 1.0 0.53299 0.69824 0.60251 1.0000 + Te Te1332 1.0 0.50174 0.72949 0.60251 1.0000 + Te Te1333 1.0 0.47049 0.76074 0.60251 1.0000 + Te Te1334 1.0 0.43924 0.79199 0.60251 1.0000 + Te Te1335 1.0 0.40799 0.82324 0.60251 1.0000 + Te Te1336 1.0 0.37674 0.85449 0.60251 1.0000 + Te Te1337 1.0 0.34549 0.88574 0.60251 1.0000 + Te Te1338 1.0 0.31424 0.91699 0.60251 1.0000 + Te Te1339 1.0 0.28299 0.94824 0.60251 1.0000 + Te Te1340 1.0 0.25174 0.97949 0.60251 1.0000 + Te Te1341 1.0 0.22049 0.01074 0.60251 1.0000 + Te Te1342 1.0 0.18924 0.04199 0.60251 1.0000 + Te Te1343 1.0 0.15799 0.07324 0.60251 1.0000 + Te Te1344 1.0 0.12674 0.10449 0.60251 1.0000 + Te Te1345 1.0 0.62674 0.66699 0.60251 1.0000 + Te Te1346 1.0 0.59549 0.69824 0.60251 1.0000 + Te Te1347 1.0 0.56424 0.72949 0.60251 1.0000 + Te Te1348 1.0 0.53299 0.76074 0.60251 1.0000 + Te Te1349 1.0 0.50174 0.79199 0.60251 1.0000 + Te Te1350 1.0 0.47049 0.82324 0.60251 1.0000 + Te Te1351 1.0 0.43924 0.85449 0.60251 1.0000 + Te Te1352 1.0 0.40799 0.88574 0.60251 1.0000 + Te Te1353 1.0 0.37674 0.91699 0.60251 1.0000 + Te Te1354 1.0 0.34549 0.94824 0.60251 1.0000 + Te Te1355 1.0 0.31424 0.97949 0.60251 1.0000 + Te Te1356 1.0 0.28299 0.01074 0.60251 1.0000 + Te Te1357 1.0 0.25174 0.04199 0.60251 1.0000 + Te Te1358 1.0 0.22049 0.07324 0.60251 1.0000 + Te Te1359 1.0 0.18924 0.10449 0.60251 1.0000 + Te Te1360 1.0 0.15799 0.13574 0.60251 1.0000 + Te Te1361 1.0 0.65799 0.69824 0.60251 1.0000 + Te Te1362 1.0 0.62674 0.72949 0.60251 1.0000 + Te Te1363 1.0 0.59549 0.76074 0.60251 1.0000 + Te Te1364 1.0 0.56424 0.79199 0.60251 1.0000 + Te Te1365 1.0 0.53299 0.82324 0.60251 1.0000 + Te Te1366 1.0 0.50174 0.85449 0.60251 1.0000 + Te Te1367 1.0 0.47049 0.88574 0.60251 1.0000 + Te Te1368 1.0 0.43924 0.91699 0.60251 1.0000 + Te Te1369 1.0 0.40799 0.94824 0.60251 1.0000 + Te Te1370 1.0 0.37674 0.97949 0.60251 1.0000 + Te Te1371 1.0 0.34549 0.01074 0.60251 1.0000 + Te Te1372 1.0 0.31424 0.04199 0.60251 1.0000 + Te Te1373 1.0 0.28299 0.07324 0.60251 1.0000 + Te Te1374 1.0 0.25174 0.10449 0.60251 1.0000 + Te Te1375 1.0 0.22049 0.13574 0.60251 1.0000 + Te Te1376 1.0 0.18924 0.16699 0.60251 1.0000 + Te Te1377 1.0 0.68924 0.72949 0.60251 1.0000 + Te Te1378 1.0 0.65799 0.76074 0.60251 1.0000 + Te Te1379 1.0 0.62674 0.79199 0.60251 1.0000 + Te Te1380 1.0 0.59549 0.82324 0.60251 1.0000 + Te Te1381 1.0 0.56424 0.85449 0.60251 1.0000 + Te Te1382 1.0 0.53299 0.88574 0.60251 1.0000 + Te Te1383 1.0 0.50174 0.91699 0.60251 1.0000 + Te Te1384 1.0 0.47049 0.94824 0.60251 1.0000 + Te Te1385 1.0 0.43924 0.97949 0.60251 1.0000 + Te Te1386 1.0 0.40799 0.01074 0.60251 1.0000 + Te Te1387 1.0 0.37674 0.04199 0.60251 1.0000 + Te Te1388 1.0 0.34549 0.07324 0.60251 1.0000 + Te Te1389 1.0 0.31424 0.10449 0.60251 1.0000 + Te Te1390 1.0 0.28299 0.13574 0.60251 1.0000 + Te Te1391 1.0 0.25174 0.16699 0.60251 1.0000 + Te Te1392 1.0 0.22049 0.19824 0.60251 1.0000 + Te Te1393 1.0 0.72049 0.76074 0.60251 1.0000 + Te Te1394 1.0 0.68924 0.79199 0.60251 1.0000 + Te Te1395 1.0 0.65799 0.82324 0.60251 1.0000 + Te Te1396 1.0 0.62674 0.85449 0.60251 1.0000 + Te Te1397 1.0 0.59549 0.88574 0.60251 1.0000 + Te Te1398 1.0 0.56424 0.91699 0.60251 1.0000 + Te Te1399 1.0 0.53299 0.94824 0.60251 1.0000 + Te Te1400 1.0 0.50174 0.97949 0.60251 1.0000 + Te Te1401 1.0 0.47049 0.01074 0.60251 1.0000 + Te Te1402 1.0 0.43924 0.04199 0.60251 1.0000 + Te Te1403 1.0 0.40799 0.07324 0.60251 1.0000 + Te Te1404 1.0 0.37674 0.10449 0.60251 1.0000 + Te Te1405 1.0 0.34549 0.13574 0.60251 1.0000 + Te Te1406 1.0 0.31424 0.16699 0.60251 1.0000 + Te Te1407 1.0 0.28299 0.19824 0.60251 1.0000 + Te Te1408 1.0 0.25174 0.22949 0.60251 1.0000 + Te Te1409 1.0 0.75174 0.79199 0.60251 1.0000 + Te Te1410 1.0 0.72049 0.82324 0.60251 1.0000 + Te Te1411 1.0 0.68924 0.85449 0.60251 1.0000 + Te Te1412 1.0 0.65799 0.88574 0.60251 1.0000 + Te Te1413 1.0 0.62674 0.91699 0.60251 1.0000 + Te Te1414 1.0 0.59549 0.94824 0.60251 1.0000 + Te Te1415 1.0 0.56424 0.97949 0.60251 1.0000 + Te Te1416 1.0 0.53299 0.01074 0.60251 1.0000 + Te Te1417 1.0 0.50174 0.04199 0.60251 1.0000 + Te Te1418 1.0 0.47049 0.07324 0.60251 1.0000 + Te Te1419 1.0 0.43924 0.10449 0.60251 1.0000 + Te Te1420 1.0 0.40799 0.13574 0.60251 1.0000 + Te Te1421 1.0 0.37674 0.16699 0.60251 1.0000 + Te Te1422 1.0 0.34549 0.19824 0.60251 1.0000 + Te Te1423 1.0 0.31424 0.22949 0.60251 1.0000 + Te Te1424 1.0 0.28299 0.26074 0.60251 1.0000 + Te Te1425 1.0 0.78299 0.82324 0.60251 1.0000 + Te Te1426 1.0 0.75174 0.85449 0.60251 1.0000 + Te Te1427 1.0 0.72049 0.88574 0.60251 1.0000 + Te Te1428 1.0 0.68924 0.91699 0.60251 1.0000 + Te Te1429 1.0 0.65799 0.94824 0.60251 1.0000 + Te Te1430 1.0 0.62674 0.97949 0.60251 1.0000 + Te Te1431 1.0 0.59549 0.01074 0.60251 1.0000 + Te Te1432 1.0 0.56424 0.04199 0.60251 1.0000 + Te Te1433 1.0 0.53299 0.07324 0.60251 1.0000 + Te Te1434 1.0 0.50174 0.10449 0.60251 1.0000 + Te Te1435 1.0 0.47049 0.13574 0.60251 1.0000 + Te Te1436 1.0 0.43924 0.16699 0.60251 1.0000 + Te Te1437 1.0 0.40799 0.19824 0.60251 1.0000 + Te Te1438 1.0 0.37674 0.22949 0.60251 1.0000 + Te Te1439 1.0 0.34549 0.26074 0.60251 1.0000 + Te Te1440 1.0 0.31424 0.29199 0.60251 1.0000 + Te Te1441 1.0 0.81424 0.85449 0.60251 1.0000 + Te Te1442 1.0 0.78299 0.88574 0.60251 1.0000 + Te Te1443 1.0 0.75174 0.91699 0.60251 1.0000 + Te Te1444 1.0 0.72049 0.94824 0.60251 1.0000 + Te Te1445 1.0 0.68924 0.97949 0.60251 1.0000 + Te Te1446 1.0 0.65799 0.01074 0.60251 1.0000 + Te Te1447 1.0 0.62674 0.04199 0.60251 1.0000 + Te Te1448 1.0 0.59549 0.07324 0.60251 1.0000 + Te Te1449 1.0 0.56424 0.10449 0.60251 1.0000 + Te Te1450 1.0 0.53299 0.13574 0.60251 1.0000 + Te Te1451 1.0 0.50174 0.16699 0.60251 1.0000 + Te Te1452 1.0 0.47049 0.19824 0.60251 1.0000 + Te Te1453 1.0 0.43924 0.22949 0.60251 1.0000 + Te Te1454 1.0 0.40799 0.26074 0.60251 1.0000 + Te Te1455 1.0 0.37674 0.29199 0.60251 1.0000 + Te Te1456 1.0 0.34549 0.32324 0.60251 1.0000 + Te Te1457 1.0 0.84549 0.88574 0.60251 1.0000 + Te Te1458 1.0 0.81424 0.91699 0.60251 1.0000 + Te Te1459 1.0 0.78299 0.94824 0.60251 1.0000 + Te Te1460 1.0 0.75174 0.97949 0.60251 1.0000 + Te Te1461 1.0 0.72049 0.01074 0.60251 1.0000 + Te Te1462 1.0 0.68924 0.04199 0.60251 1.0000 + Te Te1463 1.0 0.65799 0.07324 0.60251 1.0000 + Te Te1464 1.0 0.62674 0.10449 0.60251 1.0000 + Te Te1465 1.0 0.59549 0.13574 0.60251 1.0000 + Te Te1466 1.0 0.56424 0.16699 0.60251 1.0000 + Te Te1467 1.0 0.53299 0.19824 0.60251 1.0000 + Te Te1468 1.0 0.50174 0.22949 0.60251 1.0000 + Te Te1469 1.0 0.47049 0.26074 0.60251 1.0000 + Te Te1470 1.0 0.43924 0.29199 0.60251 1.0000 + Te Te1471 1.0 0.40799 0.32324 0.60251 1.0000 + Te Te1472 1.0 0.37674 0.35449 0.60251 1.0000 + Te Te1473 1.0 0.87674 0.91699 0.60251 1.0000 + Te Te1474 1.0 0.84549 0.94824 0.60251 1.0000 + Te Te1475 1.0 0.81424 0.97949 0.60251 1.0000 + Te Te1476 1.0 0.78299 0.01074 0.60251 1.0000 + Te Te1477 1.0 0.75174 0.04199 0.60251 1.0000 + Te Te1478 1.0 0.72049 0.07324 0.60251 1.0000 + Te Te1479 1.0 0.68924 0.10449 0.60251 1.0000 + Te Te1480 1.0 0.65799 0.13574 0.60251 1.0000 + Te Te1481 1.0 0.62674 0.16699 0.60251 1.0000 + Te Te1482 1.0 0.59549 0.19824 0.60251 1.0000 + Te Te1483 1.0 0.56424 0.22949 0.60251 1.0000 + Te Te1484 1.0 0.53299 0.26074 0.60251 1.0000 + Te Te1485 1.0 0.50174 0.29199 0.60251 1.0000 + Te Te1486 1.0 0.47049 0.32324 0.60251 1.0000 + Te Te1487 1.0 0.43924 0.35449 0.60251 1.0000 + Te Te1488 1.0 0.40799 0.38574 0.60251 1.0000 + Te Te1489 1.0 0.90799 0.94824 0.60251 1.0000 + Te Te1490 1.0 0.87674 0.97949 0.60251 1.0000 + Te Te1491 1.0 0.84549 0.01074 0.60251 1.0000 + Te Te1492 1.0 0.81424 0.04199 0.60251 1.0000 + Te Te1493 1.0 0.78299 0.07324 0.60251 1.0000 + Te Te1494 1.0 0.75174 0.10449 0.60251 1.0000 + Te Te1495 1.0 0.72049 0.13574 0.60251 1.0000 + Te Te1496 1.0 0.68924 0.16699 0.60251 1.0000 + Te Te1497 1.0 0.65799 0.19824 0.60251 1.0000 + Te Te1498 1.0 0.62674 0.22949 0.60251 1.0000 + Te Te1499 1.0 0.59549 0.26074 0.60251 1.0000 + Te Te1500 1.0 0.56424 0.29199 0.60251 1.0000 + Te Te1501 1.0 0.53299 0.32324 0.60251 1.0000 + Te Te1502 1.0 0.50174 0.35449 0.60251 1.0000 + Te Te1503 1.0 0.47049 0.38574 0.60251 1.0000 + Te Te1504 1.0 0.43924 0.41699 0.60251 1.0000 + Te Te1505 1.0 0.93924 0.97949 0.60251 1.0000 + Te Te1506 1.0 0.90799 0.01074 0.60251 1.0000 + Te Te1507 1.0 0.87674 0.04199 0.60251 1.0000 + Te Te1508 1.0 0.84549 0.07324 0.60251 1.0000 + Te Te1509 1.0 0.81424 0.10449 0.60251 1.0000 + Te Te1510 1.0 0.78299 0.13574 0.60251 1.0000 + Te Te1511 1.0 0.75174 0.16699 0.60251 1.0000 + Te Te1512 1.0 0.72049 0.19824 0.60251 1.0000 + Te Te1513 1.0 0.68924 0.22949 0.60251 1.0000 + Te Te1514 1.0 0.65799 0.26074 0.60251 1.0000 + Te Te1515 1.0 0.62674 0.29199 0.60251 1.0000 + Te Te1516 1.0 0.59549 0.32324 0.60251 1.0000 + Te Te1517 1.0 0.56424 0.35449 0.60251 1.0000 + Te Te1518 1.0 0.53299 0.38574 0.60251 1.0000 + Te Te1519 1.0 0.50174 0.41699 0.60251 1.0000 + Te Te1520 1.0 0.47049 0.44824 0.60251 1.0000 + Te Te1521 1.0 0.97049 0.01074 0.60251 1.0000 + Te Te1522 1.0 0.93924 0.04199 0.60251 1.0000 + Te Te1523 1.0 0.90799 0.07324 0.60251 1.0000 + Te Te1524 1.0 0.87674 0.10449 0.60251 1.0000 + Te Te1525 1.0 0.84549 0.13574 0.60251 1.0000 + Te Te1526 1.0 0.81424 0.16699 0.60251 1.0000 + Te Te1527 1.0 0.78299 0.19824 0.60251 1.0000 + Te Te1528 1.0 0.75174 0.22949 0.60251 1.0000 + Te Te1529 1.0 0.72049 0.26074 0.60251 1.0000 + Te Te1530 1.0 0.68924 0.29199 0.60251 1.0000 + Te Te1531 1.0 0.65799 0.32324 0.60251 1.0000 + Te Te1532 1.0 0.62674 0.35449 0.60251 1.0000 + Te Te1533 1.0 0.59549 0.38574 0.60251 1.0000 + Te Te1534 1.0 0.56424 0.41699 0.60251 1.0000 + Te Te1535 1.0 0.53299 0.44824 0.60251 1.0000 + Te Te1536 1.0 0.50174 0.47949 0.60251 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-4517_supercell_16x16x1.cif b/tier3/cif_file/orthogonal_2dm-4517_supercell_16x16x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..964a0a4194670ab022fe24b0f828898ba0c01831 --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-4517_supercell_16x16x1.cif @@ -0,0 +1,1817 @@ +data_image0 +_chemical_formula_structural Cu512W256S1024 +_chemical_formula_sum "Cu512 W256 S1024" +_cell_length_a 87.09 +_cell_length_b 87.09 +_cell_length_c 6.62228 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Cu Cu1 1.0 0.00000 0.03125 0.50000 1.0000 + Cu Cu2 1.0 0.00000 0.09375 0.50000 1.0000 + Cu Cu3 1.0 0.00000 0.15625 0.50000 1.0000 + Cu Cu4 1.0 0.00000 0.21875 0.50000 1.0000 + Cu Cu5 1.0 0.00000 0.28125 0.50000 1.0000 + Cu Cu6 1.0 0.00000 0.34375 0.50000 1.0000 + Cu Cu7 1.0 0.00000 0.40625 0.50000 1.0000 + Cu Cu8 1.0 0.00000 0.46875 0.50000 1.0000 + Cu Cu9 1.0 0.00000 0.53125 0.50000 1.0000 + Cu Cu10 1.0 0.00000 0.59375 0.50000 1.0000 + Cu Cu11 1.0 0.00000 0.65625 0.50000 1.0000 + Cu Cu12 1.0 0.00000 0.71875 0.50000 1.0000 + Cu Cu13 1.0 0.00000 0.78125 0.50000 1.0000 + Cu Cu14 1.0 0.00000 0.84375 0.50000 1.0000 + Cu Cu15 1.0 0.00000 0.90625 0.50000 1.0000 + Cu Cu16 1.0 0.00000 0.96875 0.50000 1.0000 + Cu Cu17 1.0 0.06250 0.03125 0.50000 1.0000 + Cu Cu18 1.0 0.06250 0.09375 0.50000 1.0000 + Cu Cu19 1.0 0.06250 0.15625 0.50000 1.0000 + Cu Cu20 1.0 0.06250 0.21875 0.50000 1.0000 + Cu Cu21 1.0 0.06250 0.28125 0.50000 1.0000 + Cu Cu22 1.0 0.06250 0.34375 0.50000 1.0000 + Cu Cu23 1.0 0.06250 0.40625 0.50000 1.0000 + Cu Cu24 1.0 0.06250 0.46875 0.50000 1.0000 + Cu Cu25 1.0 0.06250 0.53125 0.50000 1.0000 + Cu Cu26 1.0 0.06250 0.59375 0.50000 1.0000 + Cu Cu27 1.0 0.06250 0.65625 0.50000 1.0000 + Cu Cu28 1.0 0.06250 0.71875 0.50000 1.0000 + Cu Cu29 1.0 0.06250 0.78125 0.50000 1.0000 + Cu Cu30 1.0 0.06250 0.84375 0.50000 1.0000 + Cu Cu31 1.0 0.06250 0.90625 0.50000 1.0000 + Cu Cu32 1.0 0.06250 0.96875 0.50000 1.0000 + Cu Cu33 1.0 0.12500 0.03125 0.50000 1.0000 + Cu Cu34 1.0 0.12500 0.09375 0.50000 1.0000 + Cu Cu35 1.0 0.12500 0.15625 0.50000 1.0000 + Cu Cu36 1.0 0.12500 0.21875 0.50000 1.0000 + Cu Cu37 1.0 0.12500 0.28125 0.50000 1.0000 + Cu Cu38 1.0 0.12500 0.34375 0.50000 1.0000 + Cu Cu39 1.0 0.12500 0.40625 0.50000 1.0000 + Cu Cu40 1.0 0.12500 0.46875 0.50000 1.0000 + Cu Cu41 1.0 0.12500 0.53125 0.50000 1.0000 + Cu Cu42 1.0 0.12500 0.59375 0.50000 1.0000 + Cu Cu43 1.0 0.12500 0.65625 0.50000 1.0000 + Cu Cu44 1.0 0.12500 0.71875 0.50000 1.0000 + Cu Cu45 1.0 0.12500 0.78125 0.50000 1.0000 + Cu Cu46 1.0 0.12500 0.84375 0.50000 1.0000 + Cu Cu47 1.0 0.12500 0.90625 0.50000 1.0000 + Cu Cu48 1.0 0.12500 0.96875 0.50000 1.0000 + Cu Cu49 1.0 0.18750 0.03125 0.50000 1.0000 + Cu Cu50 1.0 0.18750 0.09375 0.50000 1.0000 + Cu Cu51 1.0 0.18750 0.15625 0.50000 1.0000 + Cu Cu52 1.0 0.18750 0.21875 0.50000 1.0000 + Cu Cu53 1.0 0.18750 0.28125 0.50000 1.0000 + Cu Cu54 1.0 0.18750 0.34375 0.50000 1.0000 + Cu Cu55 1.0 0.18750 0.40625 0.50000 1.0000 + Cu Cu56 1.0 0.18750 0.46875 0.50000 1.0000 + Cu Cu57 1.0 0.18750 0.53125 0.50000 1.0000 + Cu Cu58 1.0 0.18750 0.59375 0.50000 1.0000 + Cu Cu59 1.0 0.18750 0.65625 0.50000 1.0000 + Cu Cu60 1.0 0.18750 0.71875 0.50000 1.0000 + Cu Cu61 1.0 0.18750 0.78125 0.50000 1.0000 + Cu Cu62 1.0 0.18750 0.84375 0.50000 1.0000 + Cu Cu63 1.0 0.18750 0.90625 0.50000 1.0000 + Cu Cu64 1.0 0.18750 0.96875 0.50000 1.0000 + Cu Cu65 1.0 0.25000 0.03125 0.50000 1.0000 + Cu Cu66 1.0 0.25000 0.09375 0.50000 1.0000 + Cu Cu67 1.0 0.25000 0.15625 0.50000 1.0000 + Cu Cu68 1.0 0.25000 0.21875 0.50000 1.0000 + Cu Cu69 1.0 0.25000 0.28125 0.50000 1.0000 + Cu Cu70 1.0 0.25000 0.34375 0.50000 1.0000 + Cu Cu71 1.0 0.25000 0.40625 0.50000 1.0000 + Cu Cu72 1.0 0.25000 0.46875 0.50000 1.0000 + Cu Cu73 1.0 0.25000 0.53125 0.50000 1.0000 + Cu Cu74 1.0 0.25000 0.59375 0.50000 1.0000 + Cu Cu75 1.0 0.25000 0.65625 0.50000 1.0000 + Cu Cu76 1.0 0.25000 0.71875 0.50000 1.0000 + Cu Cu77 1.0 0.25000 0.78125 0.50000 1.0000 + Cu Cu78 1.0 0.25000 0.84375 0.50000 1.0000 + Cu Cu79 1.0 0.25000 0.90625 0.50000 1.0000 + Cu Cu80 1.0 0.25000 0.96875 0.50000 1.0000 + Cu Cu81 1.0 0.31250 0.03125 0.50000 1.0000 + Cu Cu82 1.0 0.31250 0.09375 0.50000 1.0000 + Cu Cu83 1.0 0.31250 0.15625 0.50000 1.0000 + Cu Cu84 1.0 0.31250 0.21875 0.50000 1.0000 + Cu Cu85 1.0 0.31250 0.28125 0.50000 1.0000 + Cu Cu86 1.0 0.31250 0.34375 0.50000 1.0000 + Cu Cu87 1.0 0.31250 0.40625 0.50000 1.0000 + Cu Cu88 1.0 0.31250 0.46875 0.50000 1.0000 + Cu Cu89 1.0 0.31250 0.53125 0.50000 1.0000 + Cu Cu90 1.0 0.31250 0.59375 0.50000 1.0000 + Cu Cu91 1.0 0.31250 0.65625 0.50000 1.0000 + Cu Cu92 1.0 0.31250 0.71875 0.50000 1.0000 + Cu Cu93 1.0 0.31250 0.78125 0.50000 1.0000 + Cu Cu94 1.0 0.31250 0.84375 0.50000 1.0000 + Cu Cu95 1.0 0.31250 0.90625 0.50000 1.0000 + Cu Cu96 1.0 0.31250 0.96875 0.50000 1.0000 + Cu Cu97 1.0 0.37500 0.03125 0.50000 1.0000 + Cu Cu98 1.0 0.37500 0.09375 0.50000 1.0000 + Cu Cu99 1.0 0.37500 0.15625 0.50000 1.0000 + Cu Cu100 1.0 0.37500 0.21875 0.50000 1.0000 + Cu Cu101 1.0 0.37500 0.28125 0.50000 1.0000 + Cu Cu102 1.0 0.37500 0.34375 0.50000 1.0000 + Cu Cu103 1.0 0.37500 0.40625 0.50000 1.0000 + Cu Cu104 1.0 0.37500 0.46875 0.50000 1.0000 + Cu Cu105 1.0 0.37500 0.53125 0.50000 1.0000 + Cu Cu106 1.0 0.37500 0.59375 0.50000 1.0000 + Cu Cu107 1.0 0.37500 0.65625 0.50000 1.0000 + Cu Cu108 1.0 0.37500 0.71875 0.50000 1.0000 + Cu Cu109 1.0 0.37500 0.78125 0.50000 1.0000 + Cu Cu110 1.0 0.37500 0.84375 0.50000 1.0000 + Cu Cu111 1.0 0.37500 0.90625 0.50000 1.0000 + Cu Cu112 1.0 0.37500 0.96875 0.50000 1.0000 + Cu Cu113 1.0 0.43750 0.03125 0.50000 1.0000 + Cu Cu114 1.0 0.43750 0.09375 0.50000 1.0000 + Cu Cu115 1.0 0.43750 0.15625 0.50000 1.0000 + Cu Cu116 1.0 0.43750 0.21875 0.50000 1.0000 + Cu Cu117 1.0 0.43750 0.28125 0.50000 1.0000 + Cu Cu118 1.0 0.43750 0.34375 0.50000 1.0000 + Cu Cu119 1.0 0.43750 0.40625 0.50000 1.0000 + Cu Cu120 1.0 0.43750 0.46875 0.50000 1.0000 + Cu Cu121 1.0 0.43750 0.53125 0.50000 1.0000 + Cu Cu122 1.0 0.43750 0.59375 0.50000 1.0000 + Cu Cu123 1.0 0.43750 0.65625 0.50000 1.0000 + Cu Cu124 1.0 0.43750 0.71875 0.50000 1.0000 + Cu Cu125 1.0 0.43750 0.78125 0.50000 1.0000 + Cu Cu126 1.0 0.43750 0.84375 0.50000 1.0000 + Cu Cu127 1.0 0.43750 0.90625 0.50000 1.0000 + Cu Cu128 1.0 0.43750 0.96875 0.50000 1.0000 + Cu Cu129 1.0 0.50000 0.03125 0.50000 1.0000 + Cu Cu130 1.0 0.50000 0.09375 0.50000 1.0000 + Cu Cu131 1.0 0.50000 0.15625 0.50000 1.0000 + Cu Cu132 1.0 0.50000 0.21875 0.50000 1.0000 + Cu Cu133 1.0 0.50000 0.28125 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Cr Cr201 1.0 0.36209 0.70915 0.55828 1.0000 + Cr Cr202 1.0 0.36209 0.79248 0.55828 1.0000 + Cr Cr203 1.0 0.36209 0.87582 0.55828 1.0000 + Cr Cr204 1.0 0.36209 0.95915 0.55828 1.0000 + Cr Cr205 1.0 0.44542 0.04248 0.55828 1.0000 + Cr Cr206 1.0 0.44542 0.12582 0.55828 1.0000 + Cr Cr207 1.0 0.44542 0.20915 0.55828 1.0000 + Cr Cr208 1.0 0.44542 0.29248 0.55828 1.0000 + Cr Cr209 1.0 0.44542 0.37582 0.55828 1.0000 + Cr Cr210 1.0 0.44542 0.45915 0.55828 1.0000 + Cr Cr211 1.0 0.44542 0.54248 0.55828 1.0000 + Cr Cr212 1.0 0.44542 0.62582 0.55828 1.0000 + Cr Cr213 1.0 0.44542 0.70915 0.55828 1.0000 + Cr Cr214 1.0 0.44542 0.79248 0.55828 1.0000 + Cr Cr215 1.0 0.44542 0.87582 0.55828 1.0000 + Cr Cr216 1.0 0.44542 0.95915 0.55828 1.0000 + Cr Cr217 1.0 0.52876 0.04248 0.55828 1.0000 + Cr Cr218 1.0 0.52876 0.12582 0.55828 1.0000 + Cr Cr219 1.0 0.52876 0.20915 0.55828 1.0000 + Cr Cr220 1.0 0.52876 0.29248 0.55828 1.0000 + Cr Cr221 1.0 0.52876 0.37582 0.55828 1.0000 + Cr Cr222 1.0 0.52876 0.45915 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b/tier3/cif_file/orthogonal_2dm-4590_supercell_16x16x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..058128c01024cf4c2203ff5c1031c89a70f625da --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-4590_supercell_16x16x1.cif @@ -0,0 +1,1561 @@ +data_image0 +_chemical_formula_structural Cu256Te256O1024 +_chemical_formula_sum "Cu256 Te256 O1024" +_cell_length_a 47.9636 +_cell_length_b 97.2107 +_cell_length_c 6.53622 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Cu Cu1 1.0 0.00006 0.03653 0.50000 1.0000 + Cu Cu2 1.0 0.00006 0.09903 0.50000 1.0000 + Cu Cu3 1.0 0.00006 0.16153 0.50000 1.0000 + Cu Cu4 1.0 0.00006 0.22403 0.50000 1.0000 + Cu Cu5 1.0 0.00006 0.28653 0.50000 1.0000 + Cu Cu6 1.0 0.00006 0.34903 0.50000 1.0000 + Cu Cu7 1.0 0.00006 0.41153 0.50000 1.0000 + Cu Cu8 1.0 0.00006 0.47403 0.50000 1.0000 + Cu Cu9 1.0 0.00006 0.53653 0.50000 1.0000 + Cu Cu10 1.0 0.00006 0.59903 0.50000 1.0000 + Cu Cu11 1.0 0.00006 0.66153 0.50000 1.0000 + Cu Cu12 1.0 0.00006 0.72403 0.50000 1.0000 + Cu Cu13 1.0 0.00006 0.78653 0.50000 1.0000 + Cu Cu14 1.0 0.00006 0.84903 0.50000 1.0000 + Cu Cu15 1.0 0.00006 0.91153 0.50000 1.0000 + Cu Cu16 1.0 0.00006 0.97403 0.50000 1.0000 + Cu Cu17 1.0 0.06256 0.03653 0.50000 1.0000 + Cu Cu18 1.0 0.06256 0.09903 0.50000 1.0000 + Cu Cu19 1.0 0.06256 0.16153 0.50000 1.0000 + Cu Cu20 1.0 0.06256 0.22403 0.50000 1.0000 + Cu Cu21 1.0 0.06256 0.28653 0.50000 1.0000 + Cu Cu22 1.0 0.06256 0.34903 0.50000 1.0000 + Cu Cu23 1.0 0.06256 0.41153 0.50000 1.0000 + Cu Cu24 1.0 0.06256 0.47403 0.50000 1.0000 + Cu Cu25 1.0 0.06256 0.53653 0.50000 1.0000 + Cu Cu26 1.0 0.06256 0.59903 0.50000 1.0000 + Cu Cu27 1.0 0.06256 0.66153 0.50000 1.0000 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1.0000 + O O1019 1.0 0.96881 0.67343 0.57435 1.0000 + O O1020 1.0 0.96881 0.73593 0.57435 1.0000 + O O1021 1.0 0.96881 0.79843 0.57435 1.0000 + O O1022 1.0 0.96881 0.86093 0.57435 1.0000 + O O1023 1.0 0.96881 0.92343 0.57435 1.0000 + O O1024 1.0 0.96881 0.98593 0.57435 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-4602_supercell_12x12x1.cif b/tier3/cif_file/orthogonal_2dm-4602_supercell_12x12x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..c9c6cc0ddde02b466f0c8daac48f40fb6a44682b --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-4602_supercell_12x12x1.cif @@ -0,0 +1,2617 @@ +data_image0 +_chemical_formula_structural Cr144Co288O864Cr144Co288O864 +_chemical_formula_sum "Cr288 Co576 O1728" +_cell_length_a 102.531 +_cell_length_b 59.9758 +_cell_length_c 5.92494 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Cr Cr1 1.0 0.00000 0.00000 0.50000 1.0000 + Cr Cr2 1.0 0.45833 0.54167 0.50000 1.0000 + Cr Cr3 1.0 0.41667 0.58333 0.50000 1.0000 + Cr Cr4 1.0 0.37500 0.62500 0.50000 1.0000 + Cr Cr5 1.0 0.33333 0.66667 0.50000 1.0000 + Cr Cr6 1.0 0.29167 0.70833 0.50000 1.0000 + Cr Cr7 1.0 0.25000 0.75000 0.50000 1.0000 + Cr Cr8 1.0 0.70833 0.29167 0.50000 1.0000 + Cr Cr9 1.0 0.16667 0.83333 0.50000 1.0000 + Cr Cr10 1.0 0.12500 0.87500 0.50000 1.0000 + Cr Cr11 1.0 0.08333 0.91667 0.50000 1.0000 + Cr Cr12 1.0 0.04167 0.95833 0.50000 1.0000 + Cr Cr13 1.0 0.04167 0.04167 0.50000 1.0000 + Cr Cr14 1.0 0.00000 0.08333 0.50000 1.0000 + Cr Cr15 1.0 0.95833 0.12500 0.50000 1.0000 + Cr Cr16 1.0 0.91667 0.16667 0.50000 1.0000 + Cr Cr17 1.0 0.87500 0.20833 0.50000 1.0000 + Cr Cr18 1.0 0.83333 0.25000 0.50000 1.0000 + Cr Cr19 1.0 0.79167 0.29167 0.50000 1.0000 + Cr Cr20 1.0 0.75000 0.33333 0.50000 1.0000 + Cr Cr21 1.0 0.70833 0.37500 0.50000 1.0000 + Cr Cr22 1.0 0.66667 0.41667 0.50000 1.0000 + Cr Cr23 1.0 0.62500 0.45833 0.50000 1.0000 + Cr Cr24 1.0 0.58333 0.50000 0.50000 1.0000 + Cr Cr25 1.0 0.08333 0.08333 0.50000 1.0000 + Cr Cr26 1.0 0.04167 0.12500 0.50000 1.0000 + Cr Cr27 1.0 0.00000 0.16667 0.50000 1.0000 + Cr Cr28 1.0 0.95833 0.20833 0.50000 1.0000 + Cr Cr29 1.0 0.91667 0.25000 0.50000 1.0000 + Cr Cr30 1.0 0.87500 0.29167 0.50000 1.0000 + Cr Cr31 1.0 0.83333 0.33333 0.50000 1.0000 + Cr Cr32 1.0 0.79167 0.37500 0.50000 1.0000 + Cr Cr33 1.0 0.75000 0.41667 0.50000 1.0000 + Cr Cr34 1.0 0.70833 0.45833 0.50000 1.0000 + Cr Cr35 1.0 0.66667 0.50000 0.50000 1.0000 + Cr Cr36 1.0 0.62500 0.54167 0.50000 1.0000 + Cr Cr37 1.0 0.12500 0.12500 0.50000 1.0000 + Cr Cr38 1.0 0.08333 0.16667 0.50000 1.0000 + Cr Cr39 1.0 0.04167 0.20833 0.50000 1.0000 + Cr Cr40 1.0 0.00000 0.25000 0.50000 1.0000 + Cr Cr41 1.0 0.95833 0.29167 0.50000 1.0000 + Cr Cr42 1.0 0.91667 0.33333 0.50000 1.0000 + Cr Cr43 1.0 0.87500 0.37500 0.50000 1.0000 + Cr Cr44 1.0 0.83333 0.41667 0.50000 1.0000 + Cr Cr45 1.0 0.79167 0.45833 0.50000 1.0000 + Cr Cr46 1.0 0.75000 0.50000 0.50000 1.0000 + Cr Cr47 1.0 0.70833 0.54167 0.50000 1.0000 + Cr Cr48 1.0 0.66667 0.58333 0.50000 1.0000 + Cr Cr49 1.0 0.16667 0.16667 0.50000 1.0000 + Cr Cr50 1.0 0.12500 0.20833 0.50000 1.0000 + Cr Cr51 1.0 0.08333 0.25000 0.50000 1.0000 + Cr Cr52 1.0 0.04167 0.29167 0.50000 1.0000 + Cr Cr53 1.0 0.00000 0.33333 0.50000 1.0000 + Cr Cr54 1.0 0.95833 0.37500 0.50000 1.0000 + Cr Cr55 1.0 0.91667 0.41667 0.50000 1.0000 + Cr Cr56 1.0 0.87500 0.45833 0.50000 1.0000 + Cr Cr57 1.0 0.83333 0.50000 0.50000 1.0000 + Cr Cr58 1.0 0.79167 0.54167 0.50000 1.0000 + Cr Cr59 1.0 0.75000 0.58333 0.50000 1.0000 + Cr Cr60 1.0 0.70833 0.62500 0.50000 1.0000 + Cr Cr61 1.0 0.20833 0.20833 0.50000 1.0000 + Cr Cr62 1.0 0.16667 0.25000 0.50000 1.0000 + Cr Cr63 1.0 0.12500 0.29167 0.50000 1.0000 + Cr Cr64 1.0 0.08333 0.33333 0.50000 1.0000 + Cr Cr65 1.0 0.04167 0.37500 0.50000 1.0000 + Cr Cr66 1.0 0.00000 0.41667 0.50000 1.0000 + Cr Cr67 1.0 0.95833 0.45833 0.50000 1.0000 + Cr Cr68 1.0 0.91667 0.50000 0.50000 1.0000 + Cr Cr69 1.0 0.87500 0.54167 0.50000 1.0000 + Cr Cr70 1.0 0.83333 0.58333 0.50000 1.0000 + Cr Cr71 1.0 0.79167 0.62500 0.50000 1.0000 + Cr Cr72 1.0 0.75000 0.66667 0.50000 1.0000 + Cr Cr73 1.0 0.25000 0.25000 0.50000 1.0000 + Cr Cr74 1.0 0.20833 0.29167 0.50000 1.0000 + Cr Cr75 1.0 0.16667 0.33333 0.50000 1.0000 + Cr Cr76 1.0 0.12500 0.37500 0.50000 1.0000 + Cr Cr77 1.0 0.08333 0.41667 0.50000 1.0000 + Cr Cr78 1.0 0.04167 0.45833 0.50000 1.0000 + Cr Cr79 1.0 0.00000 0.50000 0.50000 1.0000 + Cr Cr80 1.0 0.95833 0.54167 0.50000 1.0000 + Cr Cr81 1.0 0.91667 0.58333 0.50000 1.0000 + Cr Cr82 1.0 0.87500 0.62500 0.50000 1.0000 + Cr Cr83 1.0 0.83333 0.66667 0.50000 1.0000 + Cr Cr84 1.0 0.79167 0.70833 0.50000 1.0000 + Cr Cr85 1.0 0.29167 0.29167 0.50000 1.0000 + Cr Cr86 1.0 0.25000 0.33333 0.50000 1.0000 + Cr Cr87 1.0 0.20833 0.37500 0.50000 1.0000 + Cr Cr88 1.0 0.16667 0.41667 0.50000 1.0000 + Cr Cr89 1.0 0.12500 0.45833 0.50000 1.0000 + Cr Cr90 1.0 0.08333 0.50000 0.50000 1.0000 + Cr Cr91 1.0 0.04167 0.54167 0.50000 1.0000 + Cr Cr92 1.0 0.00000 0.58333 0.50000 1.0000 + Cr Cr93 1.0 0.95833 0.62500 0.50000 1.0000 + Cr Cr94 1.0 0.91667 0.66667 0.50000 1.0000 + Cr Cr95 1.0 0.87500 0.70833 0.50000 1.0000 + Cr Cr96 1.0 0.83333 0.75000 0.50000 1.0000 + Cr Cr97 1.0 0.33333 0.33333 0.50000 1.0000 + Cr Cr98 1.0 0.29167 0.37500 0.50000 1.0000 + Cr Cr99 1.0 0.25000 0.41667 0.50000 1.0000 + Cr Cr100 1.0 0.20833 0.45833 0.50000 1.0000 + Cr Cr101 1.0 0.16667 0.50000 0.50000 1.0000 + Cr Cr102 1.0 0.12500 0.54167 0.50000 1.0000 + Cr Cr103 1.0 0.08333 0.58333 0.50000 1.0000 + Cr Cr104 1.0 0.04167 0.62500 0.50000 1.0000 + Cr Cr105 1.0 1.00000 0.66667 0.50000 1.0000 + Cr Cr106 1.0 0.95833 0.70833 0.50000 1.0000 + Cr Cr107 1.0 0.91667 0.75000 0.50000 1.0000 + Cr Cr108 1.0 0.87500 0.79167 0.50000 1.0000 + Cr Cr109 1.0 0.37500 0.37500 0.50000 1.0000 + Cr Cr110 1.0 0.33333 0.41667 0.50000 1.0000 + Cr Cr111 1.0 0.29167 0.45833 0.50000 1.0000 + Cr Cr112 1.0 0.25000 0.50000 0.50000 1.0000 + Cr Cr113 1.0 0.20833 0.54167 0.50000 1.0000 + Cr Cr114 1.0 0.16667 0.58333 0.50000 1.0000 + Cr Cr115 1.0 0.12500 0.62500 0.50000 1.0000 + Cr Cr116 1.0 0.08333 0.66667 0.50000 1.0000 + Cr Cr117 1.0 0.04167 0.70833 0.50000 1.0000 + Cr Cr118 1.0 0.00000 0.75000 0.50000 1.0000 + Cr Cr119 1.0 0.95833 0.79167 0.50000 1.0000 + Cr Cr120 1.0 0.91667 0.83333 0.50000 1.0000 + Cr Cr121 1.0 0.41667 0.41667 0.50000 1.0000 + Cr Cr122 1.0 0.37500 0.45833 0.50000 1.0000 + Cr Cr123 1.0 0.33333 0.50000 0.50000 1.0000 + Cr Cr124 1.0 0.29167 0.54167 0.50000 1.0000 + Cr Cr125 1.0 0.25000 0.58333 0.50000 1.0000 + Cr Cr126 1.0 0.20833 0.62500 0.50000 1.0000 + Cr Cr127 1.0 0.16667 0.66667 0.50000 1.0000 + Cr Cr128 1.0 0.12500 0.70833 0.50000 1.0000 + Cr Cr129 1.0 0.08333 0.75000 0.50000 1.0000 + Cr Cr130 1.0 0.04167 0.79167 0.50000 1.0000 + Cr Cr131 1.0 1.00000 0.83333 0.50000 1.0000 + Cr Cr132 1.0 0.95833 0.87500 0.50000 1.0000 + Cr Cr133 1.0 0.45833 0.45833 0.50000 1.0000 + Cr Cr134 1.0 0.41667 0.50000 0.50000 1.0000 + Cr Cr135 1.0 0.37500 0.54167 0.50000 1.0000 + Cr Cr136 1.0 0.33333 0.58333 0.50000 1.0000 + Cr Cr137 1.0 0.29167 0.62500 0.50000 1.0000 + Cr Cr138 1.0 0.25000 0.66667 0.50000 1.0000 + Cr Cr139 1.0 0.20833 0.70833 0.50000 1.0000 + Cr Cr140 1.0 0.16667 0.75000 0.50000 1.0000 + Cr Cr141 1.0 0.12500 0.79167 0.50000 1.0000 + Cr Cr142 1.0 0.08333 0.83333 0.50000 1.0000 + Cr Cr143 1.0 0.04167 0.87500 0.50000 1.0000 + Cr Cr144 1.0 0.00000 0.91667 0.50000 1.0000 + Co Co1 1.0 0.98617 0.04167 0.50000 1.0000 + Co Co2 1.0 0.94450 0.08333 0.50000 1.0000 + Co Co3 1.0 0.90284 0.12500 0.50000 1.0000 + Co Co4 1.0 0.86117 0.16667 0.50000 1.0000 + Co Co5 1.0 0.81950 0.20833 0.50000 1.0000 + Co Co6 1.0 0.77784 0.25000 0.50000 1.0000 + Co Co7 1.0 0.73617 0.29167 0.50000 1.0000 + Co Co8 1.0 0.69450 0.33333 0.50000 1.0000 + Co Co9 1.0 0.65284 0.37500 0.50000 1.0000 + Co Co10 1.0 0.61117 0.41667 0.50000 1.0000 + Co Co11 1.0 0.56950 0.45833 0.50000 1.0000 + Co Co12 1.0 0.52784 0.50000 0.50000 1.0000 + Co Co13 1.0 0.02784 0.08333 0.50000 1.0000 + Co Co14 1.0 0.98617 0.12500 0.50000 1.0000 + Co Co15 1.0 0.94450 0.16667 0.50000 1.0000 + Co Co16 1.0 0.90284 0.20833 0.50000 1.0000 + Co Co17 1.0 0.86117 0.25000 0.50000 1.0000 + Co Co18 1.0 0.81950 0.29167 0.50000 1.0000 + Co Co19 1.0 0.77784 0.33333 0.50000 1.0000 + Co Co20 1.0 0.73617 0.37500 0.50000 1.0000 + Co Co21 1.0 0.69450 0.41667 0.50000 1.0000 + Co Co22 1.0 0.65284 0.45833 0.50000 1.0000 + Co Co23 1.0 0.61117 0.50000 0.50000 1.0000 + Co Co24 1.0 0.56950 0.54167 0.50000 1.0000 + Co Co25 1.0 0.06950 0.12500 0.50000 1.0000 + Co Co26 1.0 0.02784 0.16667 0.50000 1.0000 + Co Co27 1.0 0.98617 0.20833 0.50000 1.0000 + Co Co28 1.0 0.94450 0.25000 0.50000 1.0000 + Co Co29 1.0 0.90284 0.29167 0.50000 1.0000 + Co Co30 1.0 0.86117 0.33333 0.50000 1.0000 + Co Co31 1.0 0.81950 0.37500 0.50000 1.0000 + Co Co32 1.0 0.77784 0.41667 0.50000 1.0000 + Co Co33 1.0 0.73617 0.45833 0.50000 1.0000 + Co Co34 1.0 0.69450 0.50000 0.50000 1.0000 + Co Co35 1.0 0.65284 0.54167 0.50000 1.0000 + Co Co36 1.0 0.61117 0.58333 0.50000 1.0000 + Co Co37 1.0 0.11117 0.16667 0.50000 1.0000 + Co Co38 1.0 0.06950 0.20833 0.50000 1.0000 + Co Co39 1.0 0.02784 0.25000 0.50000 1.0000 + Co Co40 1.0 0.98617 0.29167 0.50000 1.0000 + Co Co41 1.0 0.94450 0.33333 0.50000 1.0000 + Co Co42 1.0 0.90284 0.37500 0.50000 1.0000 + Co Co43 1.0 0.86117 0.41667 0.50000 1.0000 + Co Co44 1.0 0.81950 0.45833 0.50000 1.0000 + Co Co45 1.0 0.77784 0.50000 0.50000 1.0000 + Co Co46 1.0 0.73617 0.54167 0.50000 1.0000 + Co Co47 1.0 0.69450 0.58333 0.50000 1.0000 + Co Co48 1.0 0.65284 0.62500 0.50000 1.0000 + Co Co49 1.0 0.15284 0.20833 0.50000 1.0000 + Co Co50 1.0 0.11117 0.25000 0.50000 1.0000 + Co Co51 1.0 0.06950 0.29167 0.50000 1.0000 + Co Co52 1.0 0.02784 0.33333 0.50000 1.0000 + Co Co53 1.0 0.98617 0.37500 0.50000 1.0000 + Co Co54 1.0 0.94450 0.41667 0.50000 1.0000 + Co Co55 1.0 0.90284 0.45833 0.50000 1.0000 + Co Co56 1.0 0.86117 0.50000 0.50000 1.0000 + Co Co57 1.0 0.81950 0.54167 0.50000 1.0000 + Co Co58 1.0 0.77784 0.58333 0.50000 1.0000 + Co Co59 1.0 0.73617 0.62500 0.50000 1.0000 + Co Co60 1.0 0.69450 0.66667 0.50000 1.0000 + Co Co61 1.0 0.19450 0.25000 0.50000 1.0000 + Co Co62 1.0 0.15284 0.29167 0.50000 1.0000 + Co Co63 1.0 0.11117 0.33333 0.50000 1.0000 + Co Co64 1.0 0.06950 0.37500 0.50000 1.0000 + Co Co65 1.0 0.02784 0.41667 0.50000 1.0000 + Co Co66 1.0 0.98617 0.45833 0.50000 1.0000 + Co Co67 1.0 0.94450 0.50000 0.50000 1.0000 + Co Co68 1.0 0.90284 0.54167 0.50000 1.0000 + Co Co69 1.0 0.86117 0.58333 0.50000 1.0000 + Co Co70 1.0 0.81950 0.62500 0.50000 1.0000 + Co Co71 1.0 0.77784 0.66667 0.50000 1.0000 + Co Co72 1.0 0.73617 0.70833 0.50000 1.0000 + Co Co73 1.0 0.23617 0.29167 0.50000 1.0000 + Co Co74 1.0 0.19450 0.33333 0.50000 1.0000 + Co Co75 1.0 0.15284 0.37500 0.50000 1.0000 + Co Co76 1.0 0.11117 0.41667 0.50000 1.0000 + Co Co77 1.0 0.06950 0.45833 0.50000 1.0000 + Co Co78 1.0 0.02784 0.50000 0.50000 1.0000 + Co Co79 1.0 0.98617 0.54167 0.50000 1.0000 + Co Co80 1.0 0.94450 0.58333 0.50000 1.0000 + Co Co81 1.0 0.90284 0.62500 0.50000 1.0000 + Co Co82 1.0 0.86117 0.66667 0.50000 1.0000 + Co Co83 1.0 0.81950 0.70833 0.50000 1.0000 + Co Co84 1.0 0.77784 0.75000 0.50000 1.0000 + Co Co85 1.0 0.27784 0.33333 0.50000 1.0000 + Co Co86 1.0 0.23617 0.37500 0.50000 1.0000 + Co Co87 1.0 0.19450 0.41667 0.50000 1.0000 + Co Co88 1.0 0.15284 0.45833 0.50000 1.0000 + Co Co89 1.0 0.11117 0.50000 0.50000 1.0000 + Co Co90 1.0 0.06950 0.54167 0.50000 1.0000 + Co Co91 1.0 0.02784 0.58333 0.50000 1.0000 + Co Co92 1.0 0.98617 0.62500 0.50000 1.0000 + Co Co93 1.0 0.94450 0.66667 0.50000 1.0000 + Co Co94 1.0 0.90284 0.70833 0.50000 1.0000 + Co Co95 1.0 0.86117 0.75000 0.50000 1.0000 + Co Co96 1.0 0.81950 0.79167 0.50000 1.0000 + Co Co97 1.0 0.31950 0.37500 0.50000 1.0000 + Co Co98 1.0 0.27784 0.41667 0.50000 1.0000 + Co Co99 1.0 0.23617 0.45833 0.50000 1.0000 + Co Co100 1.0 0.19450 0.50000 0.50000 1.0000 + Co Co101 1.0 0.15284 0.54167 0.50000 1.0000 + Co Co102 1.0 0.11117 0.58333 0.50000 1.0000 + Co Co103 1.0 0.06950 0.62500 0.50000 1.0000 + Co Co104 1.0 0.02784 0.66667 0.50000 1.0000 + Co Co105 1.0 0.98617 0.70833 0.50000 1.0000 + Co Co106 1.0 0.94450 0.75000 0.50000 1.0000 + Co Co107 1.0 0.90284 0.79167 0.50000 1.0000 + Co Co108 1.0 0.86117 0.83333 0.50000 1.0000 + Co Co109 1.0 0.36117 0.41667 0.50000 1.0000 + Co Co110 1.0 0.31950 0.45833 0.50000 1.0000 + Co Co111 1.0 0.27784 0.50000 0.50000 1.0000 + Co Co112 1.0 0.23617 0.54167 0.50000 1.0000 + Co Co113 1.0 0.19450 0.58333 0.50000 1.0000 + Co Co114 1.0 0.15284 0.62500 0.50000 1.0000 + Co Co115 1.0 0.11117 0.66667 0.50000 1.0000 + Co Co116 1.0 0.06950 0.70833 0.50000 1.0000 + Co Co117 1.0 0.02784 0.75000 0.50000 1.0000 + Co Co118 1.0 0.98617 0.79167 0.50000 1.0000 + Co Co119 1.0 0.94450 0.83333 0.50000 1.0000 + Co Co120 1.0 0.90284 0.87500 0.50000 1.0000 + Co Co121 1.0 0.40284 0.45833 0.50000 1.0000 + Co Co122 1.0 0.36117 0.50000 0.50000 1.0000 + Co Co123 1.0 0.31950 0.54167 0.50000 1.0000 + Co Co124 1.0 0.27784 0.58333 0.50000 1.0000 + Co Co125 1.0 0.23617 0.62500 0.50000 1.0000 + Co Co126 1.0 0.19450 0.66667 0.50000 1.0000 + Co Co127 1.0 0.15284 0.70833 0.50000 1.0000 + Co Co128 1.0 0.11117 0.75000 0.50000 1.0000 + Co Co129 1.0 0.06950 0.79167 0.50000 1.0000 + Co Co130 1.0 0.02784 0.83333 0.50000 1.0000 + Co Co131 1.0 0.98617 0.87500 0.50000 1.0000 + Co Co132 1.0 0.94450 0.91667 0.50000 1.0000 + Co Co133 1.0 0.44450 0.50000 0.50000 1.0000 + Co Co134 1.0 0.40284 0.54167 0.50000 1.0000 + Co Co135 1.0 0.36117 0.58333 0.50000 1.0000 + Co Co136 1.0 0.31950 0.62500 0.50000 1.0000 + Co Co137 1.0 0.27784 0.66667 0.50000 1.0000 + Co Co138 1.0 0.23617 0.70833 0.50000 1.0000 + Co Co139 1.0 0.19450 0.75000 0.50000 1.0000 + Co Co140 1.0 0.15284 0.79167 0.50000 1.0000 + Co Co141 1.0 0.11117 0.83333 0.50000 1.0000 + Co Co142 1.0 0.06950 0.87500 0.50000 1.0000 + Co Co143 1.0 0.02784 0.91667 0.50000 1.0000 + Co Co144 1.0 0.98617 0.95833 0.50000 1.0000 + Co Co145 1.0 0.01383 0.04167 0.50000 1.0000 + Co Co146 1.0 0.97216 0.08333 0.50000 1.0000 + Co Co147 1.0 0.93050 0.12500 0.50000 1.0000 + Co Co148 1.0 0.88883 0.16667 0.50000 1.0000 + Co Co149 1.0 0.84716 0.20833 0.50000 1.0000 + Co Co150 1.0 0.80550 0.25000 0.50000 1.0000 + Co Co151 1.0 0.76383 0.29167 0.50000 1.0000 + Co Co152 1.0 0.72216 0.33333 0.50000 1.0000 + Co Co153 1.0 0.68050 0.37500 0.50000 1.0000 + Co Co154 1.0 0.63883 0.41667 0.50000 1.0000 + Co Co155 1.0 0.59716 0.45833 0.50000 1.0000 + Co Co156 1.0 0.55550 0.50000 0.50000 1.0000 + Co Co157 1.0 0.05550 0.08333 0.50000 1.0000 + Co Co158 1.0 0.01383 0.12500 0.50000 1.0000 + Co Co159 1.0 0.97216 0.16667 0.50000 1.0000 + Co Co160 1.0 0.93050 0.20833 0.50000 1.0000 + Co Co161 1.0 0.88883 0.25000 0.50000 1.0000 + Co Co162 1.0 0.84716 0.29167 0.50000 1.0000 + Co Co163 1.0 0.80550 0.33333 0.50000 1.0000 + Co Co164 1.0 0.76383 0.37500 0.50000 1.0000 + Co Co165 1.0 0.72216 0.41667 0.50000 1.0000 + Co Co166 1.0 0.68050 0.45833 0.50000 1.0000 + Co Co167 1.0 0.63883 0.50000 0.50000 1.0000 + Co Co168 1.0 0.59716 0.54167 0.50000 1.0000 + Co Co169 1.0 0.09716 0.12500 0.50000 1.0000 + Co Co170 1.0 0.05550 0.16667 0.50000 1.0000 + Co Co171 1.0 0.01383 0.20833 0.50000 1.0000 + Co Co172 1.0 0.97216 0.25000 0.50000 1.0000 + Co Co173 1.0 0.93050 0.29167 0.50000 1.0000 + Co Co174 1.0 0.88883 0.33333 0.50000 1.0000 + Co Co175 1.0 0.84716 0.37500 0.50000 1.0000 + Co Co176 1.0 0.80550 0.41667 0.50000 1.0000 + Co Co177 1.0 0.76383 0.45833 0.50000 1.0000 + Co Co178 1.0 0.72216 0.50000 0.50000 1.0000 + Co Co179 1.0 0.68050 0.54167 0.50000 1.0000 + Co Co180 1.0 0.63883 0.58333 0.50000 1.0000 + Co Co181 1.0 0.13883 0.16667 0.50000 1.0000 + Co Co182 1.0 0.09716 0.20833 0.50000 1.0000 + Co Co183 1.0 0.05550 0.25000 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Cr Cr148 1.0 0.87500 0.12500 0.50000 1.0000 + Cr Cr149 1.0 0.83333 0.16667 0.50000 1.0000 + Cr Cr150 1.0 0.79167 0.20833 0.50000 1.0000 + Cr Cr151 1.0 0.75000 0.25000 0.50000 1.0000 + Cr Cr152 1.0 0.20833 0.79167 0.50000 1.0000 + Cr Cr153 1.0 0.66667 0.33333 0.50000 1.0000 + Cr Cr154 1.0 0.62500 0.37500 0.50000 1.0000 + Cr Cr155 1.0 0.58333 0.41667 0.50000 1.0000 + Cr Cr156 1.0 0.54167 0.45833 0.50000 1.0000 + Cr Cr157 1.0 0.54167 0.54167 0.50000 1.0000 + Cr Cr158 1.0 0.50000 0.58333 0.50000 1.0000 + Cr Cr159 1.0 0.45833 0.62500 0.50000 1.0000 + Cr Cr160 1.0 0.41667 0.66667 0.50000 1.0000 + Cr Cr161 1.0 0.37500 0.70833 0.50000 1.0000 + Cr Cr162 1.0 0.33333 0.75000 0.50000 1.0000 + Cr Cr163 1.0 0.29167 0.79167 0.50000 1.0000 + Cr Cr164 1.0 0.25000 0.83333 0.50000 1.0000 + Cr Cr165 1.0 0.20833 0.87500 0.50000 1.0000 + Cr Cr166 1.0 0.16667 0.91667 0.50000 1.0000 + Cr Cr167 1.0 0.12500 0.95833 0.50000 1.0000 + Cr Cr168 1.0 0.08333 0.00000 0.50000 1.0000 + Cr Cr169 1.0 0.58333 0.58333 0.50000 1.0000 + Cr Cr170 1.0 0.54167 0.62500 0.50000 1.0000 + Cr Cr171 1.0 0.50000 0.66667 0.50000 1.0000 + Cr Cr172 1.0 0.45833 0.70833 0.50000 1.0000 + Cr Cr173 1.0 0.41667 0.75000 0.50000 1.0000 + Cr Cr174 1.0 0.37500 0.79167 0.50000 1.0000 + Cr Cr175 1.0 0.33333 0.83333 0.50000 1.0000 + Cr Cr176 1.0 0.29167 0.87500 0.50000 1.0000 + Cr Cr177 1.0 0.25000 0.91667 0.50000 1.0000 + Cr Cr178 1.0 0.20833 0.95833 0.50000 1.0000 + Cr Cr179 1.0 0.16667 0.00000 0.50000 1.0000 + Cr Cr180 1.0 0.12500 0.04167 0.50000 1.0000 + Cr Cr181 1.0 0.62500 0.62500 0.50000 1.0000 + Cr Cr182 1.0 0.58333 0.66667 0.50000 1.0000 + Cr Cr183 1.0 0.54167 0.70833 0.50000 1.0000 + Cr Cr184 1.0 0.50000 0.75000 0.50000 1.0000 + Cr Cr185 1.0 0.45833 0.79167 0.50000 1.0000 + Cr Cr186 1.0 0.41667 0.83333 0.50000 1.0000 + Cr Cr187 1.0 0.37500 0.87500 0.50000 1.0000 + Cr Cr188 1.0 0.33333 0.91667 0.50000 1.0000 + Cr Cr189 1.0 0.29167 0.95833 0.50000 1.0000 + Cr Cr190 1.0 0.25000 0.00000 0.50000 1.0000 + Cr Cr191 1.0 0.20833 0.04167 0.50000 1.0000 + Cr Cr192 1.0 0.16667 0.08333 0.50000 1.0000 + Cr Cr193 1.0 0.66667 0.66667 0.50000 1.0000 + Cr Cr194 1.0 0.62500 0.70833 0.50000 1.0000 + Cr Cr195 1.0 0.58333 0.75000 0.50000 1.0000 + Cr Cr196 1.0 0.54167 0.79167 0.50000 1.0000 + Cr Cr197 1.0 0.50000 0.83333 0.50000 1.0000 + Cr Cr198 1.0 0.45833 0.87500 0.50000 1.0000 + Cr Cr199 1.0 0.41667 0.91667 0.50000 1.0000 + Cr Cr200 1.0 0.37500 0.95833 0.50000 1.0000 + Cr Cr201 1.0 0.33333 0.00000 0.50000 1.0000 + Cr Cr202 1.0 0.29167 0.04167 0.50000 1.0000 + Cr Cr203 1.0 0.25000 0.08333 0.50000 1.0000 + Cr Cr204 1.0 0.20833 0.12500 0.50000 1.0000 + Cr Cr205 1.0 0.70833 0.70833 0.50000 1.0000 + Cr Cr206 1.0 0.66667 0.75000 0.50000 1.0000 + Cr Cr207 1.0 0.62500 0.79167 0.50000 1.0000 + Cr Cr208 1.0 0.58333 0.83333 0.50000 1.0000 + Cr Cr209 1.0 0.54167 0.87500 0.50000 1.0000 + Cr Cr210 1.0 0.50000 0.91667 0.50000 1.0000 + Cr Cr211 1.0 0.45833 0.95833 0.50000 1.0000 + Cr Cr212 1.0 0.41667 1.00000 0.50000 1.0000 + Cr Cr213 1.0 0.37500 0.04167 0.50000 1.0000 + Cr Cr214 1.0 0.33333 0.08333 0.50000 1.0000 + Cr Cr215 1.0 0.29167 0.12500 0.50000 1.0000 + Cr Cr216 1.0 0.25000 0.16667 0.50000 1.0000 + Cr Cr217 1.0 0.75000 0.75000 0.50000 1.0000 + Cr Cr218 1.0 0.70833 0.79167 0.50000 1.0000 + Cr Cr219 1.0 0.66667 0.83333 0.50000 1.0000 + Cr Cr220 1.0 0.62500 0.87500 0.50000 1.0000 + Cr Cr221 1.0 0.58333 0.91667 0.50000 1.0000 + Cr Cr222 1.0 0.54167 0.95833 0.50000 1.0000 + Cr Cr223 1.0 0.50000 0.00000 0.50000 1.0000 + Cr Cr224 1.0 0.45833 0.04167 0.50000 1.0000 + Cr Cr225 1.0 0.41667 0.08333 0.50000 1.0000 + Cr Cr226 1.0 0.37500 0.12500 0.50000 1.0000 + Cr Cr227 1.0 0.33333 0.16667 0.50000 1.0000 + Cr Cr228 1.0 0.29167 0.20833 0.50000 1.0000 + Cr Cr229 1.0 0.79167 0.79167 0.50000 1.0000 + Cr Cr230 1.0 0.75000 0.83333 0.50000 1.0000 + Cr Cr231 1.0 0.70833 0.87500 0.50000 1.0000 + Cr Cr232 1.0 0.66667 0.91667 0.50000 1.0000 + Cr Cr233 1.0 0.62500 0.95833 0.50000 1.0000 + Cr Cr234 1.0 0.58333 0.00000 0.50000 1.0000 + Cr Cr235 1.0 0.54167 0.04167 0.50000 1.0000 + Cr Cr236 1.0 0.50000 0.08333 0.50000 1.0000 + Cr Cr237 1.0 0.45833 0.12500 0.50000 1.0000 + Cr Cr238 1.0 0.41667 0.16667 0.50000 1.0000 + Cr Cr239 1.0 0.37500 0.20833 0.50000 1.0000 + Cr Cr240 1.0 0.33333 0.25000 0.50000 1.0000 + Cr Cr241 1.0 0.83333 0.83333 0.50000 1.0000 + Cr Cr242 1.0 0.79167 0.87500 0.50000 1.0000 + Cr Cr243 1.0 0.75000 0.91667 0.50000 1.0000 + Cr Cr244 1.0 0.70833 0.95833 0.50000 1.0000 + Cr Cr245 1.0 0.66667 1.00000 0.50000 1.0000 + Cr Cr246 1.0 0.62500 0.04167 0.50000 1.0000 + Cr Cr247 1.0 0.58333 0.08333 0.50000 1.0000 + Cr Cr248 1.0 0.54167 0.12500 0.50000 1.0000 + Cr Cr249 1.0 0.50000 0.16667 0.50000 1.0000 + Cr Cr250 1.0 0.45833 0.20833 0.50000 1.0000 + Cr Cr251 1.0 0.41667 0.25000 0.50000 1.0000 + Cr Cr252 1.0 0.37500 0.29167 0.50000 1.0000 + Cr Cr253 1.0 0.87500 0.87500 0.50000 1.0000 + Cr Cr254 1.0 0.83333 0.91667 0.50000 1.0000 + Cr Cr255 1.0 0.79167 0.95833 0.50000 1.0000 + Cr Cr256 1.0 0.75000 1.00000 0.50000 1.0000 + Cr Cr257 1.0 0.70833 0.04167 0.50000 1.0000 + Cr Cr258 1.0 0.66667 0.08333 0.50000 1.0000 + Cr Cr259 1.0 0.62500 0.12500 0.50000 1.0000 + Cr Cr260 1.0 0.58333 0.16667 0.50000 1.0000 + Cr Cr261 1.0 0.54167 0.20833 0.50000 1.0000 + Cr Cr262 1.0 0.50000 0.25000 0.50000 1.0000 + Cr Cr263 1.0 0.45833 0.29167 0.50000 1.0000 + Cr Cr264 1.0 0.41667 0.33333 0.50000 1.0000 + Cr Cr265 1.0 0.91667 0.91667 0.50000 1.0000 + Cr Cr266 1.0 0.87500 0.95833 0.50000 1.0000 + Cr Cr267 1.0 0.83333 1.00000 0.50000 1.0000 + Cr Cr268 1.0 0.79167 0.04167 0.50000 1.0000 + Cr Cr269 1.0 0.75000 0.08333 0.50000 1.0000 + Cr Cr270 1.0 0.70833 0.12500 0.50000 1.0000 + Cr Cr271 1.0 0.66667 0.16667 0.50000 1.0000 + Cr Cr272 1.0 0.62500 0.20833 0.50000 1.0000 + Cr Cr273 1.0 0.58333 0.25000 0.50000 1.0000 + Cr Cr274 1.0 0.54167 0.29167 0.50000 1.0000 + Cr Cr275 1.0 0.50000 0.33333 0.50000 1.0000 + Cr Cr276 1.0 0.45833 0.37500 0.50000 1.0000 + Cr Cr277 1.0 0.95833 0.95833 0.50000 1.0000 + Cr Cr278 1.0 0.91667 1.00000 0.50000 1.0000 + Cr Cr279 1.0 0.87500 0.04167 0.50000 1.0000 + Cr Cr280 1.0 0.83333 0.08333 0.50000 1.0000 + Cr Cr281 1.0 0.79167 0.12500 0.50000 1.0000 + Cr Cr282 1.0 0.75000 0.16667 0.50000 1.0000 + Cr Cr283 1.0 0.70833 0.20833 0.50000 1.0000 + Cr Cr284 1.0 0.66667 0.25000 0.50000 1.0000 + Cr Cr285 1.0 0.62500 0.29167 0.50000 1.0000 + Cr Cr286 1.0 0.58333 0.33333 0.50000 1.0000 + Cr Cr287 1.0 0.54167 0.37500 0.50000 1.0000 + Cr Cr288 1.0 0.50000 0.41667 0.50000 1.0000 + Co Co289 1.0 0.48617 0.54167 0.50000 1.0000 + Co Co290 1.0 0.44450 0.58333 0.50000 1.0000 + Co Co291 1.0 0.40284 0.62500 0.50000 1.0000 + Co Co292 1.0 0.36117 0.66667 0.50000 1.0000 + Co Co293 1.0 0.31950 0.70833 0.50000 1.0000 + Co Co294 1.0 0.27784 0.75000 0.50000 1.0000 + Co Co295 1.0 0.23617 0.79167 0.50000 1.0000 + Co Co296 1.0 0.19450 0.83333 0.50000 1.0000 + Co Co297 1.0 0.15284 0.87500 0.50000 1.0000 + Co Co298 1.0 0.11117 0.91667 0.50000 1.0000 + Co Co299 1.0 0.06950 0.95833 0.50000 1.0000 + Co Co300 1.0 0.02784 0.00000 0.50000 1.0000 + Co Co301 1.0 0.52784 0.58333 0.50000 1.0000 + Co Co302 1.0 0.48617 0.62500 0.50000 1.0000 + Co Co303 1.0 0.44450 0.66667 0.50000 1.0000 + Co Co304 1.0 0.40284 0.70833 0.50000 1.0000 + Co Co305 1.0 0.36117 0.75000 0.50000 1.0000 + Co Co306 1.0 0.31950 0.79167 0.50000 1.0000 + Co Co307 1.0 0.27784 0.83333 0.50000 1.0000 + Co Co308 1.0 0.23617 0.87500 0.50000 1.0000 + Co Co309 1.0 0.19450 0.91667 0.50000 1.0000 + Co Co310 1.0 0.15284 0.95833 0.50000 1.0000 + Co Co311 1.0 0.11117 0.00000 0.50000 1.0000 + Co Co312 1.0 0.06950 0.04167 0.50000 1.0000 + Co Co313 1.0 0.56950 0.62500 0.50000 1.0000 + Co Co314 1.0 0.52784 0.66667 0.50000 1.0000 + Co Co315 1.0 0.48617 0.70833 0.50000 1.0000 + Co Co316 1.0 0.44450 0.75000 0.50000 1.0000 + Co Co317 1.0 0.40284 0.79167 0.50000 1.0000 + Co Co318 1.0 0.36117 0.83333 0.50000 1.0000 + Co Co319 1.0 0.31950 0.87500 0.50000 1.0000 + Co Co320 1.0 0.27784 0.91667 0.50000 1.0000 + Co Co321 1.0 0.23617 0.95833 0.50000 1.0000 + Co Co322 1.0 0.19450 0.00000 0.50000 1.0000 + Co Co323 1.0 0.15284 0.04167 0.50000 1.0000 + Co Co324 1.0 0.11117 0.08333 0.50000 1.0000 + Co Co325 1.0 0.61117 0.66667 0.50000 1.0000 + Co Co326 1.0 0.56950 0.70833 0.50000 1.0000 + Co Co327 1.0 0.52784 0.75000 0.50000 1.0000 + Co Co328 1.0 0.48617 0.79167 0.50000 1.0000 + Co Co329 1.0 0.44450 0.83333 0.50000 1.0000 + Co Co330 1.0 0.40284 0.87500 0.50000 1.0000 + Co Co331 1.0 0.36117 0.91667 0.50000 1.0000 + Co Co332 1.0 0.31950 0.95833 0.50000 1.0000 + Co Co333 1.0 0.27784 0.00000 0.50000 1.0000 + Co Co334 1.0 0.23617 0.04167 0.50000 1.0000 + Co Co335 1.0 0.19450 0.08333 0.50000 1.0000 + Co Co336 1.0 0.15284 0.12500 0.50000 1.0000 + Co Co337 1.0 0.65284 0.70833 0.50000 1.0000 + Co Co338 1.0 0.61117 0.75000 0.50000 1.0000 + Co Co339 1.0 0.56950 0.79167 0.50000 1.0000 + Co Co340 1.0 0.52784 0.83333 0.50000 1.0000 + Co Co341 1.0 0.48617 0.87500 0.50000 1.0000 + Co Co342 1.0 0.44450 0.91667 0.50000 1.0000 + Co Co343 1.0 0.40284 0.95833 0.50000 1.0000 + Co Co344 1.0 0.36117 0.00000 0.50000 1.0000 + Co Co345 1.0 0.31950 0.04167 0.50000 1.0000 + Co Co346 1.0 0.27784 0.08333 0.50000 1.0000 + Co Co347 1.0 0.23617 0.12500 0.50000 1.0000 + Co Co348 1.0 0.19450 0.16667 0.50000 1.0000 + Co Co349 1.0 0.69450 0.75000 0.50000 1.0000 + Co Co350 1.0 0.65284 0.79167 0.50000 1.0000 + Co Co351 1.0 0.61117 0.83333 0.50000 1.0000 + Co Co352 1.0 0.56950 0.87500 0.50000 1.0000 + Co Co353 1.0 0.52784 0.91667 0.50000 1.0000 + Co Co354 1.0 0.48617 0.95833 0.50000 1.0000 + Co Co355 1.0 0.44450 0.00000 0.50000 1.0000 + Co Co356 1.0 0.40284 0.04167 0.50000 1.0000 + Co Co357 1.0 0.36117 0.08333 0.50000 1.0000 + Co Co358 1.0 0.31950 0.12500 0.50000 1.0000 + Co Co359 1.0 0.27784 0.16667 0.50000 1.0000 + Co Co360 1.0 0.23617 0.20833 0.50000 1.0000 + Co Co361 1.0 0.73617 0.79167 0.50000 1.0000 + Co Co362 1.0 0.69450 0.83333 0.50000 1.0000 + Co Co363 1.0 0.65284 0.87500 0.50000 1.0000 + Co Co364 1.0 0.61117 0.91667 0.50000 1.0000 + Co Co365 1.0 0.56950 0.95833 0.50000 1.0000 + Co Co366 1.0 0.52784 0.00000 0.50000 1.0000 + Co Co367 1.0 0.48617 0.04167 0.50000 1.0000 + Co Co368 1.0 0.44450 0.08333 0.50000 1.0000 + Co Co369 1.0 0.40284 0.12500 0.50000 1.0000 + Co Co370 1.0 0.36117 0.16667 0.50000 1.0000 + Co Co371 1.0 0.31950 0.20833 0.50000 1.0000 + Co Co372 1.0 0.27784 0.25000 0.50000 1.0000 + Co Co373 1.0 0.77784 0.83333 0.50000 1.0000 + Co Co374 1.0 0.73617 0.87500 0.50000 1.0000 + Co Co375 1.0 0.69450 0.91667 0.50000 1.0000 + Co Co376 1.0 0.65284 0.95833 0.50000 1.0000 + Co Co377 1.0 0.61117 0.00000 0.50000 1.0000 + Co Co378 1.0 0.56950 0.04167 0.50000 1.0000 + Co Co379 1.0 0.52784 0.08333 0.50000 1.0000 + Co Co380 1.0 0.48617 0.12500 0.50000 1.0000 + Co Co381 1.0 0.44450 0.16667 0.50000 1.0000 + Co Co382 1.0 0.40284 0.20833 0.50000 1.0000 + Co Co383 1.0 0.36117 0.25000 0.50000 1.0000 + Co Co384 1.0 0.31950 0.29167 0.50000 1.0000 + Co Co385 1.0 0.81950 0.87500 0.50000 1.0000 + Co Co386 1.0 0.77784 0.91667 0.50000 1.0000 + Co Co387 1.0 0.73617 0.95833 0.50000 1.0000 + Co Co388 1.0 0.69450 1.00000 0.50000 1.0000 + Co Co389 1.0 0.65284 0.04167 0.50000 1.0000 + Co Co390 1.0 0.61117 0.08333 0.50000 1.0000 + Co Co391 1.0 0.56950 0.12500 0.50000 1.0000 + Co Co392 1.0 0.52784 0.16667 0.50000 1.0000 + Co Co393 1.0 0.48617 0.20833 0.50000 1.0000 + Co Co394 1.0 0.44450 0.25000 0.50000 1.0000 + Co Co395 1.0 0.40284 0.29167 0.50000 1.0000 + Co Co396 1.0 0.36117 0.33333 0.50000 1.0000 + Co Co397 1.0 0.86117 0.91667 0.50000 1.0000 + Co Co398 1.0 0.81950 0.95833 0.50000 1.0000 + Co Co399 1.0 0.77784 1.00000 0.50000 1.0000 + Co Co400 1.0 0.73617 0.04167 0.50000 1.0000 + Co Co401 1.0 0.69450 0.08333 0.50000 1.0000 + Co Co402 1.0 0.65284 0.12500 0.50000 1.0000 + Co Co403 1.0 0.61117 0.16667 0.50000 1.0000 + Co Co404 1.0 0.56950 0.20833 0.50000 1.0000 + Co Co405 1.0 0.52784 0.25000 0.50000 1.0000 + Co Co406 1.0 0.48617 0.29167 0.50000 1.0000 + Co Co407 1.0 0.44450 0.33333 0.50000 1.0000 + Co Co408 1.0 0.40284 0.37500 0.50000 1.0000 + Co Co409 1.0 0.90284 0.95833 0.50000 1.0000 + Co Co410 1.0 0.86117 1.00000 0.50000 1.0000 + Co Co411 1.0 0.81950 0.04167 0.50000 1.0000 + Co Co412 1.0 0.77784 0.08333 0.50000 1.0000 + Co Co413 1.0 0.73617 0.12500 0.50000 1.0000 + Co Co414 1.0 0.69450 0.16667 0.50000 1.0000 + Co Co415 1.0 0.65284 0.20833 0.50000 1.0000 + Co Co416 1.0 0.61117 0.25000 0.50000 1.0000 + Co Co417 1.0 0.56950 0.29167 0.50000 1.0000 + Co Co418 1.0 0.52784 0.33333 0.50000 1.0000 + Co Co419 1.0 0.48617 0.37500 0.50000 1.0000 + Co Co420 1.0 0.44450 0.41667 0.50000 1.0000 + Co Co421 1.0 0.94450 1.00000 0.50000 1.0000 + Co Co422 1.0 0.90284 0.04167 0.50000 1.0000 + Co Co423 1.0 0.86117 0.08333 0.50000 1.0000 + Co Co424 1.0 0.81950 0.12500 0.50000 1.0000 + Co Co425 1.0 0.77784 0.16667 0.50000 1.0000 + Co Co426 1.0 0.73617 0.20833 0.50000 1.0000 + Co Co427 1.0 0.69450 0.25000 0.50000 1.0000 + Co Co428 1.0 0.65284 0.29167 0.50000 1.0000 + Co Co429 1.0 0.61117 0.33333 0.50000 1.0000 + Co Co430 1.0 0.56950 0.37500 0.50000 1.0000 + Co Co431 1.0 0.52784 0.41667 0.50000 1.0000 + Co Co432 1.0 0.48617 0.45833 0.50000 1.0000 + Co Co433 1.0 0.51383 0.54167 0.50000 1.0000 + Co Co434 1.0 0.47216 0.58333 0.50000 1.0000 + Co Co435 1.0 0.43050 0.62500 0.50000 1.0000 + Co Co436 1.0 0.38883 0.66667 0.50000 1.0000 + Co Co437 1.0 0.34716 0.70833 0.50000 1.0000 + Co Co438 1.0 0.30550 0.75000 0.50000 1.0000 + Co Co439 1.0 0.26383 0.79167 0.50000 1.0000 + Co Co440 1.0 0.22216 0.83333 0.50000 1.0000 + Co Co441 1.0 0.18050 0.87500 0.50000 1.0000 + Co Co442 1.0 0.13883 0.91667 0.50000 1.0000 + Co Co443 1.0 0.09716 0.95833 0.50000 1.0000 + Co Co444 1.0 0.05550 0.00000 0.50000 1.0000 + Co Co445 1.0 0.55550 0.58333 0.50000 1.0000 + Co Co446 1.0 0.51383 0.62500 0.50000 1.0000 + Co Co447 1.0 0.47216 0.66667 0.50000 1.0000 + Co Co448 1.0 0.43050 0.70833 0.50000 1.0000 + Co Co449 1.0 0.38883 0.75000 0.50000 1.0000 + Co Co450 1.0 0.34716 0.79167 0.50000 1.0000 + Co Co451 1.0 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Fe144Co432O1152Fe144Co432O1152 +_chemical_formula_sum "Fe288 Co864 O2304" +_cell_length_a 119.449 +_cell_length_b 68.964 +_cell_length_c 5.90353 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Fe Fe1 1.0 0.05556 0.00000 0.50000 1.0000 + Fe Fe2 1.0 0.09722 0.04167 0.50000 1.0000 + Fe Fe3 1.0 0.13889 0.08333 0.50000 1.0000 + Fe Fe4 1.0 0.18056 0.12500 0.50000 1.0000 + Fe Fe5 1.0 0.22222 0.16667 0.50000 1.0000 + Fe Fe6 1.0 0.26389 0.20833 0.50000 1.0000 + Fe Fe7 1.0 0.30556 0.25000 0.50000 1.0000 + Fe Fe8 1.0 0.34722 0.29167 0.50000 1.0000 + Fe Fe9 1.0 0.38889 0.33333 0.50000 1.0000 + Fe Fe10 1.0 0.43056 0.37500 0.50000 1.0000 + Fe Fe11 1.0 0.47222 0.41667 0.50000 1.0000 + Fe Fe12 1.0 0.51389 0.45833 0.50000 1.0000 + Fe Fe13 1.0 0.09722 0.95833 0.50000 1.0000 + Fe Fe14 1.0 0.13889 1.00000 0.50000 1.0000 + Fe Fe15 1.0 0.18056 0.04167 0.50000 1.0000 + Fe Fe16 1.0 0.22222 0.08333 0.50000 1.0000 + Fe Fe17 1.0 0.26389 0.12500 0.50000 1.0000 + Fe Fe18 1.0 0.30556 0.16667 0.50000 1.0000 + Fe Fe19 1.0 0.34722 0.20833 0.50000 1.0000 + Fe Fe20 1.0 0.38889 0.25000 0.50000 1.0000 + Fe Fe21 1.0 0.43056 0.29167 0.50000 1.0000 + Fe Fe22 1.0 0.47222 0.33333 0.50000 1.0000 + Fe Fe23 1.0 0.51389 0.37500 0.50000 1.0000 + Fe Fe24 1.0 0.55556 0.41667 0.50000 1.0000 + Fe Fe25 1.0 0.13889 0.91667 0.50000 1.0000 + Fe Fe26 1.0 0.18056 0.95833 0.50000 1.0000 + Fe Fe27 1.0 0.22222 1.00000 0.50000 1.0000 + Fe Fe28 1.0 0.26389 0.04167 0.50000 1.0000 + Fe Fe29 1.0 0.30556 0.08333 0.50000 1.0000 + Fe Fe30 1.0 0.34722 0.12500 0.50000 1.0000 + Fe Fe31 1.0 0.38889 0.16667 0.50000 1.0000 + Fe Fe32 1.0 0.43056 0.20833 0.50000 1.0000 + Fe Fe33 1.0 0.47222 0.25000 0.50000 1.0000 + Fe Fe34 1.0 0.51389 0.29167 0.50000 1.0000 + Fe Fe35 1.0 0.55556 0.33333 0.50000 1.0000 + Fe Fe36 1.0 0.59722 0.37500 0.50000 1.0000 + Fe Fe37 1.0 0.18056 0.87500 0.50000 1.0000 + Fe Fe38 1.0 0.22222 0.91667 0.50000 1.0000 + Fe Fe39 1.0 0.26389 0.95833 0.50000 1.0000 + Fe Fe40 1.0 0.30556 0.00000 0.50000 1.0000 + Fe Fe41 1.0 0.34722 0.04167 0.50000 1.0000 + Fe Fe42 1.0 0.38889 0.08333 0.50000 1.0000 + Fe Fe43 1.0 0.43056 0.12500 0.50000 1.0000 + Fe Fe44 1.0 0.47222 0.16667 0.50000 1.0000 + Fe Fe45 1.0 0.51389 0.20833 0.50000 1.0000 + Fe Fe46 1.0 0.55556 0.25000 0.50000 1.0000 + Fe Fe47 1.0 0.59722 0.29167 0.50000 1.0000 + Fe Fe48 1.0 0.63889 0.33333 0.50000 1.0000 + Fe Fe49 1.0 0.22222 0.83333 0.50000 1.0000 + Fe Fe50 1.0 0.26389 0.87500 0.50000 1.0000 + Fe Fe51 1.0 0.30556 0.91667 0.50000 1.0000 + Fe Fe52 1.0 0.34722 0.95833 0.50000 1.0000 + Fe Fe53 1.0 0.38889 0.00000 0.50000 1.0000 + Fe Fe54 1.0 0.43056 0.04167 0.50000 1.0000 + Fe Fe55 1.0 0.47222 0.08333 0.50000 1.0000 + Fe Fe56 1.0 0.51389 0.12500 0.50000 1.0000 + Fe Fe57 1.0 0.55556 0.16667 0.50000 1.0000 + Fe Fe58 1.0 0.59722 0.20833 0.50000 1.0000 + Fe Fe59 1.0 0.63889 0.25000 0.50000 1.0000 + Fe Fe60 1.0 0.68056 0.29167 0.50000 1.0000 + Fe Fe61 1.0 0.26389 0.79167 0.50000 1.0000 + Fe Fe62 1.0 0.30556 0.83333 0.50000 1.0000 + Fe Fe63 1.0 0.34722 0.87500 0.50000 1.0000 + Fe Fe64 1.0 0.38889 0.91667 0.50000 1.0000 + Fe Fe65 1.0 0.43056 0.95833 0.50000 1.0000 + Fe Fe66 1.0 0.47222 1.00000 0.50000 1.0000 + Fe Fe67 1.0 0.51389 0.04167 0.50000 1.0000 + Fe Fe68 1.0 0.55556 0.08333 0.50000 1.0000 + Fe Fe69 1.0 0.59722 0.12500 0.50000 1.0000 + Fe Fe70 1.0 0.63889 0.16667 0.50000 1.0000 + Fe Fe71 1.0 0.68056 0.20833 0.50000 1.0000 + Fe Fe72 1.0 0.72222 0.25000 0.50000 1.0000 + Fe Fe73 1.0 0.30556 0.75000 0.50000 1.0000 + Fe Fe74 1.0 0.34722 0.79167 0.50000 1.0000 + Fe Fe75 1.0 0.38889 0.83333 0.50000 1.0000 + Fe Fe76 1.0 0.43056 0.87500 0.50000 1.0000 + Fe Fe77 1.0 0.47222 0.91667 0.50000 1.0000 + Fe Fe78 1.0 0.51389 0.95833 0.50000 1.0000 + Fe Fe79 1.0 0.55556 1.00000 0.50000 1.0000 + Fe Fe80 1.0 0.59722 0.04167 0.50000 1.0000 + Fe Fe81 1.0 0.63889 0.08333 0.50000 1.0000 + Fe Fe82 1.0 0.68056 0.12500 0.50000 1.0000 + Fe Fe83 1.0 0.72222 0.16667 0.50000 1.0000 + Fe Fe84 1.0 0.76389 0.20833 0.50000 1.0000 + Fe Fe85 1.0 0.34722 0.70833 0.50000 1.0000 + Fe Fe86 1.0 0.38889 0.75000 0.50000 1.0000 + Fe Fe87 1.0 0.43056 0.79167 0.50000 1.0000 + Fe Fe88 1.0 0.47222 0.83333 0.50000 1.0000 + Fe Fe89 1.0 0.51389 0.87500 0.50000 1.0000 + Fe Fe90 1.0 0.55556 0.91667 0.50000 1.0000 + Fe Fe91 1.0 0.59722 0.95833 0.50000 1.0000 + Fe Fe92 1.0 0.63889 1.00000 0.50000 1.0000 + Fe Fe93 1.0 0.68056 0.04167 0.50000 1.0000 + Fe Fe94 1.0 0.72222 0.08333 0.50000 1.0000 + Fe Fe95 1.0 0.76389 0.12500 0.50000 1.0000 + Fe Fe96 1.0 0.80556 0.16667 0.50000 1.0000 + Fe Fe97 1.0 0.38889 0.66667 0.50000 1.0000 + Fe Fe98 1.0 0.43056 0.70833 0.50000 1.0000 + Fe Fe99 1.0 0.47222 0.75000 0.50000 1.0000 + Fe Fe100 1.0 0.51389 0.79167 0.50000 1.0000 + Fe Fe101 1.0 0.55556 0.83333 0.50000 1.0000 + Fe Fe102 1.0 0.59722 0.87500 0.50000 1.0000 + Fe Fe103 1.0 0.63889 0.91667 0.50000 1.0000 + Fe Fe104 1.0 0.68056 0.95833 0.50000 1.0000 + Fe Fe105 1.0 0.72222 1.00000 0.50000 1.0000 + Fe Fe106 1.0 0.76389 0.04167 0.50000 1.0000 + Fe Fe107 1.0 0.80556 0.08333 0.50000 1.0000 + Fe Fe108 1.0 0.84722 0.12500 0.50000 1.0000 + Fe Fe109 1.0 0.43056 0.62500 0.50000 1.0000 + Fe Fe110 1.0 0.47222 0.66667 0.50000 1.0000 + Fe Fe111 1.0 0.51389 0.70833 0.50000 1.0000 + Fe Fe112 1.0 0.55556 0.75000 0.50000 1.0000 + Fe Fe113 1.0 0.59722 0.79167 0.50000 1.0000 + Fe Fe114 1.0 0.63889 0.83333 0.50000 1.0000 + Fe Fe115 1.0 0.68056 0.87500 0.50000 1.0000 + Fe Fe116 1.0 0.72222 0.91667 0.50000 1.0000 + Fe Fe117 1.0 0.76389 0.95833 0.50000 1.0000 + Fe Fe118 1.0 0.80556 1.00000 0.50000 1.0000 + Fe Fe119 1.0 0.84722 0.04167 0.50000 1.0000 + Fe Fe120 1.0 0.88889 0.08333 0.50000 1.0000 + Fe Fe121 1.0 0.47222 0.58333 0.50000 1.0000 + Fe Fe122 1.0 0.51389 0.62500 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O1093 1.0 0.31276 0.72839 0.66091 1.0000 + O O1094 1.0 0.35443 0.77006 0.66091 1.0000 + O O1095 1.0 0.39609 0.81172 0.66091 1.0000 + O O1096 1.0 0.43776 0.85339 0.66091 1.0000 + O O1097 1.0 0.47943 0.89506 0.66091 1.0000 + O O1098 1.0 0.52109 0.93672 0.66091 1.0000 + O O1099 1.0 0.56276 0.97839 0.66091 1.0000 + O O1100 1.0 0.60443 0.02006 0.66091 1.0000 + O O1101 1.0 0.64609 0.06172 0.66091 1.0000 + O O1102 1.0 0.68776 0.10339 0.66091 1.0000 + O O1103 1.0 0.72943 0.14506 0.66091 1.0000 + O O1104 1.0 0.77109 0.18672 0.66091 1.0000 + O O1105 1.0 0.35443 0.68672 0.66091 1.0000 + O O1106 1.0 0.39609 0.72839 0.66091 1.0000 + O O1107 1.0 0.43776 0.77006 0.66091 1.0000 + O O1108 1.0 0.47943 0.81172 0.66091 1.0000 + O O1109 1.0 0.52109 0.85339 0.66091 1.0000 + O O1110 1.0 0.56276 0.89506 0.66091 1.0000 + O O1111 1.0 0.60443 0.93672 0.66091 1.0000 + O O1112 1.0 0.64609 0.97839 0.66091 1.0000 + O O1113 1.0 0.68776 0.02006 0.66091 1.0000 + O O1114 1.0 0.72943 0.06172 0.66091 1.0000 + O O1115 1.0 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0.50000 1.0000 + Fe Fe217 1.0 0.80556 0.25000 0.50000 1.0000 + Fe Fe218 1.0 0.84722 0.29167 0.50000 1.0000 + Fe Fe219 1.0 0.88889 0.33333 0.50000 1.0000 + Fe Fe220 1.0 0.93056 0.37500 0.50000 1.0000 + Fe Fe221 1.0 0.97222 0.41667 0.50000 1.0000 + Fe Fe222 1.0 0.01389 0.45833 0.50000 1.0000 + Fe Fe223 1.0 0.05556 0.50000 0.50000 1.0000 + Fe Fe224 1.0 0.09722 0.54167 0.50000 1.0000 + Fe Fe225 1.0 0.13889 0.58333 0.50000 1.0000 + Fe Fe226 1.0 0.18056 0.62500 0.50000 1.0000 + Fe Fe227 1.0 0.22222 0.66667 0.50000 1.0000 + Fe Fe228 1.0 0.26389 0.70833 0.50000 1.0000 + Fe Fe229 1.0 0.84722 0.20833 0.50000 1.0000 + Fe Fe230 1.0 0.88889 0.25000 0.50000 1.0000 + Fe Fe231 1.0 0.93056 0.29167 0.50000 1.0000 + Fe Fe232 1.0 0.97222 0.33333 0.50000 1.0000 + Fe Fe233 1.0 0.01389 0.37500 0.50000 1.0000 + Fe Fe234 1.0 0.05556 0.41667 0.50000 1.0000 + Fe Fe235 1.0 0.09722 0.45833 0.50000 1.0000 + Fe Fe236 1.0 0.13889 0.50000 0.50000 1.0000 + Fe Fe237 1.0 0.18056 0.54167 0.50000 1.0000 + Fe Fe238 1.0 0.22222 0.58333 0.50000 1.0000 + Fe Fe239 1.0 0.26389 0.62500 0.50000 1.0000 + Fe Fe240 1.0 0.30556 0.66667 0.50000 1.0000 + Fe Fe241 1.0 0.88889 0.16667 0.50000 1.0000 + Fe Fe242 1.0 0.93056 0.20833 0.50000 1.0000 + Fe Fe243 1.0 0.97222 0.25000 0.50000 1.0000 + Fe Fe244 1.0 0.01389 0.29167 0.50000 1.0000 + Fe Fe245 1.0 0.05556 0.33333 0.50000 1.0000 + Fe Fe246 1.0 0.09722 0.37500 0.50000 1.0000 + Fe Fe247 1.0 0.13889 0.41667 0.50000 1.0000 + Fe Fe248 1.0 0.18056 0.45833 0.50000 1.0000 + Fe Fe249 1.0 0.22222 0.50000 0.50000 1.0000 + Fe Fe250 1.0 0.26389 0.54167 0.50000 1.0000 + Fe Fe251 1.0 0.30556 0.58333 0.50000 1.0000 + Fe Fe252 1.0 0.34722 0.62500 0.50000 1.0000 + Fe Fe253 1.0 0.93056 0.12500 0.50000 1.0000 + Fe Fe254 1.0 0.97222 0.16667 0.50000 1.0000 + Fe Fe255 1.0 0.01389 0.20833 0.50000 1.0000 + Fe Fe256 1.0 0.05556 0.25000 0.50000 1.0000 + Fe Fe257 1.0 0.09722 0.29167 0.50000 1.0000 + Fe Fe258 1.0 0.13889 0.33333 0.50000 1.0000 + Fe Fe259 1.0 0.18056 0.37500 0.50000 1.0000 + Fe Fe260 1.0 0.22222 0.41667 0.50000 1.0000 + Fe Fe261 1.0 0.26389 0.45833 0.50000 1.0000 + Fe Fe262 1.0 0.30556 0.50000 0.50000 1.0000 + Fe Fe263 1.0 0.34722 0.54167 0.50000 1.0000 + Fe Fe264 1.0 0.38889 0.58333 0.50000 1.0000 + Fe Fe265 1.0 0.97222 0.08333 0.50000 1.0000 + Fe Fe266 1.0 0.01389 0.12500 0.50000 1.0000 + Fe Fe267 1.0 0.05556 0.16667 0.50000 1.0000 + Fe Fe268 1.0 0.09722 0.20833 0.50000 1.0000 + Fe Fe269 1.0 0.13889 0.25000 0.50000 1.0000 + Fe Fe270 1.0 0.18056 0.29167 0.50000 1.0000 + Fe Fe271 1.0 0.22222 0.33333 0.50000 1.0000 + Fe Fe272 1.0 0.26389 0.37500 0.50000 1.0000 + Fe Fe273 1.0 0.30556 0.41667 0.50000 1.0000 + Fe Fe274 1.0 0.34722 0.45833 0.50000 1.0000 + Fe Fe275 1.0 0.38889 0.50000 0.50000 1.0000 + Fe Fe276 1.0 0.43056 0.54167 0.50000 1.0000 + Fe Fe277 1.0 0.01389 0.04167 0.50000 1.0000 + Fe Fe278 1.0 0.05556 0.08333 0.50000 1.0000 + Fe Fe279 1.0 0.09722 0.12500 0.50000 1.0000 + Fe Fe280 1.0 0.13889 0.16667 0.50000 1.0000 + Fe Fe281 1.0 0.18056 0.20833 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Co Co599 1.0 0.99306 0.89583 0.50000 1.0000 + Co Co600 1.0 0.03472 0.93750 0.50000 1.0000 + Co Co601 1.0 0.61806 0.43750 0.50000 1.0000 + Co Co602 1.0 0.65972 0.47917 0.50000 1.0000 + Co Co603 1.0 0.70139 0.52083 0.50000 1.0000 + Co Co604 1.0 0.74306 0.56250 0.50000 1.0000 + Co Co605 1.0 0.78472 0.60417 0.50000 1.0000 + Co Co606 1.0 0.82639 0.64583 0.50000 1.0000 + Co Co607 1.0 0.86806 0.68750 0.50000 1.0000 + Co Co608 1.0 0.90972 0.72917 0.50000 1.0000 + Co Co609 1.0 0.95139 0.77083 0.50000 1.0000 + Co Co610 1.0 0.99306 0.81250 0.50000 1.0000 + Co Co611 1.0 0.03472 0.85417 0.50000 1.0000 + Co Co612 1.0 0.07639 0.89583 0.50000 1.0000 + Co Co613 1.0 0.65972 0.39583 0.50000 1.0000 + Co Co614 1.0 0.70139 0.43750 0.50000 1.0000 + Co Co615 1.0 0.74306 0.47917 0.50000 1.0000 + Co Co616 1.0 0.78472 0.52083 0.50000 1.0000 + Co Co617 1.0 0.82639 0.56250 0.50000 1.0000 + Co Co618 1.0 0.86806 0.60417 0.50000 1.0000 + Co Co619 1.0 0.90972 0.64583 0.50000 1.0000 + Co Co620 1.0 0.95139 0.68750 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0.50230 1.0000 + O O1525 1.0 0.13768 0.17088 0.50230 1.0000 + O O1526 1.0 0.16893 0.20213 0.50230 1.0000 + O O1527 1.0 0.20018 0.23338 0.50230 1.0000 + O O1528 1.0 0.23143 0.26463 0.50230 1.0000 + O O1529 1.0 0.26268 0.29588 0.50230 1.0000 + O O1530 1.0 0.29393 0.32713 0.50230 1.0000 + O O1531 1.0 0.32518 0.35838 0.50230 1.0000 + O O1532 1.0 0.35643 0.38963 0.50230 1.0000 + O O1533 1.0 0.38768 0.42088 0.50230 1.0000 + O O1534 1.0 0.41893 0.45213 0.50230 1.0000 + O O1535 1.0 0.45018 0.48338 0.50230 1.0000 + O O1536 1.0 0.48143 0.51463 0.50230 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-4757_supercell_12x12x1.cif b/tier3/cif_file/orthogonal_2dm-4757_supercell_12x12x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..5344fad172b8db4624a186f912d4f4ca779511c5 --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-4757_supercell_12x12x1.cif @@ -0,0 +1,2617 @@ +data_image0 +_chemical_formula_structural Fe144Co288O864Fe144Co288O864 +_chemical_formula_sum "Fe288 Co576 O1728" +_cell_length_a 103.205 +_cell_length_b 60.0819 +_cell_length_c 5.93564 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Fe Fe1 1.0 0.00000 0.00000 0.50000 1.0000 + Fe Fe2 1.0 0.95833 0.04167 0.50000 1.0000 + Fe Fe3 1.0 0.91667 0.08333 0.50000 1.0000 + Fe Fe4 1.0 0.87500 0.12500 0.50000 1.0000 + Fe Fe5 1.0 0.83333 0.16667 0.50000 1.0000 + Fe Fe6 1.0 0.29167 0.70833 0.50000 1.0000 + Fe Fe7 1.0 0.75000 0.25000 0.50000 1.0000 + Fe Fe8 1.0 0.20833 0.79167 0.50000 1.0000 + Fe Fe9 1.0 0.16667 0.83333 0.50000 1.0000 + Fe Fe10 1.0 0.62500 0.37500 0.50000 1.0000 + Fe Fe11 1.0 0.58333 0.41667 0.50000 1.0000 + Fe Fe12 1.0 0.54167 0.45833 0.50000 1.0000 + Fe Fe13 1.0 0.04167 0.04167 0.50000 1.0000 + Fe Fe14 1.0 0.00000 0.08333 0.50000 1.0000 + Fe Fe15 1.0 0.95833 0.12500 0.50000 1.0000 + Fe Fe16 1.0 0.91667 0.16667 0.50000 1.0000 + Fe Fe17 1.0 0.87500 0.20833 0.50000 1.0000 + Fe Fe18 1.0 0.83333 0.25000 0.50000 1.0000 + Fe Fe19 1.0 0.79167 0.29167 0.50000 1.0000 + Fe Fe20 1.0 0.75000 0.33333 0.50000 1.0000 + Fe Fe21 1.0 0.70833 0.37500 0.50000 1.0000 + Fe Fe22 1.0 0.66667 0.41667 0.50000 1.0000 + Fe Fe23 1.0 0.62500 0.45833 0.50000 1.0000 + Fe Fe24 1.0 0.58333 0.50000 0.50000 1.0000 + Fe Fe25 1.0 0.08333 0.08333 0.50000 1.0000 + Fe Fe26 1.0 0.04167 0.12500 0.50000 1.0000 + Fe Fe27 1.0 0.00000 0.16667 0.50000 1.0000 + Fe Fe28 1.0 0.95833 0.20833 0.50000 1.0000 + Fe Fe29 1.0 0.91667 0.25000 0.50000 1.0000 + Fe Fe30 1.0 0.87500 0.29167 0.50000 1.0000 + Fe Fe31 1.0 0.83333 0.33333 0.50000 1.0000 + Fe Fe32 1.0 0.79167 0.37500 0.50000 1.0000 + Fe Fe33 1.0 0.75000 0.41667 0.50000 1.0000 + Fe Fe34 1.0 0.70833 0.45833 0.50000 1.0000 + Fe Fe35 1.0 0.66667 0.50000 0.50000 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+_chemical_formula_sum "Li512 Sn512 Cl1536" +_cell_length_a 181.992 +_cell_length_b 105.073 +_cell_length_c 5.62015 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Li Li1 1.0 0.02083 0.00000 0.64414 1.0000 + Li Li2 1.0 0.05208 0.03125 0.64414 1.0000 + Li Li3 1.0 0.08333 0.06250 0.64414 1.0000 + Li Li4 1.0 0.11458 0.09375 0.64414 1.0000 + Li Li5 1.0 0.14583 0.12500 0.64414 1.0000 + Li Li6 1.0 0.17708 0.15625 0.64414 1.0000 + Li Li7 1.0 0.20833 0.18750 0.64414 1.0000 + Li Li8 1.0 0.23958 0.21875 0.64414 1.0000 + Li Li9 1.0 0.27083 0.25000 0.64414 1.0000 + Li Li10 1.0 0.30208 0.28125 0.64414 1.0000 + Li Li11 1.0 0.33333 0.31250 0.64414 1.0000 + Li Li12 1.0 0.36458 0.34375 0.64414 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+ Li Li145 1.0 0.30208 0.71875 0.64414 1.0000 + Li Li146 1.0 0.33333 0.75000 0.64414 1.0000 + Li Li147 1.0 0.36458 0.78125 0.64414 1.0000 + Li Li148 1.0 0.39583 0.81250 0.64414 1.0000 + Li Li149 1.0 0.42708 0.84375 0.64414 1.0000 + Li Li150 1.0 0.45833 0.87500 0.64414 1.0000 + Li Li151 1.0 0.48958 0.90625 0.64414 1.0000 + Li Li152 1.0 0.52083 0.93750 0.64414 1.0000 + Li Li153 1.0 0.55208 0.96875 0.64414 1.0000 + Li Li154 1.0 0.58333 0.00000 0.64414 1.0000 + Li Li155 1.0 0.61458 0.03125 0.64414 1.0000 + Li Li156 1.0 0.64583 0.06250 0.64414 1.0000 + Li Li157 1.0 0.67708 0.09375 0.64414 1.0000 + Li Li158 1.0 0.70833 0.12500 0.64414 1.0000 + Li Li159 1.0 0.73958 0.15625 0.64414 1.0000 + Li Li160 1.0 0.77083 0.18750 0.64414 1.0000 + Li Li161 1.0 0.33333 0.68750 0.64414 1.0000 + Li Li162 1.0 0.36458 0.71875 0.64414 1.0000 + Li Li163 1.0 0.39583 0.75000 0.64414 1.0000 + Li Li164 1.0 0.42708 0.78125 0.64414 1.0000 + Li Li165 1.0 0.45833 0.81250 0.64414 1.0000 + Li Li166 1.0 0.48958 0.84375 0.64414 1.0000 + Li Li167 1.0 0.52083 0.87500 0.64414 1.0000 + Li Li168 1.0 0.55208 0.90625 0.64414 1.0000 + Li Li169 1.0 0.58333 0.93750 0.64414 1.0000 + Li Li170 1.0 0.61458 0.96875 0.64414 1.0000 + Li Li171 1.0 0.64583 0.00000 0.64414 1.0000 + Li Li172 1.0 0.67708 0.03125 0.64414 1.0000 + Li Li173 1.0 0.70833 0.06250 0.64414 1.0000 + Li Li174 1.0 0.73958 0.09375 0.64414 1.0000 + Li Li175 1.0 0.77083 0.12500 0.64414 1.0000 + Li Li176 1.0 0.80208 0.15625 0.64414 1.0000 + Li Li177 1.0 0.36458 0.65625 0.64414 1.0000 + Li Li178 1.0 0.39583 0.68750 0.64414 1.0000 + Li Li179 1.0 0.42708 0.71875 0.64414 1.0000 + Li Li180 1.0 0.45833 0.75000 0.64414 1.0000 + Li Li181 1.0 0.48958 0.78125 0.64414 1.0000 + Li Li182 1.0 0.52083 0.81250 0.64414 1.0000 + Li Li183 1.0 0.55208 0.84375 0.64414 1.0000 + Li Li184 1.0 0.58333 0.87500 0.64414 1.0000 + Li Li185 1.0 0.61458 0.90625 0.64414 1.0000 + Li Li186 1.0 0.64583 0.93750 0.64414 1.0000 + Li Li187 1.0 0.67708 0.96875 0.64414 1.0000 + Li Li188 1.0 0.70833 0.00000 0.64414 1.0000 + Li Li189 1.0 0.73958 0.03125 0.64414 1.0000 + Li Li190 1.0 0.77083 0.06250 0.64414 1.0000 + Li Li191 1.0 0.80208 0.09375 0.64414 1.0000 + Li Li192 1.0 0.83333 0.12500 0.64414 1.0000 + Li Li193 1.0 0.39583 0.62500 0.64414 1.0000 + Li Li194 1.0 0.42708 0.65625 0.64414 1.0000 + Li Li195 1.0 0.45833 0.68750 0.64414 1.0000 + Li Li196 1.0 0.48958 0.71875 0.64414 1.0000 + Li Li197 1.0 0.52083 0.75000 0.64414 1.0000 + Li Li198 1.0 0.55208 0.78125 0.64414 1.0000 + Li Li199 1.0 0.58333 0.81250 0.64414 1.0000 + Li Li200 1.0 0.61458 0.84375 0.64414 1.0000 + Li Li201 1.0 0.64583 0.87500 0.64414 1.0000 + Li Li202 1.0 0.67708 0.90625 0.64414 1.0000 + Li Li203 1.0 0.70833 0.93750 0.64414 1.0000 + Li Li204 1.0 0.73958 0.96875 0.64414 1.0000 + Li Li205 1.0 0.77083 0.00000 0.64414 1.0000 + Li Li206 1.0 0.80208 0.03125 0.64414 1.0000 + Li Li207 1.0 0.83333 0.06250 0.64414 1.0000 + Li Li208 1.0 0.86458 0.09375 0.64414 1.0000 + Li Li209 1.0 0.42708 0.59375 0.64414 1.0000 + Li Li210 1.0 0.45833 0.62500 0.64414 1.0000 + Li Li211 1.0 0.48958 0.65625 0.64414 1.0000 + Li Li212 1.0 0.52083 0.68750 0.64414 1.0000 + Li Li213 1.0 0.55208 0.71875 0.64414 1.0000 + Li Li214 1.0 0.58333 0.75000 0.64414 1.0000 + Li Li215 1.0 0.61458 0.78125 0.64414 1.0000 + Li Li216 1.0 0.64583 0.81250 0.64414 1.0000 + Li Li217 1.0 0.67708 0.84375 0.64414 1.0000 + Li Li218 1.0 0.70833 0.87500 0.64414 1.0000 + Li Li219 1.0 0.73958 0.90625 0.64414 1.0000 + Li Li220 1.0 0.77083 0.93750 0.64414 1.0000 + Li Li221 1.0 0.80208 0.96875 0.64414 1.0000 + Li Li222 1.0 0.83333 1.00000 0.64414 1.0000 + Li Li223 1.0 0.86458 0.03125 0.64414 1.0000 + Li Li224 1.0 0.89583 0.06250 0.64414 1.0000 + Li Li225 1.0 0.45833 0.56250 0.64414 1.0000 + Li Li226 1.0 0.48958 0.59375 0.64414 1.0000 + Li Li227 1.0 0.52083 0.62500 0.64414 1.0000 + Li Li228 1.0 0.55208 0.65625 0.64414 1.0000 + Li Li229 1.0 0.58333 0.68750 0.64414 1.0000 + Li Li230 1.0 0.61458 0.71875 0.64414 1.0000 + Li Li231 1.0 0.64583 0.75000 0.64414 1.0000 + Li Li232 1.0 0.67708 0.78125 0.64414 1.0000 + Li Li233 1.0 0.70833 0.81250 0.64414 1.0000 + Li Li234 1.0 0.73958 0.84375 0.64414 1.0000 + Li Li235 1.0 0.77083 0.87500 0.64414 1.0000 + Li Li236 1.0 0.80208 0.90625 0.64414 1.0000 + Li Li237 1.0 0.83333 0.93750 0.64414 1.0000 + Li Li238 1.0 0.86458 0.96875 0.64414 1.0000 + Li Li239 1.0 0.89583 0.00000 0.64414 1.0000 + Li Li240 1.0 0.92708 0.03125 0.64414 1.0000 + Li Li241 1.0 0.48958 0.53125 0.64414 1.0000 + Li Li242 1.0 0.52083 0.56250 0.64414 1.0000 + Li Li243 1.0 0.55208 0.59375 0.64414 1.0000 + Li Li244 1.0 0.58333 0.62500 0.64414 1.0000 + Li Li245 1.0 0.61458 0.65625 0.64414 1.0000 + Li Li246 1.0 0.64583 0.68750 0.64414 1.0000 + Li Li247 1.0 0.67708 0.71875 0.64414 1.0000 + Li Li248 1.0 0.70833 0.75000 0.64414 1.0000 + Li Li249 1.0 0.73958 0.78125 0.64414 1.0000 + Li Li250 1.0 0.77083 0.81250 0.64414 1.0000 + Li Li251 1.0 0.80208 0.84375 0.64414 1.0000 + Li Li252 1.0 0.83333 0.87500 0.64414 1.0000 + Li Li253 1.0 0.86458 0.90625 0.64414 1.0000 + Li Li254 1.0 0.89583 0.93750 0.64414 1.0000 + Li Li255 1.0 0.92708 0.96875 0.64414 1.0000 + Li Li256 1.0 0.95833 0.00000 0.64414 1.0000 + Sn Sn1 1.0 0.00000 0.00000 0.35586 1.0000 + Sn Sn2 1.0 0.03125 0.03125 0.35586 1.0000 + Sn Sn3 1.0 0.06250 0.06250 0.35586 1.0000 + Sn Sn4 1.0 0.09375 0.09375 0.35586 1.0000 + Sn Sn5 1.0 0.12500 0.12500 0.35586 1.0000 + Sn Sn6 1.0 0.15625 0.15625 0.35586 1.0000 + Sn Sn7 1.0 0.18750 0.18750 0.35586 1.0000 + Sn Sn8 1.0 0.21875 0.21875 0.35586 1.0000 + Sn Sn9 1.0 0.25000 0.25000 0.35586 1.0000 + Sn Sn10 1.0 0.28125 0.28125 0.35586 1.0000 + Sn Sn11 1.0 0.31250 0.31250 0.35586 1.0000 + Sn Sn12 1.0 0.34375 0.34375 0.35586 1.0000 + Sn Sn13 1.0 0.37500 0.37500 0.35586 1.0000 + Sn Sn14 1.0 0.40625 0.40625 0.35586 1.0000 + Sn Sn15 1.0 0.93750 0.93750 0.35586 1.0000 + Sn Sn16 1.0 0.46875 0.46875 0.35586 1.0000 + Sn Sn17 1.0 0.03125 0.96875 0.35586 1.0000 + Sn Sn18 1.0 0.06250 0.00000 0.35586 1.0000 + Sn Sn19 1.0 0.09375 0.03125 0.35586 1.0000 + Sn Sn20 1.0 0.12500 0.06250 0.35586 1.0000 + Sn Sn21 1.0 0.15625 0.09375 0.35586 1.0000 + Sn Sn22 1.0 0.18750 0.12500 0.35586 1.0000 + Sn Sn23 1.0 0.21875 0.15625 0.35586 1.0000 + Sn Sn24 1.0 0.25000 0.18750 0.35586 1.0000 + Sn Sn25 1.0 0.28125 0.21875 0.35586 1.0000 + Sn Sn26 1.0 0.31250 0.25000 0.35586 1.0000 + Sn Sn27 1.0 0.34375 0.28125 0.35586 1.0000 + Sn Sn28 1.0 0.37500 0.31250 0.35586 1.0000 + Sn Sn29 1.0 0.40625 0.34375 0.35586 1.0000 + Sn Sn30 1.0 0.43750 0.37500 0.35586 1.0000 + Sn Sn31 1.0 0.46875 0.40625 0.35586 1.0000 + Sn Sn32 1.0 0.50000 0.43750 0.35586 1.0000 + Sn Sn33 1.0 0.06250 0.93750 0.35586 1.0000 + Sn Sn34 1.0 0.09375 0.96875 0.35586 1.0000 + Sn Sn35 1.0 0.12500 0.00000 0.35586 1.0000 + Sn Sn36 1.0 0.15625 0.03125 0.35586 1.0000 + Sn Sn37 1.0 0.18750 0.06250 0.35586 1.0000 + Sn Sn38 1.0 0.21875 0.09375 0.35586 1.0000 + Sn Sn39 1.0 0.25000 0.12500 0.35586 1.0000 + Sn Sn40 1.0 0.28125 0.15625 0.35586 1.0000 + Sn Sn41 1.0 0.31250 0.18750 0.35586 1.0000 + Sn Sn42 1.0 0.34375 0.21875 0.35586 1.0000 + Sn Sn43 1.0 0.37500 0.25000 0.35586 1.0000 + Sn Sn44 1.0 0.40625 0.28125 0.35586 1.0000 + Sn Sn45 1.0 0.43750 0.31250 0.35586 1.0000 + Sn Sn46 1.0 0.46875 0.34375 0.35586 1.0000 + Sn Sn47 1.0 0.50000 0.37500 0.35586 1.0000 + Sn Sn48 1.0 0.53125 0.40625 0.35586 1.0000 + Sn Sn49 1.0 0.09375 0.90625 0.35586 1.0000 + Sn Sn50 1.0 0.12500 0.93750 0.35586 1.0000 + Sn Sn51 1.0 0.15625 0.96875 0.35586 1.0000 + Sn Sn52 1.0 0.18750 0.00000 0.35586 1.0000 + Sn Sn53 1.0 0.21875 0.03125 0.35586 1.0000 + Sn Sn54 1.0 0.25000 0.06250 0.35586 1.0000 + Sn Sn55 1.0 0.28125 0.09375 0.35586 1.0000 + Sn Sn56 1.0 0.31250 0.12500 0.35586 1.0000 + Sn Sn57 1.0 0.34375 0.15625 0.35586 1.0000 + Sn Sn58 1.0 0.37500 0.18750 0.35586 1.0000 + Sn Sn59 1.0 0.40625 0.21875 0.35586 1.0000 + Sn Sn60 1.0 0.43750 0.25000 0.35586 1.0000 + Sn Sn61 1.0 0.46875 0.28125 0.35586 1.0000 + Sn Sn62 1.0 0.50000 0.31250 0.35586 1.0000 + Sn Sn63 1.0 0.53125 0.34375 0.35586 1.0000 + Sn Sn64 1.0 0.56250 0.37500 0.35586 1.0000 + Sn Sn65 1.0 0.12500 0.87500 0.35586 1.0000 + Sn Sn66 1.0 0.15625 0.90625 0.35586 1.0000 + Sn Sn67 1.0 0.18750 0.93750 0.35586 1.0000 + Sn Sn68 1.0 0.21875 0.96875 0.35586 1.0000 + Sn Sn69 1.0 0.25000 0.00000 0.35586 1.0000 + Sn Sn70 1.0 0.28125 0.03125 0.35586 1.0000 + Sn Sn71 1.0 0.31250 0.06250 0.35586 1.0000 + Sn Sn72 1.0 0.34375 0.09375 0.35586 1.0000 + Sn Sn73 1.0 0.37500 0.12500 0.35586 1.0000 + Sn Sn74 1.0 0.40625 0.15625 0.35586 1.0000 + Sn Sn75 1.0 0.43750 0.18750 0.35586 1.0000 + Sn Sn76 1.0 0.46875 0.21875 0.35586 1.0000 + Sn Sn77 1.0 0.50000 0.25000 0.35586 1.0000 + Sn Sn78 1.0 0.53125 0.28125 0.35586 1.0000 + Sn Sn79 1.0 0.56250 0.31250 0.35586 1.0000 + Sn Sn80 1.0 0.59375 0.34375 0.35586 1.0000 + Sn Sn81 1.0 0.15625 0.84375 0.35586 1.0000 + Sn Sn82 1.0 0.18750 0.87500 0.35586 1.0000 + Sn Sn83 1.0 0.21875 0.90625 0.35586 1.0000 + Sn Sn84 1.0 0.25000 0.93750 0.35586 1.0000 + Sn Sn85 1.0 0.28125 0.96875 0.35586 1.0000 + Sn Sn86 1.0 0.31250 0.00000 0.35586 1.0000 + Sn Sn87 1.0 0.34375 0.03125 0.35586 1.0000 + Sn Sn88 1.0 0.37500 0.06250 0.35586 1.0000 + Sn Sn89 1.0 0.40625 0.09375 0.35586 1.0000 + Sn Sn90 1.0 0.43750 0.12500 0.35586 1.0000 + Sn Sn91 1.0 0.46875 0.15625 0.35586 1.0000 + Sn Sn92 1.0 0.50000 0.18750 0.35586 1.0000 + Sn Sn93 1.0 0.53125 0.21875 0.35586 1.0000 + Sn Sn94 1.0 0.56250 0.25000 0.35586 1.0000 + Sn Sn95 1.0 0.59375 0.28125 0.35586 1.0000 + Sn Sn96 1.0 0.62500 0.31250 0.35586 1.0000 + Sn Sn97 1.0 0.18750 0.81250 0.35586 1.0000 + Sn Sn98 1.0 0.21875 0.84375 0.35586 1.0000 + Sn Sn99 1.0 0.25000 0.87500 0.35586 1.0000 + Sn Sn100 1.0 0.28125 0.90625 0.35586 1.0000 + Sn Sn101 1.0 0.31250 0.93750 0.35586 1.0000 + Sn Sn102 1.0 0.34375 0.96875 0.35586 1.0000 + Sn Sn103 1.0 0.37500 0.00000 0.35586 1.0000 + Sn Sn104 1.0 0.40625 0.03125 0.35586 1.0000 + Sn Sn105 1.0 0.43750 0.06250 0.35586 1.0000 + Sn Sn106 1.0 0.46875 0.09375 0.35586 1.0000 + Sn Sn107 1.0 0.50000 0.12500 0.35586 1.0000 + Sn Sn108 1.0 0.53125 0.15625 0.35586 1.0000 + Sn Sn109 1.0 0.56250 0.18750 0.35586 1.0000 + Sn Sn110 1.0 0.59375 0.21875 0.35586 1.0000 + Sn Sn111 1.0 0.62500 0.25000 0.35586 1.0000 + Sn Sn112 1.0 0.65625 0.28125 0.35586 1.0000 + Sn Sn113 1.0 0.21875 0.78125 0.35586 1.0000 + Sn Sn114 1.0 0.25000 0.81250 0.35586 1.0000 + Sn Sn115 1.0 0.28125 0.84375 0.35586 1.0000 + Sn Sn116 1.0 0.31250 0.87500 0.35586 1.0000 + Sn Sn117 1.0 0.34375 0.90625 0.35586 1.0000 + Sn Sn118 1.0 0.37500 0.93750 0.35586 1.0000 + Sn Sn119 1.0 0.40625 0.96875 0.35586 1.0000 + Sn Sn120 1.0 0.43750 0.00000 0.35586 1.0000 + Sn Sn121 1.0 0.46875 0.03125 0.35586 1.0000 + Sn Sn122 1.0 0.50000 0.06250 0.35586 1.0000 + Sn Sn123 1.0 0.53125 0.09375 0.35586 1.0000 + Sn Sn124 1.0 0.56250 0.12500 0.35586 1.0000 + Sn Sn125 1.0 0.59375 0.15625 0.35586 1.0000 + Sn Sn126 1.0 0.62500 0.18750 0.35586 1.0000 + Sn Sn127 1.0 0.65625 0.21875 0.35586 1.0000 + Sn Sn128 1.0 0.68750 0.25000 0.35586 1.0000 + Sn Sn129 1.0 0.25000 0.75000 0.35586 1.0000 + Sn Sn130 1.0 0.28125 0.78125 0.35586 1.0000 + Sn Sn131 1.0 0.31250 0.81250 0.35586 1.0000 + Sn Sn132 1.0 0.34375 0.84375 0.35586 1.0000 + Sn Sn133 1.0 0.37500 0.87500 0.35586 1.0000 + Sn Sn134 1.0 0.40625 0.90625 0.35586 1.0000 + Sn Sn135 1.0 0.43750 0.93750 0.35586 1.0000 + Sn Sn136 1.0 0.46875 0.96875 0.35586 1.0000 + Sn Sn137 1.0 0.50000 0.00000 0.35586 1.0000 + Sn Sn138 1.0 0.53125 0.03125 0.35586 1.0000 + Sn Sn139 1.0 0.56250 0.06250 0.35586 1.0000 + Sn Sn140 1.0 0.59375 0.09375 0.35586 1.0000 + Sn Sn141 1.0 0.62500 0.12500 0.35586 1.0000 + Sn Sn142 1.0 0.65625 0.15625 0.35586 1.0000 + Sn Sn143 1.0 0.68750 0.18750 0.35586 1.0000 + Sn Sn144 1.0 0.71875 0.21875 0.35586 1.0000 + Sn Sn145 1.0 0.28125 0.71875 0.35586 1.0000 + Sn Sn146 1.0 0.31250 0.75000 0.35586 1.0000 + Sn Sn147 1.0 0.34375 0.78125 0.35586 1.0000 + Sn Sn148 1.0 0.37500 0.81250 0.35586 1.0000 + Sn Sn149 1.0 0.40625 0.84375 0.35586 1.0000 + Sn Sn150 1.0 0.43750 0.87500 0.35586 1.0000 + Sn Sn151 1.0 0.46875 0.90625 0.35586 1.0000 + Sn Sn152 1.0 0.50000 0.93750 0.35586 1.0000 + Sn Sn153 1.0 0.53125 0.96875 0.35586 1.0000 + Sn Sn154 1.0 0.56250 1.00000 0.35586 1.0000 + Sn Sn155 1.0 0.59375 0.03125 0.35586 1.0000 + Sn Sn156 1.0 0.62500 0.06250 0.35586 1.0000 + Sn Sn157 1.0 0.65625 0.09375 0.35586 1.0000 + Sn Sn158 1.0 0.68750 0.12500 0.35586 1.0000 + Sn Sn159 1.0 0.71875 0.15625 0.35586 1.0000 + Sn Sn160 1.0 0.75000 0.18750 0.35586 1.0000 + Sn Sn161 1.0 0.31250 0.68750 0.35586 1.0000 + Sn Sn162 1.0 0.34375 0.71875 0.35586 1.0000 + Sn Sn163 1.0 0.37500 0.75000 0.35586 1.0000 + Sn Sn164 1.0 0.40625 0.78125 0.35586 1.0000 + Sn Sn165 1.0 0.43750 0.81250 0.35586 1.0000 + Sn Sn166 1.0 0.46875 0.84375 0.35586 1.0000 + Sn Sn167 1.0 0.50000 0.87500 0.35586 1.0000 + Sn Sn168 1.0 0.53125 0.90625 0.35586 1.0000 + Sn Sn169 1.0 0.56250 0.93750 0.35586 1.0000 + Sn Sn170 1.0 0.59375 0.96875 0.35586 1.0000 + Sn Sn171 1.0 0.62500 1.00000 0.35586 1.0000 + Sn Sn172 1.0 0.65625 0.03125 0.35586 1.0000 + Sn Sn173 1.0 0.68750 0.06250 0.35586 1.0000 + Sn Sn174 1.0 0.71875 0.09375 0.35586 1.0000 + Sn Sn175 1.0 0.75000 0.12500 0.35586 1.0000 + Sn Sn176 1.0 0.78125 0.15625 0.35586 1.0000 + Sn Sn177 1.0 0.34375 0.65625 0.35586 1.0000 + Sn Sn178 1.0 0.37500 0.68750 0.35586 1.0000 + Sn Sn179 1.0 0.40625 0.71875 0.35586 1.0000 + Sn Sn180 1.0 0.43750 0.75000 0.35586 1.0000 + Sn Sn181 1.0 0.46875 0.78125 0.35586 1.0000 + Sn Sn182 1.0 0.50000 0.81250 0.35586 1.0000 + Sn Sn183 1.0 0.53125 0.84375 0.35586 1.0000 + Sn Sn184 1.0 0.56250 0.87500 0.35586 1.0000 + Sn Sn185 1.0 0.59375 0.90625 0.35586 1.0000 + Sn Sn186 1.0 0.62500 0.93750 0.35586 1.0000 + Sn Sn187 1.0 0.65625 0.96875 0.35586 1.0000 + Sn Sn188 1.0 0.68750 0.00000 0.35586 1.0000 + Sn Sn189 1.0 0.71875 0.03125 0.35586 1.0000 + Sn Sn190 1.0 0.75000 0.06250 0.35586 1.0000 + Sn Sn191 1.0 0.78125 0.09375 0.35586 1.0000 + Sn Sn192 1.0 0.81250 0.12500 0.35586 1.0000 + Sn Sn193 1.0 0.37500 0.62500 0.35586 1.0000 + Sn Sn194 1.0 0.40625 0.65625 0.35586 1.0000 + Sn Sn195 1.0 0.43750 0.68750 0.35586 1.0000 + Sn Sn196 1.0 0.46875 0.71875 0.35586 1.0000 + Sn Sn197 1.0 0.50000 0.75000 0.35586 1.0000 + Sn Sn198 1.0 0.53125 0.78125 0.35586 1.0000 + Sn Sn199 1.0 0.56250 0.81250 0.35586 1.0000 + Sn Sn200 1.0 0.59375 0.84375 0.35586 1.0000 + Sn Sn201 1.0 0.62500 0.87500 0.35586 1.0000 + Sn Sn202 1.0 0.65625 0.90625 0.35586 1.0000 + Sn Sn203 1.0 0.68750 0.93750 0.35586 1.0000 + Sn Sn204 1.0 0.71875 0.96875 0.35586 1.0000 + Sn Sn205 1.0 0.75000 0.00000 0.35586 1.0000 + Sn Sn206 1.0 0.78125 0.03125 0.35586 1.0000 + Sn Sn207 1.0 0.81250 0.06250 0.35586 1.0000 + Sn Sn208 1.0 0.84375 0.09375 0.35586 1.0000 + Sn Sn209 1.0 0.40625 0.59375 0.35586 1.0000 + Sn Sn210 1.0 0.43750 0.62500 0.35586 1.0000 + Sn Sn211 1.0 0.46875 0.65625 0.35586 1.0000 + Sn Sn212 1.0 0.50000 0.68750 0.35586 1.0000 + Sn Sn213 1.0 0.53125 0.71875 0.35586 1.0000 + Sn Sn214 1.0 0.56250 0.75000 0.35586 1.0000 + Sn Sn215 1.0 0.59375 0.78125 0.35586 1.0000 + Sn Sn216 1.0 0.62500 0.81250 0.35586 1.0000 + Sn Sn217 1.0 0.65625 0.84375 0.35586 1.0000 + Sn Sn218 1.0 0.68750 0.87500 0.35586 1.0000 + Sn Sn219 1.0 0.71875 0.90625 0.35586 1.0000 + Sn Sn220 1.0 0.75000 0.93750 0.35586 1.0000 + Sn Sn221 1.0 0.78125 0.96875 0.35586 1.0000 + Sn Sn222 1.0 0.81250 0.00000 0.35586 1.0000 + Sn Sn223 1.0 0.84375 0.03125 0.35586 1.0000 + Sn Sn224 1.0 0.87500 0.06250 0.35586 1.0000 + Sn Sn225 1.0 0.43750 0.56250 0.35586 1.0000 + Sn Sn226 1.0 0.46875 0.59375 0.35586 1.0000 + Sn Sn227 1.0 0.50000 0.62500 0.35586 1.0000 + Sn Sn228 1.0 0.53125 0.65625 0.35586 1.0000 + Sn Sn229 1.0 0.56250 0.68750 0.35586 1.0000 + Sn Sn230 1.0 0.59375 0.71875 0.35586 1.0000 + Sn Sn231 1.0 0.62500 0.75000 0.35586 1.0000 + Sn Sn232 1.0 0.65625 0.78125 0.35586 1.0000 + Sn Sn233 1.0 0.68750 0.81250 0.35586 1.0000 + Sn Sn234 1.0 0.71875 0.84375 0.35586 1.0000 + Sn Sn235 1.0 0.75000 0.87500 0.35586 1.0000 + Sn Sn236 1.0 0.78125 0.90625 0.35586 1.0000 + Sn Sn237 1.0 0.81250 0.93750 0.35586 1.0000 + Sn Sn238 1.0 0.84375 0.96875 0.35586 1.0000 + Sn Sn239 1.0 0.87500 0.00000 0.35586 1.0000 + Sn Sn240 1.0 0.90625 0.03125 0.35586 1.0000 + Sn Sn241 1.0 0.46875 0.53125 0.35586 1.0000 + Sn Sn242 1.0 0.50000 0.56250 0.35586 1.0000 + Sn Sn243 1.0 0.53125 0.59375 0.35586 1.0000 + Sn Sn244 1.0 0.56250 0.62500 0.35586 1.0000 + Sn Sn245 1.0 0.59375 0.65625 0.35586 1.0000 + Sn Sn246 1.0 0.62500 0.68750 0.35586 1.0000 + Sn Sn247 1.0 0.65625 0.71875 0.35586 1.0000 + Sn Sn248 1.0 0.68750 0.75000 0.35586 1.0000 + Sn Sn249 1.0 0.71875 0.78125 0.35586 1.0000 + Sn Sn250 1.0 0.75000 0.81250 0.35586 1.0000 + Sn Sn251 1.0 0.78125 0.84375 0.35586 1.0000 + Sn Sn252 1.0 0.81250 0.87500 0.35586 1.0000 + Sn Sn253 1.0 0.84375 0.90625 0.35586 1.0000 + Sn Sn254 1.0 0.87500 0.93750 0.35586 1.0000 + Sn Sn255 1.0 0.90625 0.96875 0.35586 1.0000 + Sn Sn256 1.0 0.93750 0.00000 0.35586 1.0000 + Cl Cl1 1.0 0.04114 0.97951 0.59797 1.0000 + Cl Cl2 1.0 0.07239 0.01076 0.59797 1.0000 + Cl Cl3 1.0 0.10364 0.04201 0.59797 1.0000 + Cl Cl4 1.0 0.13489 0.07326 0.59797 1.0000 + Cl Cl5 1.0 0.16614 0.10451 0.59797 1.0000 + Cl Cl6 1.0 0.19739 0.13576 0.59797 1.0000 + Cl Cl7 1.0 0.22864 0.16701 0.59797 1.0000 + Cl Cl8 1.0 0.25989 0.19826 0.59797 1.0000 + Cl Cl9 1.0 0.29114 0.22951 0.59797 1.0000 + Cl Cl10 1.0 0.32239 0.26076 0.59797 1.0000 + Cl Cl11 1.0 0.35364 0.29201 0.59797 1.0000 + Cl Cl12 1.0 0.38489 0.32326 0.59797 1.0000 + Cl Cl13 1.0 0.41614 0.35451 0.59797 1.0000 + Cl Cl14 1.0 0.44739 0.38576 0.59797 1.0000 + Cl Cl15 1.0 0.47864 0.41701 0.59797 1.0000 + Cl Cl16 1.0 0.50989 0.44826 0.59797 1.0000 + Cl Cl17 1.0 0.07239 0.94826 0.59797 1.0000 + Cl Cl18 1.0 0.10364 0.97951 0.59797 1.0000 + Cl Cl19 1.0 0.13489 0.01076 0.59797 1.0000 + Cl Cl20 1.0 0.16614 0.04201 0.59797 1.0000 + Cl Cl21 1.0 0.19739 0.07326 0.59797 1.0000 + Cl Cl22 1.0 0.22864 0.10451 0.59797 1.0000 + Cl Cl23 1.0 0.25989 0.13576 0.59797 1.0000 + Cl Cl24 1.0 0.29114 0.16701 0.59797 1.0000 + Cl Cl25 1.0 0.32239 0.19826 0.59797 1.0000 + Cl Cl26 1.0 0.35364 0.22951 0.59797 1.0000 + Cl Cl27 1.0 0.38489 0.26076 0.59797 1.0000 + Cl Cl28 1.0 0.41614 0.29201 0.59797 1.0000 + Cl Cl29 1.0 0.44739 0.32326 0.59797 1.0000 + Cl Cl30 1.0 0.47864 0.35451 0.59797 1.0000 + Cl Cl31 1.0 0.50989 0.38576 0.59797 1.0000 + Cl Cl32 1.0 0.54114 0.41701 0.59797 1.0000 + Cl Cl33 1.0 0.10364 0.91701 0.59797 1.0000 + Cl Cl34 1.0 0.13489 0.94826 0.59797 1.0000 + Cl Cl35 1.0 0.16614 0.97951 0.59797 1.0000 + Cl Cl36 1.0 0.19739 0.01076 0.59797 1.0000 + Cl Cl37 1.0 0.22864 0.04201 0.59797 1.0000 + Cl Cl38 1.0 0.25989 0.07326 0.59797 1.0000 + Cl Cl39 1.0 0.29114 0.10451 0.59797 1.0000 + Cl Cl40 1.0 0.32239 0.13576 0.59797 1.0000 + Cl Cl41 1.0 0.35364 0.16701 0.59797 1.0000 + Cl Cl42 1.0 0.38489 0.19826 0.59797 1.0000 + Cl Cl43 1.0 0.41614 0.22951 0.59797 1.0000 + Cl Cl44 1.0 0.44739 0.26076 0.59797 1.0000 + Cl Cl45 1.0 0.47864 0.29201 0.59797 1.0000 + Cl Cl46 1.0 0.50989 0.32326 0.59797 1.0000 + Cl Cl47 1.0 0.54114 0.35451 0.59797 1.0000 + Cl Cl48 1.0 0.57239 0.38576 0.59797 1.0000 + Cl Cl49 1.0 0.13489 0.88576 0.59797 1.0000 + Cl Cl50 1.0 0.16614 0.91701 0.59797 1.0000 + Cl Cl51 1.0 0.19739 0.94826 0.59797 1.0000 + Cl Cl52 1.0 0.22864 0.97951 0.59797 1.0000 + Cl Cl53 1.0 0.25989 0.01076 0.59797 1.0000 + Cl Cl54 1.0 0.29114 0.04201 0.59797 1.0000 + Cl Cl55 1.0 0.32239 0.07326 0.59797 1.0000 + Cl Cl56 1.0 0.35364 0.10451 0.59797 1.0000 + Cl Cl57 1.0 0.38489 0.13576 0.59797 1.0000 + Cl Cl58 1.0 0.41614 0.16701 0.59797 1.0000 + Cl Cl59 1.0 0.44739 0.19826 0.59797 1.0000 + Cl Cl60 1.0 0.47864 0.22951 0.59797 1.0000 + Cl Cl61 1.0 0.50989 0.26076 0.59797 1.0000 + Cl Cl62 1.0 0.54114 0.29201 0.59797 1.0000 + Cl Cl63 1.0 0.57239 0.32326 0.59797 1.0000 + Cl Cl64 1.0 0.60364 0.35451 0.59797 1.0000 + Cl Cl65 1.0 0.16614 0.85451 0.59797 1.0000 + Cl Cl66 1.0 0.19739 0.88576 0.59797 1.0000 + Cl Cl67 1.0 0.22864 0.91701 0.59797 1.0000 + Cl Cl68 1.0 0.25989 0.94826 0.59797 1.0000 + Cl Cl69 1.0 0.29114 0.97951 0.59797 1.0000 + Cl Cl70 1.0 0.32239 0.01076 0.59797 1.0000 + Cl Cl71 1.0 0.35364 0.04201 0.59797 1.0000 + Cl Cl72 1.0 0.38489 0.07326 0.59797 1.0000 + Cl Cl73 1.0 0.41614 0.10451 0.59797 1.0000 + Cl Cl74 1.0 0.44739 0.13576 0.59797 1.0000 + Cl Cl75 1.0 0.47864 0.16701 0.59797 1.0000 + Cl Cl76 1.0 0.50989 0.19826 0.59797 1.0000 + Cl Cl77 1.0 0.54114 0.22951 0.59797 1.0000 + Cl Cl78 1.0 0.57239 0.26076 0.59797 1.0000 + Cl Cl79 1.0 0.60364 0.29201 0.59797 1.0000 + Cl Cl80 1.0 0.63489 0.32326 0.59797 1.0000 + Cl Cl81 1.0 0.19739 0.82326 0.59797 1.0000 + Cl Cl82 1.0 0.22864 0.85451 0.59797 1.0000 + Cl Cl83 1.0 0.25989 0.88576 0.59797 1.0000 + Cl Cl84 1.0 0.29114 0.91701 0.59797 1.0000 + Cl Cl85 1.0 0.32239 0.94826 0.59797 1.0000 + Cl Cl86 1.0 0.35364 0.97951 0.59797 1.0000 + Cl Cl87 1.0 0.38489 0.01076 0.59797 1.0000 + Cl Cl88 1.0 0.41614 0.04201 0.59797 1.0000 + Cl Cl89 1.0 0.44739 0.07326 0.59797 1.0000 + Cl Cl90 1.0 0.47864 0.10451 0.59797 1.0000 + Cl Cl91 1.0 0.50989 0.13576 0.59797 1.0000 + Cl Cl92 1.0 0.54114 0.16701 0.59797 1.0000 + Cl Cl93 1.0 0.57239 0.19826 0.59797 1.0000 + Cl Cl94 1.0 0.60364 0.22951 0.59797 1.0000 + Cl Cl95 1.0 0.63489 0.26076 0.59797 1.0000 + Cl Cl96 1.0 0.66614 0.29201 0.59797 1.0000 + Cl Cl97 1.0 0.22864 0.79201 0.59797 1.0000 + Cl Cl98 1.0 0.25989 0.82326 0.59797 1.0000 + Cl Cl99 1.0 0.29114 0.85451 0.59797 1.0000 + Cl Cl100 1.0 0.32239 0.88576 0.59797 1.0000 + Cl Cl101 1.0 0.35364 0.91701 0.59797 1.0000 + Cl Cl102 1.0 0.38489 0.94826 0.59797 1.0000 + Cl Cl103 1.0 0.41614 0.97951 0.59797 1.0000 + Cl Cl104 1.0 0.44739 0.01076 0.59797 1.0000 + Cl Cl105 1.0 0.47864 0.04201 0.59797 1.0000 + Cl Cl106 1.0 0.50989 0.07326 0.59797 1.0000 + Cl Cl107 1.0 0.54114 0.10451 0.59797 1.0000 + Cl Cl108 1.0 0.57239 0.13576 0.59797 1.0000 + Cl Cl109 1.0 0.60364 0.16701 0.59797 1.0000 + Cl Cl110 1.0 0.63489 0.19826 0.59797 1.0000 + Cl Cl111 1.0 0.66614 0.22951 0.59797 1.0000 + Cl Cl112 1.0 0.69739 0.26076 0.59797 1.0000 + Cl Cl113 1.0 0.25989 0.76076 0.59797 1.0000 + Cl Cl114 1.0 0.29114 0.79201 0.59797 1.0000 + Cl Cl115 1.0 0.32239 0.82326 0.59797 1.0000 + Cl Cl116 1.0 0.35364 0.85451 0.59797 1.0000 + Cl Cl117 1.0 0.38489 0.88576 0.59797 1.0000 + Cl Cl118 1.0 0.41614 0.91701 0.59797 1.0000 + Cl Cl119 1.0 0.44739 0.94826 0.59797 1.0000 + Cl Cl120 1.0 0.47864 0.97951 0.59797 1.0000 + Cl Cl121 1.0 0.50989 0.01076 0.59797 1.0000 + Cl Cl122 1.0 0.54114 0.04201 0.59797 1.0000 + Cl Cl123 1.0 0.57239 0.07326 0.59797 1.0000 + Cl Cl124 1.0 0.60364 0.10451 0.59797 1.0000 + Cl Cl125 1.0 0.63489 0.13576 0.59797 1.0000 + Cl Cl126 1.0 0.66614 0.16701 0.59797 1.0000 + Cl Cl127 1.0 0.69739 0.19826 0.59797 1.0000 + Cl Cl128 1.0 0.72864 0.22951 0.59797 1.0000 + Cl Cl129 1.0 0.29114 0.72951 0.59797 1.0000 + Cl Cl130 1.0 0.32239 0.76076 0.59797 1.0000 + Cl Cl131 1.0 0.35364 0.79201 0.59797 1.0000 + Cl Cl132 1.0 0.38489 0.82326 0.59797 1.0000 + Cl Cl133 1.0 0.41614 0.85451 0.59797 1.0000 + Cl Cl134 1.0 0.44739 0.88576 0.59797 1.0000 + Cl Cl135 1.0 0.47864 0.91701 0.59797 1.0000 + Cl Cl136 1.0 0.50989 0.94826 0.59797 1.0000 + Cl Cl137 1.0 0.54114 0.97951 0.59797 1.0000 + Cl Cl138 1.0 0.57239 0.01076 0.59797 1.0000 + Cl Cl139 1.0 0.60364 0.04201 0.59797 1.0000 + Cl Cl140 1.0 0.63489 0.07326 0.59797 1.0000 + Cl Cl141 1.0 0.66614 0.10451 0.59797 1.0000 + Cl Cl142 1.0 0.69739 0.13576 0.59797 1.0000 + Cl Cl143 1.0 0.72864 0.16701 0.59797 1.0000 + Cl Cl144 1.0 0.75989 0.19826 0.59797 1.0000 + Cl Cl145 1.0 0.32239 0.69826 0.59797 1.0000 + Cl Cl146 1.0 0.35364 0.72951 0.59797 1.0000 + Cl Cl147 1.0 0.38489 0.76076 0.59797 1.0000 + Cl Cl148 1.0 0.41614 0.79201 0.59797 1.0000 + Cl Cl149 1.0 0.44739 0.82326 0.59797 1.0000 + Cl Cl150 1.0 0.47864 0.85451 0.59797 1.0000 + Cl Cl151 1.0 0.50989 0.88576 0.59797 1.0000 + Cl Cl152 1.0 0.54114 0.91701 0.59797 1.0000 + Cl Cl153 1.0 0.57239 0.94826 0.59797 1.0000 + Cl Cl154 1.0 0.60364 0.97951 0.59797 1.0000 + Cl Cl155 1.0 0.63489 0.01076 0.59797 1.0000 + Cl Cl156 1.0 0.66614 0.04201 0.59797 1.0000 + Cl Cl157 1.0 0.69739 0.07326 0.59797 1.0000 + Cl Cl158 1.0 0.72864 0.10451 0.59797 1.0000 + Cl Cl159 1.0 0.75989 0.13576 0.59797 1.0000 + Cl Cl160 1.0 0.79114 0.16701 0.59797 1.0000 + Cl Cl161 1.0 0.35364 0.66701 0.59797 1.0000 + Cl Cl162 1.0 0.38489 0.69826 0.59797 1.0000 + Cl Cl163 1.0 0.41614 0.72951 0.59797 1.0000 + Cl Cl164 1.0 0.44739 0.76076 0.59797 1.0000 + Cl Cl165 1.0 0.47864 0.79201 0.59797 1.0000 + Cl Cl166 1.0 0.50989 0.82326 0.59797 1.0000 + Cl Cl167 1.0 0.54114 0.85451 0.59797 1.0000 + Cl Cl168 1.0 0.57239 0.88576 0.59797 1.0000 + Cl Cl169 1.0 0.60364 0.91701 0.59797 1.0000 + Cl Cl170 1.0 0.63489 0.94826 0.59797 1.0000 + Cl Cl171 1.0 0.66614 0.97951 0.59797 1.0000 + Cl Cl172 1.0 0.69739 0.01076 0.59797 1.0000 + Cl Cl173 1.0 0.72864 0.04201 0.59797 1.0000 + Cl Cl174 1.0 0.75989 0.07326 0.59797 1.0000 + Cl Cl175 1.0 0.79114 0.10451 0.59797 1.0000 + Cl Cl176 1.0 0.82239 0.13576 0.59797 1.0000 + Cl Cl177 1.0 0.38489 0.63576 0.59797 1.0000 + Cl Cl178 1.0 0.41614 0.66701 0.59797 1.0000 + Cl Cl179 1.0 0.44739 0.69826 0.59797 1.0000 + Cl Cl180 1.0 0.47864 0.72951 0.59797 1.0000 + Cl Cl181 1.0 0.50989 0.76076 0.59797 1.0000 + Cl Cl182 1.0 0.54114 0.79201 0.59797 1.0000 + Cl Cl183 1.0 0.57239 0.82326 0.59797 1.0000 + Cl Cl184 1.0 0.60364 0.85451 0.59797 1.0000 + Cl Cl185 1.0 0.63489 0.88576 0.59797 1.0000 + Cl Cl186 1.0 0.66614 0.91701 0.59797 1.0000 + Cl Cl187 1.0 0.69739 0.94826 0.59797 1.0000 + Cl Cl188 1.0 0.72864 0.97951 0.59797 1.0000 + Cl Cl189 1.0 0.75989 0.01076 0.59797 1.0000 + Cl Cl190 1.0 0.79114 0.04201 0.59797 1.0000 + Cl Cl191 1.0 0.82239 0.07326 0.59797 1.0000 + Cl Cl192 1.0 0.85364 0.10451 0.59797 1.0000 + Cl Cl193 1.0 0.41614 0.60451 0.59797 1.0000 + Cl Cl194 1.0 0.44739 0.63576 0.59797 1.0000 + Cl Cl195 1.0 0.47864 0.66701 0.59797 1.0000 + Cl Cl196 1.0 0.50989 0.69826 0.59797 1.0000 + Cl Cl197 1.0 0.54114 0.72951 0.59797 1.0000 + Cl Cl198 1.0 0.57239 0.76076 0.59797 1.0000 + Cl Cl199 1.0 0.60364 0.79201 0.59797 1.0000 + Cl Cl200 1.0 0.63489 0.82326 0.59797 1.0000 + Cl Cl201 1.0 0.66614 0.85451 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0.95833 0.56250 0.64414 1.0000 + Li Li362 1.0 0.98958 0.59375 0.64414 1.0000 + Li Li363 1.0 0.02083 0.62500 0.64414 1.0000 + Li Li364 1.0 0.05208 0.65625 0.64414 1.0000 + Li Li365 1.0 0.08333 0.68750 0.64414 1.0000 + Li Li366 1.0 0.11458 0.71875 0.64414 1.0000 + Li Li367 1.0 0.14583 0.75000 0.64414 1.0000 + Li Li368 1.0 0.17708 0.78125 0.64414 1.0000 + Li Li369 1.0 0.73958 0.28125 0.64414 1.0000 + Li Li370 1.0 0.77083 0.31250 0.64414 1.0000 + Li Li371 1.0 0.80208 0.34375 0.64414 1.0000 + Li Li372 1.0 0.83333 0.37500 0.64414 1.0000 + Li Li373 1.0 0.86458 0.40625 0.64414 1.0000 + Li Li374 1.0 0.89583 0.43750 0.64414 1.0000 + Li Li375 1.0 0.92708 0.46875 0.64414 1.0000 + Li Li376 1.0 0.95833 0.50000 0.64414 1.0000 + Li Li377 1.0 0.98958 0.53125 0.64414 1.0000 + Li Li378 1.0 0.02083 0.56250 0.64414 1.0000 + Li Li379 1.0 0.05208 0.59375 0.64414 1.0000 + Li Li380 1.0 0.08333 0.62500 0.64414 1.0000 + Li Li381 1.0 0.11458 0.65625 0.64414 1.0000 + Li Li382 1.0 0.14583 0.68750 0.64414 1.0000 + Li Li383 1.0 0.17708 0.71875 0.64414 1.0000 + Li Li384 1.0 0.20833 0.75000 0.64414 1.0000 + Li Li385 1.0 0.77083 0.25000 0.64414 1.0000 + Li Li386 1.0 0.80208 0.28125 0.64414 1.0000 + Li Li387 1.0 0.83333 0.31250 0.64414 1.0000 + Li Li388 1.0 0.86458 0.34375 0.64414 1.0000 + Li Li389 1.0 0.89583 0.37500 0.64414 1.0000 + Li Li390 1.0 0.92708 0.40625 0.64414 1.0000 + Li Li391 1.0 0.95833 0.43750 0.64414 1.0000 + Li Li392 1.0 0.98958 0.46875 0.64414 1.0000 + Li Li393 1.0 0.02083 0.50000 0.64414 1.0000 + Li Li394 1.0 0.05208 0.53125 0.64414 1.0000 + Li Li395 1.0 0.08333 0.56250 0.64414 1.0000 + Li Li396 1.0 0.11458 0.59375 0.64414 1.0000 + Li Li397 1.0 0.14583 0.62500 0.64414 1.0000 + Li Li398 1.0 0.17708 0.65625 0.64414 1.0000 + Li Li399 1.0 0.20833 0.68750 0.64414 1.0000 + Li Li400 1.0 0.23958 0.71875 0.64414 1.0000 + Li Li401 1.0 0.80208 0.21875 0.64414 1.0000 + Li Li402 1.0 0.83333 0.25000 0.64414 1.0000 + Li Li403 1.0 0.86458 0.28125 0.64414 1.0000 + Li Li404 1.0 0.89583 0.31250 0.64414 1.0000 + Li Li405 1.0 0.92708 0.34375 0.64414 1.0000 + Li Li406 1.0 0.95833 0.37500 0.64414 1.0000 + Li Li407 1.0 0.98958 0.40625 0.64414 1.0000 + Li Li408 1.0 0.02083 0.43750 0.64414 1.0000 + Li Li409 1.0 0.05208 0.46875 0.64414 1.0000 + Li Li410 1.0 0.08333 0.50000 0.64414 1.0000 + Li Li411 1.0 0.11458 0.53125 0.64414 1.0000 + Li Li412 1.0 0.14583 0.56250 0.64414 1.0000 + Li Li413 1.0 0.17708 0.59375 0.64414 1.0000 + Li Li414 1.0 0.20833 0.62500 0.64414 1.0000 + Li Li415 1.0 0.23958 0.65625 0.64414 1.0000 + Li Li416 1.0 0.27083 0.68750 0.64414 1.0000 + Li Li417 1.0 0.83333 0.18750 0.64414 1.0000 + Li Li418 1.0 0.86458 0.21875 0.64414 1.0000 + Li Li419 1.0 0.89583 0.25000 0.64414 1.0000 + Li Li420 1.0 0.92708 0.28125 0.64414 1.0000 + Li Li421 1.0 0.95833 0.31250 0.64414 1.0000 + Li Li422 1.0 0.98958 0.34375 0.64414 1.0000 + Li Li423 1.0 0.02083 0.37500 0.64414 1.0000 + Li Li424 1.0 0.05208 0.40625 0.64414 1.0000 + Li Li425 1.0 0.08333 0.43750 0.64414 1.0000 + Li Li426 1.0 0.11458 0.46875 0.64414 1.0000 + Li Li427 1.0 0.14583 0.50000 0.64414 1.0000 + Li Li428 1.0 0.17708 0.53125 0.64414 1.0000 + Li Li429 1.0 0.20833 0.56250 0.64414 1.0000 + Li Li430 1.0 0.23958 0.59375 0.64414 1.0000 + Li Li431 1.0 0.27083 0.62500 0.64414 1.0000 + Li Li432 1.0 0.30208 0.65625 0.64414 1.0000 + Li Li433 1.0 0.86458 0.15625 0.64414 1.0000 + Li Li434 1.0 0.89583 0.18750 0.64414 1.0000 + Li Li435 1.0 0.92708 0.21875 0.64414 1.0000 + Li Li436 1.0 0.95833 0.25000 0.64414 1.0000 + Li Li437 1.0 0.98958 0.28125 0.64414 1.0000 + Li Li438 1.0 0.02083 0.31250 0.64414 1.0000 + Li Li439 1.0 0.05208 0.34375 0.64414 1.0000 + Li Li440 1.0 0.08333 0.37500 0.64414 1.0000 + Li Li441 1.0 0.11458 0.40625 0.64414 1.0000 + Li Li442 1.0 0.14583 0.43750 0.64414 1.0000 + Li Li443 1.0 0.17708 0.46875 0.64414 1.0000 + Li Li444 1.0 0.20833 0.50000 0.64414 1.0000 + Li Li445 1.0 0.23958 0.53125 0.64414 1.0000 + Li Li446 1.0 0.27083 0.56250 0.64414 1.0000 + Li Li447 1.0 0.30208 0.59375 0.64414 1.0000 + Li Li448 1.0 0.33333 0.62500 0.64414 1.0000 + Li Li449 1.0 0.89583 0.12500 0.64414 1.0000 + Li Li450 1.0 0.92708 0.15625 0.64414 1.0000 + Li Li451 1.0 0.95833 0.18750 0.64414 1.0000 + Li Li452 1.0 0.98958 0.21875 0.64414 1.0000 + Li Li453 1.0 0.02083 0.25000 0.64414 1.0000 + Li Li454 1.0 0.05208 0.28125 0.64414 1.0000 + Li Li455 1.0 0.08333 0.31250 0.64414 1.0000 + Li Li456 1.0 0.11458 0.34375 0.64414 1.0000 + Li Li457 1.0 0.14583 0.37500 0.64414 1.0000 + Li Li458 1.0 0.17708 0.40625 0.64414 1.0000 + Li Li459 1.0 0.20833 0.43750 0.64414 1.0000 + Li Li460 1.0 0.23958 0.46875 0.64414 1.0000 + Li Li461 1.0 0.27083 0.50000 0.64414 1.0000 + Li Li462 1.0 0.30208 0.53125 0.64414 1.0000 + Li Li463 1.0 0.33333 0.56250 0.64414 1.0000 + Li Li464 1.0 0.36458 0.59375 0.64414 1.0000 + Li Li465 1.0 0.92708 0.09375 0.64414 1.0000 + Li Li466 1.0 0.95833 0.12500 0.64414 1.0000 + Li Li467 1.0 0.98958 0.15625 0.64414 1.0000 + Li Li468 1.0 0.02083 0.18750 0.64414 1.0000 + Li Li469 1.0 0.05208 0.21875 0.64414 1.0000 + Li Li470 1.0 0.08333 0.25000 0.64414 1.0000 + Li Li471 1.0 0.11458 0.28125 0.64414 1.0000 + Li Li472 1.0 0.14583 0.31250 0.64414 1.0000 + Li Li473 1.0 0.17708 0.34375 0.64414 1.0000 + Li Li474 1.0 0.20833 0.37500 0.64414 1.0000 + Li Li475 1.0 0.23958 0.40625 0.64414 1.0000 + Li Li476 1.0 0.27083 0.43750 0.64414 1.0000 + Li Li477 1.0 0.30208 0.46875 0.64414 1.0000 + Li Li478 1.0 0.33333 0.50000 0.64414 1.0000 + Li Li479 1.0 0.36458 0.53125 0.64414 1.0000 + Li Li480 1.0 0.39583 0.56250 0.64414 1.0000 + Li Li481 1.0 0.95833 0.06250 0.64414 1.0000 + Li Li482 1.0 0.98958 0.09375 0.64414 1.0000 + Li Li483 1.0 0.02083 0.12500 0.64414 1.0000 + Li Li484 1.0 0.05208 0.15625 0.64414 1.0000 + Li Li485 1.0 0.08333 0.18750 0.64414 1.0000 + Li Li486 1.0 0.11458 0.21875 0.64414 1.0000 + Li Li487 1.0 0.14583 0.25000 0.64414 1.0000 + Li Li488 1.0 0.17708 0.28125 0.64414 1.0000 + Li Li489 1.0 0.20833 0.31250 0.64414 1.0000 + Li Li490 1.0 0.23958 0.34375 0.64414 1.0000 + Li Li491 1.0 0.27083 0.37500 0.64414 1.0000 + Li Li492 1.0 0.30208 0.40625 0.64414 1.0000 + Li Li493 1.0 0.33333 0.43750 0.64414 1.0000 + Li Li494 1.0 0.36458 0.46875 0.64414 1.0000 + Li Li495 1.0 0.39583 0.50000 0.64414 1.0000 + Li Li496 1.0 0.42708 0.53125 0.64414 1.0000 + Li Li497 1.0 0.98958 0.03125 0.64414 1.0000 + Li Li498 1.0 0.02083 0.06250 0.64414 1.0000 + Li Li499 1.0 0.05208 0.09375 0.64414 1.0000 + Li Li500 1.0 0.08333 0.12500 0.64414 1.0000 + Li Li501 1.0 0.11458 0.15625 0.64414 1.0000 + Li Li502 1.0 0.14583 0.18750 0.64414 1.0000 + Li Li503 1.0 0.17708 0.21875 0.64414 1.0000 + Li Li504 1.0 0.20833 0.25000 0.64414 1.0000 + Li Li505 1.0 0.23958 0.28125 0.64414 1.0000 + Li Li506 1.0 0.27083 0.31250 0.64414 1.0000 + Li Li507 1.0 0.30208 0.34375 0.64414 1.0000 + Li Li508 1.0 0.33333 0.37500 0.64414 1.0000 + Li Li509 1.0 0.36458 0.40625 0.64414 1.0000 + Li Li510 1.0 0.39583 0.43750 0.64414 1.0000 + Li Li511 1.0 0.42708 0.46875 0.64414 1.0000 + Li Li512 1.0 0.45833 0.50000 0.64414 1.0000 + Sn Sn257 1.0 0.50000 0.50000 0.35586 1.0000 + Sn Sn258 1.0 0.53125 0.53125 0.35586 1.0000 + Sn Sn259 1.0 0.56250 0.56250 0.35586 1.0000 + Sn Sn260 1.0 0.59375 0.59375 0.35586 1.0000 + Sn Sn261 1.0 0.62500 0.62500 0.35586 1.0000 + Sn Sn262 1.0 0.65625 0.65625 0.35586 1.0000 + Sn Sn263 1.0 0.68750 0.68750 0.35586 1.0000 + Sn Sn264 1.0 0.71875 0.71875 0.35586 1.0000 + Sn Sn265 1.0 0.75000 0.75000 0.35586 1.0000 + Sn Sn266 1.0 0.78125 0.78125 0.35586 1.0000 + Sn Sn267 1.0 0.81250 0.81250 0.35586 1.0000 + Sn Sn268 1.0 0.84375 0.84375 0.35586 1.0000 + Sn Sn269 1.0 0.87500 0.87500 0.35586 1.0000 + Sn Sn270 1.0 0.90625 0.90625 0.35586 1.0000 + Sn Sn271 1.0 0.43750 0.43750 0.35586 1.0000 + Sn Sn272 1.0 0.96875 0.96875 0.35586 1.0000 + Sn Sn273 1.0 0.53125 0.46875 0.35586 1.0000 + Sn Sn274 1.0 0.56250 0.50000 0.35586 1.0000 + Sn Sn275 1.0 0.59375 0.53125 0.35586 1.0000 + Sn Sn276 1.0 0.62500 0.56250 0.35586 1.0000 + Sn Sn277 1.0 0.65625 0.59375 0.35586 1.0000 + Sn Sn278 1.0 0.68750 0.62500 0.35586 1.0000 + Sn Sn279 1.0 0.71875 0.65625 0.35586 1.0000 + Sn Sn280 1.0 0.75000 0.68750 0.35586 1.0000 + Sn Sn281 1.0 0.78125 0.71875 0.35586 1.0000 + Sn Sn282 1.0 0.81250 0.75000 0.35586 1.0000 + Sn Sn283 1.0 0.84375 0.78125 0.35586 1.0000 + Sn Sn284 1.0 0.87500 0.81250 0.35586 1.0000 + Sn Sn285 1.0 0.90625 0.84375 0.35586 1.0000 + Sn Sn286 1.0 0.93750 0.87500 0.35586 1.0000 + Sn Sn287 1.0 0.96875 0.90625 0.35586 1.0000 + Sn Sn288 1.0 0.00000 0.93750 0.35586 1.0000 + Sn Sn289 1.0 0.56250 0.43750 0.35586 1.0000 + Sn Sn290 1.0 0.59375 0.46875 0.35586 1.0000 + Sn Sn291 1.0 0.62500 0.50000 0.35586 1.0000 + Sn Sn292 1.0 0.65625 0.53125 0.35586 1.0000 + Sn Sn293 1.0 0.68750 0.56250 0.35586 1.0000 + Sn Sn294 1.0 0.71875 0.59375 0.35586 1.0000 + Sn Sn295 1.0 0.75000 0.62500 0.35586 1.0000 + Sn Sn296 1.0 0.78125 0.65625 0.35586 1.0000 + Sn Sn297 1.0 0.81250 0.68750 0.35586 1.0000 + Sn Sn298 1.0 0.84375 0.71875 0.35586 1.0000 + Sn Sn299 1.0 0.87500 0.75000 0.35586 1.0000 + Sn Sn300 1.0 0.90625 0.78125 0.35586 1.0000 + Sn Sn301 1.0 0.93750 0.81250 0.35586 1.0000 + Sn Sn302 1.0 0.96875 0.84375 0.35586 1.0000 + Sn Sn303 1.0 0.00000 0.87500 0.35586 1.0000 + Sn Sn304 1.0 0.03125 0.90625 0.35586 1.0000 + Sn Sn305 1.0 0.59375 0.40625 0.35586 1.0000 + Sn Sn306 1.0 0.62500 0.43750 0.35586 1.0000 + Sn Sn307 1.0 0.65625 0.46875 0.35586 1.0000 + Sn Sn308 1.0 0.68750 0.50000 0.35586 1.0000 + Sn Sn309 1.0 0.71875 0.53125 0.35586 1.0000 + Sn Sn310 1.0 0.75000 0.56250 0.35586 1.0000 + Sn Sn311 1.0 0.78125 0.59375 0.35586 1.0000 + Sn Sn312 1.0 0.81250 0.62500 0.35586 1.0000 + Sn Sn313 1.0 0.84375 0.65625 0.35586 1.0000 + Sn Sn314 1.0 0.87500 0.68750 0.35586 1.0000 + Sn Sn315 1.0 0.90625 0.71875 0.35586 1.0000 + Sn Sn316 1.0 0.93750 0.75000 0.35586 1.0000 + Sn Sn317 1.0 0.96875 0.78125 0.35586 1.0000 + Sn Sn318 1.0 0.00000 0.81250 0.35586 1.0000 + Sn Sn319 1.0 0.03125 0.84375 0.35586 1.0000 + Sn Sn320 1.0 0.06250 0.87500 0.35586 1.0000 + Sn Sn321 1.0 0.62500 0.37500 0.35586 1.0000 + Sn Sn322 1.0 0.65625 0.40625 0.35586 1.0000 + Sn Sn323 1.0 0.68750 0.43750 0.35586 1.0000 + Sn Sn324 1.0 0.71875 0.46875 0.35586 1.0000 + Sn Sn325 1.0 0.75000 0.50000 0.35586 1.0000 + Sn Sn326 1.0 0.78125 0.53125 0.35586 1.0000 + Sn Sn327 1.0 0.81250 0.56250 0.35586 1.0000 + Sn Sn328 1.0 0.84375 0.59375 0.35586 1.0000 + Sn Sn329 1.0 0.87500 0.62500 0.35586 1.0000 + Sn Sn330 1.0 0.90625 0.65625 0.35586 1.0000 + Sn Sn331 1.0 0.93750 0.68750 0.35586 1.0000 + Sn Sn332 1.0 0.96875 0.71875 0.35586 1.0000 + Sn Sn333 1.0 0.00000 0.75000 0.35586 1.0000 + Sn Sn334 1.0 0.03125 0.78125 0.35586 1.0000 + Sn Sn335 1.0 0.06250 0.81250 0.35586 1.0000 + Sn Sn336 1.0 0.09375 0.84375 0.35586 1.0000 + Sn Sn337 1.0 0.65625 0.34375 0.35586 1.0000 + Sn Sn338 1.0 0.68750 0.37500 0.35586 1.0000 + Sn Sn339 1.0 0.71875 0.40625 0.35586 1.0000 + Sn Sn340 1.0 0.75000 0.43750 0.35586 1.0000 + Sn Sn341 1.0 0.78125 0.46875 0.35586 1.0000 + Sn Sn342 1.0 0.81250 0.50000 0.35586 1.0000 + Sn Sn343 1.0 0.84375 0.53125 0.35586 1.0000 + Sn Sn344 1.0 0.87500 0.56250 0.35586 1.0000 + Sn Sn345 1.0 0.90625 0.59375 0.35586 1.0000 + Sn Sn346 1.0 0.93750 0.62500 0.35586 1.0000 + Sn Sn347 1.0 0.96875 0.65625 0.35586 1.0000 + Sn Sn348 1.0 0.00000 0.68750 0.35586 1.0000 + Sn Sn349 1.0 0.03125 0.71875 0.35586 1.0000 + Sn Sn350 1.0 0.06250 0.75000 0.35586 1.0000 + Sn Sn351 1.0 0.09375 0.78125 0.35586 1.0000 + Sn Sn352 1.0 0.12500 0.81250 0.35586 1.0000 + Sn Sn353 1.0 0.68750 0.31250 0.35586 1.0000 + Sn Sn354 1.0 0.71875 0.34375 0.35586 1.0000 + Sn Sn355 1.0 0.75000 0.37500 0.35586 1.0000 + Sn Sn356 1.0 0.78125 0.40625 0.35586 1.0000 + Sn Sn357 1.0 0.81250 0.43750 0.35586 1.0000 + Sn Sn358 1.0 0.84375 0.46875 0.35586 1.0000 + Sn Sn359 1.0 0.87500 0.50000 0.35586 1.0000 + Sn Sn360 1.0 0.90625 0.53125 0.35586 1.0000 + Sn Sn361 1.0 0.93750 0.56250 0.35586 1.0000 + Sn Sn362 1.0 0.96875 0.59375 0.35586 1.0000 + Sn Sn363 1.0 0.00000 0.62500 0.35586 1.0000 + Sn Sn364 1.0 0.03125 0.65625 0.35586 1.0000 + Sn Sn365 1.0 0.06250 0.68750 0.35586 1.0000 + Sn Sn366 1.0 0.09375 0.71875 0.35586 1.0000 + Sn Sn367 1.0 0.12500 0.75000 0.35586 1.0000 + Sn Sn368 1.0 0.15625 0.78125 0.35586 1.0000 + Sn Sn369 1.0 0.71875 0.28125 0.35586 1.0000 + Sn Sn370 1.0 0.75000 0.31250 0.35586 1.0000 + Sn Sn371 1.0 0.78125 0.34375 0.35586 1.0000 + Sn Sn372 1.0 0.81250 0.37500 0.35586 1.0000 + Sn Sn373 1.0 0.84375 0.40625 0.35586 1.0000 + Sn Sn374 1.0 0.87500 0.43750 0.35586 1.0000 + Sn Sn375 1.0 0.90625 0.46875 0.35586 1.0000 + Sn Sn376 1.0 0.93750 0.50000 0.35586 1.0000 + Sn Sn377 1.0 0.96875 0.53125 0.35586 1.0000 + Sn Sn378 1.0 0.00000 0.56250 0.35586 1.0000 + Sn Sn379 1.0 0.03125 0.59375 0.35586 1.0000 + Sn Sn380 1.0 0.06250 0.62500 0.35586 1.0000 + Sn Sn381 1.0 0.09375 0.65625 0.35586 1.0000 + Sn Sn382 1.0 0.12500 0.68750 0.35586 1.0000 + Sn Sn383 1.0 0.15625 0.71875 0.35586 1.0000 + Sn Sn384 1.0 0.18750 0.75000 0.35586 1.0000 + Sn Sn385 1.0 0.75000 0.25000 0.35586 1.0000 + Sn Sn386 1.0 0.78125 0.28125 0.35586 1.0000 + Sn Sn387 1.0 0.81250 0.31250 0.35586 1.0000 + Sn Sn388 1.0 0.84375 0.34375 0.35586 1.0000 + Sn Sn389 1.0 0.87500 0.37500 0.35586 1.0000 + Sn Sn390 1.0 0.90625 0.40625 0.35586 1.0000 + Sn Sn391 1.0 0.93750 0.43750 0.35586 1.0000 + Sn Sn392 1.0 0.96875 0.46875 0.35586 1.0000 + Sn Sn393 1.0 1.00000 0.50000 0.35586 1.0000 + Sn Sn394 1.0 0.03125 0.53125 0.35586 1.0000 + Sn Sn395 1.0 0.06250 0.56250 0.35586 1.0000 + Sn Sn396 1.0 0.09375 0.59375 0.35586 1.0000 + Sn Sn397 1.0 0.12500 0.62500 0.35586 1.0000 + Sn Sn398 1.0 0.15625 0.65625 0.35586 1.0000 + Sn Sn399 1.0 0.18750 0.68750 0.35586 1.0000 + Sn Sn400 1.0 0.21875 0.71875 0.35586 1.0000 + Sn Sn401 1.0 0.78125 0.21875 0.35586 1.0000 + Sn Sn402 1.0 0.81250 0.25000 0.35586 1.0000 + Sn Sn403 1.0 0.84375 0.28125 0.35586 1.0000 + Sn Sn404 1.0 0.87500 0.31250 0.35586 1.0000 + Sn Sn405 1.0 0.90625 0.34375 0.35586 1.0000 + Sn Sn406 1.0 0.93750 0.37500 0.35586 1.0000 + Sn Sn407 1.0 0.96875 0.40625 0.35586 1.0000 + Sn Sn408 1.0 0.00000 0.43750 0.35586 1.0000 + Sn Sn409 1.0 0.03125 0.46875 0.35586 1.0000 + Sn Sn410 1.0 0.06250 0.50000 0.35586 1.0000 + Sn Sn411 1.0 0.09375 0.53125 0.35586 1.0000 + Sn Sn412 1.0 0.12500 0.56250 0.35586 1.0000 + Sn Sn413 1.0 0.15625 0.59375 0.35586 1.0000 + Sn Sn414 1.0 0.18750 0.62500 0.35586 1.0000 + Sn Sn415 1.0 0.21875 0.65625 0.35586 1.0000 + Sn Sn416 1.0 0.25000 0.68750 0.35586 1.0000 + Sn Sn417 1.0 0.81250 0.18750 0.35586 1.0000 + Sn Sn418 1.0 0.84375 0.21875 0.35586 1.0000 + Sn Sn419 1.0 0.87500 0.25000 0.35586 1.0000 + Sn Sn420 1.0 0.90625 0.28125 0.35586 1.0000 + Sn Sn421 1.0 0.93750 0.31250 0.35586 1.0000 + Sn Sn422 1.0 0.96875 0.34375 0.35586 1.0000 + Sn Sn423 1.0 0.00000 0.37500 0.35586 1.0000 + Sn Sn424 1.0 0.03125 0.40625 0.35586 1.0000 + Sn Sn425 1.0 0.06250 0.43750 0.35586 1.0000 + Sn Sn426 1.0 0.09375 0.46875 0.35586 1.0000 + Sn Sn427 1.0 0.12500 0.50000 0.35586 1.0000 + Sn Sn428 1.0 0.15625 0.53125 0.35586 1.0000 + Sn Sn429 1.0 0.18750 0.56250 0.35586 1.0000 + Sn Sn430 1.0 0.21875 0.59375 0.35586 1.0000 + Sn Sn431 1.0 0.25000 0.62500 0.35586 1.0000 + Sn Sn432 1.0 0.28125 0.65625 0.35586 1.0000 + Sn Sn433 1.0 0.84375 0.15625 0.35586 1.0000 + Sn Sn434 1.0 0.87500 0.18750 0.35586 1.0000 + Sn Sn435 1.0 0.90625 0.21875 0.35586 1.0000 + Sn Sn436 1.0 0.93750 0.25000 0.35586 1.0000 + Sn Sn437 1.0 0.96875 0.28125 0.35586 1.0000 + Sn Sn438 1.0 0.00000 0.31250 0.35586 1.0000 + Sn Sn439 1.0 0.03125 0.34375 0.35586 1.0000 + Sn Sn440 1.0 0.06250 0.37500 0.35586 1.0000 + Sn Sn441 1.0 0.09375 0.40625 0.35586 1.0000 + Sn Sn442 1.0 0.12500 0.43750 0.35586 1.0000 + Sn Sn443 1.0 0.15625 0.46875 0.35586 1.0000 + Sn Sn444 1.0 0.18750 0.50000 0.35586 1.0000 + Sn Sn445 1.0 0.21875 0.53125 0.35586 1.0000 + Sn Sn446 1.0 0.25000 0.56250 0.35586 1.0000 + Sn Sn447 1.0 0.28125 0.59375 0.35586 1.0000 + Sn Sn448 1.0 0.31250 0.62500 0.35586 1.0000 + Sn Sn449 1.0 0.87500 0.12500 0.35586 1.0000 + Sn Sn450 1.0 0.90625 0.15625 0.35586 1.0000 + Sn Sn451 1.0 0.93750 0.18750 0.35586 1.0000 + Sn Sn452 1.0 0.96875 0.21875 0.35586 1.0000 + Sn Sn453 1.0 0.00000 0.25000 0.35586 1.0000 + Sn Sn454 1.0 0.03125 0.28125 0.35586 1.0000 + Sn Sn455 1.0 0.06250 0.31250 0.35586 1.0000 + Sn Sn456 1.0 0.09375 0.34375 0.35586 1.0000 + Sn Sn457 1.0 0.12500 0.37500 0.35586 1.0000 + Sn Sn458 1.0 0.15625 0.40625 0.35586 1.0000 + Sn Sn459 1.0 0.18750 0.43750 0.35586 1.0000 + Sn Sn460 1.0 0.21875 0.46875 0.35586 1.0000 + Sn Sn461 1.0 0.25000 0.50000 0.35586 1.0000 + Sn Sn462 1.0 0.28125 0.53125 0.35586 1.0000 + Sn Sn463 1.0 0.31250 0.56250 0.35586 1.0000 + Sn Sn464 1.0 0.34375 0.59375 0.35586 1.0000 + Sn Sn465 1.0 0.90625 0.09375 0.35586 1.0000 + Sn Sn466 1.0 0.93750 0.12500 0.35586 1.0000 + Sn Sn467 1.0 0.96875 0.15625 0.35586 1.0000 + Sn Sn468 1.0 0.00000 0.18750 0.35586 1.0000 + Sn Sn469 1.0 0.03125 0.21875 0.35586 1.0000 + Sn Sn470 1.0 0.06250 0.25000 0.35586 1.0000 + Sn Sn471 1.0 0.09375 0.28125 0.35586 1.0000 + Sn Sn472 1.0 0.12500 0.31250 0.35586 1.0000 + Sn Sn473 1.0 0.15625 0.34375 0.35586 1.0000 + Sn Sn474 1.0 0.18750 0.37500 0.35586 1.0000 + Sn Sn475 1.0 0.21875 0.40625 0.35586 1.0000 + Sn Sn476 1.0 0.25000 0.43750 0.35586 1.0000 + Sn Sn477 1.0 0.28125 0.46875 0.35586 1.0000 + Sn Sn478 1.0 0.31250 0.50000 0.35586 1.0000 + Sn Sn479 1.0 0.34375 0.53125 0.35586 1.0000 + Sn Sn480 1.0 0.37500 0.56250 0.35586 1.0000 + Sn Sn481 1.0 0.93750 0.06250 0.35586 1.0000 + Sn Sn482 1.0 0.96875 0.09375 0.35586 1.0000 + Sn Sn483 1.0 0.00000 0.12500 0.35586 1.0000 + Sn Sn484 1.0 0.03125 0.15625 0.35586 1.0000 + Sn Sn485 1.0 0.06250 0.18750 0.35586 1.0000 + Sn Sn486 1.0 0.09375 0.21875 0.35586 1.0000 + Sn Sn487 1.0 0.12500 0.25000 0.35586 1.0000 + Sn Sn488 1.0 0.15625 0.28125 0.35586 1.0000 + Sn Sn489 1.0 0.18750 0.31250 0.35586 1.0000 + Sn Sn490 1.0 0.21875 0.34375 0.35586 1.0000 + Sn Sn491 1.0 0.25000 0.37500 0.35586 1.0000 + Sn Sn492 1.0 0.28125 0.40625 0.35586 1.0000 + Sn Sn493 1.0 0.31250 0.43750 0.35586 1.0000 + Sn Sn494 1.0 0.34375 0.46875 0.35586 1.0000 + Sn Sn495 1.0 0.37500 0.50000 0.35586 1.0000 + Sn Sn496 1.0 0.40625 0.53125 0.35586 1.0000 + Sn Sn497 1.0 0.96875 0.03125 0.35586 1.0000 + Sn Sn498 1.0 0.00000 0.06250 0.35586 1.0000 + Sn Sn499 1.0 0.03125 0.09375 0.35586 1.0000 + Sn Sn500 1.0 0.06250 0.12500 0.35586 1.0000 + Sn Sn501 1.0 0.09375 0.15625 0.35586 1.0000 + Sn Sn502 1.0 0.12500 0.18750 0.35586 1.0000 + Sn Sn503 1.0 0.15625 0.21875 0.35586 1.0000 + Sn Sn504 1.0 0.18750 0.25000 0.35586 1.0000 + Sn Sn505 1.0 0.21875 0.28125 0.35586 1.0000 + Sn Sn506 1.0 0.25000 0.31250 0.35586 1.0000 + Sn Sn507 1.0 0.28125 0.34375 0.35586 1.0000 + Sn Sn508 1.0 0.31250 0.37500 0.35586 1.0000 + Sn Sn509 1.0 0.34375 0.40625 0.35586 1.0000 + Sn Sn510 1.0 0.37500 0.43750 0.35586 1.0000 + Sn Sn511 1.0 0.40625 0.46875 0.35586 1.0000 + Sn Sn512 1.0 0.43750 0.50000 0.35586 1.0000 + Cl Cl769 1.0 0.54114 0.47951 0.59797 1.0000 + Cl Cl770 1.0 0.57239 0.51076 0.59797 1.0000 + Cl Cl771 1.0 0.60364 0.54201 0.59797 1.0000 + Cl Cl772 1.0 0.63489 0.57326 0.59797 1.0000 + Cl Cl773 1.0 0.66614 0.60451 0.59797 1.0000 + Cl Cl774 1.0 0.69739 0.63576 0.59797 1.0000 + Cl Cl775 1.0 0.72864 0.66701 0.59797 1.0000 + Cl Cl776 1.0 0.75989 0.69826 0.59797 1.0000 + Cl Cl777 1.0 0.79114 0.72951 0.59797 1.0000 + Cl Cl778 1.0 0.82239 0.76076 0.59797 1.0000 + Cl Cl779 1.0 0.85364 0.79201 0.59797 1.0000 + Cl Cl780 1.0 0.88489 0.82326 0.59797 1.0000 + Cl Cl781 1.0 0.91614 0.85451 0.59797 1.0000 + Cl Cl782 1.0 0.94739 0.88576 0.59797 1.0000 + Cl Cl783 1.0 0.97864 0.91701 0.59797 1.0000 + Cl Cl784 1.0 0.00989 0.94826 0.59797 1.0000 + Cl Cl785 1.0 0.57239 0.44826 0.59797 1.0000 + Cl Cl786 1.0 0.60364 0.47951 0.59797 1.0000 + Cl Cl787 1.0 0.63489 0.51076 0.59797 1.0000 + Cl Cl788 1.0 0.66614 0.54201 0.59797 1.0000 + Cl Cl789 1.0 0.69739 0.57326 0.59797 1.0000 + Cl Cl790 1.0 0.72864 0.60451 0.59797 1.0000 + Cl Cl791 1.0 0.75989 0.63576 0.59797 1.0000 + Cl Cl792 1.0 0.79114 0.66701 0.59797 1.0000 + Cl Cl793 1.0 0.82239 0.69826 0.59797 1.0000 + Cl Cl794 1.0 0.85364 0.72951 0.59797 1.0000 + Cl Cl795 1.0 0.88489 0.76076 0.59797 1.0000 + Cl Cl796 1.0 0.91614 0.79201 0.59797 1.0000 + Cl Cl797 1.0 0.94739 0.82326 0.59797 1.0000 + Cl Cl798 1.0 0.97864 0.85451 0.59797 1.0000 + Cl Cl799 1.0 0.00989 0.88576 0.59797 1.0000 + Cl Cl800 1.0 0.04114 0.91701 0.59797 1.0000 + Cl Cl801 1.0 0.60364 0.41701 0.59797 1.0000 + Cl Cl802 1.0 0.63489 0.44826 0.59797 1.0000 + Cl Cl803 1.0 0.66614 0.47951 0.59797 1.0000 + Cl Cl804 1.0 0.69739 0.51076 0.59797 1.0000 + Cl Cl805 1.0 0.72864 0.54201 0.59797 1.0000 + Cl Cl806 1.0 0.75989 0.57326 0.59797 1.0000 + Cl Cl807 1.0 0.79114 0.60451 0.59797 1.0000 + Cl Cl808 1.0 0.82239 0.63576 0.59797 1.0000 + Cl Cl809 1.0 0.85364 0.66701 0.59797 1.0000 + Cl Cl810 1.0 0.88489 0.69826 0.59797 1.0000 + Cl Cl811 1.0 0.91614 0.72951 0.59797 1.0000 + Cl Cl812 1.0 0.94739 0.76076 0.59797 1.0000 + Cl Cl813 1.0 0.97864 0.79201 0.59797 1.0000 + Cl Cl814 1.0 0.00989 0.82326 0.59797 1.0000 + Cl Cl815 1.0 0.04114 0.85451 0.59797 1.0000 + Cl Cl816 1.0 0.07239 0.88576 0.59797 1.0000 + Cl Cl817 1.0 0.63489 0.38576 0.59797 1.0000 + Cl Cl818 1.0 0.66614 0.41701 0.59797 1.0000 + Cl Cl819 1.0 0.69739 0.44826 0.59797 1.0000 + Cl Cl820 1.0 0.72864 0.47951 0.59797 1.0000 + Cl Cl821 1.0 0.75989 0.51076 0.59797 1.0000 + Cl Cl822 1.0 0.79114 0.54201 0.59797 1.0000 + Cl Cl823 1.0 0.82239 0.57326 0.59797 1.0000 + Cl Cl824 1.0 0.85364 0.60451 0.59797 1.0000 + Cl Cl825 1.0 0.88489 0.63576 0.59797 1.0000 + Cl Cl826 1.0 0.91614 0.66701 0.59797 1.0000 + Cl Cl827 1.0 0.94739 0.69826 0.59797 1.0000 + Cl Cl828 1.0 0.97864 0.72951 0.59797 1.0000 + Cl Cl829 1.0 0.00989 0.76076 0.59797 1.0000 + Cl Cl830 1.0 0.04114 0.79201 0.59797 1.0000 + Cl Cl831 1.0 0.07239 0.82326 0.59797 1.0000 + Cl Cl832 1.0 0.10364 0.85451 0.59797 1.0000 + Cl Cl833 1.0 0.66614 0.35451 0.59797 1.0000 + Cl Cl834 1.0 0.69739 0.38576 0.59797 1.0000 + Cl Cl835 1.0 0.72864 0.41701 0.59797 1.0000 + Cl Cl836 1.0 0.75989 0.44826 0.59797 1.0000 + Cl Cl837 1.0 0.79114 0.47951 0.59797 1.0000 + Cl Cl838 1.0 0.82239 0.51076 0.59797 1.0000 + Cl Cl839 1.0 0.85364 0.54201 0.59797 1.0000 + Cl Cl840 1.0 0.88489 0.57326 0.59797 1.0000 + Cl Cl841 1.0 0.91614 0.60451 0.59797 1.0000 + Cl Cl842 1.0 0.94739 0.63576 0.59797 1.0000 + Cl Cl843 1.0 0.97864 0.66701 0.59797 1.0000 + Cl Cl844 1.0 0.00989 0.69826 0.59797 1.0000 + Cl Cl845 1.0 0.04114 0.72951 0.59797 1.0000 + Cl Cl846 1.0 0.07239 0.76076 0.59797 1.0000 + Cl Cl847 1.0 0.10364 0.79201 0.59797 1.0000 + Cl Cl848 1.0 0.13489 0.82326 0.59797 1.0000 + Cl Cl849 1.0 0.69739 0.32326 0.59797 1.0000 + Cl Cl850 1.0 0.72864 0.35451 0.59797 1.0000 + Cl Cl851 1.0 0.75989 0.38576 0.59797 1.0000 + Cl Cl852 1.0 0.79114 0.41701 0.59797 1.0000 + Cl Cl853 1.0 0.82239 0.44826 0.59797 1.0000 + Cl Cl854 1.0 0.85364 0.47951 0.59797 1.0000 + Cl Cl855 1.0 0.88489 0.51076 0.59797 1.0000 + Cl Cl856 1.0 0.91614 0.54201 0.59797 1.0000 + Cl Cl857 1.0 0.94739 0.57326 0.59797 1.0000 + Cl Cl858 1.0 0.97864 0.60451 0.59797 1.0000 + Cl Cl859 1.0 0.00989 0.63576 0.59797 1.0000 + Cl Cl860 1.0 0.04114 0.66701 0.59797 1.0000 + Cl Cl861 1.0 0.07239 0.69826 0.59797 1.0000 + Cl Cl862 1.0 0.10364 0.72951 0.59797 1.0000 + Cl Cl863 1.0 0.13489 0.76076 0.59797 1.0000 + Cl Cl864 1.0 0.16614 0.79201 0.59797 1.0000 + Cl Cl865 1.0 0.72864 0.29201 0.59797 1.0000 + Cl Cl866 1.0 0.75989 0.32326 0.59797 1.0000 + Cl Cl867 1.0 0.79114 0.35451 0.59797 1.0000 + Cl Cl868 1.0 0.82239 0.38576 0.59797 1.0000 + Cl Cl869 1.0 0.85364 0.41701 0.59797 1.0000 + Cl Cl870 1.0 0.88489 0.44826 0.59797 1.0000 + Cl Cl871 1.0 0.91614 0.47951 0.59797 1.0000 + Cl Cl872 1.0 0.94739 0.51076 0.59797 1.0000 + Cl Cl873 1.0 0.97864 0.54201 0.59797 1.0000 + Cl Cl874 1.0 0.00989 0.57326 0.59797 1.0000 + Cl Cl875 1.0 0.04114 0.60451 0.59797 1.0000 + Cl Cl876 1.0 0.07239 0.63576 0.59797 1.0000 + Cl Cl877 1.0 0.10364 0.66701 0.59797 1.0000 + Cl Cl878 1.0 0.13489 0.69826 0.59797 1.0000 + Cl Cl879 1.0 0.16614 0.72951 0.59797 1.0000 + Cl Cl880 1.0 0.19739 0.76076 0.59797 1.0000 + Cl Cl881 1.0 0.75989 0.26076 0.59797 1.0000 + Cl Cl882 1.0 0.79114 0.29201 0.59797 1.0000 + Cl Cl883 1.0 0.82239 0.32326 0.59797 1.0000 + Cl Cl884 1.0 0.85364 0.35451 0.59797 1.0000 + Cl Cl885 1.0 0.88489 0.38576 0.59797 1.0000 + Cl Cl886 1.0 0.91614 0.41701 0.59797 1.0000 + Cl Cl887 1.0 0.94739 0.44826 0.59797 1.0000 + Cl Cl888 1.0 0.97864 0.47951 0.59797 1.0000 + Cl Cl889 1.0 0.00989 0.51076 0.59797 1.0000 + Cl Cl890 1.0 0.04114 0.54201 0.59797 1.0000 + Cl Cl891 1.0 0.07239 0.57326 0.59797 1.0000 + Cl Cl892 1.0 0.10364 0.60451 0.59797 1.0000 + Cl Cl893 1.0 0.13489 0.63576 0.59797 1.0000 + Cl Cl894 1.0 0.16614 0.66701 0.59797 1.0000 + Cl Cl895 1.0 0.19739 0.69826 0.59797 1.0000 + Cl Cl896 1.0 0.22864 0.72951 0.59797 1.0000 + Cl Cl897 1.0 0.79114 0.22951 0.59797 1.0000 + Cl Cl898 1.0 0.82239 0.26076 0.59797 1.0000 + Cl Cl899 1.0 0.85364 0.29201 0.59797 1.0000 + Cl Cl900 1.0 0.88489 0.32326 0.59797 1.0000 + Cl Cl901 1.0 0.91614 0.35451 0.59797 1.0000 + Cl Cl902 1.0 0.94739 0.38576 0.59797 1.0000 + Cl Cl903 1.0 0.97864 0.41701 0.59797 1.0000 + Cl Cl904 1.0 0.00989 0.44826 0.59797 1.0000 + Cl Cl905 1.0 0.04114 0.47951 0.59797 1.0000 + Cl Cl906 1.0 0.07239 0.51076 0.59797 1.0000 + Cl Cl907 1.0 0.10364 0.54201 0.59797 1.0000 + Cl Cl908 1.0 0.13489 0.57326 0.59797 1.0000 + Cl Cl909 1.0 0.16614 0.60451 0.59797 1.0000 + Cl Cl910 1.0 0.19739 0.63576 0.59797 1.0000 + Cl Cl911 1.0 0.22864 0.66701 0.59797 1.0000 + Cl Cl912 1.0 0.25989 0.69826 0.59797 1.0000 + Cl Cl913 1.0 0.82239 0.19826 0.59797 1.0000 + Cl Cl914 1.0 0.85364 0.22951 0.59797 1.0000 + Cl Cl915 1.0 0.88489 0.26076 0.59797 1.0000 + Cl Cl916 1.0 0.91614 0.29201 0.59797 1.0000 + Cl Cl917 1.0 0.94739 0.32326 0.59797 1.0000 + Cl Cl918 1.0 0.97864 0.35451 0.59797 1.0000 + Cl Cl919 1.0 0.00989 0.38576 0.59797 1.0000 + Cl Cl920 1.0 0.04114 0.41701 0.59797 1.0000 + Cl Cl921 1.0 0.07239 0.44826 0.59797 1.0000 + Cl Cl922 1.0 0.10364 0.47951 0.59797 1.0000 + Cl Cl923 1.0 0.13489 0.51076 0.59797 1.0000 + Cl Cl924 1.0 0.16614 0.54201 0.59797 1.0000 + Cl Cl925 1.0 0.19739 0.57326 0.59797 1.0000 + Cl Cl926 1.0 0.22864 0.60451 0.59797 1.0000 + Cl Cl927 1.0 0.25989 0.63576 0.59797 1.0000 + Cl Cl928 1.0 0.29114 0.66701 0.59797 1.0000 + Cl Cl929 1.0 0.85364 0.16701 0.59797 1.0000 + Cl Cl930 1.0 0.88489 0.19826 0.59797 1.0000 + Cl Cl931 1.0 0.91614 0.22951 0.59797 1.0000 + Cl Cl932 1.0 0.94739 0.26076 0.59797 1.0000 + Cl Cl933 1.0 0.97864 0.29201 0.59797 1.0000 + Cl Cl934 1.0 0.00989 0.32326 0.59797 1.0000 + Cl Cl935 1.0 0.04114 0.35451 0.59797 1.0000 + Cl Cl936 1.0 0.07239 0.38576 0.59797 1.0000 + Cl Cl937 1.0 0.10364 0.41701 0.59797 1.0000 + Cl Cl938 1.0 0.13489 0.44826 0.59797 1.0000 + Cl Cl939 1.0 0.16614 0.47951 0.59797 1.0000 + Cl Cl940 1.0 0.19739 0.51076 0.59797 1.0000 + Cl Cl941 1.0 0.22864 0.54201 0.59797 1.0000 + Cl Cl942 1.0 0.25989 0.57326 0.59797 1.0000 + Cl Cl943 1.0 0.29114 0.60451 0.59797 1.0000 + Cl Cl944 1.0 0.32239 0.63576 0.59797 1.0000 + Cl Cl945 1.0 0.88489 0.13576 0.59797 1.0000 + Cl Cl946 1.0 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Cl Cl968 1.0 0.13489 0.32326 0.59797 1.0000 + Cl Cl969 1.0 0.16614 0.35451 0.59797 1.0000 + Cl Cl970 1.0 0.19739 0.38576 0.59797 1.0000 + Cl Cl971 1.0 0.22864 0.41701 0.59797 1.0000 + Cl Cl972 1.0 0.25989 0.44826 0.59797 1.0000 + Cl Cl973 1.0 0.29114 0.47951 0.59797 1.0000 + Cl Cl974 1.0 0.32239 0.51076 0.59797 1.0000 + Cl Cl975 1.0 0.35364 0.54201 0.59797 1.0000 + Cl Cl976 1.0 0.38489 0.57326 0.59797 1.0000 + Cl Cl977 1.0 0.94739 0.07326 0.59797 1.0000 + Cl Cl978 1.0 0.97864 0.10451 0.59797 1.0000 + Cl Cl979 1.0 0.00989 0.13576 0.59797 1.0000 + Cl Cl980 1.0 0.04114 0.16701 0.59797 1.0000 + Cl Cl981 1.0 0.07239 0.19826 0.59797 1.0000 + Cl Cl982 1.0 0.10364 0.22951 0.59797 1.0000 + Cl Cl983 1.0 0.13489 0.26076 0.59797 1.0000 + Cl Cl984 1.0 0.16614 0.29201 0.59797 1.0000 + Cl Cl985 1.0 0.19739 0.32326 0.59797 1.0000 + Cl Cl986 1.0 0.22864 0.35451 0.59797 1.0000 + Cl Cl987 1.0 0.25989 0.38576 0.59797 1.0000 + Cl Cl988 1.0 0.29114 0.41701 0.59797 1.0000 + Cl Cl989 1.0 0.32239 0.44826 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0000000000000000000000000000000000000000..f12bb1961f14f8813325dc832cb6ad5da94362a5 --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-4842_supercell_12x12x1.cif @@ -0,0 +1,2905 @@ +data_image0 +_chemical_formula_structural As864H288O1728 +_chemical_formula_sum "As864 H288 O1728" +_cell_length_a 55.1381 +_cell_length_b 152.46 +_cell_length_c 6.562 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + As As1 1.0 0.02000 0.02386 0.32980 1.0000 + As As2 1.0 0.02000 0.10719 0.32980 1.0000 + As As3 1.0 0.02000 0.19053 0.32980 1.0000 + As As4 1.0 0.02000 0.27386 0.32980 1.0000 + As As5 1.0 0.02000 0.35719 0.32980 1.0000 + As As6 1.0 0.02000 0.44053 0.32980 1.0000 + As As7 1.0 0.02000 0.52386 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O1599 1.0 0.13443 0.21700 0.38467 1.0000 + O O1600 1.0 0.13443 0.30034 0.38467 1.0000 + O O1601 1.0 0.13443 0.38367 0.38467 1.0000 + O O1602 1.0 0.13443 0.46700 0.38467 1.0000 + O O1603 1.0 0.13443 0.55034 0.38467 1.0000 + O O1604 1.0 0.13443 0.63367 0.38467 1.0000 + O O1605 1.0 0.13443 0.71700 0.38467 1.0000 + O O1606 1.0 0.13443 0.80034 0.38467 1.0000 + O O1607 1.0 0.13443 0.88367 0.38467 1.0000 + O O1608 1.0 0.13443 0.96700 0.38467 1.0000 + O O1609 1.0 0.21776 0.05034 0.38467 1.0000 + O O1610 1.0 0.21776 0.13367 0.38467 1.0000 + O O1611 1.0 0.21776 0.21700 0.38467 1.0000 + O O1612 1.0 0.21776 0.30034 0.38467 1.0000 + O O1613 1.0 0.21776 0.38367 0.38467 1.0000 + O O1614 1.0 0.21776 0.46700 0.38467 1.0000 + O O1615 1.0 0.21776 0.55034 0.38467 1.0000 + O O1616 1.0 0.21776 0.63367 0.38467 1.0000 + O O1617 1.0 0.21776 0.71700 0.38467 1.0000 + O O1618 1.0 0.21776 0.80034 0.38467 1.0000 + O O1619 1.0 0.21776 0.88367 0.38467 1.0000 + O O1620 1.0 0.21776 0.96700 0.38467 1.0000 + O O1621 1.0 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0.88367 0.38467 1.0000 + O O1644 1.0 0.38443 0.96700 0.38467 1.0000 + O O1645 1.0 0.46776 0.05034 0.38467 1.0000 + O O1646 1.0 0.46776 0.13367 0.38467 1.0000 + O O1647 1.0 0.46776 0.21700 0.38467 1.0000 + O O1648 1.0 0.46776 0.30034 0.38467 1.0000 + O O1649 1.0 0.46776 0.38367 0.38467 1.0000 + O O1650 1.0 0.46776 0.46700 0.38467 1.0000 + O O1651 1.0 0.46776 0.55034 0.38467 1.0000 + O O1652 1.0 0.46776 0.63367 0.38467 1.0000 + O O1653 1.0 0.46776 0.71700 0.38467 1.0000 + O O1654 1.0 0.46776 0.80034 0.38467 1.0000 + O O1655 1.0 0.46776 0.88367 0.38467 1.0000 + O O1656 1.0 0.46776 0.96700 0.38467 1.0000 + O O1657 1.0 0.55109 0.05034 0.38467 1.0000 + O O1658 1.0 0.55109 0.13367 0.38467 1.0000 + O O1659 1.0 0.55109 0.21700 0.38467 1.0000 + O O1660 1.0 0.55109 0.30034 0.38467 1.0000 + O O1661 1.0 0.55109 0.38367 0.38467 1.0000 + O O1662 1.0 0.55109 0.46700 0.38467 1.0000 + O O1663 1.0 0.55109 0.55034 0.38467 1.0000 + O O1664 1.0 0.55109 0.63367 0.38467 1.0000 + O O1665 1.0 0.55109 0.71700 0.38467 1.0000 + O O1666 1.0 0.55109 0.80034 0.38467 1.0000 + O O1667 1.0 0.55109 0.88367 0.38467 1.0000 + O O1668 1.0 0.55109 0.96700 0.38467 1.0000 + O O1669 1.0 0.63443 0.05034 0.38467 1.0000 + O O1670 1.0 0.63443 0.13367 0.38467 1.0000 + O O1671 1.0 0.63443 0.21700 0.38467 1.0000 + O O1672 1.0 0.63443 0.30034 0.38467 1.0000 + O O1673 1.0 0.63443 0.38367 0.38467 1.0000 + O O1674 1.0 0.63443 0.46700 0.38467 1.0000 + O O1675 1.0 0.63443 0.55034 0.38467 1.0000 + O O1676 1.0 0.63443 0.63367 0.38467 1.0000 + O O1677 1.0 0.63443 0.71700 0.38467 1.0000 + O O1678 1.0 0.63443 0.80034 0.38467 1.0000 + O O1679 1.0 0.63443 0.88367 0.38467 1.0000 + O O1680 1.0 0.63443 0.96700 0.38467 1.0000 + O O1681 1.0 0.71776 0.05034 0.38467 1.0000 + O O1682 1.0 0.71776 0.13367 0.38467 1.0000 + O O1683 1.0 0.71776 0.21700 0.38467 1.0000 + O O1684 1.0 0.71776 0.30034 0.38467 1.0000 + O O1685 1.0 0.71776 0.38367 0.38467 1.0000 + O O1686 1.0 0.71776 0.46700 0.38467 1.0000 + O O1687 1.0 0.71776 0.55034 0.38467 1.0000 + O O1688 1.0 0.71776 0.63367 0.38467 1.0000 + O O1689 1.0 0.71776 0.71700 0.38467 1.0000 + O O1690 1.0 0.71776 0.80034 0.38467 1.0000 + O O1691 1.0 0.71776 0.88367 0.38467 1.0000 + O O1692 1.0 0.71776 0.96700 0.38467 1.0000 + O O1693 1.0 0.80109 0.05034 0.38467 1.0000 + O O1694 1.0 0.80109 0.13367 0.38467 1.0000 + O O1695 1.0 0.80109 0.21700 0.38467 1.0000 + O O1696 1.0 0.80109 0.30034 0.38467 1.0000 + O O1697 1.0 0.80109 0.38367 0.38467 1.0000 + O O1698 1.0 0.80109 0.46700 0.38467 1.0000 + O O1699 1.0 0.80109 0.55034 0.38467 1.0000 + O O1700 1.0 0.80109 0.63367 0.38467 1.0000 + O O1701 1.0 0.80109 0.71700 0.38467 1.0000 + O O1702 1.0 0.80109 0.80034 0.38467 1.0000 + O O1703 1.0 0.80109 0.88367 0.38467 1.0000 + O O1704 1.0 0.80109 0.96700 0.38467 1.0000 + O O1705 1.0 0.88443 0.05034 0.38467 1.0000 + O O1706 1.0 0.88443 0.13367 0.38467 1.0000 + O O1707 1.0 0.88443 0.21700 0.38467 1.0000 + O O1708 1.0 0.88443 0.30034 0.38467 1.0000 + O O1709 1.0 0.88443 0.38367 0.38467 1.0000 + O O1710 1.0 0.88443 0.46700 0.38467 1.0000 + O O1711 1.0 0.88443 0.55034 0.38467 1.0000 + O O1712 1.0 0.88443 0.63367 0.38467 1.0000 + O O1713 1.0 0.88443 0.71700 0.38467 1.0000 + O O1714 1.0 0.88443 0.80034 0.38467 1.0000 + O O1715 1.0 0.88443 0.88367 0.38467 1.0000 + O O1716 1.0 0.88443 0.96700 0.38467 1.0000 + O O1717 1.0 0.96776 0.05034 0.38467 1.0000 + O O1718 1.0 0.96776 0.13367 0.38467 1.0000 + O O1719 1.0 0.96776 0.21700 0.38467 1.0000 + O O1720 1.0 0.96776 0.30034 0.38467 1.0000 + O O1721 1.0 0.96776 0.38367 0.38467 1.0000 + O O1722 1.0 0.96776 0.46700 0.38467 1.0000 + O O1723 1.0 0.96776 0.55034 0.38467 1.0000 + O O1724 1.0 0.96776 0.63367 0.38467 1.0000 + O O1725 1.0 0.96776 0.71700 0.38467 1.0000 + O O1726 1.0 0.96776 0.80034 0.38467 1.0000 + O O1727 1.0 0.96776 0.88367 0.38467 1.0000 + O O1728 1.0 0.96776 0.96700 0.38467 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-4863_supercell_16x16x1.cif b/tier3/cif_file/orthogonal_2dm-4863_supercell_16x16x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..ef54183134b729f8805691c926a2105c4e6ab89a --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-4863_supercell_16x16x1.cif @@ -0,0 +1,1561 @@ +data_image0 +_chemical_formula_structural Ni256Te256O1024 +_chemical_formula_sum "Ni256 Te256 O1024" +_cell_length_a 49.5091 +_cell_length_b 85.325 +_cell_length_c 6.14824 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Ni Ni1 1.0 0.03125 0.05291 0.50000 1.0000 + Ni Ni2 1.0 0.03125 0.11541 0.50000 1.0000 + Ni Ni3 1.0 0.03125 0.17791 0.50000 1.0000 + Ni Ni4 1.0 0.03125 0.24041 0.50000 1.0000 + Ni Ni5 1.0 0.03125 0.30291 0.50000 1.0000 + Ni Ni6 1.0 0.03125 0.36541 0.50000 1.0000 + Ni Ni7 1.0 0.03125 0.42791 0.50000 1.0000 + Ni Ni8 1.0 0.03125 0.49041 0.50000 1.0000 + Ni Ni9 1.0 0.03125 0.55291 0.50000 1.0000 + Ni Ni10 1.0 0.03125 0.61541 0.50000 1.0000 + Ni Ni11 1.0 0.03125 0.67791 0.50000 1.0000 + Ni Ni12 1.0 0.03125 0.74041 0.50000 1.0000 + Ni Ni13 1.0 0.03125 0.80291 0.50000 1.0000 + Ni Ni14 1.0 0.03125 0.86541 0.50000 1.0000 + Ni Ni15 1.0 0.03125 0.92791 0.50000 1.0000 + Ni Ni16 1.0 0.03125 0.99041 0.50000 1.0000 + Ni Ni17 1.0 0.09375 0.05291 0.50000 1.0000 + Ni Ni18 1.0 0.09375 0.11541 0.50000 1.0000 + Ni Ni19 1.0 0.09375 0.17791 0.50000 1.0000 + Ni Ni20 1.0 0.09375 0.24041 0.50000 1.0000 + Ni Ni21 1.0 0.09375 0.30291 0.50000 1.0000 + Ni Ni22 1.0 0.09375 0.36541 0.50000 1.0000 + Ni Ni23 1.0 0.09375 0.42791 0.50000 1.0000 + Ni Ni24 1.0 0.09375 0.49041 0.50000 1.0000 + Ni Ni25 1.0 0.09375 0.55291 0.50000 1.0000 + Ni Ni26 1.0 0.09375 0.61541 0.50000 1.0000 + Ni Ni27 1.0 0.09375 0.67791 0.50000 1.0000 + Ni Ni28 1.0 0.09375 0.74041 0.50000 1.0000 + Ni Ni29 1.0 0.09375 0.80291 0.50000 1.0000 + Ni Ni30 1.0 0.09375 0.86541 0.50000 1.0000 + Ni Ni31 1.0 0.09375 0.92791 0.50000 1.0000 + Ni Ni32 1.0 0.09375 0.99041 0.50000 1.0000 + Ni Ni33 1.0 0.15625 0.05291 0.50000 1.0000 + Ni Ni34 1.0 0.15625 0.11541 0.50000 1.0000 + Ni Ni35 1.0 0.15625 0.17791 0.50000 1.0000 + Ni Ni36 1.0 0.15625 0.24041 0.50000 1.0000 + Ni Ni37 1.0 0.15625 0.30291 0.50000 1.0000 + Ni Ni38 1.0 0.15625 0.36541 0.50000 1.0000 + Ni Ni39 1.0 0.15625 0.42791 0.50000 1.0000 + Ni Ni40 1.0 0.15625 0.49041 0.50000 1.0000 + Ni Ni41 1.0 0.15625 0.55291 0.50000 1.0000 + Ni Ni42 1.0 0.15625 0.61541 0.50000 1.0000 + Ni Ni43 1.0 0.15625 0.67791 0.50000 1.0000 + Ni Ni44 1.0 0.15625 0.74041 0.50000 1.0000 + Ni Ni45 1.0 0.15625 0.80291 0.50000 1.0000 + Ni Ni46 1.0 0.15625 0.86541 0.50000 1.0000 + Ni Ni47 1.0 0.15625 0.92791 0.50000 1.0000 + Ni Ni48 1.0 0.15625 0.99041 0.50000 1.0000 + Ni Ni49 1.0 0.21875 0.05291 0.50000 1.0000 + Ni Ni50 1.0 0.21875 0.11541 0.50000 1.0000 + Ni Ni51 1.0 0.21875 0.17791 0.50000 1.0000 + Ni Ni52 1.0 0.21875 0.24041 0.50000 1.0000 + Ni Ni53 1.0 0.21875 0.30291 0.50000 1.0000 + Ni Ni54 1.0 0.21875 0.36541 0.50000 1.0000 + Ni Ni55 1.0 0.21875 0.42791 0.50000 1.0000 + Ni Ni56 1.0 0.21875 0.49041 0.50000 1.0000 + Ni Ni57 1.0 0.21875 0.55291 0.50000 1.0000 + Ni Ni58 1.0 0.21875 0.61541 0.50000 1.0000 + Ni Ni59 1.0 0.21875 0.67791 0.50000 1.0000 + Ni Ni60 1.0 0.21875 0.74041 0.50000 1.0000 + Ni Ni61 1.0 0.21875 0.80291 0.50000 1.0000 + Ni Ni62 1.0 0.21875 0.86541 0.50000 1.0000 + Ni Ni63 1.0 0.21875 0.92791 0.50000 1.0000 + Ni Ni64 1.0 0.21875 0.99041 0.50000 1.0000 + Ni Ni65 1.0 0.28125 0.05291 0.50000 1.0000 + Ni Ni66 1.0 0.28125 0.11541 0.50000 1.0000 + Ni Ni67 1.0 0.28125 0.17791 0.50000 1.0000 + Ni Ni68 1.0 0.28125 0.24041 0.50000 1.0000 + Ni Ni69 1.0 0.28125 0.30291 0.50000 1.0000 + Ni Ni70 1.0 0.28125 0.36541 0.50000 1.0000 + Ni Ni71 1.0 0.28125 0.42791 0.50000 1.0000 + Ni Ni72 1.0 0.28125 0.49041 0.50000 1.0000 + Ni Ni73 1.0 0.28125 0.55291 0.50000 1.0000 + Ni Ni74 1.0 0.28125 0.61541 0.50000 1.0000 + Ni Ni75 1.0 0.28125 0.67791 0.50000 1.0000 + Ni Ni76 1.0 0.28125 0.74041 0.50000 1.0000 + Ni Ni77 1.0 0.28125 0.80291 0.50000 1.0000 + Ni Ni78 1.0 0.28125 0.86541 0.50000 1.0000 + Ni Ni79 1.0 0.28125 0.92791 0.50000 1.0000 + Ni Ni80 1.0 0.28125 0.99041 0.50000 1.0000 + Ni Ni81 1.0 0.34375 0.05291 0.50000 1.0000 + Ni Ni82 1.0 0.34375 0.11541 0.50000 1.0000 + Ni Ni83 1.0 0.34375 0.17791 0.50000 1.0000 + Ni Ni84 1.0 0.34375 0.24041 0.50000 1.0000 + Ni Ni85 1.0 0.34375 0.30291 0.50000 1.0000 + Ni Ni86 1.0 0.34375 0.36541 0.50000 1.0000 + Ni Ni87 1.0 0.34375 0.42791 0.50000 1.0000 + Ni Ni88 1.0 0.34375 0.49041 0.50000 1.0000 + Ni Ni89 1.0 0.34375 0.55291 0.50000 1.0000 + Ni Ni90 1.0 0.34375 0.61541 0.50000 1.0000 + Ni Ni91 1.0 0.34375 0.67791 0.50000 1.0000 + Ni Ni92 1.0 0.34375 0.74041 0.50000 1.0000 + Ni Ni93 1.0 0.34375 0.80291 0.50000 1.0000 + Ni Ni94 1.0 0.34375 0.86541 0.50000 1.0000 + Ni Ni95 1.0 0.34375 0.92791 0.50000 1.0000 + Ni Ni96 1.0 0.34375 0.99041 0.50000 1.0000 + Ni Ni97 1.0 0.40625 0.05291 0.50000 1.0000 + Ni Ni98 1.0 0.40625 0.11541 0.50000 1.0000 + Ni Ni99 1.0 0.40625 0.17791 0.50000 1.0000 + Ni Ni100 1.0 0.40625 0.24041 0.50000 1.0000 + Ni Ni101 1.0 0.40625 0.30291 0.50000 1.0000 + Ni Ni102 1.0 0.40625 0.36541 0.50000 1.0000 + Ni Ni103 1.0 0.40625 0.42791 0.50000 1.0000 + Ni Ni104 1.0 0.40625 0.49041 0.50000 1.0000 + Ni Ni105 1.0 0.40625 0.55291 0.50000 1.0000 + Ni Ni106 1.0 0.40625 0.61541 0.50000 1.0000 + Ni Ni107 1.0 0.40625 0.67791 0.50000 1.0000 + Ni Ni108 1.0 0.40625 0.74041 0.50000 1.0000 + Ni Ni109 1.0 0.40625 0.80291 0.50000 1.0000 + Ni Ni110 1.0 0.40625 0.86541 0.50000 1.0000 + Ni Ni111 1.0 0.40625 0.92791 0.50000 1.0000 + Ni Ni112 1.0 0.40625 0.99041 0.50000 1.0000 + Ni Ni113 1.0 0.46875 0.05291 0.50000 1.0000 + Ni Ni114 1.0 0.46875 0.11541 0.50000 1.0000 + Ni Ni115 1.0 0.46875 0.17791 0.50000 1.0000 + Ni Ni116 1.0 0.46875 0.24041 0.50000 1.0000 + Ni Ni117 1.0 0.46875 0.30291 0.50000 1.0000 + Ni Ni118 1.0 0.46875 0.36541 0.50000 1.0000 + Ni Ni119 1.0 0.46875 0.42791 0.50000 1.0000 + Ni Ni120 1.0 0.46875 0.49041 0.50000 1.0000 + Ni Ni121 1.0 0.46875 0.55291 0.50000 1.0000 + Ni Ni122 1.0 0.46875 0.61541 0.50000 1.0000 + Ni Ni123 1.0 0.46875 0.67791 0.50000 1.0000 + Ni Ni124 1.0 0.46875 0.74041 0.50000 1.0000 + Ni Ni125 1.0 0.46875 0.80291 0.50000 1.0000 + Ni Ni126 1.0 0.46875 0.86541 0.50000 1.0000 + Ni Ni127 1.0 0.46875 0.92791 0.50000 1.0000 + Ni Ni128 1.0 0.46875 0.99041 0.50000 1.0000 + Ni Ni129 1.0 0.53125 0.05291 0.50000 1.0000 + Ni Ni130 1.0 0.53125 0.11541 0.50000 1.0000 + Ni Ni131 1.0 0.53125 0.17791 0.50000 1.0000 + Ni Ni132 1.0 0.53125 0.24041 0.50000 1.0000 + Ni Ni133 1.0 0.53125 0.30291 0.50000 1.0000 + Ni Ni134 1.0 0.53125 0.36541 0.50000 1.0000 + Ni Ni135 1.0 0.53125 0.42791 0.50000 1.0000 + Ni Ni136 1.0 0.53125 0.49041 0.50000 1.0000 + Ni Ni137 1.0 0.53125 0.55291 0.50000 1.0000 + Ni Ni138 1.0 0.53125 0.61541 0.50000 1.0000 + Ni Ni139 1.0 0.53125 0.67791 0.50000 1.0000 + Ni Ni140 1.0 0.53125 0.74041 0.50000 1.0000 + Ni Ni141 1.0 0.53125 0.80291 0.50000 1.0000 + Ni Ni142 1.0 0.53125 0.86541 0.50000 1.0000 + Ni Ni143 1.0 0.53125 0.92791 0.50000 1.0000 + Ni Ni144 1.0 0.53125 0.99041 0.50000 1.0000 + Ni Ni145 1.0 0.59375 0.05291 0.50000 1.0000 + Ni Ni146 1.0 0.59375 0.11541 0.50000 1.0000 + Ni Ni147 1.0 0.59375 0.17791 0.50000 1.0000 + Ni Ni148 1.0 0.59375 0.24041 0.50000 1.0000 + Ni Ni149 1.0 0.59375 0.30291 0.50000 1.0000 + Ni Ni150 1.0 0.59375 0.36541 0.50000 1.0000 + Ni Ni151 1.0 0.59375 0.42791 0.50000 1.0000 + Ni Ni152 1.0 0.59375 0.49041 0.50000 1.0000 + Ni Ni153 1.0 0.59375 0.55291 0.50000 1.0000 + Ni Ni154 1.0 0.59375 0.61541 0.50000 1.0000 + Ni Ni155 1.0 0.59375 0.67791 0.50000 1.0000 + Ni Ni156 1.0 0.59375 0.74041 0.50000 1.0000 + Ni Ni157 1.0 0.59375 0.80291 0.50000 1.0000 + Ni Ni158 1.0 0.59375 0.86541 0.50000 1.0000 + Ni Ni159 1.0 0.59375 0.92791 0.50000 1.0000 + Ni Ni160 1.0 0.59375 0.99041 0.50000 1.0000 + Ni Ni161 1.0 0.65625 0.05291 0.50000 1.0000 + Ni Ni162 1.0 0.65625 0.11541 0.50000 1.0000 + Ni Ni163 1.0 0.65625 0.17791 0.50000 1.0000 + Ni Ni164 1.0 0.65625 0.24041 0.50000 1.0000 + Ni Ni165 1.0 0.65625 0.30291 0.50000 1.0000 + Ni Ni166 1.0 0.65625 0.36541 0.50000 1.0000 + Ni Ni167 1.0 0.65625 0.42791 0.50000 1.0000 + Ni Ni168 1.0 0.65625 0.49041 0.50000 1.0000 + Ni Ni169 1.0 0.65625 0.55291 0.50000 1.0000 + Ni Ni170 1.0 0.65625 0.61541 0.50000 1.0000 + Ni Ni171 1.0 0.65625 0.67791 0.50000 1.0000 + Ni Ni172 1.0 0.65625 0.74041 0.50000 1.0000 + Ni Ni173 1.0 0.65625 0.80291 0.50000 1.0000 + Ni Ni174 1.0 0.65625 0.86541 0.50000 1.0000 + Ni Ni175 1.0 0.65625 0.92791 0.50000 1.0000 + Ni Ni176 1.0 0.65625 0.99041 0.50000 1.0000 + Ni Ni177 1.0 0.71875 0.05291 0.50000 1.0000 + Ni Ni178 1.0 0.71875 0.11541 0.50000 1.0000 + Ni Ni179 1.0 0.71875 0.17791 0.50000 1.0000 + Ni Ni180 1.0 0.71875 0.24041 0.50000 1.0000 + Ni Ni181 1.0 0.71875 0.30291 0.50000 1.0000 + Ni Ni182 1.0 0.71875 0.36541 0.50000 1.0000 + Ni Ni183 1.0 0.71875 0.42791 0.50000 1.0000 + Ni Ni184 1.0 0.71875 0.49041 0.50000 1.0000 + Ni Ni185 1.0 0.71875 0.55291 0.50000 1.0000 + Ni Ni186 1.0 0.71875 0.61541 0.50000 1.0000 + Ni Ni187 1.0 0.71875 0.67791 0.50000 1.0000 + Ni Ni188 1.0 0.71875 0.74041 0.50000 1.0000 + Ni Ni189 1.0 0.71875 0.80291 0.50000 1.0000 + Ni Ni190 1.0 0.71875 0.86541 0.50000 1.0000 + Ni Ni191 1.0 0.71875 0.92791 0.50000 1.0000 + Ni Ni192 1.0 0.71875 0.99041 0.50000 1.0000 + Ni Ni193 1.0 0.78125 0.05291 0.50000 1.0000 + Ni Ni194 1.0 0.78125 0.11541 0.50000 1.0000 + Ni Ni195 1.0 0.78125 0.17791 0.50000 1.0000 + Ni Ni196 1.0 0.78125 0.24041 0.50000 1.0000 + Ni Ni197 1.0 0.78125 0.30291 0.50000 1.0000 + Ni Ni198 1.0 0.78125 0.36541 0.50000 1.0000 + Ni Ni199 1.0 0.78125 0.42791 0.50000 1.0000 + Ni Ni200 1.0 0.78125 0.49041 0.50000 1.0000 + Ni Ni201 1.0 0.78125 0.55291 0.50000 1.0000 + Ni Ni202 1.0 0.78125 0.61541 0.50000 1.0000 + Ni Ni203 1.0 0.78125 0.67791 0.50000 1.0000 + Ni Ni204 1.0 0.78125 0.74041 0.50000 1.0000 + Ni Ni205 1.0 0.78125 0.80291 0.50000 1.0000 + Ni Ni206 1.0 0.78125 0.86541 0.50000 1.0000 + Ni Ni207 1.0 0.78125 0.92791 0.50000 1.0000 + Ni Ni208 1.0 0.78125 0.99041 0.50000 1.0000 + Ni Ni209 1.0 0.84375 0.05291 0.50000 1.0000 + Ni Ni210 1.0 0.84375 0.11541 0.50000 1.0000 + Ni Ni211 1.0 0.84375 0.17791 0.50000 1.0000 + Ni Ni212 1.0 0.84375 0.24041 0.50000 1.0000 + Ni Ni213 1.0 0.84375 0.30291 0.50000 1.0000 + Ni Ni214 1.0 0.84375 0.36541 0.50000 1.0000 + Ni Ni215 1.0 0.84375 0.42791 0.50000 1.0000 + Ni Ni216 1.0 0.84375 0.49041 0.50000 1.0000 + Ni Ni217 1.0 0.84375 0.55291 0.50000 1.0000 + Ni Ni218 1.0 0.84375 0.61541 0.50000 1.0000 + Ni Ni219 1.0 0.84375 0.67791 0.50000 1.0000 + Ni Ni220 1.0 0.84375 0.74041 0.50000 1.0000 + Ni Ni221 1.0 0.84375 0.80291 0.50000 1.0000 + Ni Ni222 1.0 0.84375 0.86541 0.50000 1.0000 + Ni Ni223 1.0 0.84375 0.92791 0.50000 1.0000 + Ni Ni224 1.0 0.84375 0.99041 0.50000 1.0000 + Ni Ni225 1.0 0.90625 0.05291 0.50000 1.0000 + Ni Ni226 1.0 0.90625 0.11541 0.50000 1.0000 + Ni Ni227 1.0 0.90625 0.17791 0.50000 1.0000 + Ni Ni228 1.0 0.90625 0.24041 0.50000 1.0000 + Ni Ni229 1.0 0.90625 0.30291 0.50000 1.0000 + Ni Ni230 1.0 0.90625 0.36541 0.50000 1.0000 + Ni Ni231 1.0 0.90625 0.42791 0.50000 1.0000 + Ni Ni232 1.0 0.90625 0.49041 0.50000 1.0000 + Ni Ni233 1.0 0.90625 0.55291 0.50000 1.0000 + Ni Ni234 1.0 0.90625 0.61541 0.50000 1.0000 + Ni Ni235 1.0 0.90625 0.67791 0.50000 1.0000 + Ni Ni236 1.0 0.90625 0.74041 0.50000 1.0000 + Ni Ni237 1.0 0.90625 0.80291 0.50000 1.0000 + Ni Ni238 1.0 0.90625 0.86541 0.50000 1.0000 + Ni Ni239 1.0 0.90625 0.92791 0.50000 1.0000 + Ni Ni240 1.0 0.90625 0.99041 0.50000 1.0000 + Ni Ni241 1.0 0.96875 0.05291 0.50000 1.0000 + Ni Ni242 1.0 0.96875 0.11541 0.50000 1.0000 + Ni Ni243 1.0 0.96875 0.17791 0.50000 1.0000 + Ni Ni244 1.0 0.96875 0.24041 0.50000 1.0000 + Ni Ni245 1.0 0.96875 0.30291 0.50000 1.0000 + Ni Ni246 1.0 0.96875 0.36541 0.50000 1.0000 + Ni Ni247 1.0 0.96875 0.42791 0.50000 1.0000 + Ni Ni248 1.0 0.96875 0.49041 0.50000 1.0000 + Ni Ni249 1.0 0.96875 0.55291 0.50000 1.0000 + Ni Ni250 1.0 0.96875 0.61541 0.50000 1.0000 + Ni Ni251 1.0 0.96875 0.67791 0.50000 1.0000 + Ni Ni252 1.0 0.96875 0.74041 0.50000 1.0000 + Ni Ni253 1.0 0.96875 0.80291 0.50000 1.0000 + Ni Ni254 1.0 0.96875 0.86541 0.50000 1.0000 + Ni Ni255 1.0 0.96875 0.92791 0.50000 1.0000 + Ni Ni256 1.0 0.96875 0.99041 0.50000 1.0000 + Te Te1 1.0 0.00000 0.02166 0.50000 1.0000 + Te Te2 1.0 0.00000 0.08416 0.50000 1.0000 + Te Te3 1.0 0.00000 0.14666 0.50000 1.0000 + Te Te4 1.0 0.00000 0.20916 0.50000 1.0000 + Te Te5 1.0 0.00000 0.27166 0.50000 1.0000 + Te Te6 1.0 0.00000 0.33416 0.50000 1.0000 + Te Te7 1.0 0.00000 0.39666 0.50000 1.0000 + Te Te8 1.0 0.00000 0.45916 0.50000 1.0000 + Te Te9 1.0 0.00000 0.52166 0.50000 1.0000 + Te Te10 1.0 0.00000 0.58416 0.50000 1.0000 + Te Te11 1.0 0.00000 0.64666 0.50000 1.0000 + Te Te12 1.0 0.00000 0.70916 0.50000 1.0000 + Te Te13 1.0 0.00000 0.77166 0.50000 1.0000 + Te Te14 1.0 0.00000 0.83416 0.50000 1.0000 + Te Te15 1.0 0.00000 0.89666 0.50000 1.0000 + Te Te16 1.0 0.00000 0.95916 0.50000 1.0000 + Te Te17 1.0 0.06250 0.02166 0.50000 1.0000 + Te Te18 1.0 0.06250 0.08416 0.50000 1.0000 + Te Te19 1.0 0.06250 0.14666 0.50000 1.0000 + Te Te20 1.0 0.06250 0.20916 0.50000 1.0000 + Te Te21 1.0 0.06250 0.27166 0.50000 1.0000 + Te Te22 1.0 0.06250 0.33416 0.50000 1.0000 + Te Te23 1.0 0.06250 0.39666 0.50000 1.0000 + Te Te24 1.0 0.06250 0.45916 0.50000 1.0000 + Te Te25 1.0 0.06250 0.52166 0.50000 1.0000 + Te Te26 1.0 0.06250 0.58416 0.50000 1.0000 + Te Te27 1.0 0.06250 0.64666 0.50000 1.0000 + Te Te28 1.0 0.06250 0.70916 0.50000 1.0000 + Te Te29 1.0 0.06250 0.77166 0.50000 1.0000 + Te Te30 1.0 0.06250 0.83416 0.50000 1.0000 + Te Te31 1.0 0.06250 0.89666 0.50000 1.0000 + Te Te32 1.0 0.06250 0.95916 0.50000 1.0000 + Te Te33 1.0 0.12500 0.02166 0.50000 1.0000 + Te Te34 1.0 0.12500 0.08416 0.50000 1.0000 + Te Te35 1.0 0.12500 0.14666 0.50000 1.0000 + Te Te36 1.0 0.12500 0.20916 0.50000 1.0000 + Te Te37 1.0 0.12500 0.27166 0.50000 1.0000 + Te Te38 1.0 0.12500 0.33416 0.50000 1.0000 + Te Te39 1.0 0.12500 0.39666 0.50000 1.0000 + Te Te40 1.0 0.12500 0.45916 0.50000 1.0000 + Te Te41 1.0 0.12500 0.52166 0.50000 1.0000 + Te Te42 1.0 0.12500 0.58416 0.50000 1.0000 + Te Te43 1.0 0.12500 0.64666 0.50000 1.0000 + Te Te44 1.0 0.12500 0.70916 0.50000 1.0000 + Te Te45 1.0 0.12500 0.77166 0.50000 1.0000 + Te Te46 1.0 0.12500 0.83416 0.50000 1.0000 + Te Te47 1.0 0.12500 0.89666 0.50000 1.0000 + Te Te48 1.0 0.12500 0.95916 0.50000 1.0000 + Te Te49 1.0 0.18750 0.02166 0.50000 1.0000 + Te Te50 1.0 0.18750 0.08416 0.50000 1.0000 + Te Te51 1.0 0.18750 0.14666 0.50000 1.0000 + Te Te52 1.0 0.18750 0.20916 0.50000 1.0000 + Te Te53 1.0 0.18750 0.27166 0.50000 1.0000 + Te Te54 1.0 0.18750 0.33416 0.50000 1.0000 + Te Te55 1.0 0.18750 0.39666 0.50000 1.0000 + Te Te56 1.0 0.18750 0.45916 0.50000 1.0000 + Te Te57 1.0 0.18750 0.52166 0.50000 1.0000 + Te Te58 1.0 0.18750 0.58416 0.50000 1.0000 + Te Te59 1.0 0.18750 0.64666 0.50000 1.0000 + Te Te60 1.0 0.18750 0.70916 0.50000 1.0000 + Te Te61 1.0 0.18750 0.77166 0.50000 1.0000 + Te Te62 1.0 0.18750 0.83416 0.50000 1.0000 + Te Te63 1.0 0.18750 0.89666 0.50000 1.0000 + Te Te64 1.0 0.18750 0.95916 0.50000 1.0000 + Te Te65 1.0 0.25000 0.02166 0.50000 1.0000 + Te Te66 1.0 0.25000 0.08416 0.50000 1.0000 + Te Te67 1.0 0.25000 0.14666 0.50000 1.0000 + Te Te68 1.0 0.25000 0.20916 0.50000 1.0000 + Te Te69 1.0 0.25000 0.27166 0.50000 1.0000 + Te Te70 1.0 0.25000 0.33416 0.50000 1.0000 + Te Te71 1.0 0.25000 0.39666 0.50000 1.0000 + Te Te72 1.0 0.25000 0.45916 0.50000 1.0000 + Te Te73 1.0 0.25000 0.52166 0.50000 1.0000 + Te Te74 1.0 0.25000 0.58416 0.50000 1.0000 + Te Te75 1.0 0.25000 0.64666 0.50000 1.0000 + Te Te76 1.0 0.25000 0.70916 0.50000 1.0000 + Te Te77 1.0 0.25000 0.77166 0.50000 1.0000 + Te Te78 1.0 0.25000 0.83416 0.50000 1.0000 + Te Te79 1.0 0.25000 0.89666 0.50000 1.0000 + Te Te80 1.0 0.25000 0.95916 0.50000 1.0000 + Te Te81 1.0 0.31250 0.02166 0.50000 1.0000 + Te Te82 1.0 0.31250 0.08416 0.50000 1.0000 + Te Te83 1.0 0.31250 0.14666 0.50000 1.0000 + Te Te84 1.0 0.31250 0.20916 0.50000 1.0000 + Te Te85 1.0 0.31250 0.27166 0.50000 1.0000 + Te Te86 1.0 0.31250 0.33416 0.50000 1.0000 + Te Te87 1.0 0.31250 0.39666 0.50000 1.0000 + Te Te88 1.0 0.31250 0.45916 0.50000 1.0000 + Te Te89 1.0 0.31250 0.52166 0.50000 1.0000 + Te Te90 1.0 0.31250 0.58416 0.50000 1.0000 + Te Te91 1.0 0.31250 0.64666 0.50000 1.0000 + Te Te92 1.0 0.31250 0.70916 0.50000 1.0000 + Te Te93 1.0 0.31250 0.77166 0.50000 1.0000 + Te Te94 1.0 0.31250 0.83416 0.50000 1.0000 + Te Te95 1.0 0.31250 0.89666 0.50000 1.0000 + Te Te96 1.0 0.31250 0.95916 0.50000 1.0000 + Te Te97 1.0 0.37500 0.02166 0.50000 1.0000 + Te Te98 1.0 0.37500 0.08416 0.50000 1.0000 + Te Te99 1.0 0.37500 0.14666 0.50000 1.0000 + Te Te100 1.0 0.37500 0.20916 0.50000 1.0000 + Te Te101 1.0 0.37500 0.27166 0.50000 1.0000 + Te Te102 1.0 0.37500 0.33416 0.50000 1.0000 + Te Te103 1.0 0.37500 0.39666 0.50000 1.0000 + Te Te104 1.0 0.37500 0.45916 0.50000 1.0000 + Te Te105 1.0 0.37500 0.52166 0.50000 1.0000 + Te Te106 1.0 0.37500 0.58416 0.50000 1.0000 + Te Te107 1.0 0.37500 0.64666 0.50000 1.0000 + Te Te108 1.0 0.37500 0.70916 0.50000 1.0000 + Te Te109 1.0 0.37500 0.77166 0.50000 1.0000 + Te Te110 1.0 0.37500 0.83416 0.50000 1.0000 + Te Te111 1.0 0.37500 0.89666 0.50000 1.0000 + Te Te112 1.0 0.37500 0.95916 0.50000 1.0000 + Te Te113 1.0 0.43750 0.02166 0.50000 1.0000 + Te Te114 1.0 0.43750 0.08416 0.50000 1.0000 + Te Te115 1.0 0.43750 0.14666 0.50000 1.0000 + Te Te116 1.0 0.43750 0.20916 0.50000 1.0000 + Te Te117 1.0 0.43750 0.27166 0.50000 1.0000 + Te Te118 1.0 0.43750 0.33416 0.50000 1.0000 + Te Te119 1.0 0.43750 0.39666 0.50000 1.0000 + Te Te120 1.0 0.43750 0.45916 0.50000 1.0000 + Te Te121 1.0 0.43750 0.52166 0.50000 1.0000 + Te Te122 1.0 0.43750 0.58416 0.50000 1.0000 + Te Te123 1.0 0.43750 0.64666 0.50000 1.0000 + Te Te124 1.0 0.43750 0.70916 0.50000 1.0000 + Te Te125 1.0 0.43750 0.77166 0.50000 1.0000 + Te Te126 1.0 0.43750 0.83416 0.50000 1.0000 + Te Te127 1.0 0.43750 0.89666 0.50000 1.0000 + Te Te128 1.0 0.43750 0.95916 0.50000 1.0000 + Te Te129 1.0 0.50000 0.02166 0.50000 1.0000 + Te Te130 1.0 0.50000 0.08416 0.50000 1.0000 + Te Te131 1.0 0.50000 0.14666 0.50000 1.0000 + Te Te132 1.0 0.50000 0.20916 0.50000 1.0000 + Te Te133 1.0 0.50000 0.27166 0.50000 1.0000 + Te Te134 1.0 0.50000 0.33416 0.50000 1.0000 + Te Te135 1.0 0.50000 0.39666 0.50000 1.0000 + Te Te136 1.0 0.50000 0.45916 0.50000 1.0000 + Te Te137 1.0 0.50000 0.52166 0.50000 1.0000 + Te Te138 1.0 0.50000 0.58416 0.50000 1.0000 + Te Te139 1.0 0.50000 0.64666 0.50000 1.0000 + Te Te140 1.0 0.50000 0.70916 0.50000 1.0000 + Te Te141 1.0 0.50000 0.77166 0.50000 1.0000 + Te Te142 1.0 0.50000 0.83416 0.50000 1.0000 + Te Te143 1.0 0.50000 0.89666 0.50000 1.0000 + Te Te144 1.0 0.50000 0.95916 0.50000 1.0000 + Te Te145 1.0 0.56250 0.02166 0.50000 1.0000 + Te Te146 1.0 0.56250 0.08416 0.50000 1.0000 + Te Te147 1.0 0.56250 0.14666 0.50000 1.0000 + Te Te148 1.0 0.56250 0.20916 0.50000 1.0000 + Te Te149 1.0 0.56250 0.27166 0.50000 1.0000 + Te Te150 1.0 0.56250 0.33416 0.50000 1.0000 + Te Te151 1.0 0.56250 0.39666 0.50000 1.0000 + Te Te152 1.0 0.56250 0.45916 0.50000 1.0000 + Te Te153 1.0 0.56250 0.52166 0.50000 1.0000 + Te Te154 1.0 0.56250 0.58416 0.50000 1.0000 + Te Te155 1.0 0.56250 0.64666 0.50000 1.0000 + Te Te156 1.0 0.56250 0.70916 0.50000 1.0000 + Te Te157 1.0 0.56250 0.77166 0.50000 1.0000 + Te Te158 1.0 0.56250 0.83416 0.50000 1.0000 + Te Te159 1.0 0.56250 0.89666 0.50000 1.0000 + Te Te160 1.0 0.56250 0.95916 0.50000 1.0000 + Te Te161 1.0 0.62500 0.02166 0.50000 1.0000 + Te Te162 1.0 0.62500 0.08416 0.50000 1.0000 + Te Te163 1.0 0.62500 0.14666 0.50000 1.0000 + Te Te164 1.0 0.62500 0.20916 0.50000 1.0000 + Te Te165 1.0 0.62500 0.27166 0.50000 1.0000 + Te Te166 1.0 0.62500 0.33416 0.50000 1.0000 + Te Te167 1.0 0.62500 0.39666 0.50000 1.0000 + Te Te168 1.0 0.62500 0.45916 0.50000 1.0000 + Te Te169 1.0 0.62500 0.52166 0.50000 1.0000 + Te Te170 1.0 0.62500 0.58416 0.50000 1.0000 + Te Te171 1.0 0.62500 0.64666 0.50000 1.0000 + Te Te172 1.0 0.62500 0.70916 0.50000 1.0000 + Te Te173 1.0 0.62500 0.77166 0.50000 1.0000 + Te Te174 1.0 0.62500 0.83416 0.50000 1.0000 + Te Te175 1.0 0.62500 0.89666 0.50000 1.0000 + Te Te176 1.0 0.62500 0.95916 0.50000 1.0000 + Te Te177 1.0 0.68750 0.02166 0.50000 1.0000 + Te Te178 1.0 0.68750 0.08416 0.50000 1.0000 + Te Te179 1.0 0.68750 0.14666 0.50000 1.0000 + Te Te180 1.0 0.68750 0.20916 0.50000 1.0000 + Te Te181 1.0 0.68750 0.27166 0.50000 1.0000 + Te Te182 1.0 0.68750 0.33416 0.50000 1.0000 + Te Te183 1.0 0.68750 0.39666 0.50000 1.0000 + Te Te184 1.0 0.68750 0.45916 0.50000 1.0000 + Te Te185 1.0 0.68750 0.52166 0.50000 1.0000 + Te Te186 1.0 0.68750 0.58416 0.50000 1.0000 + Te Te187 1.0 0.68750 0.64666 0.50000 1.0000 + Te Te188 1.0 0.68750 0.70916 0.50000 1.0000 + Te Te189 1.0 0.68750 0.77166 0.50000 1.0000 + Te Te190 1.0 0.68750 0.83416 0.50000 1.0000 + Te Te191 1.0 0.68750 0.89666 0.50000 1.0000 + Te Te192 1.0 0.68750 0.95916 0.50000 1.0000 + Te Te193 1.0 0.75000 0.02166 0.50000 1.0000 + Te Te194 1.0 0.75000 0.08416 0.50000 1.0000 + Te Te195 1.0 0.75000 0.14666 0.50000 1.0000 + Te Te196 1.0 0.75000 0.20916 0.50000 1.0000 + Te Te197 1.0 0.75000 0.27166 0.50000 1.0000 + Te Te198 1.0 0.75000 0.33416 0.50000 1.0000 + Te Te199 1.0 0.75000 0.39666 0.50000 1.0000 + Te Te200 1.0 0.75000 0.45916 0.50000 1.0000 + Te Te201 1.0 0.75000 0.52166 0.50000 1.0000 + Te Te202 1.0 0.75000 0.58416 0.50000 1.0000 + Te Te203 1.0 0.75000 0.64666 0.50000 1.0000 + Te Te204 1.0 0.75000 0.70916 0.50000 1.0000 + Te Te205 1.0 0.75000 0.77166 0.50000 1.0000 + Te Te206 1.0 0.75000 0.83416 0.50000 1.0000 + Te Te207 1.0 0.75000 0.89666 0.50000 1.0000 + Te Te208 1.0 0.75000 0.95916 0.50000 1.0000 + Te Te209 1.0 0.81250 0.02166 0.50000 1.0000 + Te Te210 1.0 0.81250 0.08416 0.50000 1.0000 + Te Te211 1.0 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Co Co795 1.0 0.86806 0.35417 0.50000 1.0000 + Co Co796 1.0 0.90972 0.39583 0.50000 1.0000 + Co Co797 1.0 0.95139 0.43750 0.50000 1.0000 + Co Co798 1.0 0.99306 0.47917 0.50000 1.0000 + Co Co799 1.0 0.03472 0.52083 0.50000 1.0000 + Co Co800 1.0 0.07639 0.56250 0.50000 1.0000 + Co Co801 1.0 0.11806 0.60417 0.50000 1.0000 + Co Co802 1.0 0.15972 0.64583 0.50000 1.0000 + Co Co803 1.0 0.20139 0.68750 0.50000 1.0000 + Co Co804 1.0 0.24306 0.72917 0.50000 1.0000 + Co Co805 1.0 0.82639 0.22917 0.50000 1.0000 + Co Co806 1.0 0.86806 0.27083 0.50000 1.0000 + Co Co807 1.0 0.90972 0.31250 0.50000 1.0000 + Co Co808 1.0 0.95139 0.35417 0.50000 1.0000 + Co Co809 1.0 0.99306 0.39583 0.50000 1.0000 + Co Co810 1.0 0.03472 0.43750 0.50000 1.0000 + Co Co811 1.0 0.07639 0.47917 0.50000 1.0000 + Co Co812 1.0 0.11806 0.52083 0.50000 1.0000 + Co Co813 1.0 0.15972 0.56250 0.50000 1.0000 + Co Co814 1.0 0.20139 0.60417 0.50000 1.0000 + Co Co815 1.0 0.24306 0.64583 0.50000 1.0000 + Co Co816 1.0 0.28472 0.68750 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0.28472 0.52083 0.50000 1.0000 + Co Co839 1.0 0.32639 0.56250 0.50000 1.0000 + Co Co840 1.0 0.36806 0.60417 0.50000 1.0000 + Co Co841 1.0 0.95139 0.10417 0.50000 1.0000 + Co Co842 1.0 0.99306 0.14583 0.50000 1.0000 + Co Co843 1.0 0.03472 0.18750 0.50000 1.0000 + Co Co844 1.0 0.07639 0.22917 0.50000 1.0000 + Co Co845 1.0 0.11806 0.27083 0.50000 1.0000 + Co Co846 1.0 0.15972 0.31250 0.50000 1.0000 + Co Co847 1.0 0.20139 0.35417 0.50000 1.0000 + Co Co848 1.0 0.24306 0.39583 0.50000 1.0000 + Co Co849 1.0 0.28472 0.43750 0.50000 1.0000 + Co Co850 1.0 0.32639 0.47917 0.50000 1.0000 + Co Co851 1.0 0.36806 0.52083 0.50000 1.0000 + Co Co852 1.0 0.40972 0.56250 0.50000 1.0000 + Co Co853 1.0 0.99306 0.06250 0.50000 1.0000 + Co Co854 1.0 0.03472 0.10417 0.50000 1.0000 + Co Co855 1.0 0.07639 0.14583 0.50000 1.0000 + Co Co856 1.0 0.11806 0.18750 0.50000 1.0000 + Co Co857 1.0 0.15972 0.22917 0.50000 1.0000 + Co Co858 1.0 0.20139 0.27083 0.50000 1.0000 + Co Co859 1.0 0.24306 0.31250 0.50000 1.0000 + Co Co860 1.0 0.28472 0.35417 0.50000 1.0000 + Co Co861 1.0 0.32639 0.39583 0.50000 1.0000 + Co Co862 1.0 0.36806 0.43750 0.50000 1.0000 + Co Co863 1.0 0.40972 0.47917 0.50000 1.0000 + Co Co864 1.0 0.45139 0.52083 0.50000 1.0000 + Te Te145 1.0 0.55556 0.50000 0.50000 1.0000 + Te Te146 1.0 0.59722 0.54167 0.50000 1.0000 + Te Te147 1.0 0.63889 0.58333 0.50000 1.0000 + Te Te148 1.0 0.68056 0.62500 0.50000 1.0000 + Te Te149 1.0 0.72222 0.66667 0.50000 1.0000 + Te Te150 1.0 0.76389 0.70833 0.50000 1.0000 + Te Te151 1.0 0.80556 0.75000 0.50000 1.0000 + Te Te152 1.0 0.84722 0.79167 0.50000 1.0000 + Te Te153 1.0 0.88889 0.83333 0.50000 1.0000 + Te Te154 1.0 0.93056 0.87500 0.50000 1.0000 + Te Te155 1.0 0.97222 0.91667 0.50000 1.0000 + Te Te156 1.0 0.01389 0.95833 0.50000 1.0000 + Te Te157 1.0 0.59722 0.45833 0.50000 1.0000 + Te Te158 1.0 0.63889 0.50000 0.50000 1.0000 + Te Te159 1.0 0.68056 0.54167 0.50000 1.0000 + Te Te160 1.0 0.72222 0.58333 0.50000 1.0000 + Te Te161 1.0 0.76389 0.62500 0.50000 1.0000 + Te Te162 1.0 0.80556 0.66667 0.50000 1.0000 + Te Te163 1.0 0.84722 0.70833 0.50000 1.0000 + Te Te164 1.0 0.88889 0.75000 0.50000 1.0000 + Te Te165 1.0 0.93056 0.79167 0.50000 1.0000 + Te Te166 1.0 0.97222 0.83333 0.50000 1.0000 + Te Te167 1.0 0.01389 0.87500 0.50000 1.0000 + Te Te168 1.0 0.05556 0.91667 0.50000 1.0000 + Te Te169 1.0 0.63889 0.41667 0.50000 1.0000 + Te Te170 1.0 0.68056 0.45833 0.50000 1.0000 + Te Te171 1.0 0.72222 0.50000 0.50000 1.0000 + Te Te172 1.0 0.76389 0.54167 0.50000 1.0000 + Te Te173 1.0 0.80556 0.58333 0.50000 1.0000 + Te Te174 1.0 0.84722 0.62500 0.50000 1.0000 + Te Te175 1.0 0.88889 0.66667 0.50000 1.0000 + Te Te176 1.0 0.93056 0.70833 0.50000 1.0000 + Te Te177 1.0 0.97222 0.75000 0.50000 1.0000 + Te Te178 1.0 0.01389 0.79167 0.50000 1.0000 + Te Te179 1.0 0.05556 0.83333 0.50000 1.0000 + Te Te180 1.0 0.09722 0.87500 0.50000 1.0000 + Te Te181 1.0 0.68056 0.37500 0.50000 1.0000 + Te Te182 1.0 0.72222 0.41667 0.50000 1.0000 + Te Te183 1.0 0.76389 0.45833 0.50000 1.0000 + Te Te184 1.0 0.80556 0.50000 0.50000 1.0000 + Te Te185 1.0 0.84722 0.54167 0.50000 1.0000 + Te Te186 1.0 0.88889 0.58333 0.50000 1.0000 + Te Te187 1.0 0.93056 0.62500 0.50000 1.0000 + Te Te188 1.0 0.97222 0.66667 0.50000 1.0000 + Te Te189 1.0 0.01389 0.70833 0.50000 1.0000 + Te Te190 1.0 0.05556 0.75000 0.50000 1.0000 + Te Te191 1.0 0.09722 0.79167 0.50000 1.0000 + Te Te192 1.0 0.13889 0.83333 0.50000 1.0000 + Te Te193 1.0 0.72222 0.33333 0.50000 1.0000 + Te Te194 1.0 0.76389 0.37500 0.50000 1.0000 + Te Te195 1.0 0.80556 0.41667 0.50000 1.0000 + Te Te196 1.0 0.84722 0.45833 0.50000 1.0000 + Te Te197 1.0 0.88889 0.50000 0.50000 1.0000 + Te Te198 1.0 0.93056 0.54167 0.50000 1.0000 + Te Te199 1.0 0.97222 0.58333 0.50000 1.0000 + Te Te200 1.0 0.01389 0.62500 0.50000 1.0000 + Te Te201 1.0 0.05556 0.66667 0.50000 1.0000 + Te Te202 1.0 0.09722 0.70833 0.50000 1.0000 + Te Te203 1.0 0.13889 0.75000 0.50000 1.0000 + Te Te204 1.0 0.18056 0.79167 0.50000 1.0000 + Te Te205 1.0 0.76389 0.29167 0.50000 1.0000 + Te Te206 1.0 0.80556 0.33333 0.50000 1.0000 + Te Te207 1.0 0.84722 0.37500 0.50000 1.0000 + Te Te208 1.0 0.88889 0.41667 0.50000 1.0000 + Te Te209 1.0 0.93056 0.45833 0.50000 1.0000 + Te Te210 1.0 0.97222 0.50000 0.50000 1.0000 + Te Te211 1.0 0.01389 0.54167 0.50000 1.0000 + Te Te212 1.0 0.05556 0.58333 0.50000 1.0000 + Te Te213 1.0 0.09722 0.62500 0.50000 1.0000 + Te Te214 1.0 0.13889 0.66667 0.50000 1.0000 + Te Te215 1.0 0.18056 0.70833 0.50000 1.0000 + Te Te216 1.0 0.22222 0.75000 0.50000 1.0000 + Te Te217 1.0 0.80556 0.25000 0.50000 1.0000 + Te Te218 1.0 0.84722 0.29167 0.50000 1.0000 + Te Te219 1.0 0.88889 0.33333 0.50000 1.0000 + Te Te220 1.0 0.93056 0.37500 0.50000 1.0000 + Te Te221 1.0 0.97222 0.41667 0.50000 1.0000 + Te Te222 1.0 0.01389 0.45833 0.50000 1.0000 + Te Te223 1.0 0.05556 0.50000 0.50000 1.0000 + Te Te224 1.0 0.09722 0.54167 0.50000 1.0000 + Te Te225 1.0 0.13889 0.58333 0.50000 1.0000 + Te Te226 1.0 0.18056 0.62500 0.50000 1.0000 + Te Te227 1.0 0.22222 0.66667 0.50000 1.0000 + Te Te228 1.0 0.26389 0.70833 0.50000 1.0000 + Te Te229 1.0 0.84722 0.20833 0.50000 1.0000 + Te Te230 1.0 0.88889 0.25000 0.50000 1.0000 + Te Te231 1.0 0.93056 0.29167 0.50000 1.0000 + Te Te232 1.0 0.97222 0.33333 0.50000 1.0000 + Te Te233 1.0 0.01389 0.37500 0.50000 1.0000 + Te Te234 1.0 0.05556 0.41667 0.50000 1.0000 + Te Te235 1.0 0.09722 0.45833 0.50000 1.0000 + Te Te236 1.0 0.13889 0.50000 0.50000 1.0000 + Te Te237 1.0 0.18056 0.54167 0.50000 1.0000 + Te Te238 1.0 0.22222 0.58333 0.50000 1.0000 + Te Te239 1.0 0.26389 0.62500 0.50000 1.0000 + Te Te240 1.0 0.30556 0.66667 0.50000 1.0000 + Te Te241 1.0 0.88889 0.16667 0.50000 1.0000 + Te Te242 1.0 0.93056 0.20833 0.50000 1.0000 + Te Te243 1.0 0.97222 0.25000 0.50000 1.0000 + Te Te244 1.0 0.01389 0.29167 0.50000 1.0000 + Te Te245 1.0 0.05556 0.33333 0.50000 1.0000 + Te Te246 1.0 0.09722 0.37500 0.50000 1.0000 + Te Te247 1.0 0.13889 0.41667 0.50000 1.0000 + Te Te248 1.0 0.18056 0.45833 0.50000 1.0000 + Te Te249 1.0 0.22222 0.50000 0.50000 1.0000 + Te Te250 1.0 0.26389 0.54167 0.50000 1.0000 + Te Te251 1.0 0.30556 0.58333 0.50000 1.0000 + Te Te252 1.0 0.34722 0.62500 0.50000 1.0000 + Te Te253 1.0 0.93056 0.12500 0.50000 1.0000 + Te Te254 1.0 0.97222 0.16667 0.50000 1.0000 + Te Te255 1.0 0.01389 0.20833 0.50000 1.0000 + Te Te256 1.0 0.05556 0.25000 0.50000 1.0000 + Te Te257 1.0 0.09722 0.29167 0.50000 1.0000 + Te Te258 1.0 0.13889 0.33333 0.50000 1.0000 + Te Te259 1.0 0.18056 0.37500 0.50000 1.0000 + Te Te260 1.0 0.22222 0.41667 0.50000 1.0000 + Te Te261 1.0 0.26389 0.45833 0.50000 1.0000 + Te Te262 1.0 0.30556 0.50000 0.50000 1.0000 + Te Te263 1.0 0.34722 0.54167 0.50000 1.0000 + Te Te264 1.0 0.38889 0.58333 0.50000 1.0000 + Te Te265 1.0 0.97222 0.08333 0.50000 1.0000 + Te Te266 1.0 0.01389 0.12500 0.50000 1.0000 + Te Te267 1.0 0.05556 0.16667 0.50000 1.0000 + Te Te268 1.0 0.09722 0.20833 0.50000 1.0000 + Te Te269 1.0 0.13889 0.25000 0.50000 1.0000 + Te Te270 1.0 0.18056 0.29167 0.50000 1.0000 + Te Te271 1.0 0.22222 0.33333 0.50000 1.0000 + Te Te272 1.0 0.26389 0.37500 0.50000 1.0000 + Te Te273 1.0 0.30556 0.41667 0.50000 1.0000 + Te Te274 1.0 0.34722 0.45833 0.50000 1.0000 + Te Te275 1.0 0.38889 0.50000 0.50000 1.0000 + Te Te276 1.0 0.43056 0.54167 0.50000 1.0000 + Te Te277 1.0 0.01389 0.04167 0.50000 1.0000 + Te Te278 1.0 0.05556 0.08333 0.50000 1.0000 + Te Te279 1.0 0.09722 0.12500 0.50000 1.0000 + Te Te280 1.0 0.13889 0.16667 0.50000 1.0000 + Te Te281 1.0 0.18056 0.20833 0.50000 1.0000 + Te Te282 1.0 0.22222 0.25000 0.50000 1.0000 + Te Te283 1.0 0.26389 0.29167 0.50000 1.0000 + Te Te284 1.0 0.30556 0.33333 0.50000 1.0000 + Te Te285 1.0 0.34722 0.37500 0.50000 1.0000 + Te Te286 1.0 0.38889 0.41667 0.50000 1.0000 + Te Te287 1.0 0.43056 0.45833 0.50000 1.0000 + Te Te288 1.0 0.47222 0.50000 0.50000 1.0000 + O O1153 1.0 0.54883 0.47982 0.33101 1.0000 + O O1154 1.0 0.59050 0.52149 0.33101 1.0000 + O O1155 1.0 0.63216 0.56316 0.33101 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--- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-4919_supercell_12x12x1.cif @@ -0,0 +1,3481 @@ +data_image0 +_chemical_formula_structural Co432Ni144O1152Co432Ni144O1152 +_chemical_formula_sum "Co864 Ni288 O2304" +_cell_length_a 116.604 +_cell_length_b 67.3213 +_cell_length_c 5.95807 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Co Co1 1.0 0.02083 0.02083 0.50000 1.0000 + Co Co2 1.0 0.06250 0.06250 0.50000 1.0000 + Co Co3 1.0 0.10417 0.10417 0.50000 1.0000 + Co Co4 1.0 0.64583 0.64583 0.50000 1.0000 + Co Co5 1.0 0.18750 0.18750 0.50000 1.0000 + Co Co6 1.0 0.72917 0.72917 0.50000 1.0000 + Co Co7 1.0 0.77083 0.77083 0.50000 1.0000 + Co Co8 1.0 0.81250 0.81250 0.50000 1.0000 + Co 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Co Co423 1.0 0.56250 0.60417 0.50000 1.0000 + Co Co424 1.0 0.60417 0.64583 0.50000 1.0000 + Co Co425 1.0 0.64583 0.68750 0.50000 1.0000 + Co Co426 1.0 0.68750 0.72917 0.50000 1.0000 + Co Co427 1.0 0.72917 0.77083 0.50000 1.0000 + Co Co428 1.0 0.77083 0.81250 0.50000 1.0000 + Co Co429 1.0 0.81250 0.85417 0.50000 1.0000 + Co Co430 1.0 0.85417 0.89583 0.50000 1.0000 + Co Co431 1.0 0.89583 0.93750 0.50000 1.0000 + Co Co432 1.0 0.93750 0.97917 0.50000 1.0000 + Ni Ni1 1.0 0.00000 0.00000 0.50000 1.0000 + Ni Ni2 1.0 0.54167 0.54167 0.50000 1.0000 + Ni Ni3 1.0 0.58333 0.58333 0.50000 1.0000 + Ni Ni4 1.0 0.12500 0.12500 0.50000 1.0000 + Ni Ni5 1.0 0.16667 0.16667 0.50000 1.0000 + Ni Ni6 1.0 0.70833 0.70833 0.50000 1.0000 + Ni Ni7 1.0 0.25000 0.25000 0.50000 1.0000 + Ni Ni8 1.0 0.79167 0.79167 0.50000 1.0000 + Ni Ni9 1.0 0.83333 0.83333 0.50000 1.0000 + Ni Ni10 1.0 0.37500 0.37500 0.50000 1.0000 + Ni Ni11 1.0 0.41667 0.41667 0.50000 1.0000 + Ni Ni12 1.0 0.95833 0.95833 0.50000 1.0000 + Ni Ni13 1.0 0.04167 0.95833 0.50000 1.0000 + Ni Ni14 1.0 0.08333 0.00000 0.50000 1.0000 + Ni Ni15 1.0 0.12500 0.04167 0.50000 1.0000 + Ni Ni16 1.0 0.16667 0.08333 0.50000 1.0000 + Ni Ni17 1.0 0.20833 0.12500 0.50000 1.0000 + Ni Ni18 1.0 0.25000 0.16667 0.50000 1.0000 + Ni Ni19 1.0 0.29167 0.20833 0.50000 1.0000 + Ni Ni20 1.0 0.33333 0.25000 0.50000 1.0000 + Ni Ni21 1.0 0.37500 0.29167 0.50000 1.0000 + Ni Ni22 1.0 0.41667 0.33333 0.50000 1.0000 + Ni Ni23 1.0 0.45833 0.37500 0.50000 1.0000 + Ni Ni24 1.0 0.50000 0.41667 0.50000 1.0000 + Ni Ni25 1.0 0.08333 0.91667 0.50000 1.0000 + Ni Ni26 1.0 0.12500 0.95833 0.50000 1.0000 + Ni Ni27 1.0 0.16667 0.00000 0.50000 1.0000 + Ni Ni28 1.0 0.20833 0.04167 0.50000 1.0000 + Ni Ni29 1.0 0.25000 0.08333 0.50000 1.0000 + Ni Ni30 1.0 0.29167 0.12500 0.50000 1.0000 + Ni Ni31 1.0 0.33333 0.16667 0.50000 1.0000 + Ni Ni32 1.0 0.37500 0.20833 0.50000 1.0000 + Ni Ni33 1.0 0.41667 0.25000 0.50000 1.0000 + Ni Ni34 1.0 0.45833 0.29167 0.50000 1.0000 + Ni Ni35 1.0 0.50000 0.33333 0.50000 1.0000 + Ni Ni36 1.0 0.54167 0.37500 0.50000 1.0000 + Ni Ni37 1.0 0.12500 0.87500 0.50000 1.0000 + Ni Ni38 1.0 0.16667 0.91667 0.50000 1.0000 + Ni Ni39 1.0 0.20833 0.95833 0.50000 1.0000 + Ni Ni40 1.0 0.25000 0.00000 0.50000 1.0000 + Ni Ni41 1.0 0.29167 0.04167 0.50000 1.0000 + Ni Ni42 1.0 0.33333 0.08333 0.50000 1.0000 + Ni Ni43 1.0 0.37500 0.12500 0.50000 1.0000 + Ni Ni44 1.0 0.41667 0.16667 0.50000 1.0000 + Ni Ni45 1.0 0.45833 0.20833 0.50000 1.0000 + Ni Ni46 1.0 0.50000 0.25000 0.50000 1.0000 + Ni Ni47 1.0 0.54167 0.29167 0.50000 1.0000 + Ni Ni48 1.0 0.58333 0.33333 0.50000 1.0000 + Ni Ni49 1.0 0.16667 0.83333 0.50000 1.0000 + Ni Ni50 1.0 0.20833 0.87500 0.50000 1.0000 + Ni Ni51 1.0 0.25000 0.91667 0.50000 1.0000 + Ni Ni52 1.0 0.29167 0.95833 0.50000 1.0000 + Ni Ni53 1.0 0.33333 0.00000 0.50000 1.0000 + Ni Ni54 1.0 0.37500 0.04167 0.50000 1.0000 + Ni Ni55 1.0 0.41667 0.08333 0.50000 1.0000 + Ni Ni56 1.0 0.45833 0.12500 0.50000 1.0000 + Ni Ni57 1.0 0.50000 0.16667 0.50000 1.0000 + Ni Ni58 1.0 0.54167 0.20833 0.50000 1.0000 + Ni Ni59 1.0 0.58333 0.25000 0.50000 1.0000 + Ni Ni60 1.0 0.62500 0.29167 0.50000 1.0000 + Ni Ni61 1.0 0.20833 0.79167 0.50000 1.0000 + Ni Ni62 1.0 0.25000 0.83333 0.50000 1.0000 + Ni Ni63 1.0 0.29167 0.87500 0.50000 1.0000 + Ni Ni64 1.0 0.33333 0.91667 0.50000 1.0000 + Ni Ni65 1.0 0.37500 0.95833 0.50000 1.0000 + Ni Ni66 1.0 0.41667 1.00000 0.50000 1.0000 + Ni Ni67 1.0 0.45833 0.04167 0.50000 1.0000 + Ni Ni68 1.0 0.50000 0.08333 0.50000 1.0000 + Ni Ni69 1.0 0.54167 0.12500 0.50000 1.0000 + Ni Ni70 1.0 0.58333 0.16667 0.50000 1.0000 + Ni Ni71 1.0 0.62500 0.20833 0.50000 1.0000 + Ni Ni72 1.0 0.66667 0.25000 0.50000 1.0000 + Ni Ni73 1.0 0.25000 0.75000 0.50000 1.0000 + Ni Ni74 1.0 0.29167 0.79167 0.50000 1.0000 + Ni Ni75 1.0 0.33333 0.83333 0.50000 1.0000 + Ni Ni76 1.0 0.37500 0.87500 0.50000 1.0000 + Ni Ni77 1.0 0.41667 0.91667 0.50000 1.0000 + Ni Ni78 1.0 0.45833 0.95833 0.50000 1.0000 + Ni Ni79 1.0 0.50000 0.00000 0.50000 1.0000 + Ni Ni80 1.0 0.54167 0.04167 0.50000 1.0000 + Ni Ni81 1.0 0.58333 0.08333 0.50000 1.0000 + Ni Ni82 1.0 0.62500 0.12500 0.50000 1.0000 + Ni Ni83 1.0 0.66667 0.16667 0.50000 1.0000 + Ni Ni84 1.0 0.70833 0.20833 0.50000 1.0000 + Ni Ni85 1.0 0.29167 0.70833 0.50000 1.0000 + Ni Ni86 1.0 0.33333 0.75000 0.50000 1.0000 + Ni Ni87 1.0 0.37500 0.79167 0.50000 1.0000 + Ni Ni88 1.0 0.41667 0.83333 0.50000 1.0000 + Ni Ni89 1.0 0.45833 0.87500 0.50000 1.0000 + Ni Ni90 1.0 0.50000 0.91667 0.50000 1.0000 + Ni Ni91 1.0 0.54167 0.95833 0.50000 1.0000 + Ni Ni92 1.0 0.58333 1.00000 0.50000 1.0000 + Ni Ni93 1.0 0.62500 0.04167 0.50000 1.0000 + Ni Ni94 1.0 0.66667 0.08333 0.50000 1.0000 + Ni Ni95 1.0 0.70833 0.12500 0.50000 1.0000 + Ni Ni96 1.0 0.75000 0.16667 0.50000 1.0000 + Ni Ni97 1.0 0.33333 0.66667 0.50000 1.0000 + Ni Ni98 1.0 0.37500 0.70833 0.50000 1.0000 + Ni Ni99 1.0 0.41667 0.75000 0.50000 1.0000 + Ni Ni100 1.0 0.45833 0.79167 0.50000 1.0000 + Ni Ni101 1.0 0.50000 0.83333 0.50000 1.0000 + Ni Ni102 1.0 0.54167 0.87500 0.50000 1.0000 + Ni Ni103 1.0 0.58333 0.91667 0.50000 1.0000 + Ni Ni104 1.0 0.62500 0.95833 0.50000 1.0000 + Ni Ni105 1.0 0.66667 1.00000 0.50000 1.0000 + Ni Ni106 1.0 0.70833 0.04167 0.50000 1.0000 + Ni Ni107 1.0 0.75000 0.08333 0.50000 1.0000 + Ni Ni108 1.0 0.79167 0.12500 0.50000 1.0000 + Ni Ni109 1.0 0.37500 0.62500 0.50000 1.0000 + Ni Ni110 1.0 0.41667 0.66667 0.50000 1.0000 + Ni Ni111 1.0 0.45833 0.70833 0.50000 1.0000 + Ni Ni112 1.0 0.50000 0.75000 0.50000 1.0000 + Ni Ni113 1.0 0.54167 0.79167 0.50000 1.0000 + Ni Ni114 1.0 0.58333 0.83333 0.50000 1.0000 + Ni Ni115 1.0 0.62500 0.87500 0.50000 1.0000 + Ni Ni116 1.0 0.66667 0.91667 0.50000 1.0000 + Ni Ni117 1.0 0.70833 0.95833 0.50000 1.0000 + Ni Ni118 1.0 0.75000 0.00000 0.50000 1.0000 + Ni Ni119 1.0 0.79167 0.04167 0.50000 1.0000 + Ni Ni120 1.0 0.83333 0.08333 0.50000 1.0000 + Ni Ni121 1.0 0.41667 0.58333 0.50000 1.0000 + Ni Ni122 1.0 0.45833 0.62500 0.50000 1.0000 + Ni Ni123 1.0 0.50000 0.66667 0.50000 1.0000 + Ni Ni124 1.0 0.54167 0.70833 0.50000 1.0000 + Ni Ni125 1.0 0.58333 0.75000 0.50000 1.0000 + Ni Ni126 1.0 0.62500 0.79167 0.50000 1.0000 + Ni Ni127 1.0 0.66667 0.83333 0.50000 1.0000 + Ni Ni128 1.0 0.70833 0.87500 0.50000 1.0000 + Ni Ni129 1.0 0.75000 0.91667 0.50000 1.0000 + Ni Ni130 1.0 0.79167 0.95833 0.50000 1.0000 + Ni Ni131 1.0 0.83333 1.00000 0.50000 1.0000 + Ni Ni132 1.0 0.87500 0.04167 0.50000 1.0000 + Ni Ni133 1.0 0.45833 0.54167 0.50000 1.0000 + Ni Ni134 1.0 0.50000 0.58333 0.50000 1.0000 + Ni Ni135 1.0 0.54167 0.62500 0.50000 1.0000 + Ni Ni136 1.0 0.58333 0.66667 0.50000 1.0000 + Ni Ni137 1.0 0.62500 0.70833 0.50000 1.0000 + Ni Ni138 1.0 0.66667 0.75000 0.50000 1.0000 + Ni Ni139 1.0 0.70833 0.79167 0.50000 1.0000 + Ni Ni140 1.0 0.75000 0.83333 0.50000 1.0000 + Ni Ni141 1.0 0.79167 0.87500 0.50000 1.0000 + Ni Ni142 1.0 0.83333 0.91667 0.50000 1.0000 + Ni Ni143 1.0 0.87500 0.95833 0.50000 1.0000 + Ni Ni144 1.0 0.91667 0.00000 0.50000 1.0000 + O O1 1.0 0.03475 0.02092 0.33908 1.0000 + O O2 1.0 0.07642 0.06259 0.33908 1.0000 + O O3 1.0 0.11809 0.10426 0.33908 1.0000 + O O4 1.0 0.15975 0.14592 0.33908 1.0000 + O O5 1.0 0.20142 0.18759 0.33908 1.0000 + O O6 1.0 0.24309 0.22926 0.33908 1.0000 + O O7 1.0 0.28475 0.27092 0.33908 1.0000 + O O8 1.0 0.32642 0.31259 0.33908 1.0000 + O O9 1.0 0.36809 0.35426 0.33908 1.0000 + O O10 1.0 0.40975 0.39592 0.33908 1.0000 + O O11 1.0 0.45142 0.43759 0.33908 1.0000 + O O12 1.0 0.49309 0.47926 0.33908 1.0000 + O O13 1.0 0.07642 0.97926 0.33908 1.0000 + O O14 1.0 0.11809 0.02092 0.33908 1.0000 + O O15 1.0 0.15975 0.06259 0.33908 1.0000 + O O16 1.0 0.20142 0.10426 0.33908 1.0000 + O O17 1.0 0.24309 0.14592 0.33908 1.0000 + O O18 1.0 0.28475 0.18759 0.33908 1.0000 + O O19 1.0 0.32642 0.22926 0.33908 1.0000 + O O20 1.0 0.36809 0.27092 0.33908 1.0000 + O O21 1.0 0.40975 0.31259 0.33908 1.0000 + O O22 1.0 0.45142 0.35426 0.33908 1.0000 + O O23 1.0 0.49309 0.39592 0.33908 1.0000 + O O24 1.0 0.53475 0.43759 0.33908 1.0000 + O O25 1.0 0.11809 0.93759 0.33908 1.0000 + O O26 1.0 0.15975 0.97926 0.33908 1.0000 + O O27 1.0 0.20142 0.02092 0.33908 1.0000 + O O28 1.0 0.24309 0.06259 0.33908 1.0000 + O O29 1.0 0.28475 0.10426 0.33908 1.0000 + O O30 1.0 0.32642 0.14592 0.33908 1.0000 + O O31 1.0 0.36809 0.18759 0.33908 1.0000 + O O32 1.0 0.40975 0.22926 0.33908 1.0000 + O O33 1.0 0.45142 0.27092 0.33908 1.0000 + O O34 1.0 0.49309 0.31259 0.33908 1.0000 + O O35 1.0 0.53475 0.35426 0.33908 1.0000 + O O36 1.0 0.57642 0.39592 0.33908 1.0000 + O O37 1.0 0.15975 0.89592 0.33908 1.0000 + O O38 1.0 0.20142 0.93759 0.33908 1.0000 + O O39 1.0 0.24309 0.97926 0.33908 1.0000 + O O40 1.0 0.28475 0.02092 0.33908 1.0000 + O O41 1.0 0.32642 0.06259 0.33908 1.0000 + O O42 1.0 0.36809 0.10426 0.33908 1.0000 + O O43 1.0 0.40975 0.14592 0.33908 1.0000 + O O44 1.0 0.45142 0.18759 0.33908 1.0000 + O O45 1.0 0.49309 0.22926 0.33908 1.0000 + O O46 1.0 0.53475 0.27092 0.33908 1.0000 + O O47 1.0 0.57642 0.31259 0.33908 1.0000 + O O48 1.0 0.61809 0.35426 0.33908 1.0000 + O O49 1.0 0.20142 0.85426 0.33908 1.0000 + O O50 1.0 0.24309 0.89592 0.33908 1.0000 + O O51 1.0 0.28475 0.93759 0.33908 1.0000 + O O52 1.0 0.32642 0.97926 0.33908 1.0000 + O O53 1.0 0.36809 0.02092 0.33908 1.0000 + O O54 1.0 0.40975 0.06259 0.33908 1.0000 + O O55 1.0 0.45142 0.10426 0.33908 1.0000 + O O56 1.0 0.49309 0.14592 0.33908 1.0000 + O O57 1.0 0.53475 0.18759 0.33908 1.0000 + O O58 1.0 0.57642 0.22926 0.33908 1.0000 + O O59 1.0 0.61809 0.27092 0.33908 1.0000 + O O60 1.0 0.65975 0.31259 0.33908 1.0000 + O O61 1.0 0.24309 0.81259 0.33908 1.0000 + O O62 1.0 0.28475 0.85426 0.33908 1.0000 + O O63 1.0 0.32642 0.89592 0.33908 1.0000 + O O64 1.0 0.36809 0.93759 0.33908 1.0000 + O O65 1.0 0.40975 0.97926 0.33908 1.0000 + O O66 1.0 0.45142 0.02092 0.33908 1.0000 + O O67 1.0 0.49309 0.06259 0.33908 1.0000 + O O68 1.0 0.53475 0.10426 0.33908 1.0000 + O O69 1.0 0.57642 0.14592 0.33908 1.0000 + O O70 1.0 0.61809 0.18759 0.33908 1.0000 + O O71 1.0 0.65975 0.22926 0.33908 1.0000 + O O72 1.0 0.70142 0.27092 0.33908 1.0000 + O O73 1.0 0.28475 0.77092 0.33908 1.0000 + O O74 1.0 0.32642 0.81259 0.33908 1.0000 + O O75 1.0 0.36809 0.85426 0.33908 1.0000 + O O76 1.0 0.40975 0.89592 0.33908 1.0000 + O O77 1.0 0.45142 0.93759 0.33908 1.0000 + O O78 1.0 0.49309 0.97926 0.33908 1.0000 + O O79 1.0 0.53475 0.02092 0.33908 1.0000 + O O80 1.0 0.57642 0.06259 0.33908 1.0000 + O O81 1.0 0.61809 0.10426 0.33908 1.0000 + O O82 1.0 0.65975 0.14592 0.33908 1.0000 + O O83 1.0 0.70142 0.18759 0.33908 1.0000 + O O84 1.0 0.74309 0.22926 0.33908 1.0000 + O O85 1.0 0.32642 0.72926 0.33908 1.0000 + O O86 1.0 0.36809 0.77092 0.33908 1.0000 + O O87 1.0 0.40975 0.81259 0.33908 1.0000 + O O88 1.0 0.45142 0.85426 0.33908 1.0000 + O O89 1.0 0.49309 0.89592 0.33908 1.0000 + O O90 1.0 0.53475 0.93759 0.33908 1.0000 + O O91 1.0 0.57642 0.97926 0.33908 1.0000 + O O92 1.0 0.61809 0.02092 0.33908 1.0000 + O O93 1.0 0.65975 0.06259 0.33908 1.0000 + O O94 1.0 0.70142 0.10426 0.33908 1.0000 + O O95 1.0 0.74309 0.14592 0.33908 1.0000 + O O96 1.0 0.78475 0.18759 0.33908 1.0000 + O O97 1.0 0.36809 0.68759 0.33908 1.0000 + O O98 1.0 0.40975 0.72926 0.33908 1.0000 + O O99 1.0 0.45142 0.77092 0.33908 1.0000 + O O100 1.0 0.49309 0.81259 0.33908 1.0000 + O O101 1.0 0.53475 0.85426 0.33908 1.0000 + O O102 1.0 0.57642 0.89592 0.33908 1.0000 + O O103 1.0 0.61809 0.93759 0.33908 1.0000 + O O104 1.0 0.65975 0.97926 0.33908 1.0000 + O O105 1.0 0.70142 0.02092 0.33908 1.0000 + O O106 1.0 0.74309 0.06259 0.33908 1.0000 + O O107 1.0 0.78475 0.10426 0.33908 1.0000 + O O108 1.0 0.82642 0.14592 0.33908 1.0000 + O O109 1.0 0.40975 0.64592 0.33908 1.0000 + O O110 1.0 0.45142 0.68759 0.33908 1.0000 + O O111 1.0 0.49309 0.72926 0.33908 1.0000 + O O112 1.0 0.53475 0.77092 0.33908 1.0000 + O O113 1.0 0.57642 0.81259 0.33908 1.0000 + O O114 1.0 0.61809 0.85426 0.33908 1.0000 + O O115 1.0 0.65975 0.89592 0.33908 1.0000 + O O116 1.0 0.70142 0.93759 0.33908 1.0000 + O 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Co Co653 1.0 0.95833 0.41667 0.50000 1.0000 + Co Co654 1.0 0.00000 0.45833 0.50000 1.0000 + Co Co655 1.0 0.04167 0.50000 0.50000 1.0000 + Co Co656 1.0 0.08333 0.54167 0.50000 1.0000 + Co Co657 1.0 0.12500 0.58333 0.50000 1.0000 + Co Co658 1.0 0.16667 0.62500 0.50000 1.0000 + Co Co659 1.0 0.20833 0.66667 0.50000 1.0000 + Co Co660 1.0 0.25000 0.70833 0.50000 1.0000 + Co Co661 1.0 0.83333 0.20833 0.50000 1.0000 + Co Co662 1.0 0.87500 0.25000 0.50000 1.0000 + Co Co663 1.0 0.91667 0.29167 0.50000 1.0000 + Co Co664 1.0 0.95833 0.33333 0.50000 1.0000 + Co Co665 1.0 0.00000 0.37500 0.50000 1.0000 + Co Co666 1.0 0.04167 0.41667 0.50000 1.0000 + Co Co667 1.0 0.08333 0.45833 0.50000 1.0000 + Co Co668 1.0 0.12500 0.50000 0.50000 1.0000 + Co Co669 1.0 0.16667 0.54167 0.50000 1.0000 + Co Co670 1.0 0.20833 0.58333 0.50000 1.0000 + Co Co671 1.0 0.25000 0.62500 0.50000 1.0000 + Co Co672 1.0 0.29167 0.66667 0.50000 1.0000 + Co Co673 1.0 0.87500 0.16667 0.50000 1.0000 + Co Co674 1.0 0.91667 0.20833 0.50000 1.0000 + Co Co675 1.0 0.95833 0.25000 0.50000 1.0000 + Co Co676 1.0 0.00000 0.29167 0.50000 1.0000 + Co Co677 1.0 0.04167 0.33333 0.50000 1.0000 + Co Co678 1.0 0.08333 0.37500 0.50000 1.0000 + Co Co679 1.0 0.12500 0.41667 0.50000 1.0000 + Co Co680 1.0 0.16667 0.45833 0.50000 1.0000 + Co Co681 1.0 0.20833 0.50000 0.50000 1.0000 + Co Co682 1.0 0.25000 0.54167 0.50000 1.0000 + Co Co683 1.0 0.29167 0.58333 0.50000 1.0000 + Co Co684 1.0 0.33333 0.62500 0.50000 1.0000 + Co Co685 1.0 0.91667 0.12500 0.50000 1.0000 + Co Co686 1.0 0.95833 0.16667 0.50000 1.0000 + Co Co687 1.0 0.00000 0.20833 0.50000 1.0000 + Co Co688 1.0 0.04167 0.25000 0.50000 1.0000 + Co Co689 1.0 0.08333 0.29167 0.50000 1.0000 + Co Co690 1.0 0.12500 0.33333 0.50000 1.0000 + Co Co691 1.0 0.16667 0.37500 0.50000 1.0000 + Co Co692 1.0 0.20833 0.41667 0.50000 1.0000 + Co Co693 1.0 0.25000 0.45833 0.50000 1.0000 + Co Co694 1.0 0.29167 0.50000 0.50000 1.0000 + Co Co695 1.0 0.33333 0.54167 0.50000 1.0000 + Co Co696 1.0 0.37500 0.58333 0.50000 1.0000 + Co Co697 1.0 0.95833 0.08333 0.50000 1.0000 + Co Co698 1.0 0.00000 0.12500 0.50000 1.0000 + Co Co699 1.0 0.04167 0.16667 0.50000 1.0000 + Co Co700 1.0 0.08333 0.20833 0.50000 1.0000 + Co Co701 1.0 0.12500 0.25000 0.50000 1.0000 + Co Co702 1.0 0.16667 0.29167 0.50000 1.0000 + Co Co703 1.0 0.20833 0.33333 0.50000 1.0000 + Co Co704 1.0 0.25000 0.37500 0.50000 1.0000 + Co Co705 1.0 0.29167 0.41667 0.50000 1.0000 + Co Co706 1.0 0.33333 0.45833 0.50000 1.0000 + Co Co707 1.0 0.37500 0.50000 0.50000 1.0000 + Co Co708 1.0 0.41667 0.54167 0.50000 1.0000 + Co Co709 1.0 0.00000 0.04167 0.50000 1.0000 + Co Co710 1.0 0.04167 0.08333 0.50000 1.0000 + Co Co711 1.0 0.08333 0.12500 0.50000 1.0000 + Co Co712 1.0 0.12500 0.16667 0.50000 1.0000 + Co Co713 1.0 0.16667 0.20833 0.50000 1.0000 + Co Co714 1.0 0.20833 0.25000 0.50000 1.0000 + Co Co715 1.0 0.25000 0.29167 0.50000 1.0000 + Co Co716 1.0 0.29167 0.33333 0.50000 1.0000 + Co Co717 1.0 0.33333 0.37500 0.50000 1.0000 + Co Co718 1.0 0.37500 0.41667 0.50000 1.0000 + Co Co719 1.0 0.41667 0.45833 0.50000 1.0000 + Co Co720 1.0 0.45833 0.50000 0.50000 1.0000 + Co Co721 1.0 0.52083 0.47917 0.50000 1.0000 + Co Co722 1.0 0.56250 0.52083 0.50000 1.0000 + Co Co723 1.0 0.60417 0.56250 0.50000 1.0000 + Co Co724 1.0 0.64583 0.60417 0.50000 1.0000 + Co Co725 1.0 0.68750 0.64583 0.50000 1.0000 + Co Co726 1.0 0.72917 0.68750 0.50000 1.0000 + Co Co727 1.0 0.77083 0.72917 0.50000 1.0000 + Co Co728 1.0 0.81250 0.77083 0.50000 1.0000 + Co Co729 1.0 0.85417 0.81250 0.50000 1.0000 + Co Co730 1.0 0.89583 0.85417 0.50000 1.0000 + Co Co731 1.0 0.93750 0.89583 0.50000 1.0000 + Co Co732 1.0 0.97917 0.93750 0.50000 1.0000 + Co Co733 1.0 0.56250 0.43750 0.50000 1.0000 + Co Co734 1.0 0.60417 0.47917 0.50000 1.0000 + Co Co735 1.0 0.64583 0.52083 0.50000 1.0000 + Co Co736 1.0 0.68750 0.56250 0.50000 1.0000 + Co Co737 1.0 0.72917 0.60417 0.50000 1.0000 + Co Co738 1.0 0.77083 0.64583 0.50000 1.0000 + Co Co739 1.0 0.81250 0.68750 0.50000 1.0000 + Co Co740 1.0 0.85417 0.72917 0.50000 1.0000 + Co Co741 1.0 0.89583 0.77083 0.50000 1.0000 + Co Co742 1.0 0.93750 0.81250 0.50000 1.0000 + Co Co743 1.0 0.97917 0.85417 0.50000 1.0000 + Co Co744 1.0 0.02083 0.89583 0.50000 1.0000 + Co Co745 1.0 0.60417 0.39583 0.50000 1.0000 + Co Co746 1.0 0.64583 0.43750 0.50000 1.0000 + Co Co747 1.0 0.68750 0.47917 0.50000 1.0000 + Co Co748 1.0 0.72917 0.52083 0.50000 1.0000 + Co Co749 1.0 0.77083 0.56250 0.50000 1.0000 + Co Co750 1.0 0.81250 0.60417 0.50000 1.0000 + Co Co751 1.0 0.85417 0.64583 0.50000 1.0000 + Co Co752 1.0 0.89583 0.68750 0.50000 1.0000 + Co Co753 1.0 0.93750 0.72917 0.50000 1.0000 + Co Co754 1.0 0.97917 0.77083 0.50000 1.0000 + Co Co755 1.0 0.02083 0.81250 0.50000 1.0000 + Co Co756 1.0 0.06250 0.85417 0.50000 1.0000 + Co Co757 1.0 0.64583 0.35417 0.50000 1.0000 + Co Co758 1.0 0.68750 0.39583 0.50000 1.0000 + Co Co759 1.0 0.72917 0.43750 0.50000 1.0000 + Co Co760 1.0 0.77083 0.47917 0.50000 1.0000 + Co Co761 1.0 0.81250 0.52083 0.50000 1.0000 + Co Co762 1.0 0.85417 0.56250 0.50000 1.0000 + Co Co763 1.0 0.89583 0.60417 0.50000 1.0000 + Co Co764 1.0 0.93750 0.64583 0.50000 1.0000 + Co Co765 1.0 0.97917 0.68750 0.50000 1.0000 + Co Co766 1.0 0.02083 0.72917 0.50000 1.0000 + Co Co767 1.0 0.06250 0.77083 0.50000 1.0000 + Co Co768 1.0 0.10417 0.81250 0.50000 1.0000 + Co Co769 1.0 0.68750 0.31250 0.50000 1.0000 + Co Co770 1.0 0.72917 0.35417 0.50000 1.0000 + Co Co771 1.0 0.77083 0.39583 0.50000 1.0000 + Co Co772 1.0 0.81250 0.43750 0.50000 1.0000 + Co Co773 1.0 0.85417 0.47917 0.50000 1.0000 + Co Co774 1.0 0.89583 0.52083 0.50000 1.0000 + Co Co775 1.0 0.93750 0.56250 0.50000 1.0000 + Co Co776 1.0 0.97917 0.60417 0.50000 1.0000 + Co Co777 1.0 0.02083 0.64583 0.50000 1.0000 + Co Co778 1.0 0.06250 0.68750 0.50000 1.0000 + Co Co779 1.0 0.10417 0.72917 0.50000 1.0000 + Co Co780 1.0 0.14583 0.77083 0.50000 1.0000 + Co Co781 1.0 0.72917 0.27083 0.50000 1.0000 + Co Co782 1.0 0.77083 0.31250 0.50000 1.0000 + Co Co783 1.0 0.81250 0.35417 0.50000 1.0000 + Co Co784 1.0 0.85417 0.39583 0.50000 1.0000 + Co Co785 1.0 0.89583 0.43750 0.50000 1.0000 + Co Co786 1.0 0.93750 0.47917 0.50000 1.0000 + Co Co787 1.0 0.97917 0.52083 0.50000 1.0000 + Co Co788 1.0 0.02083 0.56250 0.50000 1.0000 + Co Co789 1.0 0.06250 0.60417 0.50000 1.0000 + Co Co790 1.0 0.10417 0.64583 0.50000 1.0000 + Co Co791 1.0 0.14583 0.68750 0.50000 1.0000 + Co Co792 1.0 0.18750 0.72917 0.50000 1.0000 + Co Co793 1.0 0.77083 0.22917 0.50000 1.0000 + Co Co794 1.0 0.81250 0.27083 0.50000 1.0000 + Co Co795 1.0 0.85417 0.31250 0.50000 1.0000 + Co Co796 1.0 0.89583 0.35417 0.50000 1.0000 + Co Co797 1.0 0.93750 0.39583 0.50000 1.0000 + Co Co798 1.0 0.97917 0.43750 0.50000 1.0000 + Co Co799 1.0 0.02083 0.47917 0.50000 1.0000 + Co Co800 1.0 0.06250 0.52083 0.50000 1.0000 + Co Co801 1.0 0.10417 0.56250 0.50000 1.0000 + Co Co802 1.0 0.14583 0.60417 0.50000 1.0000 + Co Co803 1.0 0.18750 0.64583 0.50000 1.0000 + Co Co804 1.0 0.22917 0.68750 0.50000 1.0000 + Co Co805 1.0 0.81250 0.18750 0.50000 1.0000 + Co Co806 1.0 0.85417 0.22917 0.50000 1.0000 + Co Co807 1.0 0.89583 0.27083 0.50000 1.0000 + Co Co808 1.0 0.93750 0.31250 0.50000 1.0000 + Co Co809 1.0 0.97917 0.35417 0.50000 1.0000 + Co Co810 1.0 0.02083 0.39583 0.50000 1.0000 + Co Co811 1.0 0.06250 0.43750 0.50000 1.0000 + Co Co812 1.0 0.10417 0.47917 0.50000 1.0000 + Co Co813 1.0 0.14583 0.52083 0.50000 1.0000 + Co Co814 1.0 0.18750 0.56250 0.50000 1.0000 + Co Co815 1.0 0.22917 0.60417 0.50000 1.0000 + Co Co816 1.0 0.27083 0.64583 0.50000 1.0000 + Co Co817 1.0 0.85417 0.14583 0.50000 1.0000 + Co Co818 1.0 0.89583 0.18750 0.50000 1.0000 + Co Co819 1.0 0.93750 0.22917 0.50000 1.0000 + Co Co820 1.0 0.97917 0.27083 0.50000 1.0000 + Co Co821 1.0 0.02083 0.31250 0.50000 1.0000 + Co Co822 1.0 0.06250 0.35417 0.50000 1.0000 + Co Co823 1.0 0.10417 0.39583 0.50000 1.0000 + Co Co824 1.0 0.14583 0.43750 0.50000 1.0000 + Co Co825 1.0 0.18750 0.47917 0.50000 1.0000 + Co Co826 1.0 0.22917 0.52083 0.50000 1.0000 + Co Co827 1.0 0.27083 0.56250 0.50000 1.0000 + Co Co828 1.0 0.31250 0.60417 0.50000 1.0000 + Co Co829 1.0 0.89583 0.10417 0.50000 1.0000 + Co Co830 1.0 0.93750 0.14583 0.50000 1.0000 + Co Co831 1.0 0.97917 0.18750 0.50000 1.0000 + Co Co832 1.0 0.02083 0.22917 0.50000 1.0000 + Co Co833 1.0 0.06250 0.27083 0.50000 1.0000 + Co Co834 1.0 0.10417 0.31250 0.50000 1.0000 + Co Co835 1.0 0.14583 0.35417 0.50000 1.0000 + Co Co836 1.0 0.18750 0.39583 0.50000 1.0000 + Co Co837 1.0 0.22917 0.43750 0.50000 1.0000 + Co Co838 1.0 0.27083 0.47917 0.50000 1.0000 + Co Co839 1.0 0.31250 0.52083 0.50000 1.0000 + Co Co840 1.0 0.35417 0.56250 0.50000 1.0000 + Co Co841 1.0 0.93750 0.06250 0.50000 1.0000 + Co Co842 1.0 0.97917 0.10417 0.50000 1.0000 + Co Co843 1.0 0.02083 0.14583 0.50000 1.0000 + Co Co844 1.0 0.06250 0.18750 0.50000 1.0000 + Co Co845 1.0 0.10417 0.22917 0.50000 1.0000 + Co Co846 1.0 0.14583 0.27083 0.50000 1.0000 + Co Co847 1.0 0.18750 0.31250 0.50000 1.0000 + Co Co848 1.0 0.22917 0.35417 0.50000 1.0000 + Co Co849 1.0 0.27083 0.39583 0.50000 1.0000 + Co Co850 1.0 0.31250 0.43750 0.50000 1.0000 + Co Co851 1.0 0.35417 0.47917 0.50000 1.0000 + Co Co852 1.0 0.39583 0.52083 0.50000 1.0000 + Co Co853 1.0 0.97917 0.02083 0.50000 1.0000 + Co Co854 1.0 0.02083 0.06250 0.50000 1.0000 + Co Co855 1.0 0.06250 0.10417 0.50000 1.0000 + Co Co856 1.0 0.10417 0.14583 0.50000 1.0000 + Co Co857 1.0 0.14583 0.18750 0.50000 1.0000 + Co Co858 1.0 0.18750 0.22917 0.50000 1.0000 + Co Co859 1.0 0.22917 0.27083 0.50000 1.0000 + Co Co860 1.0 0.27083 0.31250 0.50000 1.0000 + Co Co861 1.0 0.31250 0.35417 0.50000 1.0000 + Co Co862 1.0 0.35417 0.39583 0.50000 1.0000 + Co Co863 1.0 0.39583 0.43750 0.50000 1.0000 + Co Co864 1.0 0.43750 0.47917 0.50000 1.0000 + Ni Ni145 1.0 0.50000 0.50000 0.50000 1.0000 + Ni Ni146 1.0 0.04167 0.04167 0.50000 1.0000 + Ni Ni147 1.0 0.08333 0.08333 0.50000 1.0000 + Ni Ni148 1.0 0.62500 0.62500 0.50000 1.0000 + Ni Ni149 1.0 0.66667 0.66667 0.50000 1.0000 + Ni Ni150 1.0 0.20833 0.20833 0.50000 1.0000 + Ni Ni151 1.0 0.75000 0.75000 0.50000 1.0000 + Ni Ni152 1.0 0.29167 0.29167 0.50000 1.0000 + Ni Ni153 1.0 0.33333 0.33333 0.50000 1.0000 + Ni Ni154 1.0 0.87500 0.87500 0.50000 1.0000 + Ni Ni155 1.0 0.91667 0.91667 0.50000 1.0000 + Ni Ni156 1.0 0.45833 0.45833 0.50000 1.0000 + Ni Ni157 1.0 0.54167 0.45833 0.50000 1.0000 + Ni Ni158 1.0 0.58333 0.50000 0.50000 1.0000 + Ni Ni159 1.0 0.62500 0.54167 0.50000 1.0000 + Ni Ni160 1.0 0.66667 0.58333 0.50000 1.0000 + Ni Ni161 1.0 0.70833 0.62500 0.50000 1.0000 + Ni Ni162 1.0 0.75000 0.66667 0.50000 1.0000 + Ni Ni163 1.0 0.79167 0.70833 0.50000 1.0000 + Ni Ni164 1.0 0.83333 0.75000 0.50000 1.0000 + Ni Ni165 1.0 0.87500 0.79167 0.50000 1.0000 + Ni Ni166 1.0 0.91667 0.83333 0.50000 1.0000 + Ni Ni167 1.0 0.95833 0.87500 0.50000 1.0000 + Ni Ni168 1.0 1.00000 0.91667 0.50000 1.0000 + Ni Ni169 1.0 0.58333 0.41667 0.50000 1.0000 + Ni Ni170 1.0 0.62500 0.45833 0.50000 1.0000 + Ni Ni171 1.0 0.66667 0.50000 0.50000 1.0000 + Ni Ni172 1.0 0.70833 0.54167 0.50000 1.0000 + Ni Ni173 1.0 0.75000 0.58333 0.50000 1.0000 + Ni Ni174 1.0 0.79167 0.62500 0.50000 1.0000 + Ni Ni175 1.0 0.83333 0.66667 0.50000 1.0000 + Ni Ni176 1.0 0.87500 0.70833 0.50000 1.0000 + Ni Ni177 1.0 0.91667 0.75000 0.50000 1.0000 + Ni Ni178 1.0 0.95833 0.79167 0.50000 1.0000 + Ni Ni179 1.0 0.00000 0.83333 0.50000 1.0000 + Ni Ni180 1.0 0.04167 0.87500 0.50000 1.0000 + Ni Ni181 1.0 0.62500 0.37500 0.50000 1.0000 + Ni Ni182 1.0 0.66667 0.41667 0.50000 1.0000 + Ni Ni183 1.0 0.70833 0.45833 0.50000 1.0000 + Ni Ni184 1.0 0.75000 0.50000 0.50000 1.0000 + Ni Ni185 1.0 0.79167 0.54167 0.50000 1.0000 + Ni Ni186 1.0 0.83333 0.58333 0.50000 1.0000 + Ni Ni187 1.0 0.87500 0.62500 0.50000 1.0000 + Ni Ni188 1.0 0.91667 0.66667 0.50000 1.0000 + Ni Ni189 1.0 0.95833 0.70833 0.50000 1.0000 + Ni Ni190 1.0 0.00000 0.75000 0.50000 1.0000 + Ni Ni191 1.0 0.04167 0.79167 0.50000 1.0000 + Ni Ni192 1.0 0.08333 0.83333 0.50000 1.0000 + Ni Ni193 1.0 0.66667 0.33333 0.50000 1.0000 + Ni Ni194 1.0 0.70833 0.37500 0.50000 1.0000 + Ni Ni195 1.0 0.75000 0.41667 0.50000 1.0000 + Ni Ni196 1.0 0.79167 0.45833 0.50000 1.0000 + Ni Ni197 1.0 0.83333 0.50000 0.50000 1.0000 + Ni Ni198 1.0 0.87500 0.54167 0.50000 1.0000 + Ni Ni199 1.0 0.91667 0.58333 0.50000 1.0000 + Ni Ni200 1.0 0.95833 0.62500 0.50000 1.0000 + Ni Ni201 1.0 0.00000 0.66667 0.50000 1.0000 + Ni Ni202 1.0 0.04167 0.70833 0.50000 1.0000 + Ni Ni203 1.0 0.08333 0.75000 0.50000 1.0000 + Ni Ni204 1.0 0.12500 0.79167 0.50000 1.0000 + Ni Ni205 1.0 0.70833 0.29167 0.50000 1.0000 + Ni Ni206 1.0 0.75000 0.33333 0.50000 1.0000 + Ni Ni207 1.0 0.79167 0.37500 0.50000 1.0000 + Ni Ni208 1.0 0.83333 0.41667 0.50000 1.0000 + Ni Ni209 1.0 0.87500 0.45833 0.50000 1.0000 + Ni Ni210 1.0 0.91667 0.50000 0.50000 1.0000 + Ni Ni211 1.0 0.95833 0.54167 0.50000 1.0000 + Ni Ni212 1.0 0.00000 0.58333 0.50000 1.0000 + Ni Ni213 1.0 0.04167 0.62500 0.50000 1.0000 + Ni Ni214 1.0 0.08333 0.66667 0.50000 1.0000 + Ni Ni215 1.0 0.12500 0.70833 0.50000 1.0000 + Ni Ni216 1.0 0.16667 0.75000 0.50000 1.0000 + Ni Ni217 1.0 0.75000 0.25000 0.50000 1.0000 + Ni Ni218 1.0 0.79167 0.29167 0.50000 1.0000 + Ni Ni219 1.0 0.83333 0.33333 0.50000 1.0000 + Ni Ni220 1.0 0.87500 0.37500 0.50000 1.0000 + Ni Ni221 1.0 0.91667 0.41667 0.50000 1.0000 + Ni Ni222 1.0 0.95833 0.45833 0.50000 1.0000 + Ni Ni223 1.0 0.00000 0.50000 0.50000 1.0000 + Ni Ni224 1.0 0.04167 0.54167 0.50000 1.0000 + Ni Ni225 1.0 0.08333 0.58333 0.50000 1.0000 + Ni Ni226 1.0 0.12500 0.62500 0.50000 1.0000 + Ni Ni227 1.0 0.16667 0.66667 0.50000 1.0000 + Ni Ni228 1.0 0.20833 0.70833 0.50000 1.0000 + Ni Ni229 1.0 0.79167 0.20833 0.50000 1.0000 + Ni Ni230 1.0 0.83333 0.25000 0.50000 1.0000 + Ni Ni231 1.0 0.87500 0.29167 0.50000 1.0000 + Ni Ni232 1.0 0.91667 0.33333 0.50000 1.0000 + Ni Ni233 1.0 0.95833 0.37500 0.50000 1.0000 + Ni Ni234 1.0 0.00000 0.41667 0.50000 1.0000 + Ni Ni235 1.0 0.04167 0.45833 0.50000 1.0000 + Ni Ni236 1.0 0.08333 0.50000 0.50000 1.0000 + Ni Ni237 1.0 0.12500 0.54167 0.50000 1.0000 + Ni Ni238 1.0 0.16667 0.58333 0.50000 1.0000 + Ni Ni239 1.0 0.20833 0.62500 0.50000 1.0000 + Ni Ni240 1.0 0.25000 0.66667 0.50000 1.0000 + Ni Ni241 1.0 0.83333 0.16667 0.50000 1.0000 + Ni Ni242 1.0 0.87500 0.20833 0.50000 1.0000 + Ni Ni243 1.0 0.91667 0.25000 0.50000 1.0000 + Ni Ni244 1.0 0.95833 0.29167 0.50000 1.0000 + Ni Ni245 1.0 1.00000 0.33333 0.50000 1.0000 + Ni Ni246 1.0 0.04167 0.37500 0.50000 1.0000 + Ni Ni247 1.0 0.08333 0.41667 0.50000 1.0000 + Ni Ni248 1.0 0.12500 0.45833 0.50000 1.0000 + Ni Ni249 1.0 0.16667 0.50000 0.50000 1.0000 + Ni Ni250 1.0 0.20833 0.54167 0.50000 1.0000 + Ni Ni251 1.0 0.25000 0.58333 0.50000 1.0000 + Ni Ni252 1.0 0.29167 0.62500 0.50000 1.0000 + Ni Ni253 1.0 0.87500 0.12500 0.50000 1.0000 + Ni Ni254 1.0 0.91667 0.16667 0.50000 1.0000 + Ni Ni255 1.0 0.95833 0.20833 0.50000 1.0000 + Ni Ni256 1.0 0.00000 0.25000 0.50000 1.0000 + Ni Ni257 1.0 0.04167 0.29167 0.50000 1.0000 + Ni Ni258 1.0 0.08333 0.33333 0.50000 1.0000 + Ni Ni259 1.0 0.12500 0.37500 0.50000 1.0000 + Ni Ni260 1.0 0.16667 0.41667 0.50000 1.0000 + Ni Ni261 1.0 0.20833 0.45833 0.50000 1.0000 + Ni Ni262 1.0 0.25000 0.50000 0.50000 1.0000 + Ni Ni263 1.0 0.29167 0.54167 0.50000 1.0000 + Ni Ni264 1.0 0.33333 0.58333 0.50000 1.0000 + Ni Ni265 1.0 0.91667 0.08333 0.50000 1.0000 + Ni Ni266 1.0 0.95833 0.12500 0.50000 1.0000 + Ni Ni267 1.0 0.00000 0.16667 0.50000 1.0000 + Ni Ni268 1.0 0.04167 0.20833 0.50000 1.0000 + Ni Ni269 1.0 0.08333 0.25000 0.50000 1.0000 + Ni Ni270 1.0 0.12500 0.29167 0.50000 1.0000 + Ni Ni271 1.0 0.16667 0.33333 0.50000 1.0000 + Ni Ni272 1.0 0.20833 0.37500 0.50000 1.0000 + Ni Ni273 1.0 0.25000 0.41667 0.50000 1.0000 + Ni Ni274 1.0 0.29167 0.45833 0.50000 1.0000 + Ni Ni275 1.0 0.33333 0.50000 0.50000 1.0000 + Ni Ni276 1.0 0.37500 0.54167 0.50000 1.0000 + Ni Ni277 1.0 0.95833 0.04167 0.50000 1.0000 + Ni Ni278 1.0 0.00000 0.08333 0.50000 1.0000 + Ni Ni279 1.0 0.04167 0.12500 0.50000 1.0000 + Ni Ni280 1.0 0.08333 0.16667 0.50000 1.0000 + Ni Ni281 1.0 0.12500 0.20833 0.50000 1.0000 + Ni Ni282 1.0 0.16667 0.25000 0.50000 1.0000 + Ni Ni283 1.0 0.20833 0.29167 0.50000 1.0000 + Ni Ni284 1.0 0.25000 0.33333 0.50000 1.0000 + Ni Ni285 1.0 0.29167 0.37500 0.50000 1.0000 + Ni Ni286 1.0 0.33333 0.41667 0.50000 1.0000 + Ni Ni287 1.0 0.37500 0.45833 0.50000 1.0000 + Ni Ni288 1.0 0.41667 0.50000 0.50000 1.0000 + O O1153 1.0 0.53475 0.52092 0.33908 1.0000 + O O1154 1.0 0.57642 0.56259 0.33908 1.0000 + O O1155 1.0 0.61809 0.60426 0.33908 1.0000 + O O1156 1.0 0.65975 0.64592 0.33908 1.0000 + O O1157 1.0 0.70142 0.68759 0.33908 1.0000 + O O1158 1.0 0.74309 0.72926 0.33908 1.0000 + O O1159 1.0 0.78475 0.77092 0.33908 1.0000 + O O1160 1.0 0.82642 0.81259 0.33908 1.0000 + O O1161 1.0 0.86809 0.85426 0.33908 1.0000 + O O1162 1.0 0.90975 0.89592 0.33908 1.0000 + O O1163 1.0 0.95142 0.93759 0.33908 1.0000 + O O1164 1.0 0.99309 0.97926 0.33908 1.0000 + O O1165 1.0 0.57642 0.47926 0.33908 1.0000 + O O1166 1.0 0.61809 0.52092 0.33908 1.0000 + O O1167 1.0 0.65975 0.56259 0.33908 1.0000 + O O1168 1.0 0.70142 0.60426 0.33908 1.0000 + O O1169 1.0 0.74309 0.64592 0.33908 1.0000 + O O1170 1.0 0.78475 0.68759 0.33908 1.0000 + O O1171 1.0 0.82642 0.72926 0.33908 1.0000 + O O1172 1.0 0.86809 0.77092 0.33908 1.0000 + O O1173 1.0 0.90975 0.81259 0.33908 1.0000 + O O1174 1.0 0.95142 0.85426 0.33908 1.0000 + O O1175 1.0 0.99309 0.89592 0.33908 1.0000 + O O1176 1.0 0.03475 0.93759 0.33908 1.0000 + O O1177 1.0 0.61809 0.43759 0.33908 1.0000 + O O1178 1.0 0.65975 0.47926 0.33908 1.0000 + O O1179 1.0 0.70142 0.52092 0.33908 1.0000 + O O1180 1.0 0.74309 0.56259 0.33908 1.0000 + O O1181 1.0 0.78475 0.60426 0.33908 1.0000 + O O1182 1.0 0.82642 0.64592 0.33908 1.0000 + O O1183 1.0 0.86809 0.68759 0.33908 1.0000 + O O1184 1.0 0.90975 0.72926 0.33908 1.0000 + O O1185 1.0 0.95142 0.77092 0.33908 1.0000 + O O1186 1.0 0.99309 0.81259 0.33908 1.0000 + O O1187 1.0 0.03475 0.85426 0.33908 1.0000 + O O1188 1.0 0.07642 0.89592 0.33908 1.0000 + O O1189 1.0 0.65975 0.39592 0.33908 1.0000 + O O1190 1.0 0.70142 0.43759 0.33908 1.0000 + O O1191 1.0 0.74309 0.47926 0.33908 1.0000 + O O1192 1.0 0.78475 0.52092 0.33908 1.0000 + O O1193 1.0 0.82642 0.56259 0.33908 1.0000 + O O1194 1.0 0.86809 0.60426 0.33908 1.0000 + O O1195 1.0 0.90975 0.64592 0.33908 1.0000 + O O1196 1.0 0.95142 0.68759 0.33908 1.0000 + O O1197 1.0 0.99309 0.72926 0.33908 1.0000 + O O1198 1.0 0.03475 0.77092 0.33908 1.0000 + O O1199 1.0 0.07642 0.81259 0.33908 1.0000 + O O1200 1.0 0.11809 0.85426 0.33908 1.0000 + O O1201 1.0 0.70142 0.35426 0.33908 1.0000 + O O1202 1.0 0.74309 0.39592 0.33908 1.0000 + O O1203 1.0 0.78475 0.43759 0.33908 1.0000 + O O1204 1.0 0.82642 0.47926 0.33908 1.0000 + O O1205 1.0 0.86809 0.52092 0.33908 1.0000 + O O1206 1.0 0.90975 0.56259 0.33908 1.0000 + O O1207 1.0 0.95142 0.60426 0.33908 1.0000 + O O1208 1.0 0.99309 0.64592 0.33908 1.0000 + O O1209 1.0 0.03475 0.68759 0.33908 1.0000 + O O1210 1.0 0.07642 0.72926 0.33908 1.0000 + O O1211 1.0 0.11809 0.77092 0.33908 1.0000 + O O1212 1.0 0.15975 0.81259 0.33908 1.0000 + O O1213 1.0 0.74309 0.31259 0.33908 1.0000 + O O1214 1.0 0.78475 0.35426 0.33908 1.0000 + O O1215 1.0 0.82642 0.39592 0.33908 1.0000 + O O1216 1.0 0.86809 0.43759 0.33908 1.0000 + O O1217 1.0 0.90975 0.47926 0.33908 1.0000 + O O1218 1.0 0.95142 0.52092 0.33908 1.0000 + O O1219 1.0 0.99309 0.56259 0.33908 1.0000 + O O1220 1.0 0.03475 0.60426 0.33908 1.0000 + O O1221 1.0 0.07642 0.64592 0.33908 1.0000 + O O1222 1.0 0.11809 0.68759 0.33908 1.0000 + O O1223 1.0 0.15975 0.72926 0.33908 1.0000 + O O1224 1.0 0.20142 0.77092 0.33908 1.0000 + O O1225 1.0 0.78475 0.27092 0.33908 1.0000 + O O1226 1.0 0.82642 0.31259 0.33908 1.0000 + O O1227 1.0 0.86809 0.35426 0.33908 1.0000 + O O1228 1.0 0.90975 0.39592 0.33908 1.0000 + O O1229 1.0 0.95142 0.43759 0.33908 1.0000 + O O1230 1.0 0.99309 0.47926 0.33908 1.0000 + O O1231 1.0 0.03475 0.52092 0.33908 1.0000 + O O1232 1.0 0.07642 0.56259 0.33908 1.0000 + O O1233 1.0 0.11809 0.60426 0.33908 1.0000 + O O1234 1.0 0.15975 0.64592 0.33908 1.0000 + O O1235 1.0 0.20142 0.68759 0.33908 1.0000 + O O1236 1.0 0.24309 0.72926 0.33908 1.0000 + O O1237 1.0 0.82642 0.22926 0.33908 1.0000 + O O1238 1.0 0.86809 0.27092 0.33908 1.0000 + O O1239 1.0 0.90975 0.31259 0.33908 1.0000 + O O1240 1.0 0.95142 0.35426 0.33908 1.0000 + O O1241 1.0 0.99309 0.39592 0.33908 1.0000 + O O1242 1.0 0.03475 0.43759 0.33908 1.0000 + O O1243 1.0 0.07642 0.47926 0.33908 1.0000 + O O1244 1.0 0.11809 0.52092 0.33908 1.0000 + O O1245 1.0 0.15975 0.56259 0.33908 1.0000 + O O1246 1.0 0.20142 0.60426 0.33908 1.0000 + O O1247 1.0 0.24309 0.64592 0.33908 1.0000 + O O1248 1.0 0.28475 0.68759 0.33908 1.0000 + O O1249 1.0 0.86809 0.18759 0.33908 1.0000 + O O1250 1.0 0.90975 0.22926 0.33908 1.0000 + O O1251 1.0 0.95142 0.27092 0.33908 1.0000 + O O1252 1.0 0.99309 0.31259 0.33908 1.0000 + O O1253 1.0 0.03475 0.35426 0.33908 1.0000 + O O1254 1.0 0.07642 0.39592 0.33908 1.0000 + O O1255 1.0 0.11809 0.43759 0.33908 1.0000 + O O1256 1.0 0.15975 0.47926 0.33908 1.0000 + O O1257 1.0 0.20142 0.52092 0.33908 1.0000 + O O1258 1.0 0.24309 0.56259 0.33908 1.0000 + O O1259 1.0 0.28475 0.60426 0.33908 1.0000 + O O1260 1.0 0.32642 0.64592 0.33908 1.0000 + O O1261 1.0 0.90975 0.14592 0.33908 1.0000 + O O1262 1.0 0.95142 0.18759 0.33908 1.0000 + O O1263 1.0 0.99309 0.22926 0.33908 1.0000 + O O1264 1.0 0.03475 0.27092 0.33908 1.0000 + O O1265 1.0 0.07642 0.31259 0.33908 1.0000 + O O1266 1.0 0.11809 0.35426 0.33908 1.0000 + O O1267 1.0 0.15975 0.39592 0.33908 1.0000 + O O1268 1.0 0.20142 0.43759 0.33908 1.0000 + O O1269 1.0 0.24309 0.47926 0.33908 1.0000 + O O1270 1.0 0.28475 0.52092 0.33908 1.0000 + O O1271 1.0 0.32642 0.56259 0.33908 1.0000 + O O1272 1.0 0.36809 0.60426 0.33908 1.0000 + O O1273 1.0 0.95142 0.10426 0.33908 1.0000 + O O1274 1.0 0.99309 0.14592 0.33908 1.0000 + O O1275 1.0 0.03475 0.18759 0.33908 1.0000 + O O1276 1.0 0.07642 0.22926 0.33908 1.0000 + O O1277 1.0 0.11809 0.27092 0.33908 1.0000 + O O1278 1.0 0.15975 0.31259 0.33908 1.0000 + O O1279 1.0 0.20142 0.35426 0.33908 1.0000 + O O1280 1.0 0.24309 0.39592 0.33908 1.0000 + O O1281 1.0 0.28475 0.43759 0.33908 1.0000 + O O1282 1.0 0.32642 0.47926 0.33908 1.0000 + O O1283 1.0 0.36809 0.52092 0.33908 1.0000 + O O1284 1.0 0.40975 0.56259 0.33908 1.0000 + O O1285 1.0 0.99309 0.06259 0.33908 1.0000 + O O1286 1.0 0.03475 0.10426 0.33908 1.0000 + O O1287 1.0 0.07642 0.14592 0.33908 1.0000 + O O1288 1.0 0.11809 0.18759 0.33908 1.0000 + O O1289 1.0 0.15975 0.22926 0.33908 1.0000 + O O1290 1.0 0.20142 0.27092 0.33908 1.0000 + O O1291 1.0 0.24309 0.31259 0.33908 1.0000 + O O1292 1.0 0.28475 0.35426 0.33908 1.0000 + O O1293 1.0 0.32642 0.39592 0.33908 1.0000 + O O1294 1.0 0.36809 0.43759 0.33908 1.0000 + O O1295 1.0 0.40975 0.47926 0.33908 1.0000 + O O1296 1.0 0.45142 0.52092 0.33908 1.0000 + O O1297 1.0 0.51383 0.50000 0.33908 1.0000 + O O1298 1.0 0.55550 0.54167 0.33908 1.0000 + O O1299 1.0 0.59716 0.58333 0.33908 1.0000 + O O1300 1.0 0.63883 0.62500 0.33908 1.0000 + O O1301 1.0 0.68050 0.66667 0.33908 1.0000 + O O1302 1.0 0.72216 0.70833 0.33908 1.0000 + O O1303 1.0 0.76383 0.75000 0.33908 1.0000 + O O1304 1.0 0.80550 0.79167 0.33908 1.0000 + O O1305 1.0 0.84716 0.83333 0.33908 1.0000 + O O1306 1.0 0.88883 0.87500 0.33908 1.0000 + O O1307 1.0 0.93050 0.91667 0.33908 1.0000 + O O1308 1.0 0.97216 0.95833 0.33908 1.0000 + O O1309 1.0 0.55550 0.45833 0.33908 1.0000 + O O1310 1.0 0.59716 0.50000 0.33908 1.0000 + O O1311 1.0 0.63883 0.54167 0.33908 1.0000 + O O1312 1.0 0.68050 0.58333 0.33908 1.0000 + O O1313 1.0 0.72216 0.62500 0.33908 1.0000 + O O1314 1.0 0.76383 0.66667 0.33908 1.0000 + O O1315 1.0 0.80550 0.70833 0.33908 1.0000 + O O1316 1.0 0.84716 0.75000 0.33908 1.0000 + O O1317 1.0 0.88883 0.79167 0.33908 1.0000 + O O1318 1.0 0.93050 0.83333 0.33908 1.0000 + O O1319 1.0 0.97216 0.87500 0.33908 1.0000 + O O1320 1.0 0.01383 0.91667 0.33908 1.0000 + O O1321 1.0 0.59716 0.41667 0.33908 1.0000 + O O1322 1.0 0.63883 0.45833 0.33908 1.0000 + O O1323 1.0 0.68050 0.50000 0.33908 1.0000 + O O1324 1.0 0.72216 0.54167 0.33908 1.0000 + O O1325 1.0 0.76383 0.58333 0.33908 1.0000 + O O1326 1.0 0.80550 0.62500 0.33908 1.0000 + O O1327 1.0 0.84716 0.66667 0.33908 1.0000 + O O1328 1.0 0.88883 0.70833 0.33908 1.0000 + O O1329 1.0 0.93050 0.75000 0.33908 1.0000 + O O1330 1.0 0.97216 0.79167 0.33908 1.0000 + O O1331 1.0 0.01383 0.83333 0.33908 1.0000 + O O1332 1.0 0.05550 0.87500 0.33908 1.0000 + O O1333 1.0 0.63883 0.37500 0.33908 1.0000 + O O1334 1.0 0.68050 0.41667 0.33908 1.0000 + O O1335 1.0 0.72216 0.45833 0.33908 1.0000 + O O1336 1.0 0.76383 0.50000 0.33908 1.0000 + O O1337 1.0 0.80550 0.54167 0.33908 1.0000 + O O1338 1.0 0.84716 0.58333 0.33908 1.0000 + O O1339 1.0 0.88883 0.62500 0.33908 1.0000 + O O1340 1.0 0.93050 0.66667 0.33908 1.0000 + O O1341 1.0 0.97216 0.70833 0.33908 1.0000 + O O1342 1.0 0.01383 0.75000 0.33908 1.0000 + O O1343 1.0 0.05550 0.79167 0.33908 1.0000 + O O1344 1.0 0.09716 0.83333 0.33908 1.0000 + O O1345 1.0 0.68050 0.33333 0.33908 1.0000 + O O1346 1.0 0.72216 0.37500 0.33908 1.0000 + O O1347 1.0 0.76383 0.41667 0.33908 1.0000 + O O1348 1.0 0.80550 0.45833 0.33908 1.0000 + O O1349 1.0 0.84716 0.50000 0.33908 1.0000 + O O1350 1.0 0.88883 0.54167 0.33908 1.0000 + O O1351 1.0 0.93050 0.58333 0.33908 1.0000 + O O1352 1.0 0.97216 0.62500 0.33908 1.0000 + O O1353 1.0 0.01383 0.66667 0.33908 1.0000 + O O1354 1.0 0.05550 0.70833 0.33908 1.0000 + O O1355 1.0 0.09716 0.75000 0.33908 1.0000 + O O1356 1.0 0.13883 0.79167 0.33908 1.0000 + O O1357 1.0 0.72216 0.29167 0.33908 1.0000 + O O1358 1.0 0.76383 0.33333 0.33908 1.0000 + O O1359 1.0 0.80550 0.37500 0.33908 1.0000 + O O1360 1.0 0.84716 0.41667 0.33908 1.0000 + O O1361 1.0 0.88883 0.45833 0.33908 1.0000 + O O1362 1.0 0.93050 0.50000 0.33908 1.0000 + O O1363 1.0 0.97216 0.54167 0.33908 1.0000 + O O1364 1.0 0.01383 0.58333 0.33908 1.0000 + O O1365 1.0 0.05550 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1.0000 + O O1014 1.0 0.95511 0.35416 0.66386 1.0000 + O O1015 1.0 0.95511 0.41666 0.66386 1.0000 + O O1016 1.0 0.95511 0.47916 0.66386 1.0000 + O O1017 1.0 0.95511 0.54166 0.66386 1.0000 + O O1018 1.0 0.95511 0.60416 0.66386 1.0000 + O O1019 1.0 0.95511 0.66666 0.66386 1.0000 + O O1020 1.0 0.95511 0.72916 0.66386 1.0000 + O O1021 1.0 0.95511 0.79166 0.66386 1.0000 + O O1022 1.0 0.95511 0.85416 0.66386 1.0000 + O O1023 1.0 0.95511 0.91666 0.66386 1.0000 + O O1024 1.0 0.95511 0.97916 0.66386 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-5004_supercell_16x16x1.cif b/tier3/cif_file/orthogonal_2dm-5004_supercell_16x16x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..3bbb1fd5d3c8277a576541a953c43499b190c356 --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-5004_supercell_16x16x1.cif @@ -0,0 +1,1049 @@ +data_image0 +_chemical_formula_structural Cu256H256O512 +_chemical_formula_sum "Cu256 H256 O512" +_cell_length_a 44.2723 +_cell_length_b 70.5584 +_cell_length_c 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1.0 0.81250 0.60931 0.59993 1.0000 + O O475 1.0 0.81250 0.67181 0.59993 1.0000 + O O476 1.0 0.81250 0.73431 0.59993 1.0000 + O O477 1.0 0.81250 0.79681 0.59993 1.0000 + O O478 1.0 0.81250 0.85931 0.59993 1.0000 + O O479 1.0 0.81250 0.92181 0.59993 1.0000 + O O480 1.0 0.81250 0.98431 0.59993 1.0000 + O O481 1.0 0.87500 0.04681 0.59993 1.0000 + O O482 1.0 0.87500 0.10931 0.59993 1.0000 + O O483 1.0 0.87500 0.17181 0.59993 1.0000 + O O484 1.0 0.87500 0.23431 0.59993 1.0000 + O O485 1.0 0.87500 0.29681 0.59993 1.0000 + O O486 1.0 0.87500 0.35931 0.59993 1.0000 + O O487 1.0 0.87500 0.42181 0.59993 1.0000 + O O488 1.0 0.87500 0.48431 0.59993 1.0000 + O O489 1.0 0.87500 0.54681 0.59993 1.0000 + O O490 1.0 0.87500 0.60931 0.59993 1.0000 + O O491 1.0 0.87500 0.67181 0.59993 1.0000 + O O492 1.0 0.87500 0.73431 0.59993 1.0000 + O O493 1.0 0.87500 0.79681 0.59993 1.0000 + O O494 1.0 0.87500 0.85931 0.59993 1.0000 + O O495 1.0 0.87500 0.92181 0.59993 1.0000 + O O496 1.0 0.87500 0.98431 0.59993 1.0000 + O O497 1.0 0.93750 0.04681 0.59993 1.0000 + O O498 1.0 0.93750 0.10931 0.59993 1.0000 + O O499 1.0 0.93750 0.17181 0.59993 1.0000 + O O500 1.0 0.93750 0.23431 0.59993 1.0000 + O O501 1.0 0.93750 0.29681 0.59993 1.0000 + O O502 1.0 0.93750 0.35931 0.59993 1.0000 + O O503 1.0 0.93750 0.42181 0.59993 1.0000 + O O504 1.0 0.93750 0.48431 0.59993 1.0000 + O O505 1.0 0.93750 0.54681 0.59993 1.0000 + O O506 1.0 0.93750 0.60931 0.59993 1.0000 + O O507 1.0 0.93750 0.67181 0.59993 1.0000 + O O508 1.0 0.93750 0.73431 0.59993 1.0000 + O O509 1.0 0.93750 0.79681 0.59993 1.0000 + O O510 1.0 0.93750 0.85931 0.59993 1.0000 + O O511 1.0 0.93750 0.92181 0.59993 1.0000 + O O512 1.0 0.93750 0.98431 0.59993 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-5057_supercell_12x12x1.cif b/tier3/cif_file/orthogonal_2dm-5057_supercell_12x12x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..3e55cc6565031d55d7dbd394df90340412c02d71 --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-5057_supercell_12x12x1.cif @@ -0,0 +1,3481 @@ +data_image0 +_chemical_formula_structural Mn432Co144O1152Mn432Co144O1152 +_chemical_formula_sum "Mn864 Co288 O2304" +_cell_length_a 121.342 +_cell_length_b 70.0569 +_cell_length_c 5.92785 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Mn Mn1 1.0 0.03472 0.97917 0.50000 1.0000 + Mn Mn2 1.0 0.07639 0.02083 0.50000 1.0000 + Mn Mn3 1.0 0.11806 0.06250 0.50000 1.0000 + Mn Mn4 1.0 0.15972 0.10417 0.50000 1.0000 + Mn Mn5 1.0 0.20139 0.14583 0.50000 1.0000 + Mn Mn6 1.0 0.24306 0.18750 0.50000 1.0000 + Mn Mn7 1.0 0.28472 0.22917 0.50000 1.0000 + Mn Mn8 1.0 0.32639 0.27083 0.50000 1.0000 + Mn Mn9 1.0 0.36806 0.31250 0.50000 1.0000 + Mn Mn10 1.0 0.40972 0.35417 0.50000 1.0000 + Mn Mn11 1.0 0.45139 0.39583 0.50000 1.0000 + Mn Mn12 1.0 0.49306 0.43750 0.50000 1.0000 + Mn Mn13 1.0 0.07639 0.93750 0.50000 1.0000 + Mn Mn14 1.0 0.11806 0.97917 0.50000 1.0000 + Mn Mn15 1.0 0.15972 0.02083 0.50000 1.0000 + Mn Mn16 1.0 0.20139 0.06250 0.50000 1.0000 + Mn Mn17 1.0 0.24306 0.10417 0.50000 1.0000 + Mn Mn18 1.0 0.28472 0.14583 0.50000 1.0000 + Mn Mn19 1.0 0.32639 0.18750 0.50000 1.0000 + Mn Mn20 1.0 0.36806 0.22917 0.50000 1.0000 + Mn Mn21 1.0 0.40972 0.27083 0.50000 1.0000 + Mn Mn22 1.0 0.45139 0.31250 0.50000 1.0000 + Mn Mn23 1.0 0.49306 0.35417 0.50000 1.0000 + Mn Mn24 1.0 0.53472 0.39583 0.50000 1.0000 + Mn Mn25 1.0 0.11806 0.89583 0.50000 1.0000 + Mn Mn26 1.0 0.15972 0.93750 0.50000 1.0000 + Mn Mn27 1.0 0.20139 0.97917 0.50000 1.0000 + Mn Mn28 1.0 0.24306 0.02083 0.50000 1.0000 + Mn Mn29 1.0 0.28472 0.06250 0.50000 1.0000 + Mn Mn30 1.0 0.32639 0.10417 0.50000 1.0000 + Mn Mn31 1.0 0.36806 0.14583 0.50000 1.0000 + Mn Mn32 1.0 0.40972 0.18750 0.50000 1.0000 + Mn Mn33 1.0 0.45139 0.22917 0.50000 1.0000 + Mn Mn34 1.0 0.49306 0.27083 0.50000 1.0000 + Mn Mn35 1.0 0.53472 0.31250 0.50000 1.0000 + Mn Mn36 1.0 0.57639 0.35417 0.50000 1.0000 + Mn Mn37 1.0 0.15972 0.85417 0.50000 1.0000 + Mn Mn38 1.0 0.20139 0.89583 0.50000 1.0000 + Mn Mn39 1.0 0.24306 0.93750 0.50000 1.0000 + Mn Mn40 1.0 0.28472 0.97917 0.50000 1.0000 + Mn Mn41 1.0 0.32639 0.02083 0.50000 1.0000 + Mn Mn42 1.0 0.36806 0.06250 0.50000 1.0000 + Mn Mn43 1.0 0.40972 0.10417 0.50000 1.0000 + Mn Mn44 1.0 0.45139 0.14583 0.50000 1.0000 + Mn Mn45 1.0 0.49306 0.18750 0.50000 1.0000 + Mn Mn46 1.0 0.53472 0.22917 0.50000 1.0000 + Mn Mn47 1.0 0.57639 0.27083 0.50000 1.0000 + Mn Mn48 1.0 0.61806 0.31250 0.50000 1.0000 + Mn Mn49 1.0 0.20139 0.81250 0.50000 1.0000 + Mn Mn50 1.0 0.24306 0.85417 0.50000 1.0000 + Mn Mn51 1.0 0.28472 0.89583 0.50000 1.0000 + Mn Mn52 1.0 0.32639 0.93750 0.50000 1.0000 + Mn Mn53 1.0 0.36806 0.97917 0.50000 1.0000 + Mn Mn54 1.0 0.40972 0.02083 0.50000 1.0000 + Mn Mn55 1.0 0.45139 0.06250 0.50000 1.0000 + Mn Mn56 1.0 0.49306 0.10417 0.50000 1.0000 + Mn Mn57 1.0 0.53472 0.14583 0.50000 1.0000 + Mn Mn58 1.0 0.57639 0.18750 0.50000 1.0000 + Mn Mn59 1.0 0.61806 0.22917 0.50000 1.0000 + Mn Mn60 1.0 0.65972 0.27083 0.50000 1.0000 + Mn Mn61 1.0 0.24306 0.77083 0.50000 1.0000 + Mn Mn62 1.0 0.28472 0.81250 0.50000 1.0000 + Mn Mn63 1.0 0.32639 0.85417 0.50000 1.0000 + Mn Mn64 1.0 0.36806 0.89583 0.50000 1.0000 + Mn Mn65 1.0 0.40972 0.93750 0.50000 1.0000 + Mn Mn66 1.0 0.45139 0.97917 0.50000 1.0000 + Mn Mn67 1.0 0.49306 0.02083 0.50000 1.0000 + Mn Mn68 1.0 0.53472 0.06250 0.50000 1.0000 + Mn Mn69 1.0 0.57639 0.10417 0.50000 1.0000 + Mn Mn70 1.0 0.61806 0.14583 0.50000 1.0000 + Mn Mn71 1.0 0.65972 0.18750 0.50000 1.0000 + Mn Mn72 1.0 0.70139 0.22917 0.50000 1.0000 + Mn Mn73 1.0 0.28472 0.72917 0.50000 1.0000 + Mn Mn74 1.0 0.32639 0.77083 0.50000 1.0000 + Mn Mn75 1.0 0.36806 0.81250 0.50000 1.0000 + Mn Mn76 1.0 0.40972 0.85417 0.50000 1.0000 + Mn Mn77 1.0 0.45139 0.89583 0.50000 1.0000 + Mn Mn78 1.0 0.49306 0.93750 0.50000 1.0000 + Mn Mn79 1.0 0.53472 0.97917 0.50000 1.0000 + Mn Mn80 1.0 0.57639 0.02083 0.50000 1.0000 + Mn Mn81 1.0 0.61806 0.06250 0.50000 1.0000 + Mn Mn82 1.0 0.65972 0.10417 0.50000 1.0000 + Mn Mn83 1.0 0.70139 0.14583 0.50000 1.0000 + Mn Mn84 1.0 0.74306 0.18750 0.50000 1.0000 + Mn Mn85 1.0 0.32639 0.68750 0.50000 1.0000 + Mn Mn86 1.0 0.36806 0.72917 0.50000 1.0000 + Mn Mn87 1.0 0.40972 0.77083 0.50000 1.0000 + Mn Mn88 1.0 0.45139 0.81250 0.50000 1.0000 + Mn Mn89 1.0 0.49306 0.85417 0.50000 1.0000 + Mn Mn90 1.0 0.53472 0.89583 0.50000 1.0000 + Mn Mn91 1.0 0.57639 0.93750 0.50000 1.0000 + Mn Mn92 1.0 0.61806 0.97917 0.50000 1.0000 + Mn Mn93 1.0 0.65972 0.02083 0.50000 1.0000 + Mn Mn94 1.0 0.70139 0.06250 0.50000 1.0000 + Mn Mn95 1.0 0.74306 0.10417 0.50000 1.0000 + Mn Mn96 1.0 0.78472 0.14583 0.50000 1.0000 + Mn Mn97 1.0 0.36806 0.64583 0.50000 1.0000 + Mn Mn98 1.0 0.40972 0.68750 0.50000 1.0000 + Mn Mn99 1.0 0.45139 0.72917 0.50000 1.0000 + Mn Mn100 1.0 0.49306 0.77083 0.50000 1.0000 + Mn Mn101 1.0 0.53472 0.81250 0.50000 1.0000 + Mn Mn102 1.0 0.57639 0.85417 0.50000 1.0000 + Mn Mn103 1.0 0.61806 0.89583 0.50000 1.0000 + Mn Mn104 1.0 0.65972 0.93750 0.50000 1.0000 + Mn Mn105 1.0 0.70139 0.97917 0.50000 1.0000 + Mn Mn106 1.0 0.74306 0.02083 0.50000 1.0000 + Mn Mn107 1.0 0.78472 0.06250 0.50000 1.0000 + Mn Mn108 1.0 0.82639 0.10417 0.50000 1.0000 + Mn Mn109 1.0 0.40972 0.60417 0.50000 1.0000 + Mn Mn110 1.0 0.45139 0.64583 0.50000 1.0000 + Mn Mn111 1.0 0.49306 0.68750 0.50000 1.0000 + Mn Mn112 1.0 0.53472 0.72917 0.50000 1.0000 + Mn Mn113 1.0 0.57639 0.77083 0.50000 1.0000 + Mn Mn114 1.0 0.61806 0.81250 0.50000 1.0000 + Mn Mn115 1.0 0.65972 0.85417 0.50000 1.0000 + Mn Mn116 1.0 0.70139 0.89583 0.50000 1.0000 + Mn Mn117 1.0 0.74306 0.93750 0.50000 1.0000 + Mn Mn118 1.0 0.78472 0.97917 0.50000 1.0000 + Mn Mn119 1.0 0.82639 0.02083 0.50000 1.0000 + Mn Mn120 1.0 0.86806 0.06250 0.50000 1.0000 + Mn Mn121 1.0 0.45139 0.56250 0.50000 1.0000 + Mn Mn122 1.0 0.49306 0.60417 0.50000 1.0000 + Mn Mn123 1.0 0.53472 0.64583 0.50000 1.0000 + Mn Mn124 1.0 0.57639 0.68750 0.50000 1.0000 + Mn Mn125 1.0 0.61806 0.72917 0.50000 1.0000 + Mn Mn126 1.0 0.65972 0.77083 0.50000 1.0000 + Mn Mn127 1.0 0.70139 0.81250 0.50000 1.0000 + Mn Mn128 1.0 0.74306 0.85417 0.50000 1.0000 + Mn Mn129 1.0 0.78472 0.89583 0.50000 1.0000 + Mn Mn130 1.0 0.82639 0.93750 0.50000 1.0000 + Mn Mn131 1.0 0.86806 0.97917 0.50000 1.0000 + Mn Mn132 1.0 0.90972 0.02083 0.50000 1.0000 + Mn Mn133 1.0 0.49306 0.52083 0.50000 1.0000 + Mn Mn134 1.0 0.53472 0.56250 0.50000 1.0000 + Mn Mn135 1.0 0.57639 0.60417 0.50000 1.0000 + Mn Mn136 1.0 0.61806 0.64583 0.50000 1.0000 + Mn Mn137 1.0 0.65972 0.68750 0.50000 1.0000 + Mn Mn138 1.0 0.70139 0.72917 0.50000 1.0000 + Mn Mn139 1.0 0.74306 0.77083 0.50000 1.0000 + Mn Mn140 1.0 0.78472 0.81250 0.50000 1.0000 + Mn Mn141 1.0 0.82639 0.85417 0.50000 1.0000 + Mn Mn142 1.0 0.86806 0.89583 0.50000 1.0000 + Mn Mn143 1.0 0.90972 0.93750 0.50000 1.0000 + Mn Mn144 1.0 0.95139 0.97917 0.50000 1.0000 + Mn Mn145 1.0 0.01389 0.00000 0.50000 1.0000 + Mn Mn146 1.0 0.05556 0.04167 0.50000 1.0000 + Mn Mn147 1.0 0.09722 0.08333 0.50000 1.0000 + Mn Mn148 1.0 0.13889 0.12500 0.50000 1.0000 + Mn Mn149 1.0 0.18056 0.16667 0.50000 1.0000 + Mn Mn150 1.0 0.22222 0.20833 0.50000 1.0000 + Mn Mn151 1.0 0.26389 0.25000 0.50000 1.0000 + Mn Mn152 1.0 0.30556 0.29167 0.50000 1.0000 + Mn Mn153 1.0 0.34722 0.33333 0.50000 1.0000 + Mn Mn154 1.0 0.38889 0.37500 0.50000 1.0000 + Mn Mn155 1.0 0.43056 0.41667 0.50000 1.0000 + Mn Mn156 1.0 0.47222 0.45833 0.50000 1.0000 + Mn Mn157 1.0 0.05556 0.95833 0.50000 1.0000 + Mn Mn158 1.0 0.09722 0.00000 0.50000 1.0000 + Mn Mn159 1.0 0.13889 0.04167 0.50000 1.0000 + Mn Mn160 1.0 0.18056 0.08333 0.50000 1.0000 + Mn Mn161 1.0 0.22222 0.12500 0.50000 1.0000 + Mn Mn162 1.0 0.26389 0.16667 0.50000 1.0000 + Mn Mn163 1.0 0.30556 0.20833 0.50000 1.0000 + Mn Mn164 1.0 0.34722 0.25000 0.50000 1.0000 + Mn Mn165 1.0 0.38889 0.29167 0.50000 1.0000 + Mn Mn166 1.0 0.43056 0.33333 0.50000 1.0000 + Mn Mn167 1.0 0.47222 0.37500 0.50000 1.0000 + Mn Mn168 1.0 0.51389 0.41667 0.50000 1.0000 + Mn Mn169 1.0 0.09722 0.91667 0.50000 1.0000 + Mn Mn170 1.0 0.13889 0.95833 0.50000 1.0000 + Mn Mn171 1.0 0.18056 0.00000 0.50000 1.0000 + Mn Mn172 1.0 0.22222 0.04167 0.50000 1.0000 + Mn Mn173 1.0 0.26389 0.08333 0.50000 1.0000 + Mn Mn174 1.0 0.30556 0.12500 0.50000 1.0000 + Mn Mn175 1.0 0.34722 0.16667 0.50000 1.0000 + Mn Mn176 1.0 0.38889 0.20833 0.50000 1.0000 + Mn Mn177 1.0 0.43056 0.25000 0.50000 1.0000 + Mn Mn178 1.0 0.47222 0.29167 0.50000 1.0000 + Mn Mn179 1.0 0.51389 0.33333 0.50000 1.0000 + Mn Mn180 1.0 0.55556 0.37500 0.50000 1.0000 + Mn Mn181 1.0 0.13889 0.87500 0.50000 1.0000 + Mn Mn182 1.0 0.18056 0.91667 0.50000 1.0000 + Mn Mn183 1.0 0.22222 0.95833 0.50000 1.0000 + Mn Mn184 1.0 0.26389 0.00000 0.50000 1.0000 + Mn Mn185 1.0 0.30556 0.04167 0.50000 1.0000 + Mn Mn186 1.0 0.34722 0.08333 0.50000 1.0000 + Mn Mn187 1.0 0.38889 0.12500 0.50000 1.0000 + Mn Mn188 1.0 0.43056 0.16667 0.50000 1.0000 + Mn Mn189 1.0 0.47222 0.20833 0.50000 1.0000 + Mn Mn190 1.0 0.51389 0.25000 0.50000 1.0000 + Mn Mn191 1.0 0.55556 0.29167 0.50000 1.0000 + Mn Mn192 1.0 0.59722 0.33333 0.50000 1.0000 + Mn Mn193 1.0 0.18056 0.83333 0.50000 1.0000 + Mn Mn194 1.0 0.22222 0.87500 0.50000 1.0000 + Mn Mn195 1.0 0.26389 0.91667 0.50000 1.0000 + Mn Mn196 1.0 0.30556 0.95833 0.50000 1.0000 + Mn Mn197 1.0 0.34722 0.00000 0.50000 1.0000 + Mn Mn198 1.0 0.38889 0.04167 0.50000 1.0000 + Mn Mn199 1.0 0.43056 0.08333 0.50000 1.0000 + Mn Mn200 1.0 0.47222 0.12500 0.50000 1.0000 + Mn Mn201 1.0 0.51389 0.16667 0.50000 1.0000 + Mn Mn202 1.0 0.55556 0.20833 0.50000 1.0000 + Mn Mn203 1.0 0.59722 0.25000 0.50000 1.0000 + Mn Mn204 1.0 0.63889 0.29167 0.50000 1.0000 + Mn Mn205 1.0 0.22222 0.79167 0.50000 1.0000 + Mn Mn206 1.0 0.26389 0.83333 0.50000 1.0000 + Mn Mn207 1.0 0.30556 0.87500 0.50000 1.0000 + Mn Mn208 1.0 0.34722 0.91667 0.50000 1.0000 + Mn Mn209 1.0 0.38889 0.95833 0.50000 1.0000 + Mn Mn210 1.0 0.43056 0.00000 0.50000 1.0000 + Mn Mn211 1.0 0.47222 0.04167 0.50000 1.0000 + Mn Mn212 1.0 0.51389 0.08333 0.50000 1.0000 + Mn Mn213 1.0 0.55556 0.12500 0.50000 1.0000 + Mn Mn214 1.0 0.59722 0.16667 0.50000 1.0000 + Mn Mn215 1.0 0.63889 0.20833 0.50000 1.0000 + Mn Mn216 1.0 0.68056 0.25000 0.50000 1.0000 + Mn Mn217 1.0 0.26389 0.75000 0.50000 1.0000 + Mn Mn218 1.0 0.30556 0.79167 0.50000 1.0000 + Mn Mn219 1.0 0.34722 0.83333 0.50000 1.0000 + Mn Mn220 1.0 0.38889 0.87500 0.50000 1.0000 + Mn Mn221 1.0 0.43056 0.91667 0.50000 1.0000 + Mn Mn222 1.0 0.47222 0.95833 0.50000 1.0000 + Mn Mn223 1.0 0.51389 0.00000 0.50000 1.0000 + Mn Mn224 1.0 0.55556 0.04167 0.50000 1.0000 + Mn Mn225 1.0 0.59722 0.08333 0.50000 1.0000 + Mn Mn226 1.0 0.63889 0.12500 0.50000 1.0000 + Mn Mn227 1.0 0.68056 0.16667 0.50000 1.0000 + Mn Mn228 1.0 0.72222 0.20833 0.50000 1.0000 + Mn Mn229 1.0 0.30556 0.70833 0.50000 1.0000 + Mn Mn230 1.0 0.34722 0.75000 0.50000 1.0000 + Mn Mn231 1.0 0.38889 0.79167 0.50000 1.0000 + Mn Mn232 1.0 0.43056 0.83333 0.50000 1.0000 + Mn Mn233 1.0 0.47222 0.87500 0.50000 1.0000 + Mn Mn234 1.0 0.51389 0.91667 0.50000 1.0000 + Mn Mn235 1.0 0.55556 0.95833 0.50000 1.0000 + Mn Mn236 1.0 0.59722 0.00000 0.50000 1.0000 + Mn Mn237 1.0 0.63889 0.04167 0.50000 1.0000 + Mn Mn238 1.0 0.68056 0.08333 0.50000 1.0000 + Mn Mn239 1.0 0.72222 0.12500 0.50000 1.0000 + Mn Mn240 1.0 0.76389 0.16667 0.50000 1.0000 + Mn Mn241 1.0 0.34722 0.66667 0.50000 1.0000 + Mn Mn242 1.0 0.38889 0.70833 0.50000 1.0000 + Mn Mn243 1.0 0.43056 0.75000 0.50000 1.0000 + Mn Mn244 1.0 0.47222 0.79167 0.50000 1.0000 + Mn Mn245 1.0 0.51389 0.83333 0.50000 1.0000 + Mn Mn246 1.0 0.55556 0.87500 0.50000 1.0000 + Mn Mn247 1.0 0.59722 0.91667 0.50000 1.0000 + Mn Mn248 1.0 0.63889 0.95833 0.50000 1.0000 + Mn Mn249 1.0 0.68056 0.00000 0.50000 1.0000 + Mn Mn250 1.0 0.72222 0.04167 0.50000 1.0000 + Mn Mn251 1.0 0.76389 0.08333 0.50000 1.0000 + Mn Mn252 1.0 0.80556 0.12500 0.50000 1.0000 + Mn Mn253 1.0 0.38889 0.62500 0.50000 1.0000 + Mn Mn254 1.0 0.43056 0.66667 0.50000 1.0000 + Mn Mn255 1.0 0.47222 0.70833 0.50000 1.0000 + Mn Mn256 1.0 0.51389 0.75000 0.50000 1.0000 + Mn Mn257 1.0 0.55556 0.79167 0.50000 1.0000 + Mn Mn258 1.0 0.59722 0.83333 0.50000 1.0000 + Mn Mn259 1.0 0.63889 0.87500 0.50000 1.0000 + Mn Mn260 1.0 0.68056 0.91667 0.50000 1.0000 + Mn Mn261 1.0 0.72222 0.95833 0.50000 1.0000 + Mn Mn262 1.0 0.76389 0.00000 0.50000 1.0000 + Mn Mn263 1.0 0.80556 0.04167 0.50000 1.0000 + Mn Mn264 1.0 0.84722 0.08333 0.50000 1.0000 + Mn Mn265 1.0 0.43056 0.58333 0.50000 1.0000 + Mn Mn266 1.0 0.47222 0.62500 0.50000 1.0000 + Mn Mn267 1.0 0.51389 0.66667 0.50000 1.0000 + Mn Mn268 1.0 0.55556 0.70833 0.50000 1.0000 + Mn Mn269 1.0 0.59722 0.75000 0.50000 1.0000 + Mn Mn270 1.0 0.63889 0.79167 0.50000 1.0000 + Mn Mn271 1.0 0.68056 0.83333 0.50000 1.0000 + Mn Mn272 1.0 0.72222 0.87500 0.50000 1.0000 + Mn Mn273 1.0 0.76389 0.91667 0.50000 1.0000 + Mn Mn274 1.0 0.80556 0.95833 0.50000 1.0000 + Mn Mn275 1.0 0.84722 0.00000 0.50000 1.0000 + Mn Mn276 1.0 0.88889 0.04167 0.50000 1.0000 + Mn Mn277 1.0 0.47222 0.54167 0.50000 1.0000 + Mn Mn278 1.0 0.51389 0.58333 0.50000 1.0000 + Mn Mn279 1.0 0.55556 0.62500 0.50000 1.0000 + Mn Mn280 1.0 0.59722 0.66667 0.50000 1.0000 + Mn Mn281 1.0 0.63889 0.70833 0.50000 1.0000 + Mn Mn282 1.0 0.68056 0.75000 0.50000 1.0000 + Mn Mn283 1.0 0.72222 0.79167 0.50000 1.0000 + Mn Mn284 1.0 0.76389 0.83333 0.50000 1.0000 + Mn Mn285 1.0 0.80556 0.87500 0.50000 1.0000 + Mn Mn286 1.0 0.84722 0.91667 0.50000 1.0000 + Mn Mn287 1.0 0.88889 0.95833 0.50000 1.0000 + Mn Mn288 1.0 0.93056 0.00000 0.50000 1.0000 + Mn Mn289 1.0 0.03472 0.02083 0.50000 1.0000 + Mn Mn290 1.0 0.07639 0.06250 0.50000 1.0000 + Mn Mn291 1.0 0.11806 0.10417 0.50000 1.0000 + Mn Mn292 1.0 0.15972 0.14583 0.50000 1.0000 + Mn Mn293 1.0 0.20139 0.18750 0.50000 1.0000 + Mn Mn294 1.0 0.24306 0.22917 0.50000 1.0000 + Mn Mn295 1.0 0.28472 0.27083 0.50000 1.0000 + Mn Mn296 1.0 0.32639 0.31250 0.50000 1.0000 + Mn Mn297 1.0 0.36806 0.35417 0.50000 1.0000 + Mn Mn298 1.0 0.40972 0.39583 0.50000 1.0000 + Mn Mn299 1.0 0.45139 0.43750 0.50000 1.0000 + Mn Mn300 1.0 0.49306 0.47917 0.50000 1.0000 + Mn Mn301 1.0 0.07639 0.97917 0.50000 1.0000 + Mn Mn302 1.0 0.11806 0.02083 0.50000 1.0000 + Mn Mn303 1.0 0.15972 0.06250 0.50000 1.0000 + Mn Mn304 1.0 0.20139 0.10417 0.50000 1.0000 + Mn Mn305 1.0 0.24306 0.14583 0.50000 1.0000 + Mn Mn306 1.0 0.28472 0.18750 0.50000 1.0000 + Mn Mn307 1.0 0.32639 0.22917 0.50000 1.0000 + Mn Mn308 1.0 0.36806 0.27083 0.50000 1.0000 + Mn Mn309 1.0 0.40972 0.31250 0.50000 1.0000 + Mn Mn310 1.0 0.45139 0.35417 0.50000 1.0000 + Mn Mn311 1.0 0.49306 0.39583 0.50000 1.0000 + Mn Mn312 1.0 0.53472 0.43750 0.50000 1.0000 + Mn Mn313 1.0 0.11806 0.93750 0.50000 1.0000 + Mn Mn314 1.0 0.15972 0.97917 0.50000 1.0000 + Mn Mn315 1.0 0.20139 0.02083 0.50000 1.0000 + Mn Mn316 1.0 0.24306 0.06250 0.50000 1.0000 + Mn Mn317 1.0 0.28472 0.10417 0.50000 1.0000 + Mn Mn318 1.0 0.32639 0.14583 0.50000 1.0000 + Mn Mn319 1.0 0.36806 0.18750 0.50000 1.0000 + Mn Mn320 1.0 0.40972 0.22917 0.50000 1.0000 + Mn Mn321 1.0 0.45139 0.27083 0.50000 1.0000 + Mn Mn322 1.0 0.49306 0.31250 0.50000 1.0000 + Mn Mn323 1.0 0.53472 0.35417 0.50000 1.0000 + Mn Mn324 1.0 0.57639 0.39583 0.50000 1.0000 + Mn Mn325 1.0 0.15972 0.89583 0.50000 1.0000 + Mn Mn326 1.0 0.20139 0.93750 0.50000 1.0000 + Mn Mn327 1.0 0.24306 0.97917 0.50000 1.0000 + Mn Mn328 1.0 0.28472 0.02083 0.50000 1.0000 + Mn Mn329 1.0 0.32639 0.06250 0.50000 1.0000 + Mn Mn330 1.0 0.36806 0.10417 0.50000 1.0000 + Mn Mn331 1.0 0.40972 0.14583 0.50000 1.0000 + Mn Mn332 1.0 0.45139 0.18750 0.50000 1.0000 + Mn Mn333 1.0 0.49306 0.22917 0.50000 1.0000 + Mn Mn334 1.0 0.53472 0.27083 0.50000 1.0000 + Mn Mn335 1.0 0.57639 0.31250 0.50000 1.0000 + Mn Mn336 1.0 0.61806 0.35417 0.50000 1.0000 + Mn Mn337 1.0 0.20139 0.85417 0.50000 1.0000 + Mn Mn338 1.0 0.24306 0.89583 0.50000 1.0000 + Mn Mn339 1.0 0.28472 0.93750 0.50000 1.0000 + Mn Mn340 1.0 0.32639 0.97917 0.50000 1.0000 + Mn Mn341 1.0 0.36806 0.02083 0.50000 1.0000 + Mn Mn342 1.0 0.40972 0.06250 0.50000 1.0000 + Mn Mn343 1.0 0.45139 0.10417 0.50000 1.0000 + Mn Mn344 1.0 0.49306 0.14583 0.50000 1.0000 + Mn Mn345 1.0 0.53472 0.18750 0.50000 1.0000 + Mn Mn346 1.0 0.57639 0.22917 0.50000 1.0000 + Mn Mn347 1.0 0.61806 0.27083 0.50000 1.0000 + Mn Mn348 1.0 0.65972 0.31250 0.50000 1.0000 + Mn Mn349 1.0 0.24306 0.81250 0.50000 1.0000 + Mn Mn350 1.0 0.28472 0.85417 0.50000 1.0000 + Mn Mn351 1.0 0.32639 0.89583 0.50000 1.0000 + Mn Mn352 1.0 0.36806 0.93750 0.50000 1.0000 + Mn Mn353 1.0 0.40972 0.97917 0.50000 1.0000 + Mn Mn354 1.0 0.45139 0.02083 0.50000 1.0000 + Mn Mn355 1.0 0.49306 0.06250 0.50000 1.0000 + Mn Mn356 1.0 0.53472 0.10417 0.50000 1.0000 + Mn Mn357 1.0 0.57639 0.14583 0.50000 1.0000 + Mn Mn358 1.0 0.61806 0.18750 0.50000 1.0000 + Mn Mn359 1.0 0.65972 0.22917 0.50000 1.0000 + Mn Mn360 1.0 0.70139 0.27083 0.50000 1.0000 + Mn Mn361 1.0 0.28472 0.77083 0.50000 1.0000 + Mn Mn362 1.0 0.32639 0.81250 0.50000 1.0000 + Mn Mn363 1.0 0.36806 0.85417 0.50000 1.0000 + Mn Mn364 1.0 0.40972 0.89583 0.50000 1.0000 + Mn Mn365 1.0 0.45139 0.93750 0.50000 1.0000 + Mn Mn366 1.0 0.49306 0.97917 0.50000 1.0000 + Mn Mn367 1.0 0.53472 0.02083 0.50000 1.0000 + Mn Mn368 1.0 0.57639 0.06250 0.50000 1.0000 + Mn Mn369 1.0 0.61806 0.10417 0.50000 1.0000 + Mn Mn370 1.0 0.65972 0.14583 0.50000 1.0000 + Mn Mn371 1.0 0.70139 0.18750 0.50000 1.0000 + Mn Mn372 1.0 0.74306 0.22917 0.50000 1.0000 + Mn Mn373 1.0 0.32639 0.72917 0.50000 1.0000 + Mn Mn374 1.0 0.36806 0.77083 0.50000 1.0000 + Mn Mn375 1.0 0.40972 0.81250 0.50000 1.0000 + Mn Mn376 1.0 0.45139 0.85417 0.50000 1.0000 + Mn Mn377 1.0 0.49306 0.89583 0.50000 1.0000 + Mn Mn378 1.0 0.53472 0.93750 0.50000 1.0000 + Mn Mn379 1.0 0.57639 0.97917 0.50000 1.0000 + Mn Mn380 1.0 0.61806 0.02083 0.50000 1.0000 + Mn Mn381 1.0 0.65972 0.06250 0.50000 1.0000 + Mn Mn382 1.0 0.70139 0.10417 0.50000 1.0000 + Mn Mn383 1.0 0.74306 0.14583 0.50000 1.0000 + Mn Mn384 1.0 0.78472 0.18750 0.50000 1.0000 + Mn Mn385 1.0 0.36806 0.68750 0.50000 1.0000 + Mn Mn386 1.0 0.40972 0.72917 0.50000 1.0000 + Mn Mn387 1.0 0.45139 0.77083 0.50000 1.0000 + Mn Mn388 1.0 0.49306 0.81250 0.50000 1.0000 + Mn Mn389 1.0 0.53472 0.85417 0.50000 1.0000 + Mn Mn390 1.0 0.57639 0.89583 0.50000 1.0000 + Mn Mn391 1.0 0.61806 0.93750 0.50000 1.0000 + Mn Mn392 1.0 0.65972 0.97917 0.50000 1.0000 + Mn Mn393 1.0 0.70139 0.02083 0.50000 1.0000 + Mn Mn394 1.0 0.74306 0.06250 0.50000 1.0000 + Mn Mn395 1.0 0.78472 0.10417 0.50000 1.0000 + Mn Mn396 1.0 0.82639 0.14583 0.50000 1.0000 + Mn Mn397 1.0 0.40972 0.64583 0.50000 1.0000 + Mn Mn398 1.0 0.45139 0.68750 0.50000 1.0000 + Mn Mn399 1.0 0.49306 0.72917 0.50000 1.0000 + Mn Mn400 1.0 0.53472 0.77083 0.50000 1.0000 + Mn Mn401 1.0 0.57639 0.81250 0.50000 1.0000 + Mn Mn402 1.0 0.61806 0.85417 0.50000 1.0000 + Mn Mn403 1.0 0.65972 0.89583 0.50000 1.0000 + Mn Mn404 1.0 0.70139 0.93750 0.50000 1.0000 + Mn Mn405 1.0 0.74306 0.97917 0.50000 1.0000 + Mn Mn406 1.0 0.78472 0.02083 0.50000 1.0000 + Mn Mn407 1.0 0.82639 0.06250 0.50000 1.0000 + Mn Mn408 1.0 0.86806 0.10417 0.50000 1.0000 + Mn Mn409 1.0 0.45139 0.60417 0.50000 1.0000 + Mn Mn410 1.0 0.49306 0.64583 0.50000 1.0000 + Mn Mn411 1.0 0.53472 0.68750 0.50000 1.0000 + Mn Mn412 1.0 0.57639 0.72917 0.50000 1.0000 + Mn Mn413 1.0 0.61806 0.77083 0.50000 1.0000 + Mn Mn414 1.0 0.65972 0.81250 0.50000 1.0000 + Mn Mn415 1.0 0.70139 0.85417 0.50000 1.0000 + Mn Mn416 1.0 0.74306 0.89583 0.50000 1.0000 + Mn Mn417 1.0 0.78472 0.93750 0.50000 1.0000 + Mn Mn418 1.0 0.82639 0.97917 0.50000 1.0000 + Mn Mn419 1.0 0.86806 0.02083 0.50000 1.0000 + Mn Mn420 1.0 0.90972 0.06250 0.50000 1.0000 + Mn Mn421 1.0 0.49306 0.56250 0.50000 1.0000 + Mn Mn422 1.0 0.53472 0.60417 0.50000 1.0000 + Mn Mn423 1.0 0.57639 0.64583 0.50000 1.0000 + Mn Mn424 1.0 0.61806 0.68750 0.50000 1.0000 + Mn Mn425 1.0 0.65972 0.72917 0.50000 1.0000 + Mn Mn426 1.0 0.70139 0.77083 0.50000 1.0000 + Mn Mn427 1.0 0.74306 0.81250 0.50000 1.0000 + Mn Mn428 1.0 0.78472 0.85417 0.50000 1.0000 + Mn Mn429 1.0 0.82639 0.89583 0.50000 1.0000 + Mn Mn430 1.0 0.86806 0.93750 0.50000 1.0000 + Mn Mn431 1.0 0.90972 0.97917 0.50000 1.0000 + Mn Mn432 1.0 0.95139 0.02083 0.50000 1.0000 + Co Co1 1.0 0.05556 0.00000 0.50000 1.0000 + Co Co2 1.0 0.09722 0.04167 0.50000 1.0000 + Co Co3 1.0 0.13889 0.08333 0.50000 1.0000 + Co Co4 1.0 0.18056 0.12500 0.50000 1.0000 + Co Co5 1.0 0.22222 0.16667 0.50000 1.0000 + Co Co6 1.0 0.26389 0.20833 0.50000 1.0000 + Co Co7 1.0 0.30556 0.25000 0.50000 1.0000 + Co Co8 1.0 0.34722 0.29167 0.50000 1.0000 + Co Co9 1.0 0.38889 0.33333 0.50000 1.0000 + Co Co10 1.0 0.43056 0.37500 0.50000 1.0000 + Co Co11 1.0 0.47222 0.41667 0.50000 1.0000 + Co Co12 1.0 0.51389 0.45833 0.50000 1.0000 + Co Co13 1.0 0.09722 0.95833 0.50000 1.0000 + Co Co14 1.0 0.13889 0.00000 0.50000 1.0000 + Co Co15 1.0 0.18056 0.04167 0.50000 1.0000 + Co Co16 1.0 0.22222 0.08333 0.50000 1.0000 + Co Co17 1.0 0.26389 0.12500 0.50000 1.0000 + Co Co18 1.0 0.30556 0.16667 0.50000 1.0000 + Co Co19 1.0 0.34722 0.20833 0.50000 1.0000 + Co Co20 1.0 0.38889 0.25000 0.50000 1.0000 + Co Co21 1.0 0.43056 0.29167 0.50000 1.0000 + Co Co22 1.0 0.47222 0.33333 0.50000 1.0000 + Co Co23 1.0 0.51389 0.37500 0.50000 1.0000 + Co Co24 1.0 0.55556 0.41667 0.50000 1.0000 + Co Co25 1.0 0.13889 0.91667 0.50000 1.0000 + Co Co26 1.0 0.18056 0.95833 0.50000 1.0000 + Co Co27 1.0 0.22222 0.00000 0.50000 1.0000 + Co Co28 1.0 0.26389 0.04167 0.50000 1.0000 + Co Co29 1.0 0.30556 0.08333 0.50000 1.0000 + Co Co30 1.0 0.34722 0.12500 0.50000 1.0000 + Co Co31 1.0 0.38889 0.16667 0.50000 1.0000 + Co Co32 1.0 0.43056 0.20833 0.50000 1.0000 + Co Co33 1.0 0.47222 0.25000 0.50000 1.0000 + Co Co34 1.0 0.51389 0.29167 0.50000 1.0000 + Co Co35 1.0 0.55556 0.33333 0.50000 1.0000 + Co Co36 1.0 0.59722 0.37500 0.50000 1.0000 + Co Co37 1.0 0.18056 0.87500 0.50000 1.0000 + Co Co38 1.0 0.22222 0.91667 0.50000 1.0000 + Co Co39 1.0 0.26389 0.95833 0.50000 1.0000 + Co Co40 1.0 0.30556 0.00000 0.50000 1.0000 + Co Co41 1.0 0.34722 0.04167 0.50000 1.0000 + Co Co42 1.0 0.38889 0.08333 0.50000 1.0000 + Co Co43 1.0 0.43056 0.12500 0.50000 1.0000 + Co Co44 1.0 0.47222 0.16667 0.50000 1.0000 + Co Co45 1.0 0.51389 0.20833 0.50000 1.0000 + Co Co46 1.0 0.55556 0.25000 0.50000 1.0000 + Co Co47 1.0 0.59722 0.29167 0.50000 1.0000 + Co Co48 1.0 0.63889 0.33333 0.50000 1.0000 + Co Co49 1.0 0.22222 0.83333 0.50000 1.0000 + Co Co50 1.0 0.26389 0.87500 0.50000 1.0000 + Co Co51 1.0 0.30556 0.91667 0.50000 1.0000 + Co Co52 1.0 0.34722 0.95833 0.50000 1.0000 + Co Co53 1.0 0.38889 0.00000 0.50000 1.0000 + Co Co54 1.0 0.43056 0.04167 0.50000 1.0000 + Co Co55 1.0 0.47222 0.08333 0.50000 1.0000 + Co Co56 1.0 0.51389 0.12500 0.50000 1.0000 + Co Co57 1.0 0.55556 0.16667 0.50000 1.0000 + Co Co58 1.0 0.59722 0.20833 0.50000 1.0000 + Co Co59 1.0 0.63889 0.25000 0.50000 1.0000 + Co Co60 1.0 0.68056 0.29167 0.50000 1.0000 + Co Co61 1.0 0.26389 0.79167 0.50000 1.0000 + Co Co62 1.0 0.30556 0.83333 0.50000 1.0000 + Co Co63 1.0 0.34722 0.87500 0.50000 1.0000 + Co Co64 1.0 0.38889 0.91667 0.50000 1.0000 + Co Co65 1.0 0.43056 0.95833 0.50000 1.0000 + Co Co66 1.0 0.47222 0.00000 0.50000 1.0000 + Co Co67 1.0 0.51389 0.04167 0.50000 1.0000 + Co Co68 1.0 0.55556 0.08333 0.50000 1.0000 + Co Co69 1.0 0.59722 0.12500 0.50000 1.0000 + Co Co70 1.0 0.63889 0.16667 0.50000 1.0000 + Co Co71 1.0 0.68056 0.20833 0.50000 1.0000 + Co Co72 1.0 0.72222 0.25000 0.50000 1.0000 + Co Co73 1.0 0.30556 0.75000 0.50000 1.0000 + Co Co74 1.0 0.34722 0.79167 0.50000 1.0000 + Co Co75 1.0 0.38889 0.83333 0.50000 1.0000 + Co Co76 1.0 0.43056 0.87500 0.50000 1.0000 + Co Co77 1.0 0.47222 0.91667 0.50000 1.0000 + Co Co78 1.0 0.51389 0.95833 0.50000 1.0000 + Co Co79 1.0 0.55556 0.00000 0.50000 1.0000 + 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0.66261 1.0000 + O O934 1.0 0.58333 0.16667 0.66261 1.0000 + O O935 1.0 0.62500 0.20833 0.66261 1.0000 + O O936 1.0 0.66667 0.25000 0.66261 1.0000 + O O937 1.0 0.25000 0.75000 0.66261 1.0000 + O O938 1.0 0.29167 0.79167 0.66261 1.0000 + O O939 1.0 0.33333 0.83333 0.66261 1.0000 + O O940 1.0 0.37500 0.87500 0.66261 1.0000 + O O941 1.0 0.41667 0.91667 0.66261 1.0000 + O O942 1.0 0.45833 0.95833 0.66261 1.0000 + O O943 1.0 0.50000 0.00000 0.66261 1.0000 + O O944 1.0 0.54167 0.04167 0.66261 1.0000 + O O945 1.0 0.58333 0.08333 0.66261 1.0000 + O O946 1.0 0.62500 0.12500 0.66261 1.0000 + O O947 1.0 0.66667 0.16667 0.66261 1.0000 + O O948 1.0 0.70833 0.20833 0.66261 1.0000 + O O949 1.0 0.29167 0.70833 0.66261 1.0000 + O O950 1.0 0.33333 0.75000 0.66261 1.0000 + O O951 1.0 0.37500 0.79167 0.66261 1.0000 + O O952 1.0 0.41667 0.83333 0.66261 1.0000 + O O953 1.0 0.45833 0.87500 0.66261 1.0000 + O O954 1.0 0.50000 0.91667 0.66261 1.0000 + O O955 1.0 0.54167 0.95833 0.66261 1.0000 + O O956 1.0 0.58333 0.00000 0.66261 1.0000 + O O957 1.0 0.62500 0.04167 0.66261 1.0000 + O O958 1.0 0.66667 0.08333 0.66261 1.0000 + O O959 1.0 0.70833 0.12500 0.66261 1.0000 + O O960 1.0 0.75000 0.16667 0.66261 1.0000 + O O961 1.0 0.33333 0.66667 0.66261 1.0000 + O O962 1.0 0.37500 0.70833 0.66261 1.0000 + O O963 1.0 0.41667 0.75000 0.66261 1.0000 + O O964 1.0 0.45833 0.79167 0.66261 1.0000 + O O965 1.0 0.50000 0.83333 0.66261 1.0000 + O O966 1.0 0.54167 0.87500 0.66261 1.0000 + O O967 1.0 0.58333 0.91667 0.66261 1.0000 + O O968 1.0 0.62500 0.95833 0.66261 1.0000 + O O969 1.0 0.66667 0.00000 0.66261 1.0000 + O O970 1.0 0.70833 0.04167 0.66261 1.0000 + O O971 1.0 0.75000 0.08333 0.66261 1.0000 + O O972 1.0 0.79167 0.12500 0.66261 1.0000 + O O973 1.0 0.37500 0.62500 0.66261 1.0000 + O O974 1.0 0.41667 0.66667 0.66261 1.0000 + O O975 1.0 0.45833 0.70833 0.66261 1.0000 + O O976 1.0 0.50000 0.75000 0.66261 1.0000 + O O977 1.0 0.54167 0.79167 0.66261 1.0000 + O O978 1.0 0.58333 0.83333 0.66261 1.0000 + O O979 1.0 0.62500 0.87500 0.66261 1.0000 + O O980 1.0 0.66667 0.91667 0.66261 1.0000 + O O981 1.0 0.70833 0.95833 0.66261 1.0000 + O O982 1.0 0.75000 0.00000 0.66261 1.0000 + O O983 1.0 0.79167 0.04167 0.66261 1.0000 + O O984 1.0 0.83333 0.08333 0.66261 1.0000 + O O985 1.0 0.41667 0.58333 0.66261 1.0000 + O O986 1.0 0.45833 0.62500 0.66261 1.0000 + O O987 1.0 0.50000 0.66667 0.66261 1.0000 + O O988 1.0 0.54167 0.70833 0.66261 1.0000 + O O989 1.0 0.58333 0.75000 0.66261 1.0000 + O O990 1.0 0.62500 0.79167 0.66261 1.0000 + O O991 1.0 0.66667 0.83333 0.66261 1.0000 + O O992 1.0 0.70833 0.87500 0.66261 1.0000 + O O993 1.0 0.75000 0.91667 0.66261 1.0000 + O O994 1.0 0.79167 0.95833 0.66261 1.0000 + O O995 1.0 0.83333 0.00000 0.66261 1.0000 + O O996 1.0 0.87500 0.04167 0.66261 1.0000 + O O997 1.0 0.45833 0.54167 0.66261 1.0000 + O O998 1.0 0.50000 0.58333 0.66261 1.0000 + O O999 1.0 0.54167 0.62500 0.66261 1.0000 + O O1000 1.0 0.58333 0.66667 0.66261 1.0000 + O O1001 1.0 0.62500 0.70833 0.66261 1.0000 + O O1002 1.0 0.66667 0.75000 0.66261 1.0000 + O O1003 1.0 0.70833 0.79167 0.66261 1.0000 + O O1004 1.0 0.75000 0.83333 0.66261 1.0000 + O O1005 1.0 0.79167 0.87500 0.66261 1.0000 + O O1006 1.0 0.83333 0.91667 0.66261 1.0000 + O O1007 1.0 0.87500 0.95833 0.66261 1.0000 + O O1008 1.0 0.91667 0.00000 0.66261 1.0000 + O O1009 1.0 0.02092 0.02059 0.66183 1.0000 + O O1010 1.0 0.06258 0.06225 0.66183 1.0000 + O O1011 1.0 0.10425 0.10392 0.66183 1.0000 + O O1012 1.0 0.14592 0.14559 0.66183 1.0000 + O O1013 1.0 0.18758 0.18725 0.66183 1.0000 + O O1014 1.0 0.22925 0.22892 0.66183 1.0000 + O O1015 1.0 0.27092 0.27059 0.66183 1.0000 + O O1016 1.0 0.31258 0.31225 0.66183 1.0000 + O O1017 1.0 0.35425 0.35392 0.66183 1.0000 + O O1018 1.0 0.39592 0.39559 0.66183 1.0000 + O O1019 1.0 0.43758 0.43725 0.66183 1.0000 + O O1020 1.0 0.47925 0.47892 0.66183 1.0000 + O O1021 1.0 0.06258 0.97892 0.66183 1.0000 + O O1022 1.0 0.10425 0.02059 0.66183 1.0000 + O O1023 1.0 0.14592 0.06225 0.66183 1.0000 + O O1024 1.0 0.18758 0.10392 0.66183 1.0000 + O O1025 1.0 0.22925 0.14559 0.66183 1.0000 + O O1026 1.0 0.27092 0.18725 0.66183 1.0000 + O O1027 1.0 0.31258 0.22892 0.66183 1.0000 + O O1028 1.0 0.35425 0.27059 0.66183 1.0000 + O O1029 1.0 0.39592 0.31225 0.66183 1.0000 + O O1030 1.0 0.43758 0.35392 0.66183 1.0000 + O O1031 1.0 0.47925 0.39559 0.66183 1.0000 + O O1032 1.0 0.52092 0.43725 0.66183 1.0000 + O O1033 1.0 0.10425 0.93725 0.66183 1.0000 + O O1034 1.0 0.14592 0.97892 0.66183 1.0000 + O O1035 1.0 0.18758 0.02059 0.66183 1.0000 + O O1036 1.0 0.22925 0.06225 0.66183 1.0000 + O O1037 1.0 0.27092 0.10392 0.66183 1.0000 + O O1038 1.0 0.31258 0.14559 0.66183 1.0000 + O O1039 1.0 0.35425 0.18725 0.66183 1.0000 + O O1040 1.0 0.39592 0.22892 0.66183 1.0000 + O O1041 1.0 0.43758 0.27059 0.66183 1.0000 + O O1042 1.0 0.47925 0.31225 0.66183 1.0000 + O O1043 1.0 0.52092 0.35392 0.66183 1.0000 + O O1044 1.0 0.56258 0.39559 0.66183 1.0000 + O O1045 1.0 0.14592 0.89559 0.66183 1.0000 + O O1046 1.0 0.18758 0.93725 0.66183 1.0000 + O O1047 1.0 0.22925 0.97892 0.66183 1.0000 + O O1048 1.0 0.27092 0.02059 0.66183 1.0000 + O O1049 1.0 0.31258 0.06225 0.66183 1.0000 + O O1050 1.0 0.35425 0.10392 0.66183 1.0000 + O O1051 1.0 0.39592 0.14559 0.66183 1.0000 + O O1052 1.0 0.43758 0.18725 0.66183 1.0000 + O O1053 1.0 0.47925 0.22892 0.66183 1.0000 + O O1054 1.0 0.52092 0.27059 0.66183 1.0000 + O O1055 1.0 0.56258 0.31225 0.66183 1.0000 + O O1056 1.0 0.60425 0.35392 0.66183 1.0000 + O O1057 1.0 0.18758 0.85392 0.66183 1.0000 + O O1058 1.0 0.22925 0.89559 0.66183 1.0000 + O O1059 1.0 0.27092 0.93725 0.66183 1.0000 + O O1060 1.0 0.31258 0.97892 0.66183 1.0000 + O O1061 1.0 0.35425 0.02059 0.66183 1.0000 + O O1062 1.0 0.39592 0.06225 0.66183 1.0000 + O O1063 1.0 0.43758 0.10392 0.66183 1.0000 + O O1064 1.0 0.47925 0.14559 0.66183 1.0000 + O O1065 1.0 0.52092 0.18725 0.66183 1.0000 + O O1066 1.0 0.56258 0.22892 0.66183 1.0000 + O O1067 1.0 0.60425 0.27059 0.66183 1.0000 + O O1068 1.0 0.64592 0.31225 0.66183 1.0000 + O O1069 1.0 0.22925 0.81225 0.66183 1.0000 + O O1070 1.0 0.27092 0.85392 0.66183 1.0000 + O O1071 1.0 0.31258 0.89559 0.66183 1.0000 + O O1072 1.0 0.35425 0.93725 0.66183 1.0000 + O O1073 1.0 0.39592 0.97892 0.66183 1.0000 + O O1074 1.0 0.43758 0.02059 0.66183 1.0000 + O O1075 1.0 0.47925 0.06225 0.66183 1.0000 + O O1076 1.0 0.52092 0.10392 0.66183 1.0000 + O O1077 1.0 0.56258 0.14559 0.66183 1.0000 + O O1078 1.0 0.60425 0.18725 0.66183 1.0000 + O O1079 1.0 0.64592 0.22892 0.66183 1.0000 + O O1080 1.0 0.68758 0.27059 0.66183 1.0000 + O O1081 1.0 0.27092 0.77059 0.66183 1.0000 + O O1082 1.0 0.31258 0.81225 0.66183 1.0000 + O O1083 1.0 0.35425 0.85392 0.66183 1.0000 + O O1084 1.0 0.39592 0.89559 0.66183 1.0000 + O O1085 1.0 0.43758 0.93725 0.66183 1.0000 + O O1086 1.0 0.47925 0.97892 0.66183 1.0000 + O O1087 1.0 0.52092 0.02059 0.66183 1.0000 + O O1088 1.0 0.56258 0.06225 0.66183 1.0000 + O O1089 1.0 0.60425 0.10392 0.66183 1.0000 + O O1090 1.0 0.64592 0.14559 0.66183 1.0000 + O O1091 1.0 0.68758 0.18725 0.66183 1.0000 + O O1092 1.0 0.72925 0.22892 0.66183 1.0000 + O O1093 1.0 0.31258 0.72892 0.66183 1.0000 + O O1094 1.0 0.35425 0.77059 0.66183 1.0000 + O O1095 1.0 0.39592 0.81225 0.66183 1.0000 + O O1096 1.0 0.43758 0.85392 0.66183 1.0000 + O O1097 1.0 0.47925 0.89559 0.66183 1.0000 + O O1098 1.0 0.52092 0.93725 0.66183 1.0000 + O O1099 1.0 0.56258 0.97892 0.66183 1.0000 + O O1100 1.0 0.60425 0.02059 0.66183 1.0000 + O O1101 1.0 0.64592 0.06225 0.66183 1.0000 + O O1102 1.0 0.68758 0.10392 0.66183 1.0000 + O O1103 1.0 0.72925 0.14559 0.66183 1.0000 + O O1104 1.0 0.77092 0.18725 0.66183 1.0000 + O O1105 1.0 0.35425 0.68725 0.66183 1.0000 + O O1106 1.0 0.39592 0.72892 0.66183 1.0000 + O O1107 1.0 0.43758 0.77059 0.66183 1.0000 + O O1108 1.0 0.47925 0.81225 0.66183 1.0000 + O O1109 1.0 0.52092 0.85392 0.66183 1.0000 + O O1110 1.0 0.56258 0.89559 0.66183 1.0000 + O O1111 1.0 0.60425 0.93725 0.66183 1.0000 + O O1112 1.0 0.64592 0.97892 0.66183 1.0000 + O O1113 1.0 0.68758 0.02059 0.66183 1.0000 + O O1114 1.0 0.72925 0.06225 0.66183 1.0000 + O O1115 1.0 0.77092 0.10392 0.66183 1.0000 + O O1116 1.0 0.81258 0.14559 0.66183 1.0000 + O O1117 1.0 0.39592 0.64559 0.66183 1.0000 + O O1118 1.0 0.43758 0.68725 0.66183 1.0000 + O O1119 1.0 0.47925 0.72892 0.66183 1.0000 + O O1120 1.0 0.52092 0.77059 0.66183 1.0000 + O O1121 1.0 0.56258 0.81225 0.66183 1.0000 + O O1122 1.0 0.60425 0.85392 0.66183 1.0000 + O O1123 1.0 0.64592 0.89559 0.66183 1.0000 + O O1124 1.0 0.68758 0.93725 0.66183 1.0000 + O O1125 1.0 0.72925 0.97892 0.66183 1.0000 + O O1126 1.0 0.77092 0.02059 0.66183 1.0000 + O O1127 1.0 0.81258 0.06225 0.66183 1.0000 + O O1128 1.0 0.85425 0.10392 0.66183 1.0000 + O O1129 1.0 0.43758 0.60392 0.66183 1.0000 + O O1130 1.0 0.47925 0.64559 0.66183 1.0000 + O O1131 1.0 0.52092 0.68725 0.66183 1.0000 + O O1132 1.0 0.56258 0.72892 0.66183 1.0000 + O O1133 1.0 0.60425 0.77059 0.66183 1.0000 + O O1134 1.0 0.64592 0.81225 0.66183 1.0000 + O O1135 1.0 0.68758 0.85392 0.66183 1.0000 + O O1136 1.0 0.72925 0.89559 0.66183 1.0000 + O O1137 1.0 0.77092 0.93725 0.66183 1.0000 + O O1138 1.0 0.81258 0.97892 0.66183 1.0000 + O O1139 1.0 0.85425 0.02059 0.66183 1.0000 + O O1140 1.0 0.89592 0.06225 0.66183 1.0000 + O O1141 1.0 0.47925 0.56225 0.66183 1.0000 + O O1142 1.0 0.52092 0.60392 0.66183 1.0000 + O O1143 1.0 0.56258 0.64559 0.66183 1.0000 + O O1144 1.0 0.60425 0.68725 0.66183 1.0000 + O O1145 1.0 0.64592 0.72892 0.66183 1.0000 + O O1146 1.0 0.68758 0.77059 0.66183 1.0000 + O O1147 1.0 0.72925 0.81225 0.66183 1.0000 + O O1148 1.0 0.77092 0.85392 0.66183 1.0000 + O O1149 1.0 0.81258 0.89559 0.66183 1.0000 + O O1150 1.0 0.85425 0.93725 0.66183 1.0000 + O O1151 1.0 0.89592 0.97892 0.66183 1.0000 + O O1152 1.0 0.93758 0.02059 0.66183 1.0000 + Mn Mn433 1.0 0.53472 0.47917 0.50000 1.0000 + Mn Mn434 1.0 0.57639 0.52083 0.50000 1.0000 + Mn Mn435 1.0 0.61806 0.56250 0.50000 1.0000 + Mn Mn436 1.0 0.65972 0.60417 0.50000 1.0000 + Mn Mn437 1.0 0.70139 0.64583 0.50000 1.0000 + Mn Mn438 1.0 0.74306 0.68750 0.50000 1.0000 + Mn Mn439 1.0 0.78472 0.72917 0.50000 1.0000 + Mn Mn440 1.0 0.82639 0.77083 0.50000 1.0000 + Mn Mn441 1.0 0.86806 0.81250 0.50000 1.0000 + Mn Mn442 1.0 0.90972 0.85417 0.50000 1.0000 + Mn Mn443 1.0 0.95139 0.89583 0.50000 1.0000 + Mn Mn444 1.0 0.99306 0.93750 0.50000 1.0000 + Mn Mn445 1.0 0.57639 0.43750 0.50000 1.0000 + Mn Mn446 1.0 0.61806 0.47917 0.50000 1.0000 + Mn Mn447 1.0 0.65972 0.52083 0.50000 1.0000 + Mn Mn448 1.0 0.70139 0.56250 0.50000 1.0000 + Mn Mn449 1.0 0.74306 0.60417 0.50000 1.0000 + Mn Mn450 1.0 0.78472 0.64583 0.50000 1.0000 + Mn Mn451 1.0 0.82639 0.68750 0.50000 1.0000 + Mn Mn452 1.0 0.86806 0.72917 0.50000 1.0000 + Mn Mn453 1.0 0.90972 0.77083 0.50000 1.0000 + Mn Mn454 1.0 0.95139 0.81250 0.50000 1.0000 + Mn Mn455 1.0 0.99306 0.85417 0.50000 1.0000 + Mn Mn456 1.0 0.03472 0.89583 0.50000 1.0000 + Mn Mn457 1.0 0.61806 0.39583 0.50000 1.0000 + Mn Mn458 1.0 0.65972 0.43750 0.50000 1.0000 + Mn Mn459 1.0 0.70139 0.47917 0.50000 1.0000 + Mn Mn460 1.0 0.74306 0.52083 0.50000 1.0000 + Mn Mn461 1.0 0.78472 0.56250 0.50000 1.0000 + Mn Mn462 1.0 0.82639 0.60417 0.50000 1.0000 + Mn Mn463 1.0 0.86806 0.64583 0.50000 1.0000 + Mn Mn464 1.0 0.90972 0.68750 0.50000 1.0000 + Mn Mn465 1.0 0.95139 0.72917 0.50000 1.0000 + Mn Mn466 1.0 0.99306 0.77083 0.50000 1.0000 + Mn Mn467 1.0 0.03472 0.81250 0.50000 1.0000 + Mn Mn468 1.0 0.07639 0.85417 0.50000 1.0000 + Mn Mn469 1.0 0.65972 0.35417 0.50000 1.0000 + Mn Mn470 1.0 0.70139 0.39583 0.50000 1.0000 + Mn Mn471 1.0 0.74306 0.43750 0.50000 1.0000 + Mn Mn472 1.0 0.78472 0.47917 0.50000 1.0000 + Mn Mn473 1.0 0.82639 0.52083 0.50000 1.0000 + Mn Mn474 1.0 0.86806 0.56250 0.50000 1.0000 + Mn Mn475 1.0 0.90972 0.60417 0.50000 1.0000 + Mn Mn476 1.0 0.95139 0.64583 0.50000 1.0000 + Mn Mn477 1.0 0.99306 0.68750 0.50000 1.0000 + Mn Mn478 1.0 0.03472 0.72917 0.50000 1.0000 + Mn Mn479 1.0 0.07639 0.77083 0.50000 1.0000 + Mn Mn480 1.0 0.11806 0.81250 0.50000 1.0000 + Mn Mn481 1.0 0.70139 0.31250 0.50000 1.0000 + Mn Mn482 1.0 0.74306 0.35417 0.50000 1.0000 + Mn Mn483 1.0 0.78472 0.39583 0.50000 1.0000 + Mn Mn484 1.0 0.82639 0.43750 0.50000 1.0000 + Mn Mn485 1.0 0.86806 0.47917 0.50000 1.0000 + Mn Mn486 1.0 0.90972 0.52083 0.50000 1.0000 + Mn Mn487 1.0 0.95139 0.56250 0.50000 1.0000 + Mn Mn488 1.0 0.99306 0.60417 0.50000 1.0000 + Mn Mn489 1.0 0.03472 0.64583 0.50000 1.0000 + Mn Mn490 1.0 0.07639 0.68750 0.50000 1.0000 + Mn Mn491 1.0 0.11806 0.72917 0.50000 1.0000 + Mn Mn492 1.0 0.15972 0.77083 0.50000 1.0000 + Mn Mn493 1.0 0.74306 0.27083 0.50000 1.0000 + Mn Mn494 1.0 0.78472 0.31250 0.50000 1.0000 + Mn Mn495 1.0 0.82639 0.35417 0.50000 1.0000 + Mn Mn496 1.0 0.86806 0.39583 0.50000 1.0000 + Mn Mn497 1.0 0.90972 0.43750 0.50000 1.0000 + Mn Mn498 1.0 0.95139 0.47917 0.50000 1.0000 + Mn Mn499 1.0 0.99306 0.52083 0.50000 1.0000 + Mn Mn500 1.0 0.03472 0.56250 0.50000 1.0000 + Mn Mn501 1.0 0.07639 0.60417 0.50000 1.0000 + Mn Mn502 1.0 0.11806 0.64583 0.50000 1.0000 + Mn Mn503 1.0 0.15972 0.68750 0.50000 1.0000 + Mn Mn504 1.0 0.20139 0.72917 0.50000 1.0000 + Mn Mn505 1.0 0.78472 0.22917 0.50000 1.0000 + Mn Mn506 1.0 0.82639 0.27083 0.50000 1.0000 + Mn Mn507 1.0 0.86806 0.31250 0.50000 1.0000 + Mn Mn508 1.0 0.90972 0.35417 0.50000 1.0000 + Mn Mn509 1.0 0.95139 0.39583 0.50000 1.0000 + Mn Mn510 1.0 0.99306 0.43750 0.50000 1.0000 + Mn Mn511 1.0 0.03472 0.47917 0.50000 1.0000 + Mn Mn512 1.0 0.07639 0.52083 0.50000 1.0000 + Mn Mn513 1.0 0.11806 0.56250 0.50000 1.0000 + Mn Mn514 1.0 0.15972 0.60417 0.50000 1.0000 + Mn Mn515 1.0 0.20139 0.64583 0.50000 1.0000 + Mn Mn516 1.0 0.24306 0.68750 0.50000 1.0000 + Mn Mn517 1.0 0.82639 0.18750 0.50000 1.0000 + Mn Mn518 1.0 0.86806 0.22917 0.50000 1.0000 + Mn Mn519 1.0 0.90972 0.27083 0.50000 1.0000 + Mn Mn520 1.0 0.95139 0.31250 0.50000 1.0000 + Mn Mn521 1.0 0.99306 0.35417 0.50000 1.0000 + Mn Mn522 1.0 0.03472 0.39583 0.50000 1.0000 + Mn Mn523 1.0 0.07639 0.43750 0.50000 1.0000 + Mn Mn524 1.0 0.11806 0.47917 0.50000 1.0000 + Mn Mn525 1.0 0.15972 0.52083 0.50000 1.0000 + Mn Mn526 1.0 0.20139 0.56250 0.50000 1.0000 + Mn Mn527 1.0 0.24306 0.60417 0.50000 1.0000 + Mn Mn528 1.0 0.28472 0.64583 0.50000 1.0000 + Mn Mn529 1.0 0.86806 0.14583 0.50000 1.0000 + Mn Mn530 1.0 0.90972 0.18750 0.50000 1.0000 + Mn Mn531 1.0 0.95139 0.22917 0.50000 1.0000 + Mn Mn532 1.0 0.99306 0.27083 0.50000 1.0000 + Mn Mn533 1.0 0.03472 0.31250 0.50000 1.0000 + Mn Mn534 1.0 0.07639 0.35417 0.50000 1.0000 + Mn Mn535 1.0 0.11806 0.39583 0.50000 1.0000 + Mn Mn536 1.0 0.15972 0.43750 0.50000 1.0000 + Mn Mn537 1.0 0.20139 0.47917 0.50000 1.0000 + Mn Mn538 1.0 0.24306 0.52083 0.50000 1.0000 + Mn Mn539 1.0 0.28472 0.56250 0.50000 1.0000 + Mn Mn540 1.0 0.32639 0.60417 0.50000 1.0000 + Mn Mn541 1.0 0.90972 0.10417 0.50000 1.0000 + Mn Mn542 1.0 0.95139 0.14583 0.50000 1.0000 + Mn Mn543 1.0 0.99306 0.18750 0.50000 1.0000 + Mn Mn544 1.0 0.03472 0.22917 0.50000 1.0000 + Mn Mn545 1.0 0.07639 0.27083 0.50000 1.0000 + Mn Mn546 1.0 0.11806 0.31250 0.50000 1.0000 + Mn Mn547 1.0 0.15972 0.35417 0.50000 1.0000 + Mn Mn548 1.0 0.20139 0.39583 0.50000 1.0000 + Mn Mn549 1.0 0.24306 0.43750 0.50000 1.0000 + Mn Mn550 1.0 0.28472 0.47917 0.50000 1.0000 + Mn Mn551 1.0 0.32639 0.52083 0.50000 1.0000 + Mn Mn552 1.0 0.36806 0.56250 0.50000 1.0000 + Mn Mn553 1.0 0.95139 0.06250 0.50000 1.0000 + Mn Mn554 1.0 0.99306 0.10417 0.50000 1.0000 + Mn Mn555 1.0 0.03472 0.14583 0.50000 1.0000 + Mn Mn556 1.0 0.07639 0.18750 0.50000 1.0000 + Mn Mn557 1.0 0.11806 0.22917 0.50000 1.0000 + Mn Mn558 1.0 0.15972 0.27083 0.50000 1.0000 + Mn Mn559 1.0 0.20139 0.31250 0.50000 1.0000 + Mn Mn560 1.0 0.24306 0.35417 0.50000 1.0000 + Mn Mn561 1.0 0.28472 0.39583 0.50000 1.0000 + Mn Mn562 1.0 0.32639 0.43750 0.50000 1.0000 + Mn Mn563 1.0 0.36806 0.47917 0.50000 1.0000 + Mn Mn564 1.0 0.40972 0.52083 0.50000 1.0000 + Mn Mn565 1.0 0.99306 0.02083 0.50000 1.0000 + Mn Mn566 1.0 0.03472 0.06250 0.50000 1.0000 + Mn Mn567 1.0 0.07639 0.10417 0.50000 1.0000 + Mn Mn568 1.0 0.11806 0.14583 0.50000 1.0000 + Mn Mn569 1.0 0.15972 0.18750 0.50000 1.0000 + Mn Mn570 1.0 0.20139 0.22917 0.50000 1.0000 + Mn Mn571 1.0 0.24306 0.27083 0.50000 1.0000 + Mn Mn572 1.0 0.28472 0.31250 0.50000 1.0000 + Mn Mn573 1.0 0.32639 0.35417 0.50000 1.0000 + Mn Mn574 1.0 0.36806 0.39583 0.50000 1.0000 + Mn Mn575 1.0 0.40972 0.43750 0.50000 1.0000 + Mn Mn576 1.0 0.45139 0.47917 0.50000 1.0000 + Mn Mn577 1.0 0.51389 0.50000 0.50000 1.0000 + Mn Mn578 1.0 0.55556 0.54167 0.50000 1.0000 + Mn Mn579 1.0 0.59722 0.58333 0.50000 1.0000 + Mn Mn580 1.0 0.63889 0.62500 0.50000 1.0000 + Mn Mn581 1.0 0.68056 0.66667 0.50000 1.0000 + Mn Mn582 1.0 0.72222 0.70833 0.50000 1.0000 + Mn Mn583 1.0 0.76389 0.75000 0.50000 1.0000 + Mn Mn584 1.0 0.80556 0.79167 0.50000 1.0000 + Mn Mn585 1.0 0.84722 0.83333 0.50000 1.0000 + Mn Mn586 1.0 0.88889 0.87500 0.50000 1.0000 + Mn Mn587 1.0 0.93056 0.91667 0.50000 1.0000 + Mn Mn588 1.0 0.97222 0.95833 0.50000 1.0000 + Mn Mn589 1.0 0.55556 0.45833 0.50000 1.0000 + Mn Mn590 1.0 0.59722 0.50000 0.50000 1.0000 + Mn Mn591 1.0 0.63889 0.54167 0.50000 1.0000 + Mn Mn592 1.0 0.68056 0.58333 0.50000 1.0000 + Mn Mn593 1.0 0.72222 0.62500 0.50000 1.0000 + Mn Mn594 1.0 0.76389 0.66667 0.50000 1.0000 + Mn Mn595 1.0 0.80556 0.70833 0.50000 1.0000 + Mn Mn596 1.0 0.84722 0.75000 0.50000 1.0000 + Mn Mn597 1.0 0.88889 0.79167 0.50000 1.0000 + Mn Mn598 1.0 0.93056 0.83333 0.50000 1.0000 + Mn Mn599 1.0 0.97222 0.87500 0.50000 1.0000 + Mn Mn600 1.0 0.01389 0.91667 0.50000 1.0000 + Mn Mn601 1.0 0.59722 0.41667 0.50000 1.0000 + Mn Mn602 1.0 0.63889 0.45833 0.50000 1.0000 + Mn Mn603 1.0 0.68056 0.50000 0.50000 1.0000 + Mn Mn604 1.0 0.72222 0.54167 0.50000 1.0000 + Mn Mn605 1.0 0.76389 0.58333 0.50000 1.0000 + Mn Mn606 1.0 0.80556 0.62500 0.50000 1.0000 + Mn Mn607 1.0 0.84722 0.66667 0.50000 1.0000 + Mn Mn608 1.0 0.88889 0.70833 0.50000 1.0000 + Mn Mn609 1.0 0.93056 0.75000 0.50000 1.0000 + Mn Mn610 1.0 0.97222 0.79167 0.50000 1.0000 + Mn Mn611 1.0 0.01389 0.83333 0.50000 1.0000 + Mn Mn612 1.0 0.05556 0.87500 0.50000 1.0000 + Mn Mn613 1.0 0.63889 0.37500 0.50000 1.0000 + Mn Mn614 1.0 0.68056 0.41667 0.50000 1.0000 + Mn Mn615 1.0 0.72222 0.45833 0.50000 1.0000 + Mn Mn616 1.0 0.76389 0.50000 0.50000 1.0000 + Mn Mn617 1.0 0.80556 0.54167 0.50000 1.0000 + Mn Mn618 1.0 0.84722 0.58333 0.50000 1.0000 + Mn Mn619 1.0 0.88889 0.62500 0.50000 1.0000 + Mn Mn620 1.0 0.93056 0.66667 0.50000 1.0000 + Mn Mn621 1.0 0.97222 0.70833 0.50000 1.0000 + Mn Mn622 1.0 0.01389 0.75000 0.50000 1.0000 + Mn Mn623 1.0 0.05556 0.79167 0.50000 1.0000 + Mn Mn624 1.0 0.09722 0.83333 0.50000 1.0000 + Mn Mn625 1.0 0.68056 0.33333 0.50000 1.0000 + Mn Mn626 1.0 0.72222 0.37500 0.50000 1.0000 + Mn Mn627 1.0 0.76389 0.41667 0.50000 1.0000 + Mn Mn628 1.0 0.80556 0.45833 0.50000 1.0000 + Mn Mn629 1.0 0.84722 0.50000 0.50000 1.0000 + Mn Mn630 1.0 0.88889 0.54167 0.50000 1.0000 + Mn Mn631 1.0 0.93056 0.58333 0.50000 1.0000 + Mn Mn632 1.0 0.97222 0.62500 0.50000 1.0000 + Mn Mn633 1.0 0.01389 0.66667 0.50000 1.0000 + Mn Mn634 1.0 0.05556 0.70833 0.50000 1.0000 + Mn Mn635 1.0 0.09722 0.75000 0.50000 1.0000 + Mn Mn636 1.0 0.13889 0.79167 0.50000 1.0000 + Mn Mn637 1.0 0.72222 0.29167 0.50000 1.0000 + Mn Mn638 1.0 0.76389 0.33333 0.50000 1.0000 + Mn Mn639 1.0 0.80556 0.37500 0.50000 1.0000 + Mn Mn640 1.0 0.84722 0.41667 0.50000 1.0000 + Mn Mn641 1.0 0.88889 0.45833 0.50000 1.0000 + Mn Mn642 1.0 0.93056 0.50000 0.50000 1.0000 + Mn Mn643 1.0 0.97222 0.54167 0.50000 1.0000 + Mn Mn644 1.0 0.01389 0.58333 0.50000 1.0000 + Mn Mn645 1.0 0.05556 0.62500 0.50000 1.0000 + Mn Mn646 1.0 0.09722 0.66667 0.50000 1.0000 + Mn Mn647 1.0 0.13889 0.70833 0.50000 1.0000 + Mn Mn648 1.0 0.18056 0.75000 0.50000 1.0000 + Mn Mn649 1.0 0.76389 0.25000 0.50000 1.0000 + Mn Mn650 1.0 0.80556 0.29167 0.50000 1.0000 + Mn Mn651 1.0 0.84722 0.33333 0.50000 1.0000 + Mn Mn652 1.0 0.88889 0.37500 0.50000 1.0000 + Mn Mn653 1.0 0.93056 0.41667 0.50000 1.0000 + Mn Mn654 1.0 0.97222 0.45833 0.50000 1.0000 + Mn Mn655 1.0 0.01389 0.50000 0.50000 1.0000 + Mn Mn656 1.0 0.05556 0.54167 0.50000 1.0000 + Mn Mn657 1.0 0.09722 0.58333 0.50000 1.0000 + Mn Mn658 1.0 0.13889 0.62500 0.50000 1.0000 + Mn Mn659 1.0 0.18056 0.66667 0.50000 1.0000 + Mn Mn660 1.0 0.22222 0.70833 0.50000 1.0000 + Mn Mn661 1.0 0.80556 0.20833 0.50000 1.0000 + Mn Mn662 1.0 0.84722 0.25000 0.50000 1.0000 + Mn Mn663 1.0 0.88889 0.29167 0.50000 1.0000 + Mn Mn664 1.0 0.93056 0.33333 0.50000 1.0000 + Mn Mn665 1.0 0.97222 0.37500 0.50000 1.0000 + Mn Mn666 1.0 0.01389 0.41667 0.50000 1.0000 + Mn Mn667 1.0 0.05556 0.45833 0.50000 1.0000 + Mn Mn668 1.0 0.09722 0.50000 0.50000 1.0000 + Mn Mn669 1.0 0.13889 0.54167 0.50000 1.0000 + Mn Mn670 1.0 0.18056 0.58333 0.50000 1.0000 + Mn Mn671 1.0 0.22222 0.62500 0.50000 1.0000 + Mn Mn672 1.0 0.26389 0.66667 0.50000 1.0000 + Mn Mn673 1.0 0.84722 0.16667 0.50000 1.0000 + Mn Mn674 1.0 0.88889 0.20833 0.50000 1.0000 + Mn Mn675 1.0 0.93056 0.25000 0.50000 1.0000 + Mn Mn676 1.0 0.97222 0.29167 0.50000 1.0000 + Mn Mn677 1.0 0.01389 0.33333 0.50000 1.0000 + Mn Mn678 1.0 0.05556 0.37500 0.50000 1.0000 + Mn Mn679 1.0 0.09722 0.41667 0.50000 1.0000 + Mn Mn680 1.0 0.13889 0.45833 0.50000 1.0000 + Mn Mn681 1.0 0.18056 0.50000 0.50000 1.0000 + Mn Mn682 1.0 0.22222 0.54167 0.50000 1.0000 + Mn Mn683 1.0 0.26389 0.58333 0.50000 1.0000 + Mn Mn684 1.0 0.30556 0.62500 0.50000 1.0000 + Mn Mn685 1.0 0.88889 0.12500 0.50000 1.0000 + Mn Mn686 1.0 0.93056 0.16667 0.50000 1.0000 + Mn Mn687 1.0 0.97222 0.20833 0.50000 1.0000 + Mn Mn688 1.0 0.01389 0.25000 0.50000 1.0000 + Mn Mn689 1.0 0.05556 0.29167 0.50000 1.0000 + Mn Mn690 1.0 0.09722 0.33333 0.50000 1.0000 + Mn Mn691 1.0 0.13889 0.37500 0.50000 1.0000 + Mn Mn692 1.0 0.18056 0.41667 0.50000 1.0000 + Mn Mn693 1.0 0.22222 0.45833 0.50000 1.0000 + Mn Mn694 1.0 0.26389 0.50000 0.50000 1.0000 + Mn Mn695 1.0 0.30556 0.54167 0.50000 1.0000 + Mn Mn696 1.0 0.34722 0.58333 0.50000 1.0000 + Mn Mn697 1.0 0.93056 0.08333 0.50000 1.0000 + Mn Mn698 1.0 0.97222 0.12500 0.50000 1.0000 + Mn Mn699 1.0 0.01389 0.16667 0.50000 1.0000 + Mn Mn700 1.0 0.05556 0.20833 0.50000 1.0000 + Mn Mn701 1.0 0.09722 0.25000 0.50000 1.0000 + Mn Mn702 1.0 0.13889 0.29167 0.50000 1.0000 + Mn Mn703 1.0 0.18056 0.33333 0.50000 1.0000 + Mn Mn704 1.0 0.22222 0.37500 0.50000 1.0000 + Mn Mn705 1.0 0.26389 0.41667 0.50000 1.0000 + Mn Mn706 1.0 0.30556 0.45833 0.50000 1.0000 + Mn Mn707 1.0 0.34722 0.50000 0.50000 1.0000 + Mn Mn708 1.0 0.38889 0.54167 0.50000 1.0000 + Mn Mn709 1.0 0.97222 0.04167 0.50000 1.0000 + Mn Mn710 1.0 0.01389 0.08333 0.50000 1.0000 + Mn Mn711 1.0 0.05556 0.12500 0.50000 1.0000 + Mn Mn712 1.0 0.09722 0.16667 0.50000 1.0000 + Mn Mn713 1.0 0.13889 0.20833 0.50000 1.0000 + Mn Mn714 1.0 0.18056 0.25000 0.50000 1.0000 + Mn Mn715 1.0 0.22222 0.29167 0.50000 1.0000 + Mn Mn716 1.0 0.26389 0.33333 0.50000 1.0000 + Mn Mn717 1.0 0.30556 0.37500 0.50000 1.0000 + Mn Mn718 1.0 0.34722 0.41667 0.50000 1.0000 + Mn Mn719 1.0 0.38889 0.45833 0.50000 1.0000 + Mn Mn720 1.0 0.43056 0.50000 0.50000 1.0000 + Mn Mn721 1.0 0.53472 0.52083 0.50000 1.0000 + Mn Mn722 1.0 0.57639 0.56250 0.50000 1.0000 + Mn Mn723 1.0 0.61806 0.60417 0.50000 1.0000 + Mn Mn724 1.0 0.65972 0.64583 0.50000 1.0000 + Mn Mn725 1.0 0.70139 0.68750 0.50000 1.0000 + Mn Mn726 1.0 0.74306 0.72917 0.50000 1.0000 + Mn Mn727 1.0 0.78472 0.77083 0.50000 1.0000 + Mn Mn728 1.0 0.82639 0.81250 0.50000 1.0000 + Mn Mn729 1.0 0.86806 0.85417 0.50000 1.0000 + Mn Mn730 1.0 0.90972 0.89583 0.50000 1.0000 + Mn Mn731 1.0 0.95139 0.93750 0.50000 1.0000 + Mn Mn732 1.0 0.99306 0.97917 0.50000 1.0000 + Mn Mn733 1.0 0.57639 0.47917 0.50000 1.0000 + Mn Mn734 1.0 0.61806 0.52083 0.50000 1.0000 + Mn Mn735 1.0 0.65972 0.56250 0.50000 1.0000 + Mn Mn736 1.0 0.70139 0.60417 0.50000 1.0000 + Mn Mn737 1.0 0.74306 0.64583 0.50000 1.0000 + Mn Mn738 1.0 0.78472 0.68750 0.50000 1.0000 + Mn Mn739 1.0 0.82639 0.72917 0.50000 1.0000 + Mn Mn740 1.0 0.86806 0.77083 0.50000 1.0000 + Mn Mn741 1.0 0.90972 0.81250 0.50000 1.0000 + Mn Mn742 1.0 0.95139 0.85417 0.50000 1.0000 + Mn Mn743 1.0 0.99306 0.89583 0.50000 1.0000 + Mn Mn744 1.0 0.03472 0.93750 0.50000 1.0000 + Mn Mn745 1.0 0.61806 0.43750 0.50000 1.0000 + Mn Mn746 1.0 0.65972 0.47917 0.50000 1.0000 + Mn Mn747 1.0 0.70139 0.52083 0.50000 1.0000 + Mn Mn748 1.0 0.74306 0.56250 0.50000 1.0000 + Mn Mn749 1.0 0.78472 0.60417 0.50000 1.0000 + Mn Mn750 1.0 0.82639 0.64583 0.50000 1.0000 + Mn Mn751 1.0 0.86806 0.68750 0.50000 1.0000 + Mn Mn752 1.0 0.90972 0.72917 0.50000 1.0000 + Mn Mn753 1.0 0.95139 0.77083 0.50000 1.0000 + Mn Mn754 1.0 0.99306 0.81250 0.50000 1.0000 + Mn Mn755 1.0 0.03472 0.85417 0.50000 1.0000 + Mn Mn756 1.0 0.07639 0.89583 0.50000 1.0000 + Mn Mn757 1.0 0.65972 0.39583 0.50000 1.0000 + Mn Mn758 1.0 0.70139 0.43750 0.50000 1.0000 + Mn Mn759 1.0 0.74306 0.47917 0.50000 1.0000 + Mn Mn760 1.0 0.78472 0.52083 0.50000 1.0000 + Mn Mn761 1.0 0.82639 0.56250 0.50000 1.0000 + Mn Mn762 1.0 0.86806 0.60417 0.50000 1.0000 + Mn Mn763 1.0 0.90972 0.64583 0.50000 1.0000 + Mn Mn764 1.0 0.95139 0.68750 0.50000 1.0000 + Mn Mn765 1.0 0.99306 0.72917 0.50000 1.0000 + Mn Mn766 1.0 0.03472 0.77083 0.50000 1.0000 + Mn Mn767 1.0 0.07639 0.81250 0.50000 1.0000 + Mn Mn768 1.0 0.11806 0.85417 0.50000 1.0000 + Mn Mn769 1.0 0.70139 0.35417 0.50000 1.0000 + Mn Mn770 1.0 0.74306 0.39583 0.50000 1.0000 + Mn Mn771 1.0 0.78472 0.43750 0.50000 1.0000 + Mn Mn772 1.0 0.82639 0.47917 0.50000 1.0000 + Mn Mn773 1.0 0.86806 0.52083 0.50000 1.0000 + Mn Mn774 1.0 0.90972 0.56250 0.50000 1.0000 + Mn Mn775 1.0 0.95139 0.60417 0.50000 1.0000 + Mn Mn776 1.0 0.99306 0.64583 0.50000 1.0000 + Mn Mn777 1.0 0.03472 0.68750 0.50000 1.0000 + Mn Mn778 1.0 0.07639 0.72917 0.50000 1.0000 + Mn Mn779 1.0 0.11806 0.77083 0.50000 1.0000 + Mn Mn780 1.0 0.15972 0.81250 0.50000 1.0000 + Mn Mn781 1.0 0.74306 0.31250 0.50000 1.0000 + Mn Mn782 1.0 0.78472 0.35417 0.50000 1.0000 + Mn Mn783 1.0 0.82639 0.39583 0.50000 1.0000 + Mn Mn784 1.0 0.86806 0.43750 0.50000 1.0000 + Mn Mn785 1.0 0.90972 0.47917 0.50000 1.0000 + Mn Mn786 1.0 0.95139 0.52083 0.50000 1.0000 + Mn Mn787 1.0 0.99306 0.56250 0.50000 1.0000 + Mn Mn788 1.0 0.03472 0.60417 0.50000 1.0000 + Mn Mn789 1.0 0.07639 0.64583 0.50000 1.0000 + Mn Mn790 1.0 0.11806 0.68750 0.50000 1.0000 + Mn Mn791 1.0 0.15972 0.72917 0.50000 1.0000 + Mn Mn792 1.0 0.20139 0.77083 0.50000 1.0000 + Mn Mn793 1.0 0.78472 0.27083 0.50000 1.0000 + Mn Mn794 1.0 0.82639 0.31250 0.50000 1.0000 + Mn Mn795 1.0 0.86806 0.35417 0.50000 1.0000 + Mn Mn796 1.0 0.90972 0.39583 0.50000 1.0000 + Mn Mn797 1.0 0.95139 0.43750 0.50000 1.0000 + Mn Mn798 1.0 0.99306 0.47917 0.50000 1.0000 + Mn Mn799 1.0 0.03472 0.52083 0.50000 1.0000 + Mn Mn800 1.0 0.07639 0.56250 0.50000 1.0000 + Mn Mn801 1.0 0.11806 0.60417 0.50000 1.0000 + Mn Mn802 1.0 0.15972 0.64583 0.50000 1.0000 + Mn Mn803 1.0 0.20139 0.68750 0.50000 1.0000 + Mn Mn804 1.0 0.24306 0.72917 0.50000 1.0000 + Mn Mn805 1.0 0.82639 0.22917 0.50000 1.0000 + Mn Mn806 1.0 0.86806 0.27083 0.50000 1.0000 + Mn Mn807 1.0 0.90972 0.31250 0.50000 1.0000 + Mn Mn808 1.0 0.95139 0.35417 0.50000 1.0000 + Mn Mn809 1.0 0.99306 0.39583 0.50000 1.0000 + Mn Mn810 1.0 0.03472 0.43750 0.50000 1.0000 + Mn Mn811 1.0 0.07639 0.47917 0.50000 1.0000 + Mn Mn812 1.0 0.11806 0.52083 0.50000 1.0000 + Mn Mn813 1.0 0.15972 0.56250 0.50000 1.0000 + Mn Mn814 1.0 0.20139 0.60417 0.50000 1.0000 + Mn Mn815 1.0 0.24306 0.64583 0.50000 1.0000 + Mn Mn816 1.0 0.28472 0.68750 0.50000 1.0000 + Mn Mn817 1.0 0.86806 0.18750 0.50000 1.0000 + Mn Mn818 1.0 0.90972 0.22917 0.50000 1.0000 + Mn Mn819 1.0 0.95139 0.27083 0.50000 1.0000 + Mn Mn820 1.0 0.99306 0.31250 0.50000 1.0000 + Mn Mn821 1.0 0.03472 0.35417 0.50000 1.0000 + Mn Mn822 1.0 0.07639 0.39583 0.50000 1.0000 + Mn Mn823 1.0 0.11806 0.43750 0.50000 1.0000 + Mn Mn824 1.0 0.15972 0.47917 0.50000 1.0000 + Mn Mn825 1.0 0.20139 0.52083 0.50000 1.0000 + Mn Mn826 1.0 0.24306 0.56250 0.50000 1.0000 + Mn Mn827 1.0 0.28472 0.60417 0.50000 1.0000 + Mn Mn828 1.0 0.32639 0.64583 0.50000 1.0000 + Mn Mn829 1.0 0.90972 0.14583 0.50000 1.0000 + Mn Mn830 1.0 0.95139 0.18750 0.50000 1.0000 + Mn Mn831 1.0 0.99306 0.22917 0.50000 1.0000 + Mn Mn832 1.0 0.03472 0.27083 0.50000 1.0000 + Mn Mn833 1.0 0.07639 0.31250 0.50000 1.0000 + Mn Mn834 1.0 0.11806 0.35417 0.50000 1.0000 + Mn Mn835 1.0 0.15972 0.39583 0.50000 1.0000 + Mn Mn836 1.0 0.20139 0.43750 0.50000 1.0000 + Mn Mn837 1.0 0.24306 0.47917 0.50000 1.0000 + Mn Mn838 1.0 0.28472 0.52083 0.50000 1.0000 + Mn Mn839 1.0 0.32639 0.56250 0.50000 1.0000 + Mn Mn840 1.0 0.36806 0.60417 0.50000 1.0000 + Mn Mn841 1.0 0.95139 0.10417 0.50000 1.0000 + Mn Mn842 1.0 0.99306 0.14583 0.50000 1.0000 + Mn Mn843 1.0 0.03472 0.18750 0.50000 1.0000 + Mn Mn844 1.0 0.07639 0.22917 0.50000 1.0000 + Mn Mn845 1.0 0.11806 0.27083 0.50000 1.0000 + Mn Mn846 1.0 0.15972 0.31250 0.50000 1.0000 + Mn Mn847 1.0 0.20139 0.35417 0.50000 1.0000 + Mn Mn848 1.0 0.24306 0.39583 0.50000 1.0000 + Mn Mn849 1.0 0.28472 0.43750 0.50000 1.0000 + Mn Mn850 1.0 0.32639 0.47917 0.50000 1.0000 + Mn Mn851 1.0 0.36806 0.52083 0.50000 1.0000 + Mn Mn852 1.0 0.40972 0.56250 0.50000 1.0000 + Mn Mn853 1.0 0.99306 0.06250 0.50000 1.0000 + Mn Mn854 1.0 0.03472 0.10417 0.50000 1.0000 + Mn Mn855 1.0 0.07639 0.14583 0.50000 1.0000 + Mn Mn856 1.0 0.11806 0.18750 0.50000 1.0000 + Mn Mn857 1.0 0.15972 0.22917 0.50000 1.0000 + Mn Mn858 1.0 0.20139 0.27083 0.50000 1.0000 + Mn Mn859 1.0 0.24306 0.31250 0.50000 1.0000 + Mn Mn860 1.0 0.28472 0.35417 0.50000 1.0000 + Mn Mn861 1.0 0.32639 0.39583 0.50000 1.0000 + Mn Mn862 1.0 0.36806 0.43750 0.50000 1.0000 + Mn Mn863 1.0 0.40972 0.47917 0.50000 1.0000 + Mn Mn864 1.0 0.45139 0.52083 0.50000 1.0000 + Co Co145 1.0 0.55556 0.50000 0.50000 1.0000 + Co Co146 1.0 0.59722 0.54167 0.50000 1.0000 + Co Co147 1.0 0.63889 0.58333 0.50000 1.0000 + Co Co148 1.0 0.68056 0.62500 0.50000 1.0000 + Co Co149 1.0 0.72222 0.66667 0.50000 1.0000 + Co Co150 1.0 0.76389 0.70833 0.50000 1.0000 + Co Co151 1.0 0.80556 0.75000 0.50000 1.0000 + Co Co152 1.0 0.84722 0.79167 0.50000 1.0000 + Co Co153 1.0 0.88889 0.83333 0.50000 1.0000 + Co Co154 1.0 0.93056 0.87500 0.50000 1.0000 + Co Co155 1.0 0.97222 0.91667 0.50000 1.0000 + Co Co156 1.0 0.01389 0.95833 0.50000 1.0000 + Co Co157 1.0 0.59722 0.45833 0.50000 1.0000 + Co Co158 1.0 0.63889 0.50000 0.50000 1.0000 + Co Co159 1.0 0.68056 0.54167 0.50000 1.0000 + Co Co160 1.0 0.72222 0.58333 0.50000 1.0000 + Co Co161 1.0 0.76389 0.62500 0.50000 1.0000 + Co Co162 1.0 0.80556 0.66667 0.50000 1.0000 + Co Co163 1.0 0.84722 0.70833 0.50000 1.0000 + Co Co164 1.0 0.88889 0.75000 0.50000 1.0000 + Co Co165 1.0 0.93056 0.79167 0.50000 1.0000 + Co Co166 1.0 0.97222 0.83333 0.50000 1.0000 + Co Co167 1.0 0.01389 0.87500 0.50000 1.0000 + Co Co168 1.0 0.05556 0.91667 0.50000 1.0000 + Co Co169 1.0 0.63889 0.41667 0.50000 1.0000 + Co Co170 1.0 0.68056 0.45833 0.50000 1.0000 + Co Co171 1.0 0.72222 0.50000 0.50000 1.0000 + Co Co172 1.0 0.76389 0.54167 0.50000 1.0000 + Co Co173 1.0 0.80556 0.58333 0.50000 1.0000 + Co Co174 1.0 0.84722 0.62500 0.50000 1.0000 + Co Co175 1.0 0.88889 0.66667 0.50000 1.0000 + Co Co176 1.0 0.93056 0.70833 0.50000 1.0000 + Co Co177 1.0 0.97222 0.75000 0.50000 1.0000 + Co Co178 1.0 0.01389 0.79167 0.50000 1.0000 + Co Co179 1.0 0.05556 0.83333 0.50000 1.0000 + Co Co180 1.0 0.09722 0.87500 0.50000 1.0000 + Co Co181 1.0 0.68056 0.37500 0.50000 1.0000 + Co Co182 1.0 0.72222 0.41667 0.50000 1.0000 + Co Co183 1.0 0.76389 0.45833 0.50000 1.0000 + Co Co184 1.0 0.80556 0.50000 0.50000 1.0000 + Co Co185 1.0 0.84722 0.54167 0.50000 1.0000 + Co Co186 1.0 0.88889 0.58333 0.50000 1.0000 + Co Co187 1.0 0.93056 0.62500 0.50000 1.0000 + Co Co188 1.0 0.97222 0.66667 0.50000 1.0000 + Co Co189 1.0 0.01389 0.70833 0.50000 1.0000 + Co Co190 1.0 0.05556 0.75000 0.50000 1.0000 + Co Co191 1.0 0.09722 0.79167 0.50000 1.0000 + Co Co192 1.0 0.13889 0.83333 0.50000 1.0000 + Co Co193 1.0 0.72222 0.33333 0.50000 1.0000 + Co Co194 1.0 0.76389 0.37500 0.50000 1.0000 + Co Co195 1.0 0.80556 0.41667 0.50000 1.0000 + Co Co196 1.0 0.84722 0.45833 0.50000 1.0000 + Co Co197 1.0 0.88889 0.50000 0.50000 1.0000 + Co Co198 1.0 0.93056 0.54167 0.50000 1.0000 + Co Co199 1.0 0.97222 0.58333 0.50000 1.0000 + Co Co200 1.0 0.01389 0.62500 0.50000 1.0000 + Co Co201 1.0 0.05556 0.66667 0.50000 1.0000 + Co Co202 1.0 0.09722 0.70833 0.50000 1.0000 + Co Co203 1.0 0.13889 0.75000 0.50000 1.0000 + Co Co204 1.0 0.18056 0.79167 0.50000 1.0000 + Co Co205 1.0 0.76389 0.29167 0.50000 1.0000 + Co Co206 1.0 0.80556 0.33333 0.50000 1.0000 + Co Co207 1.0 0.84722 0.37500 0.50000 1.0000 + Co Co208 1.0 0.88889 0.41667 0.50000 1.0000 + Co Co209 1.0 0.93056 0.45833 0.50000 1.0000 + Co Co210 1.0 0.97222 0.50000 0.50000 1.0000 + Co Co211 1.0 0.01389 0.54167 0.50000 1.0000 + Co Co212 1.0 0.05556 0.58333 0.50000 1.0000 + Co Co213 1.0 0.09722 0.62500 0.50000 1.0000 + Co Co214 1.0 0.13889 0.66667 0.50000 1.0000 + Co Co215 1.0 0.18056 0.70833 0.50000 1.0000 + Co Co216 1.0 0.22222 0.75000 0.50000 1.0000 + Co Co217 1.0 0.80556 0.25000 0.50000 1.0000 + Co Co218 1.0 0.84722 0.29167 0.50000 1.0000 + Co Co219 1.0 0.88889 0.33333 0.50000 1.0000 + Co Co220 1.0 0.93056 0.37500 0.50000 1.0000 + Co Co221 1.0 0.97222 0.41667 0.50000 1.0000 + Co Co222 1.0 0.01389 0.45833 0.50000 1.0000 + Co Co223 1.0 0.05556 0.50000 0.50000 1.0000 + Co Co224 1.0 0.09722 0.54167 0.50000 1.0000 + Co Co225 1.0 0.13889 0.58333 0.50000 1.0000 + Co Co226 1.0 0.18056 0.62500 0.50000 1.0000 + Co Co227 1.0 0.22222 0.66667 0.50000 1.0000 + Co Co228 1.0 0.26389 0.70833 0.50000 1.0000 + Co Co229 1.0 0.84722 0.20833 0.50000 1.0000 + Co Co230 1.0 0.88889 0.25000 0.50000 1.0000 + Co Co231 1.0 0.93056 0.29167 0.50000 1.0000 + Co Co232 1.0 0.97222 0.33333 0.50000 1.0000 + Co Co233 1.0 0.01389 0.37500 0.50000 1.0000 + Co Co234 1.0 0.05556 0.41667 0.50000 1.0000 + Co Co235 1.0 0.09722 0.45833 0.50000 1.0000 + Co Co236 1.0 0.13889 0.50000 0.50000 1.0000 + Co Co237 1.0 0.18056 0.54167 0.50000 1.0000 + Co Co238 1.0 0.22222 0.58333 0.50000 1.0000 + Co Co239 1.0 0.26389 0.62500 0.50000 1.0000 + Co Co240 1.0 0.30556 0.66667 0.50000 1.0000 + Co Co241 1.0 0.88889 0.16667 0.50000 1.0000 + Co Co242 1.0 0.93056 0.20833 0.50000 1.0000 + Co Co243 1.0 0.97222 0.25000 0.50000 1.0000 + Co Co244 1.0 0.01389 0.29167 0.50000 1.0000 + Co Co245 1.0 0.05556 0.33333 0.50000 1.0000 + Co Co246 1.0 0.09722 0.37500 0.50000 1.0000 + Co Co247 1.0 0.13889 0.41667 0.50000 1.0000 + Co Co248 1.0 0.18056 0.45833 0.50000 1.0000 + Co Co249 1.0 0.22222 0.50000 0.50000 1.0000 + Co Co250 1.0 0.26389 0.54167 0.50000 1.0000 + Co Co251 1.0 0.30556 0.58333 0.50000 1.0000 + Co Co252 1.0 0.34722 0.62500 0.50000 1.0000 + Co Co253 1.0 0.93056 0.12500 0.50000 1.0000 + Co Co254 1.0 0.97222 0.16667 0.50000 1.0000 + Co Co255 1.0 0.01389 0.20833 0.50000 1.0000 + Co Co256 1.0 0.05556 0.25000 0.50000 1.0000 + Co Co257 1.0 0.09722 0.29167 0.50000 1.0000 + Co Co258 1.0 0.13889 0.33333 0.50000 1.0000 + Co Co259 1.0 0.18056 0.37500 0.50000 1.0000 + Co Co260 1.0 0.22222 0.41667 0.50000 1.0000 + Co Co261 1.0 0.26389 0.45833 0.50000 1.0000 + Co Co262 1.0 0.30556 0.50000 0.50000 1.0000 + Co Co263 1.0 0.34722 0.54167 0.50000 1.0000 + Co Co264 1.0 0.38889 0.58333 0.50000 1.0000 + Co Co265 1.0 0.97222 0.08333 0.50000 1.0000 + Co Co266 1.0 0.01389 0.12500 0.50000 1.0000 + Co Co267 1.0 0.05556 0.16667 0.50000 1.0000 + Co Co268 1.0 0.09722 0.20833 0.50000 1.0000 + Co Co269 1.0 0.13889 0.25000 0.50000 1.0000 + Co Co270 1.0 0.18056 0.29167 0.50000 1.0000 + Co Co271 1.0 0.22222 0.33333 0.50000 1.0000 + Co Co272 1.0 0.26389 0.37500 0.50000 1.0000 + Co Co273 1.0 0.30556 0.41667 0.50000 1.0000 + Co Co274 1.0 0.34722 0.45833 0.50000 1.0000 + Co Co275 1.0 0.38889 0.50000 0.50000 1.0000 + Co Co276 1.0 0.43056 0.54167 0.50000 1.0000 + Co Co277 1.0 0.01389 0.04167 0.50000 1.0000 + Co Co278 1.0 0.05556 0.08333 0.50000 1.0000 + Co Co279 1.0 0.09722 0.12500 0.50000 1.0000 + Co Co280 1.0 0.13889 0.16667 0.50000 1.0000 + Co Co281 1.0 0.18056 0.20833 0.50000 1.0000 + Co Co282 1.0 0.22222 0.25000 0.50000 1.0000 + Co Co283 1.0 0.26389 0.29167 0.50000 1.0000 + Co Co284 1.0 0.30556 0.33333 0.50000 1.0000 + Co Co285 1.0 0.34722 0.37500 0.50000 1.0000 + Co Co286 1.0 0.38889 0.41667 0.50000 1.0000 + Co Co287 1.0 0.43056 0.45833 0.50000 1.0000 + Co Co288 1.0 0.47222 0.50000 0.50000 1.0000 + O O1153 1.0 0.54853 0.52108 0.33817 1.0000 + O O1154 1.0 0.59020 0.56275 0.33817 1.0000 + O O1155 1.0 0.63186 0.60441 0.33817 1.0000 + O O1156 1.0 0.67353 0.64608 0.33817 1.0000 + O O1157 1.0 0.71520 0.68775 0.33817 1.0000 + O O1158 1.0 0.75686 0.72941 0.33817 1.0000 + O O1159 1.0 0.79853 0.77108 0.33817 1.0000 + O O1160 1.0 0.84020 0.81275 0.33817 1.0000 + O O1161 1.0 0.88186 0.85441 0.33817 1.0000 + O O1162 1.0 0.92353 0.89608 0.33817 1.0000 + O O1163 1.0 0.96520 0.93775 0.33817 1.0000 + O O1164 1.0 0.00686 0.97941 0.33817 1.0000 + O O1165 1.0 0.59020 0.47941 0.33817 1.0000 + O O1166 1.0 0.63186 0.52108 0.33817 1.0000 + O O1167 1.0 0.67353 0.56275 0.33817 1.0000 + O O1168 1.0 0.71520 0.60441 0.33817 1.0000 + O O1169 1.0 0.75686 0.64608 0.33817 1.0000 + O O1170 1.0 0.79853 0.68775 0.33817 1.0000 + O O1171 1.0 0.84020 0.72941 0.33817 1.0000 + O O1172 1.0 0.88186 0.77108 0.33817 1.0000 + O O1173 1.0 0.92353 0.81275 0.33817 1.0000 + O O1174 1.0 0.96520 0.85441 0.33817 1.0000 + O O1175 1.0 0.00686 0.89608 0.33817 1.0000 + O O1176 1.0 0.04853 0.93775 0.33817 1.0000 + O O1177 1.0 0.63186 0.43775 0.33817 1.0000 + O O1178 1.0 0.67353 0.47941 0.33817 1.0000 + O O1179 1.0 0.71520 0.52108 0.33817 1.0000 + O O1180 1.0 0.75686 0.56275 0.33817 1.0000 + O O1181 1.0 0.79853 0.60441 0.33817 1.0000 + O O1182 1.0 0.84020 0.64608 0.33817 1.0000 + O O1183 1.0 0.88186 0.68775 0.33817 1.0000 + O O1184 1.0 0.92353 0.72941 0.33817 1.0000 + O O1185 1.0 0.96520 0.77108 0.33817 1.0000 + O O1186 1.0 0.00686 0.81275 0.33817 1.0000 + O O1187 1.0 0.04853 0.85441 0.33817 1.0000 + O O1188 1.0 0.09020 0.89608 0.33817 1.0000 + O O1189 1.0 0.67353 0.39608 0.33817 1.0000 + O O1190 1.0 0.71520 0.43775 0.33817 1.0000 + O O1191 1.0 0.75686 0.47941 0.33817 1.0000 + O O1192 1.0 0.79853 0.52108 0.33817 1.0000 + O O1193 1.0 0.84020 0.56275 0.33817 1.0000 + O O1194 1.0 0.88186 0.60441 0.33817 1.0000 + O O1195 1.0 0.92353 0.64608 0.33817 1.0000 + O O1196 1.0 0.96520 0.68775 0.33817 1.0000 + O O1197 1.0 0.00686 0.72941 0.33817 1.0000 + O O1198 1.0 0.04853 0.77108 0.33817 1.0000 + O O1199 1.0 0.09020 0.81275 0.33817 1.0000 + O O1200 1.0 0.13186 0.85441 0.33817 1.0000 + O O1201 1.0 0.71520 0.35441 0.33817 1.0000 + O O1202 1.0 0.75686 0.39608 0.33817 1.0000 + O O1203 1.0 0.79853 0.43775 0.33817 1.0000 + O O1204 1.0 0.84020 0.47941 0.33817 1.0000 + O O1205 1.0 0.88186 0.52108 0.33817 1.0000 + O O1206 1.0 0.92353 0.56275 0.33817 1.0000 + O O1207 1.0 0.96520 0.60441 0.33817 1.0000 + O O1208 1.0 0.00686 0.64608 0.33817 1.0000 + O O1209 1.0 0.04853 0.68775 0.33817 1.0000 + O O1210 1.0 0.09020 0.72941 0.33817 1.0000 + O O1211 1.0 0.13186 0.77108 0.33817 1.0000 + O O1212 1.0 0.17353 0.81275 0.33817 1.0000 + O O1213 1.0 0.75686 0.31275 0.33817 1.0000 + O O1214 1.0 0.79853 0.35441 0.33817 1.0000 + O O1215 1.0 0.84020 0.39608 0.33817 1.0000 + O O1216 1.0 0.88186 0.43775 0.33817 1.0000 + O O1217 1.0 0.92353 0.47941 0.33817 1.0000 + O O1218 1.0 0.96520 0.52108 0.33817 1.0000 + O O1219 1.0 0.00686 0.56275 0.33817 1.0000 + O O1220 1.0 0.04853 0.60441 0.33817 1.0000 + O O1221 1.0 0.09020 0.64608 0.33817 1.0000 + O O1222 1.0 0.13186 0.68775 0.33817 1.0000 + O O1223 1.0 0.17353 0.72941 0.33817 1.0000 + O O1224 1.0 0.21520 0.77108 0.33817 1.0000 + O O1225 1.0 0.79853 0.27108 0.33817 1.0000 + O O1226 1.0 0.84020 0.31275 0.33817 1.0000 + O O1227 1.0 0.88186 0.35441 0.33817 1.0000 + O O1228 1.0 0.92353 0.39608 0.33817 1.0000 + O O1229 1.0 0.96520 0.43775 0.33817 1.0000 + O O1230 1.0 0.00686 0.47941 0.33817 1.0000 + O O1231 1.0 0.04853 0.52108 0.33817 1.0000 + O O1232 1.0 0.09020 0.56275 0.33817 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Bi Bi520 1.0 0.61046 0.30621 0.50000 1.0000 + Bi Bi521 1.0 0.61046 0.38954 0.50000 1.0000 + Bi Bi522 1.0 0.61046 0.47288 0.50000 1.0000 + Bi Bi523 1.0 0.61046 0.55621 0.50000 1.0000 + Bi Bi524 1.0 0.61046 0.63954 0.50000 1.0000 + Bi Bi525 1.0 0.61046 0.72288 0.50000 1.0000 + Bi Bi526 1.0 0.61046 0.80621 0.50000 1.0000 + Bi Bi527 1.0 0.61046 0.88954 0.50000 1.0000 + Bi Bi528 1.0 0.61046 0.97288 0.50000 1.0000 + Bi Bi529 1.0 0.69379 0.05621 0.50000 1.0000 + Bi Bi530 1.0 0.69379 0.13954 0.50000 1.0000 + Bi Bi531 1.0 0.69379 0.22288 0.50000 1.0000 + Bi Bi532 1.0 0.69379 0.30621 0.50000 1.0000 + Bi Bi533 1.0 0.69379 0.38954 0.50000 1.0000 + Bi Bi534 1.0 0.69379 0.47288 0.50000 1.0000 + Bi Bi535 1.0 0.69379 0.55621 0.50000 1.0000 + Bi Bi536 1.0 0.69379 0.63954 0.50000 1.0000 + Bi Bi537 1.0 0.69379 0.72288 0.50000 1.0000 + Bi Bi538 1.0 0.69379 0.80621 0.50000 1.0000 + Bi Bi539 1.0 0.69379 0.88954 0.50000 1.0000 + Bi Bi540 1.0 0.69379 0.97288 0.50000 1.0000 + Bi Bi541 1.0 0.77712 0.05621 0.50000 1.0000 + Bi Bi542 1.0 0.77712 0.13954 0.50000 1.0000 + Bi Bi543 1.0 0.77712 0.22288 0.50000 1.0000 + Bi Bi544 1.0 0.77712 0.30621 0.50000 1.0000 + Bi Bi545 1.0 0.77712 0.38954 0.50000 1.0000 + Bi Bi546 1.0 0.77712 0.47288 0.50000 1.0000 + Bi Bi547 1.0 0.77712 0.55621 0.50000 1.0000 + Bi Bi548 1.0 0.77712 0.63954 0.50000 1.0000 + Bi Bi549 1.0 0.77712 0.72288 0.50000 1.0000 + Bi Bi550 1.0 0.77712 0.80621 0.50000 1.0000 + Bi Bi551 1.0 0.77712 0.88954 0.50000 1.0000 + Bi Bi552 1.0 0.77712 0.97288 0.50000 1.0000 + Bi Bi553 1.0 0.86046 0.05621 0.50000 1.0000 + Bi Bi554 1.0 0.86046 0.13954 0.50000 1.0000 + Bi Bi555 1.0 0.86046 0.22288 0.50000 1.0000 + Bi Bi556 1.0 0.86046 0.30621 0.50000 1.0000 + Bi Bi557 1.0 0.86046 0.38954 0.50000 1.0000 + Bi Bi558 1.0 0.86046 0.47288 0.50000 1.0000 + Bi Bi559 1.0 0.86046 0.55621 0.50000 1.0000 + Bi Bi560 1.0 0.86046 0.63954 0.50000 1.0000 + Bi Bi561 1.0 0.86046 0.72288 0.50000 1.0000 + Bi Bi562 1.0 0.86046 0.80621 0.50000 1.0000 + Bi Bi563 1.0 0.86046 0.88954 0.50000 1.0000 + Bi Bi564 1.0 0.86046 0.97288 0.50000 1.0000 + Bi Bi565 1.0 0.94379 0.05621 0.50000 1.0000 + Bi Bi566 1.0 0.94379 0.13954 0.50000 1.0000 + Bi Bi567 1.0 0.94379 0.22288 0.50000 1.0000 + Bi Bi568 1.0 0.94379 0.30621 0.50000 1.0000 + Bi Bi569 1.0 0.94379 0.38954 0.50000 1.0000 + Bi Bi570 1.0 0.94379 0.47288 0.50000 1.0000 + Bi Bi571 1.0 0.94379 0.55621 0.50000 1.0000 + Bi Bi572 1.0 0.94379 0.63954 0.50000 1.0000 + Bi Bi573 1.0 0.94379 0.72288 0.50000 1.0000 + Bi Bi574 1.0 0.94379 0.80621 0.50000 1.0000 + Bi Bi575 1.0 0.94379 0.88954 0.50000 1.0000 + Bi Bi576 1.0 0.94379 0.97288 0.50000 1.0000 + Pd Pd1 1.0 0.00000 0.04167 0.67324 1.0000 + Pd Pd2 1.0 1.00000 0.12500 0.67324 1.0000 + Pd Pd3 1.0 1.00000 0.20833 0.67324 1.0000 + Pd Pd4 1.0 0.00000 0.29167 0.67324 1.0000 + Pd Pd5 1.0 1.00000 0.37500 0.67324 1.0000 + Pd Pd6 1.0 0.00000 0.45833 0.67324 1.0000 + Pd Pd7 1.0 1.00000 0.54167 0.67324 1.0000 + Pd Pd8 1.0 1.00000 0.62500 0.67324 1.0000 + Pd Pd9 1.0 1.00000 0.70833 0.67324 1.0000 + Pd Pd10 1.0 1.00000 0.79167 0.67324 1.0000 + Pd Pd11 1.0 1.00000 0.87500 0.67324 1.0000 + Pd Pd12 1.0 1.00000 0.95833 0.67324 1.0000 + Pd Pd13 1.0 0.08333 0.04167 0.67324 1.0000 + Pd Pd14 1.0 0.08333 0.12500 0.67324 1.0000 + Pd Pd15 1.0 0.08333 0.20833 0.67324 1.0000 + Pd Pd16 1.0 0.08333 0.29167 0.67324 1.0000 + Pd Pd17 1.0 0.08333 0.37500 0.67324 1.0000 + Pd Pd18 1.0 0.08333 0.45833 0.67324 1.0000 + Pd Pd19 1.0 0.08333 0.54167 0.67324 1.0000 + Pd Pd20 1.0 0.08333 0.62500 0.67324 1.0000 + Pd Pd21 1.0 0.08333 0.70833 0.67324 1.0000 + Pd Pd22 1.0 0.08333 0.79167 0.67324 1.0000 + Pd Pd23 1.0 0.08333 0.87500 0.67324 1.0000 + Pd Pd24 1.0 0.08333 0.95833 0.67324 1.0000 + Pd Pd25 1.0 0.16667 0.04167 0.67324 1.0000 + Pd Pd26 1.0 0.16667 0.12500 0.67324 1.0000 + Pd Pd27 1.0 0.16667 0.20833 0.67324 1.0000 + Pd Pd28 1.0 0.16667 0.29167 0.67324 1.0000 + Pd Pd29 1.0 0.16667 0.37500 0.67324 1.0000 + Pd Pd30 1.0 0.16667 0.45833 0.67324 1.0000 + Pd Pd31 1.0 0.16667 0.54167 0.67324 1.0000 + Pd Pd32 1.0 0.16667 0.62500 0.67324 1.0000 + Pd Pd33 1.0 0.16667 0.70833 0.67324 1.0000 + Pd Pd34 1.0 0.16667 0.79167 0.67324 1.0000 + Pd Pd35 1.0 0.16667 0.87500 0.67324 1.0000 + Pd Pd36 1.0 0.16667 0.95833 0.67324 1.0000 + Pd Pd37 1.0 0.25000 0.04167 0.67324 1.0000 + Pd Pd38 1.0 0.25000 0.12500 0.67324 1.0000 + Pd Pd39 1.0 0.25000 0.20833 0.67324 1.0000 + Pd Pd40 1.0 0.25000 0.29167 0.67324 1.0000 + Pd Pd41 1.0 0.25000 0.37500 0.67324 1.0000 + Pd Pd42 1.0 0.25000 0.45833 0.67324 1.0000 + Pd Pd43 1.0 0.25000 0.54167 0.67324 1.0000 + Pd Pd44 1.0 0.25000 0.62500 0.67324 1.0000 + Pd Pd45 1.0 0.25000 0.70833 0.67324 1.0000 + Pd Pd46 1.0 0.25000 0.79167 0.67324 1.0000 + Pd Pd47 1.0 0.25000 0.87500 0.67324 1.0000 + Pd Pd48 1.0 0.25000 0.95833 0.67324 1.0000 + Pd Pd49 1.0 0.33333 0.04167 0.67324 1.0000 + Pd Pd50 1.0 0.33333 0.12500 0.67324 1.0000 + Pd Pd51 1.0 0.33333 0.20833 0.67324 1.0000 + Pd Pd52 1.0 0.33333 0.29167 0.67324 1.0000 + Pd Pd53 1.0 0.33333 0.37500 0.67324 1.0000 + Pd Pd54 1.0 0.33333 0.45833 0.67324 1.0000 + Pd Pd55 1.0 0.33333 0.54167 0.67324 1.0000 + Pd Pd56 1.0 0.33333 0.62500 0.67324 1.0000 + Pd Pd57 1.0 0.33333 0.70833 0.67324 1.0000 + Pd Pd58 1.0 0.33333 0.79167 0.67324 1.0000 + Pd Pd59 1.0 0.33333 0.87500 0.67324 1.0000 + Pd Pd60 1.0 0.33333 0.95833 0.67324 1.0000 + Pd Pd61 1.0 0.41667 0.04167 0.67324 1.0000 + Pd Pd62 1.0 0.41667 0.12500 0.67324 1.0000 + Pd Pd63 1.0 0.41667 0.20833 0.67324 1.0000 + Pd Pd64 1.0 0.41667 0.29167 0.67324 1.0000 + Pd Pd65 1.0 0.41667 0.37500 0.67324 1.0000 + Pd Pd66 1.0 0.41667 0.45833 0.67324 1.0000 + Pd Pd67 1.0 0.41667 0.54167 0.67324 1.0000 + Pd Pd68 1.0 0.41667 0.62500 0.67324 1.0000 + Pd Pd69 1.0 0.41667 0.70833 0.67324 1.0000 + Pd Pd70 1.0 0.41667 0.79167 0.67324 1.0000 + Pd Pd71 1.0 0.41667 0.87500 0.67324 1.0000 + Pd Pd72 1.0 0.41667 0.95833 0.67324 1.0000 + Pd Pd73 1.0 0.50000 0.04167 0.67324 1.0000 + Pd Pd74 1.0 0.50000 0.12500 0.67324 1.0000 + Pd Pd75 1.0 0.50000 0.20833 0.67324 1.0000 + Pd Pd76 1.0 0.50000 0.29167 0.67324 1.0000 + Pd Pd77 1.0 0.50000 0.37500 0.67324 1.0000 + Pd Pd78 1.0 0.50000 0.45833 0.67324 1.0000 + Pd Pd79 1.0 0.50000 0.54167 0.67324 1.0000 + Pd Pd80 1.0 0.50000 0.62500 0.67324 1.0000 + Pd Pd81 1.0 0.50000 0.70833 0.67324 1.0000 + Pd Pd82 1.0 0.50000 0.79167 0.67324 1.0000 + Pd Pd83 1.0 0.50000 0.87500 0.67324 1.0000 + Pd Pd84 1.0 0.50000 0.95833 0.67324 1.0000 + Pd Pd85 1.0 0.58333 0.04167 0.67324 1.0000 + Pd Pd86 1.0 0.58333 0.12500 0.67324 1.0000 + Pd Pd87 1.0 0.58333 0.20833 0.67324 1.0000 + Pd Pd88 1.0 0.58333 0.29167 0.67324 1.0000 + Pd Pd89 1.0 0.58333 0.37500 0.67324 1.0000 + Pd Pd90 1.0 0.58333 0.45833 0.67324 1.0000 + Pd Pd91 1.0 0.58333 0.54167 0.67324 1.0000 + Pd Pd92 1.0 0.58333 0.62500 0.67324 1.0000 + Pd Pd93 1.0 0.58333 0.70833 0.67324 1.0000 + Pd Pd94 1.0 0.58333 0.79167 0.67324 1.0000 + Pd Pd95 1.0 0.58333 0.87500 0.67324 1.0000 + Pd Pd96 1.0 0.58333 0.95833 0.67324 1.0000 + Pd Pd97 1.0 0.66667 0.04167 0.67324 1.0000 + Pd Pd98 1.0 0.66667 0.12500 0.67324 1.0000 + Pd Pd99 1.0 0.66667 0.20833 0.67324 1.0000 + Pd Pd100 1.0 0.66667 0.29167 0.67324 1.0000 + Pd Pd101 1.0 0.66667 0.37500 0.67324 1.0000 + Pd Pd102 1.0 0.66667 0.45833 0.67324 1.0000 + Pd Pd103 1.0 0.66667 0.54167 0.67324 1.0000 + Pd Pd104 1.0 0.66667 0.62500 0.67324 1.0000 + Pd Pd105 1.0 0.66667 0.70833 0.67324 1.0000 + Pd Pd106 1.0 0.66667 0.79167 0.67324 1.0000 + Pd Pd107 1.0 0.66667 0.87500 0.67324 1.0000 + Pd Pd108 1.0 0.66667 0.95833 0.67324 1.0000 + Pd Pd109 1.0 0.75000 0.04167 0.67324 1.0000 + Pd Pd110 1.0 0.75000 0.12500 0.67324 1.0000 + Pd Pd111 1.0 0.75000 0.20833 0.67324 1.0000 + Pd Pd112 1.0 0.75000 0.29167 0.67324 1.0000 + Pd Pd113 1.0 0.75000 0.37500 0.67324 1.0000 + Pd Pd114 1.0 0.75000 0.45833 0.67324 1.0000 + Pd Pd115 1.0 0.75000 0.54167 0.67324 1.0000 + Pd Pd116 1.0 0.75000 0.62500 0.67324 1.0000 + Pd Pd117 1.0 0.75000 0.70833 0.67324 1.0000 + Pd Pd118 1.0 0.75000 0.79167 0.67324 1.0000 + Pd Pd119 1.0 0.75000 0.87500 0.67324 1.0000 + Pd Pd120 1.0 0.75000 0.95833 0.67324 1.0000 + Pd Pd121 1.0 0.83333 0.04167 0.67324 1.0000 + Pd Pd122 1.0 0.83333 0.12500 0.67324 1.0000 + Pd Pd123 1.0 0.83333 0.20833 0.67324 1.0000 + Pd Pd124 1.0 0.83333 0.29167 0.67324 1.0000 + Pd Pd125 1.0 0.83333 0.37500 0.67324 1.0000 + Pd Pd126 1.0 0.83333 0.45833 0.67324 1.0000 + Pd Pd127 1.0 0.83333 0.54167 0.67324 1.0000 + Pd Pd128 1.0 0.83333 0.62500 0.67324 1.0000 + Pd Pd129 1.0 0.83333 0.70833 0.67324 1.0000 + Pd Pd130 1.0 0.83333 0.79167 0.67324 1.0000 + Pd Pd131 1.0 0.83333 0.87500 0.67324 1.0000 + Pd Pd132 1.0 0.83333 0.95833 0.67324 1.0000 + Pd Pd133 1.0 0.91667 0.04167 0.67324 1.0000 + Pd Pd134 1.0 0.91667 0.12500 0.67324 1.0000 + Pd Pd135 1.0 0.91667 0.20833 0.67324 1.0000 + Pd Pd136 1.0 0.91667 0.29167 0.67324 1.0000 + Pd Pd137 1.0 0.91667 0.37500 0.67324 1.0000 + Pd Pd138 1.0 0.91667 0.45833 0.67324 1.0000 + Pd Pd139 1.0 0.91667 0.54167 0.67324 1.0000 + Pd Pd140 1.0 0.91667 0.62500 0.67324 1.0000 + Pd Pd141 1.0 0.91667 0.70833 0.67324 1.0000 + Pd Pd142 1.0 0.91667 0.79167 0.67324 1.0000 + Pd Pd143 1.0 0.91667 0.87500 0.67324 1.0000 + Pd Pd144 1.0 0.91667 0.95833 0.67324 1.0000 + Pd Pd145 1.0 0.04167 0.00000 0.32676 1.0000 + Pd Pd146 1.0 0.04167 0.08333 0.32676 1.0000 + Pd Pd147 1.0 0.04167 0.16667 0.32676 1.0000 + Pd Pd148 1.0 0.04167 0.25000 0.32676 1.0000 + Pd Pd149 1.0 0.04167 0.33333 0.32676 1.0000 + Pd Pd150 1.0 0.04167 0.41667 0.32676 1.0000 + Pd Pd151 1.0 0.04167 0.50000 0.32676 1.0000 + Pd Pd152 1.0 0.04167 0.58333 0.32676 1.0000 + Pd Pd153 1.0 0.04167 0.66667 0.32676 1.0000 + Pd Pd154 1.0 0.04167 0.75000 0.32676 1.0000 + Pd Pd155 1.0 0.04167 0.83333 0.32676 1.0000 + Pd Pd156 1.0 0.04167 0.91667 0.32676 1.0000 + Pd Pd157 1.0 0.12500 0.00000 0.32676 1.0000 + Pd Pd158 1.0 0.12500 0.08333 0.32676 1.0000 + Pd Pd159 1.0 0.12500 0.16667 0.32676 1.0000 + Pd Pd160 1.0 0.12500 0.25000 0.32676 1.0000 + Pd Pd161 1.0 0.12500 0.33333 0.32676 1.0000 + Pd Pd162 1.0 0.12500 0.41667 0.32676 1.0000 + Pd Pd163 1.0 0.12500 0.50000 0.32676 1.0000 + Pd Pd164 1.0 0.12500 0.58333 0.32676 1.0000 + Pd Pd165 1.0 0.12500 0.66667 0.32676 1.0000 + Pd Pd166 1.0 0.12500 0.75000 0.32676 1.0000 + Pd Pd167 1.0 0.12500 0.83333 0.32676 1.0000 + Pd Pd168 1.0 0.12500 0.91667 0.32676 1.0000 + Pd Pd169 1.0 0.20833 0.00000 0.32676 1.0000 + Pd Pd170 1.0 0.20833 0.08333 0.32676 1.0000 + Pd Pd171 1.0 0.20833 0.16667 0.32676 1.0000 + Pd Pd172 1.0 0.20833 0.25000 0.32676 1.0000 + Pd Pd173 1.0 0.20833 0.33333 0.32676 1.0000 + Pd Pd174 1.0 0.20833 0.41667 0.32676 1.0000 + Pd Pd175 1.0 0.20833 0.50000 0.32676 1.0000 + Pd Pd176 1.0 0.20833 0.58333 0.32676 1.0000 + Pd Pd177 1.0 0.20833 0.66667 0.32676 1.0000 + Pd Pd178 1.0 0.20833 0.75000 0.32676 1.0000 + Pd Pd179 1.0 0.20833 0.83333 0.32676 1.0000 + Pd Pd180 1.0 0.20833 0.91667 0.32676 1.0000 + Pd Pd181 1.0 0.29167 0.00000 0.32676 1.0000 + Pd Pd182 1.0 0.29167 0.08333 0.32676 1.0000 + Pd Pd183 1.0 0.29167 0.16667 0.32676 1.0000 + Pd Pd184 1.0 0.29167 0.25000 0.32676 1.0000 + Pd Pd185 1.0 0.29167 0.33333 0.32676 1.0000 + Pd Pd186 1.0 0.29167 0.41667 0.32676 1.0000 + Pd Pd187 1.0 0.29167 0.50000 0.32676 1.0000 + Pd Pd188 1.0 0.29167 0.58333 0.32676 1.0000 + Pd Pd189 1.0 0.29167 0.66667 0.32676 1.0000 + Pd Pd190 1.0 0.29167 0.75000 0.32676 1.0000 + Pd Pd191 1.0 0.29167 0.83333 0.32676 1.0000 + Pd Pd192 1.0 0.29167 0.91667 0.32676 1.0000 + Pd Pd193 1.0 0.37500 0.00000 0.32676 1.0000 + Pd Pd194 1.0 0.37500 0.08333 0.32676 1.0000 + Pd Pd195 1.0 0.37500 0.16667 0.32676 1.0000 + Pd Pd196 1.0 0.37500 0.25000 0.32676 1.0000 + Pd Pd197 1.0 0.37500 0.33333 0.32676 1.0000 + Pd Pd198 1.0 0.37500 0.41667 0.32676 1.0000 + Pd Pd199 1.0 0.37500 0.50000 0.32676 1.0000 + Pd Pd200 1.0 0.37500 0.58333 0.32676 1.0000 + Pd Pd201 1.0 0.37500 0.66667 0.32676 1.0000 + Pd Pd202 1.0 0.37500 0.75000 0.32676 1.0000 + Pd Pd203 1.0 0.37500 0.83333 0.32676 1.0000 + Pd Pd204 1.0 0.37500 0.91667 0.32676 1.0000 + Pd Pd205 1.0 0.45833 0.00000 0.32676 1.0000 + Pd Pd206 1.0 0.45833 0.08333 0.32676 1.0000 + Pd Pd207 1.0 0.45833 0.16667 0.32676 1.0000 + Pd Pd208 1.0 0.45833 0.25000 0.32676 1.0000 + Pd Pd209 1.0 0.45833 0.33333 0.32676 1.0000 + Pd Pd210 1.0 0.45833 0.41667 0.32676 1.0000 + Pd Pd211 1.0 0.45833 0.50000 0.32676 1.0000 + Pd Pd212 1.0 0.45833 0.58333 0.32676 1.0000 + Pd Pd213 1.0 0.45833 0.66667 0.32676 1.0000 + Pd Pd214 1.0 0.45833 0.75000 0.32676 1.0000 + Pd Pd215 1.0 0.45833 0.83333 0.32676 1.0000 + Pd Pd216 1.0 0.45833 0.91667 0.32676 1.0000 + Pd Pd217 1.0 0.54167 0.00000 0.32676 1.0000 + Pd Pd218 1.0 0.54167 0.08333 0.32676 1.0000 + Pd Pd219 1.0 0.54167 0.16667 0.32676 1.0000 + Pd Pd220 1.0 0.54167 0.25000 0.32676 1.0000 + Pd Pd221 1.0 0.54167 0.33333 0.32676 1.0000 + Pd Pd222 1.0 0.54167 0.41667 0.32676 1.0000 + Pd Pd223 1.0 0.54167 0.50000 0.32676 1.0000 + Pd Pd224 1.0 0.54167 0.58333 0.32676 1.0000 + Pd Pd225 1.0 0.54167 0.66667 0.32676 1.0000 + Pd Pd226 1.0 0.54167 0.75000 0.32676 1.0000 + Pd Pd227 1.0 0.54167 0.83333 0.32676 1.0000 + Pd Pd228 1.0 0.54167 0.91667 0.32676 1.0000 + Pd Pd229 1.0 0.62500 0.00000 0.32676 1.0000 + Pd Pd230 1.0 0.62500 0.08333 0.32676 1.0000 + Pd Pd231 1.0 0.62500 0.16667 0.32676 1.0000 + Pd Pd232 1.0 0.62500 0.25000 0.32676 1.0000 + Pd Pd233 1.0 0.62500 0.33333 0.32676 1.0000 + Pd Pd234 1.0 0.62500 0.41667 0.32676 1.0000 + Pd Pd235 1.0 0.62500 0.50000 0.32676 1.0000 + Pd Pd236 1.0 0.62500 0.58333 0.32676 1.0000 + Pd Pd237 1.0 0.62500 0.66667 0.32676 1.0000 + Pd Pd238 1.0 0.62500 0.75000 0.32676 1.0000 + Pd Pd239 1.0 0.62500 0.83333 0.32676 1.0000 + Pd Pd240 1.0 0.62500 0.91667 0.32676 1.0000 + Pd Pd241 1.0 0.70833 0.00000 0.32676 1.0000 + Pd Pd242 1.0 0.70833 0.08333 0.32676 1.0000 + Pd Pd243 1.0 0.70833 0.16667 0.32676 1.0000 + Pd Pd244 1.0 0.70833 0.25000 0.32676 1.0000 + Pd Pd245 1.0 0.70833 0.33333 0.32676 1.0000 + Pd Pd246 1.0 0.70833 0.41667 0.32676 1.0000 + Pd Pd247 1.0 0.70833 0.50000 0.32676 1.0000 + Pd Pd248 1.0 0.70833 0.58333 0.32676 1.0000 + Pd Pd249 1.0 0.70833 0.66667 0.32676 1.0000 + Pd Pd250 1.0 0.70833 0.75000 0.32676 1.0000 + Pd Pd251 1.0 0.70833 0.83333 0.32676 1.0000 + Pd Pd252 1.0 0.70833 0.91667 0.32676 1.0000 + Pd Pd253 1.0 0.79167 0.00000 0.32676 1.0000 + Pd Pd254 1.0 0.79167 0.08333 0.32676 1.0000 + Pd Pd255 1.0 0.79167 0.16667 0.32676 1.0000 + Pd Pd256 1.0 0.79167 0.25000 0.32676 1.0000 + Pd Pd257 1.0 0.79167 0.33333 0.32676 1.0000 + Pd Pd258 1.0 0.79167 0.41667 0.32676 1.0000 + Pd Pd259 1.0 0.79167 0.50000 0.32676 1.0000 + Pd Pd260 1.0 0.79167 0.58333 0.32676 1.0000 + Pd Pd261 1.0 0.79167 0.66667 0.32676 1.0000 + Pd Pd262 1.0 0.79167 0.75000 0.32676 1.0000 + Pd Pd263 1.0 0.79167 0.83333 0.32676 1.0000 + Pd Pd264 1.0 0.79167 0.91667 0.32676 1.0000 + Pd Pd265 1.0 0.87500 0.00000 0.32676 1.0000 + Pd Pd266 1.0 0.87500 0.08333 0.32676 1.0000 + Pd Pd267 1.0 0.87500 0.16667 0.32676 1.0000 + Pd Pd268 1.0 0.87500 0.25000 0.32676 1.0000 + Pd Pd269 1.0 0.87500 0.33333 0.32676 1.0000 + Pd Pd270 1.0 0.87500 0.41667 0.32676 1.0000 + Pd Pd271 1.0 0.87500 0.50000 0.32676 1.0000 + Pd Pd272 1.0 0.87500 0.58333 0.32676 1.0000 + Pd Pd273 1.0 0.87500 0.66667 0.32676 1.0000 + Pd Pd274 1.0 0.87500 0.75000 0.32676 1.0000 + Pd Pd275 1.0 0.87500 0.83333 0.32676 1.0000 + Pd Pd276 1.0 0.87500 0.91667 0.32676 1.0000 + Pd Pd277 1.0 0.95833 0.00000 0.32676 1.0000 + Pd Pd278 1.0 0.95833 0.08333 0.32676 1.0000 + Pd Pd279 1.0 0.95833 0.16667 0.32676 1.0000 + Pd Pd280 1.0 0.95833 0.25000 0.32676 1.0000 + Pd Pd281 1.0 0.95833 0.33333 0.32676 1.0000 + Pd Pd282 1.0 0.95833 0.41667 0.32676 1.0000 + Pd Pd283 1.0 0.95833 0.50000 0.32676 1.0000 + Pd Pd284 1.0 0.95833 0.58333 0.32676 1.0000 + Pd Pd285 1.0 0.95833 0.66667 0.32676 1.0000 + Pd Pd286 1.0 0.95833 0.75000 0.32676 1.0000 + Pd Pd287 1.0 0.95833 0.83333 0.32676 1.0000 + Pd Pd288 1.0 0.95833 0.91667 0.32676 1.0000 + O O1 1.0 0.06448 0.04983 0.65694 1.0000 + O O2 1.0 0.06448 0.13317 0.65694 1.0000 + O O3 1.0 0.06448 0.21650 0.65694 1.0000 + O O4 1.0 0.06448 0.29983 0.65694 1.0000 + O O5 1.0 0.06448 0.38317 0.65694 1.0000 + O O6 1.0 0.06448 0.46650 0.65694 1.0000 + O O7 1.0 0.06448 0.54983 0.65694 1.0000 + O O8 1.0 0.06448 0.63317 0.65694 1.0000 + O O9 1.0 0.06448 0.71650 0.65694 1.0000 + O O10 1.0 0.06448 0.79983 0.65694 1.0000 + O O11 1.0 0.06448 0.88317 0.65694 1.0000 + O O12 1.0 0.06448 0.96650 0.65694 1.0000 + O O13 1.0 0.14781 0.04983 0.65694 1.0000 + O O14 1.0 0.14781 0.13317 0.65694 1.0000 + O O15 1.0 0.14781 0.21650 0.65694 1.0000 + O O16 1.0 0.14781 0.29983 0.65694 1.0000 + O O17 1.0 0.14781 0.38317 0.65694 1.0000 + O O18 1.0 0.14781 0.46650 0.65694 1.0000 + O O19 1.0 0.14781 0.54983 0.65694 1.0000 + O O20 1.0 0.14781 0.63317 0.65694 1.0000 + O O21 1.0 0.14781 0.71650 0.65694 1.0000 + O O22 1.0 0.14781 0.79983 0.65694 1.0000 + O O23 1.0 0.14781 0.88317 0.65694 1.0000 + O O24 1.0 0.14781 0.96650 0.65694 1.0000 + O O25 1.0 0.23114 0.04983 0.65694 1.0000 + O O26 1.0 0.23114 0.13317 0.65694 1.0000 + O O27 1.0 0.23114 0.21650 0.65694 1.0000 + O O28 1.0 0.23114 0.29983 0.65694 1.0000 + O O29 1.0 0.23114 0.38317 0.65694 1.0000 + O O30 1.0 0.23114 0.46650 0.65694 1.0000 + O O31 1.0 0.23114 0.54983 0.65694 1.0000 + O O32 1.0 0.23114 0.63317 0.65694 1.0000 + O O33 1.0 0.23114 0.71650 0.65694 1.0000 + O O34 1.0 0.23114 0.79983 0.65694 1.0000 + O O35 1.0 0.23114 0.88317 0.65694 1.0000 + O O36 1.0 0.23114 0.96650 0.65694 1.0000 + O O37 1.0 0.31448 0.04983 0.65694 1.0000 + O O38 1.0 0.31448 0.13317 0.65694 1.0000 + O O39 1.0 0.31448 0.21650 0.65694 1.0000 + O O40 1.0 0.31448 0.29983 0.65694 1.0000 + O O41 1.0 0.31448 0.38317 0.65694 1.0000 + O O42 1.0 0.31448 0.46650 0.65694 1.0000 + O O43 1.0 0.31448 0.54983 0.65694 1.0000 + O O44 1.0 0.31448 0.63317 0.65694 1.0000 + O O45 1.0 0.31448 0.71650 0.65694 1.0000 + O O46 1.0 0.31448 0.79983 0.65694 1.0000 + O O47 1.0 0.31448 0.88317 0.65694 1.0000 + O O48 1.0 0.31448 0.96650 0.65694 1.0000 + O O49 1.0 0.39781 0.04983 0.65694 1.0000 + O O50 1.0 0.39781 0.13317 0.65694 1.0000 + O O51 1.0 0.39781 0.21650 0.65694 1.0000 + O O52 1.0 0.39781 0.29983 0.65694 1.0000 + O O53 1.0 0.39781 0.38317 0.65694 1.0000 + O O54 1.0 0.39781 0.46650 0.65694 1.0000 + O O55 1.0 0.39781 0.54983 0.65694 1.0000 + O O56 1.0 0.39781 0.63317 0.65694 1.0000 + O O57 1.0 0.39781 0.71650 0.65694 1.0000 + O O58 1.0 0.39781 0.79983 0.65694 1.0000 + O O59 1.0 0.39781 0.88317 0.65694 1.0000 + O O60 1.0 0.39781 0.96650 0.65694 1.0000 + O O61 1.0 0.48114 0.04983 0.65694 1.0000 + O O62 1.0 0.48114 0.13317 0.65694 1.0000 + O O63 1.0 0.48114 0.21650 0.65694 1.0000 + O O64 1.0 0.48114 0.29983 0.65694 1.0000 + O O65 1.0 0.48114 0.38317 0.65694 1.0000 + O O66 1.0 0.48114 0.46650 0.65694 1.0000 + O O67 1.0 0.48114 0.54983 0.65694 1.0000 + O O68 1.0 0.48114 0.63317 0.65694 1.0000 + O O69 1.0 0.48114 0.71650 0.65694 1.0000 + O O70 1.0 0.48114 0.79983 0.65694 1.0000 + O O71 1.0 0.48114 0.88317 0.65694 1.0000 + O O72 1.0 0.48114 0.96650 0.65694 1.0000 + O O73 1.0 0.56448 0.04983 0.65694 1.0000 + O O74 1.0 0.56448 0.13317 0.65694 1.0000 + O O75 1.0 0.56448 0.21650 0.65694 1.0000 + O O76 1.0 0.56448 0.29983 0.65694 1.0000 + O O77 1.0 0.56448 0.38317 0.65694 1.0000 + O O78 1.0 0.56448 0.46650 0.65694 1.0000 + O O79 1.0 0.56448 0.54983 0.65694 1.0000 + O O80 1.0 0.56448 0.63317 0.65694 1.0000 + O O81 1.0 0.56448 0.71650 0.65694 1.0000 + O O82 1.0 0.56448 0.79983 0.65694 1.0000 + O O83 1.0 0.56448 0.88317 0.65694 1.0000 + O O84 1.0 0.56448 0.96650 0.65694 1.0000 + O O85 1.0 0.64781 0.04983 0.65694 1.0000 + O O86 1.0 0.64781 0.13317 0.65694 1.0000 + O O87 1.0 0.64781 0.21650 0.65694 1.0000 + O O88 1.0 0.64781 0.29983 0.65694 1.0000 + O O89 1.0 0.64781 0.38317 0.65694 1.0000 + O O90 1.0 0.64781 0.46650 0.65694 1.0000 + O O91 1.0 0.64781 0.54983 0.65694 1.0000 + O O92 1.0 0.64781 0.63317 0.65694 1.0000 + O O93 1.0 0.64781 0.71650 0.65694 1.0000 + O O94 1.0 0.64781 0.79983 0.65694 1.0000 + O O95 1.0 0.64781 0.88317 0.65694 1.0000 + O O96 1.0 0.64781 0.96650 0.65694 1.0000 + O O97 1.0 0.73114 0.04983 0.65694 1.0000 + O O98 1.0 0.73114 0.13317 0.65694 1.0000 + O O99 1.0 0.73114 0.21650 0.65694 1.0000 + O O100 1.0 0.73114 0.29983 0.65694 1.0000 + O O101 1.0 0.73114 0.38317 0.65694 1.0000 + O O102 1.0 0.73114 0.46650 0.65694 1.0000 + O O103 1.0 0.73114 0.54983 0.65694 1.0000 + O O104 1.0 0.73114 0.63317 0.65694 1.0000 + O O105 1.0 0.73114 0.71650 0.65694 1.0000 + O O106 1.0 0.73114 0.79983 0.65694 1.0000 + O O107 1.0 0.73114 0.88317 0.65694 1.0000 + O O108 1.0 0.73114 0.96650 0.65694 1.0000 + O O109 1.0 0.81448 0.04983 0.65694 1.0000 + O O110 1.0 0.81448 0.13317 0.65694 1.0000 + O O111 1.0 0.81448 0.21650 0.65694 1.0000 + O O112 1.0 0.81448 0.29983 0.65694 1.0000 + O O113 1.0 0.81448 0.38317 0.65694 1.0000 + O O114 1.0 0.81448 0.46650 0.65694 1.0000 + O O115 1.0 0.81448 0.54983 0.65694 1.0000 + O O116 1.0 0.81448 0.63317 0.65694 1.0000 + O O117 1.0 0.81448 0.71650 0.65694 1.0000 + O O118 1.0 0.81448 0.79983 0.65694 1.0000 + O O119 1.0 0.81448 0.88317 0.65694 1.0000 + O O120 1.0 0.81448 0.96650 0.65694 1.0000 + O O121 1.0 0.89781 0.04983 0.65694 1.0000 + O O122 1.0 0.89781 0.13317 0.65694 1.0000 + O O123 1.0 0.89781 0.21650 0.65694 1.0000 + O O124 1.0 0.89781 0.29983 0.65694 1.0000 + O O125 1.0 0.89781 0.38317 0.65694 1.0000 + O O126 1.0 0.89781 0.46650 0.65694 1.0000 + O O127 1.0 0.89781 0.54983 0.65694 1.0000 + O O128 1.0 0.89781 0.63317 0.65694 1.0000 + O O129 1.0 0.89781 0.71650 0.65694 1.0000 + O O130 1.0 0.89781 0.79983 0.65694 1.0000 + O O131 1.0 0.89781 0.88317 0.65694 1.0000 + O O132 1.0 0.89781 0.96650 0.65694 1.0000 + O O133 1.0 0.98114 0.04983 0.65694 1.0000 + O O134 1.0 0.98114 0.13317 0.65694 1.0000 + O O135 1.0 0.98114 0.21650 0.65694 1.0000 + O O136 1.0 0.98114 0.29983 0.65694 1.0000 + O O137 1.0 0.98114 0.38317 0.65694 1.0000 + O O138 1.0 0.98114 0.46650 0.65694 1.0000 + O O139 1.0 0.98114 0.54983 0.65694 1.0000 + O O140 1.0 0.98114 0.63317 0.65694 1.0000 + O O141 1.0 0.98114 0.71650 0.65694 1.0000 + O O142 1.0 0.98114 0.79983 0.65694 1.0000 + O O143 1.0 0.98114 0.88317 0.65694 1.0000 + O O144 1.0 0.98114 0.96650 0.65694 1.0000 + O O145 1.0 0.01886 0.03350 0.65694 1.0000 + O O146 1.0 0.01886 0.11683 0.65694 1.0000 + O O147 1.0 0.01886 0.20017 0.65694 1.0000 + O O148 1.0 0.01886 0.28350 0.65694 1.0000 + O O149 1.0 0.01886 0.36683 0.65694 1.0000 + O O150 1.0 0.01886 0.45017 0.65694 1.0000 + O O151 1.0 0.01886 0.53350 0.65694 1.0000 + O O152 1.0 0.01886 0.61683 0.65694 1.0000 + O O153 1.0 0.01886 0.70017 0.65694 1.0000 + O O154 1.0 0.01886 0.78350 0.65694 1.0000 + O O155 1.0 0.01886 0.86683 0.65694 1.0000 + O O156 1.0 0.01886 0.95017 0.65694 1.0000 + O O157 1.0 0.10219 0.03350 0.65694 1.0000 + O O158 1.0 0.10219 0.11683 0.65694 1.0000 + O O159 1.0 0.10219 0.20017 0.65694 1.0000 + O O160 1.0 0.10219 0.28350 0.65694 1.0000 + O O161 1.0 0.10219 0.36683 0.65694 1.0000 + O O162 1.0 0.10219 0.45017 0.65694 1.0000 + O O163 1.0 0.10219 0.53350 0.65694 1.0000 + O O164 1.0 0.10219 0.61683 0.65694 1.0000 + O O165 1.0 0.10219 0.70017 0.65694 1.0000 + O O166 1.0 0.10219 0.78350 0.65694 1.0000 + O O167 1.0 0.10219 0.86683 0.65694 1.0000 + O O168 1.0 0.10219 0.95017 0.65694 1.0000 + O O169 1.0 0.18552 0.03350 0.65694 1.0000 + O O170 1.0 0.18552 0.11683 0.65694 1.0000 + O O171 1.0 0.18552 0.20017 0.65694 1.0000 + O O172 1.0 0.18552 0.28350 0.65694 1.0000 + O O173 1.0 0.18552 0.36683 0.65694 1.0000 + O O174 1.0 0.18552 0.45017 0.65694 1.0000 + O O175 1.0 0.18552 0.53350 0.65694 1.0000 + O O176 1.0 0.18552 0.61683 0.65694 1.0000 + O O177 1.0 0.18552 0.70017 0.65694 1.0000 + O O178 1.0 0.18552 0.78350 0.65694 1.0000 + O O179 1.0 0.18552 0.86683 0.65694 1.0000 + O O180 1.0 0.18552 0.95017 0.65694 1.0000 + O O181 1.0 0.26886 0.03350 0.65694 1.0000 + O O182 1.0 0.26886 0.11683 0.65694 1.0000 + O O183 1.0 0.26886 0.20017 0.65694 1.0000 + O O184 1.0 0.26886 0.28350 0.65694 1.0000 + O O185 1.0 0.26886 0.36683 0.65694 1.0000 + O O186 1.0 0.26886 0.45017 0.65694 1.0000 + O O187 1.0 0.26886 0.53350 0.65694 1.0000 + O O188 1.0 0.26886 0.61683 0.65694 1.0000 + O O189 1.0 0.26886 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0.76886 0.34306 1.0000 + O O1139 1.0 0.86683 0.85219 0.34306 1.0000 + O O1140 1.0 0.86683 0.93552 0.34306 1.0000 + O O1141 1.0 0.95017 0.01886 0.34306 1.0000 + O O1142 1.0 0.95017 0.10219 0.34306 1.0000 + O O1143 1.0 0.95017 0.18552 0.34306 1.0000 + O O1144 1.0 0.95017 0.26886 0.34306 1.0000 + O O1145 1.0 0.95017 0.35219 0.34306 1.0000 + O O1146 1.0 0.95017 0.43552 0.34306 1.0000 + O O1147 1.0 0.95017 0.51886 0.34306 1.0000 + O O1148 1.0 0.95017 0.60219 0.34306 1.0000 + O O1149 1.0 0.95017 0.68552 0.34306 1.0000 + O O1150 1.0 0.95017 0.76886 0.34306 1.0000 + O O1151 1.0 0.95017 0.85219 0.34306 1.0000 + O O1152 1.0 0.95017 0.93552 0.34306 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-5070_supercell_8x8x1.cif b/tier3/cif_file/orthogonal_2dm-5070_supercell_8x8x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..50f8394b7ac6dd8ce6276c5e3de9b0e9308d6ead --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-5070_supercell_8x8x1.cif @@ -0,0 +1,1817 @@ +data_image0 +_chemical_formula_structural Mg256Sb512O1024 +_chemical_formula_sum "Mg256 Sb512 O1024" +_cell_length_a 85.46 +_cell_length_b 81.3731 +_cell_length_c 6.4605 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Mg Mg1 1.0 0.09376 0.01693 0.41251 1.0000 + Mg Mg2 1.0 0.09376 0.14193 0.41251 1.0000 + Mg Mg3 1.0 0.09376 0.26693 0.41251 1.0000 + Mg Mg4 1.0 0.09376 0.39193 0.41251 1.0000 + Mg Mg5 1.0 0.09376 0.51693 0.41251 1.0000 + Mg Mg6 1.0 0.09376 0.64193 0.41251 1.0000 + Mg Mg7 1.0 0.09376 0.76693 0.41251 1.0000 + Mg Mg8 1.0 0.09376 0.89193 0.41251 1.0000 + Mg Mg9 1.0 0.21876 0.01693 0.41251 1.0000 + Mg Mg10 1.0 0.21876 0.14193 0.41251 1.0000 + Mg Mg11 1.0 0.21876 0.26693 0.41251 1.0000 + Mg Mg12 1.0 0.21876 0.39193 0.41251 1.0000 + Mg Mg13 1.0 0.21876 0.51693 0.41251 1.0000 + Mg Mg14 1.0 0.21876 0.64193 0.41251 1.0000 + Mg Mg15 1.0 0.21876 0.76693 0.41251 1.0000 + Mg Mg16 1.0 0.21876 0.89193 0.41251 1.0000 + Mg Mg17 1.0 0.34376 0.01693 0.41251 1.0000 + Mg Mg18 1.0 0.34376 0.14193 0.41251 1.0000 + Mg Mg19 1.0 0.34376 0.26693 0.41251 1.0000 + Mg Mg20 1.0 0.34376 0.39193 0.41251 1.0000 + Mg Mg21 1.0 0.34376 0.51693 0.41251 1.0000 + Mg Mg22 1.0 0.34376 0.64193 0.41251 1.0000 + Mg Mg23 1.0 0.34376 0.76693 0.41251 1.0000 + Mg Mg24 1.0 0.34376 0.89193 0.41251 1.0000 + Mg Mg25 1.0 0.46876 0.01693 0.41251 1.0000 + Mg Mg26 1.0 0.46876 0.14193 0.41251 1.0000 + Mg Mg27 1.0 0.46876 0.26693 0.41251 1.0000 + Mg Mg28 1.0 0.46876 0.39193 0.41251 1.0000 + Mg Mg29 1.0 0.46876 0.51693 0.41251 1.0000 + Mg Mg30 1.0 0.46876 0.64193 0.41251 1.0000 + Mg Mg31 1.0 0.46876 0.76693 0.41251 1.0000 + Mg Mg32 1.0 0.46876 0.89193 0.41251 1.0000 + Mg Mg33 1.0 0.59376 0.01693 0.41251 1.0000 + Mg Mg34 1.0 0.59376 0.14193 0.41251 1.0000 + Mg Mg35 1.0 0.59376 0.26693 0.41251 1.0000 + Mg Mg36 1.0 0.59376 0.39193 0.41251 1.0000 + Mg Mg37 1.0 0.59376 0.51693 0.41251 1.0000 + Mg Mg38 1.0 0.59376 0.64193 0.41251 1.0000 + Mg Mg39 1.0 0.59376 0.76693 0.41251 1.0000 + Mg Mg40 1.0 0.59376 0.89193 0.41251 1.0000 + Mg Mg41 1.0 0.71876 0.01693 0.41251 1.0000 + Mg Mg42 1.0 0.71876 0.14193 0.41251 1.0000 + Mg Mg43 1.0 0.71876 0.26693 0.41251 1.0000 + Mg Mg44 1.0 0.71876 0.39193 0.41251 1.0000 + Mg Mg45 1.0 0.71876 0.51693 0.41251 1.0000 + Mg Mg46 1.0 0.71876 0.64193 0.41251 1.0000 + Mg Mg47 1.0 0.71876 0.76693 0.41251 1.0000 + Mg Mg48 1.0 0.71876 0.89193 0.41251 1.0000 + Mg Mg49 1.0 0.84376 0.01693 0.41251 1.0000 + Mg Mg50 1.0 0.84376 0.14193 0.41251 1.0000 + Mg Mg51 1.0 0.84376 0.26693 0.41251 1.0000 + Mg Mg52 1.0 0.84376 0.39193 0.41251 1.0000 + Mg Mg53 1.0 0.84376 0.51693 0.41251 1.0000 + Mg Mg54 1.0 0.84376 0.64193 0.41251 1.0000 + Mg Mg55 1.0 0.84376 0.76693 0.41251 1.0000 + Mg Mg56 1.0 0.84376 0.89193 0.41251 1.0000 + Mg Mg57 1.0 0.96876 0.01693 0.41251 1.0000 + Mg Mg58 1.0 0.96876 0.14193 0.41251 1.0000 + Mg Mg59 1.0 0.96876 0.26693 0.41251 1.0000 + Mg Mg60 1.0 0.96876 0.39193 0.41251 1.0000 + Mg Mg61 1.0 0.96876 0.51693 0.41251 1.0000 + Mg Mg62 1.0 0.96876 0.64193 0.41251 1.0000 + Mg Mg63 1.0 0.96876 0.76693 0.41251 1.0000 + Mg Mg64 1.0 0.96876 0.89193 0.41251 1.0000 + Mg Mg65 1.0 0.03126 0.04557 0.41239 1.0000 + Mg Mg66 1.0 0.03126 0.17057 0.41239 1.0000 + Mg Mg67 1.0 0.03126 0.29557 0.41239 1.0000 + Mg Mg68 1.0 0.03126 0.42057 0.41239 1.0000 + Mg Mg69 1.0 0.03126 0.54557 0.41239 1.0000 + Mg Mg70 1.0 0.03126 0.67057 0.41239 1.0000 + Mg Mg71 1.0 0.03126 0.79557 0.41239 1.0000 + Mg Mg72 1.0 0.03126 0.92057 0.41239 1.0000 + Mg Mg73 1.0 0.15626 0.04557 0.41239 1.0000 + Mg Mg74 1.0 0.15626 0.17057 0.41239 1.0000 + Mg Mg75 1.0 0.15626 0.29557 0.41239 1.0000 + Mg Mg76 1.0 0.15626 0.42057 0.41239 1.0000 + Mg Mg77 1.0 0.15626 0.54557 0.41239 1.0000 + Mg Mg78 1.0 0.15626 0.67057 0.41239 1.0000 + Mg Mg79 1.0 0.15626 0.79557 0.41239 1.0000 + Mg Mg80 1.0 0.15626 0.92057 0.41239 1.0000 + Mg Mg81 1.0 0.28126 0.04557 0.41239 1.0000 + Mg Mg82 1.0 0.28126 0.17057 0.41239 1.0000 + Mg Mg83 1.0 0.28126 0.29557 0.41239 1.0000 + Mg Mg84 1.0 0.28126 0.42057 0.41239 1.0000 + Mg Mg85 1.0 0.28126 0.54557 0.41239 1.0000 + Mg Mg86 1.0 0.28126 0.67057 0.41239 1.0000 + Mg Mg87 1.0 0.28126 0.79557 0.41239 1.0000 + Mg Mg88 1.0 0.28126 0.92057 0.41239 1.0000 + Mg Mg89 1.0 0.40626 0.04557 0.41239 1.0000 + Mg Mg90 1.0 0.40626 0.17057 0.41239 1.0000 + Mg Mg91 1.0 0.40626 0.29557 0.41239 1.0000 + Mg Mg92 1.0 0.40626 0.42057 0.41239 1.0000 + Mg Mg93 1.0 0.40626 0.54557 0.41239 1.0000 + Mg Mg94 1.0 0.40626 0.67057 0.41239 1.0000 + Mg Mg95 1.0 0.40626 0.79557 0.41239 1.0000 + Mg Mg96 1.0 0.40626 0.92057 0.41239 1.0000 + Mg Mg97 1.0 0.53126 0.04557 0.41239 1.0000 + Mg Mg98 1.0 0.53126 0.17057 0.41239 1.0000 + Mg Mg99 1.0 0.53126 0.29557 0.41239 1.0000 + Mg Mg100 1.0 0.53126 0.42057 0.41239 1.0000 + Mg Mg101 1.0 0.53126 0.54557 0.41239 1.0000 + Mg Mg102 1.0 0.53126 0.67057 0.41239 1.0000 + Mg Mg103 1.0 0.53126 0.79557 0.41239 1.0000 + Mg Mg104 1.0 0.53126 0.92057 0.41239 1.0000 + Mg Mg105 1.0 0.65626 0.04557 0.41239 1.0000 + Mg Mg106 1.0 0.65626 0.17057 0.41239 1.0000 + Mg Mg107 1.0 0.65626 0.29557 0.41239 1.0000 + Mg Mg108 1.0 0.65626 0.42057 0.41239 1.0000 + Mg Mg109 1.0 0.65626 0.54557 0.41239 1.0000 + Mg Mg110 1.0 0.65626 0.67057 0.41239 1.0000 + Mg Mg111 1.0 0.65626 0.79557 0.41239 1.0000 + Mg Mg112 1.0 0.65626 0.92057 0.41239 1.0000 + Mg Mg113 1.0 0.78126 0.04557 0.41239 1.0000 + Mg Mg114 1.0 0.78126 0.17057 0.41239 1.0000 + Mg Mg115 1.0 0.78126 0.29557 0.41239 1.0000 + Mg Mg116 1.0 0.78126 0.42057 0.41239 1.0000 + Mg Mg117 1.0 0.78126 0.54557 0.41239 1.0000 + Mg Mg118 1.0 0.78126 0.67057 0.41239 1.0000 + Mg Mg119 1.0 0.78126 0.79557 0.41239 1.0000 + Mg Mg120 1.0 0.78126 0.92057 0.41239 1.0000 + Mg Mg121 1.0 0.90626 0.04557 0.41239 1.0000 + Mg Mg122 1.0 0.90626 0.17057 0.41239 1.0000 + Mg Mg123 1.0 0.90626 0.29557 0.41239 1.0000 + Mg Mg124 1.0 0.90626 0.42057 0.41239 1.0000 + Mg Mg125 1.0 0.90626 0.54557 0.41239 1.0000 + Mg Mg126 1.0 0.90626 0.67057 0.41239 1.0000 + Mg Mg127 1.0 0.90626 0.79557 0.41239 1.0000 + Mg Mg128 1.0 0.90626 0.92057 0.41239 1.0000 + Mg Mg129 1.0 0.09374 0.07943 0.58761 1.0000 + Mg Mg130 1.0 0.09374 0.20443 0.58761 1.0000 + Mg Mg131 1.0 0.09374 0.32943 0.58761 1.0000 + Mg Mg132 1.0 0.09374 0.45443 0.58761 1.0000 + Mg Mg133 1.0 0.09374 0.57943 0.58761 1.0000 + Mg Mg134 1.0 0.09374 0.70443 0.58761 1.0000 + Mg Mg135 1.0 0.09374 0.82943 0.58761 1.0000 + Mg Mg136 1.0 0.09374 0.95443 0.58761 1.0000 + Mg Mg137 1.0 0.21874 0.07943 0.58761 1.0000 + Mg Mg138 1.0 0.21874 0.20443 0.58761 1.0000 + Mg Mg139 1.0 0.21874 0.32943 0.58761 1.0000 + Mg Mg140 1.0 0.21874 0.45443 0.58761 1.0000 + Mg Mg141 1.0 0.21874 0.57943 0.58761 1.0000 + Mg Mg142 1.0 0.21874 0.70443 0.58761 1.0000 + Mg Mg143 1.0 0.21874 0.82943 0.58761 1.0000 + Mg Mg144 1.0 0.21874 0.95443 0.58761 1.0000 + Mg Mg145 1.0 0.34374 0.07943 0.58761 1.0000 + Mg Mg146 1.0 0.34374 0.20443 0.58761 1.0000 + Mg Mg147 1.0 0.34374 0.32943 0.58761 1.0000 + Mg Mg148 1.0 0.34374 0.45443 0.58761 1.0000 + Mg Mg149 1.0 0.34374 0.57943 0.58761 1.0000 + Mg Mg150 1.0 0.34374 0.70443 0.58761 1.0000 + Mg Mg151 1.0 0.34374 0.82943 0.58761 1.0000 + Mg Mg152 1.0 0.34374 0.95443 0.58761 1.0000 + Mg Mg153 1.0 0.46874 0.07943 0.58761 1.0000 + Mg Mg154 1.0 0.46874 0.20443 0.58761 1.0000 + Mg Mg155 1.0 0.46874 0.32943 0.58761 1.0000 + Mg Mg156 1.0 0.46874 0.45443 0.58761 1.0000 + Mg Mg157 1.0 0.46874 0.57943 0.58761 1.0000 + Mg Mg158 1.0 0.46874 0.70443 0.58761 1.0000 + Mg Mg159 1.0 0.46874 0.82943 0.58761 1.0000 + Mg Mg160 1.0 0.46874 0.95443 0.58761 1.0000 + Mg Mg161 1.0 0.59374 0.07943 0.58761 1.0000 + Mg Mg162 1.0 0.59374 0.20443 0.58761 1.0000 + Mg Mg163 1.0 0.59374 0.32943 0.58761 1.0000 + Mg Mg164 1.0 0.59374 0.45443 0.58761 1.0000 + Mg Mg165 1.0 0.59374 0.57943 0.58761 1.0000 + Mg Mg166 1.0 0.59374 0.70443 0.58761 1.0000 + Mg Mg167 1.0 0.59374 0.82943 0.58761 1.0000 + Mg Mg168 1.0 0.59374 0.95443 0.58761 1.0000 + Mg Mg169 1.0 0.71874 0.07943 0.58761 1.0000 + Mg Mg170 1.0 0.71874 0.20443 0.58761 1.0000 + Mg Mg171 1.0 0.71874 0.32943 0.58761 1.0000 + Mg Mg172 1.0 0.71874 0.45443 0.58761 1.0000 + Mg Mg173 1.0 0.71874 0.57943 0.58761 1.0000 + Mg Mg174 1.0 0.71874 0.70443 0.58761 1.0000 + Mg Mg175 1.0 0.71874 0.82943 0.58761 1.0000 + Mg Mg176 1.0 0.71874 0.95443 0.58761 1.0000 + Mg Mg177 1.0 0.84374 0.07943 0.58761 1.0000 + Mg Mg178 1.0 0.84374 0.20443 0.58761 1.0000 + Mg Mg179 1.0 0.84374 0.32943 0.58761 1.0000 + Mg Mg180 1.0 0.84374 0.45443 0.58761 1.0000 + Mg Mg181 1.0 0.84374 0.57943 0.58761 1.0000 + Mg Mg182 1.0 0.84374 0.70443 0.58761 1.0000 + Mg Mg183 1.0 0.84374 0.82943 0.58761 1.0000 + Mg Mg184 1.0 0.84374 0.95443 0.58761 1.0000 + Mg Mg185 1.0 0.96874 0.07943 0.58761 1.0000 + Mg Mg186 1.0 0.96874 0.20443 0.58761 1.0000 + Mg Mg187 1.0 0.96874 0.32943 0.58761 1.0000 + Mg Mg188 1.0 0.96874 0.45443 0.58761 1.0000 + Mg Mg189 1.0 0.96874 0.57943 0.58761 1.0000 + Mg Mg190 1.0 0.96874 0.70443 0.58761 1.0000 + Mg Mg191 1.0 0.96874 0.82943 0.58761 1.0000 + Mg Mg192 1.0 0.96874 0.95443 0.58761 1.0000 + Mg Mg193 1.0 0.03124 0.10807 0.58749 1.0000 + Mg Mg194 1.0 0.03124 0.23307 0.58749 1.0000 + Mg Mg195 1.0 0.03124 0.35807 0.58749 1.0000 + Mg Mg196 1.0 0.03124 0.48307 0.58749 1.0000 + Mg Mg197 1.0 0.03124 0.60807 0.58749 1.0000 + Mg Mg198 1.0 0.03124 0.73307 0.58749 1.0000 + Mg Mg199 1.0 0.03124 0.85807 0.58749 1.0000 + Mg Mg200 1.0 0.03124 0.98307 0.58749 1.0000 + Mg Mg201 1.0 0.15624 0.10807 0.58749 1.0000 + Mg Mg202 1.0 0.15624 0.23307 0.58749 1.0000 + Mg Mg203 1.0 0.15624 0.35807 0.58749 1.0000 + Mg Mg204 1.0 0.15624 0.48307 0.58749 1.0000 + Mg Mg205 1.0 0.15624 0.60807 0.58749 1.0000 + Mg Mg206 1.0 0.15624 0.73307 0.58749 1.0000 + Mg Mg207 1.0 0.15624 0.85807 0.58749 1.0000 + Mg Mg208 1.0 0.15624 0.98307 0.58749 1.0000 + Mg Mg209 1.0 0.28124 0.10807 0.58749 1.0000 + Mg Mg210 1.0 0.28124 0.23307 0.58749 1.0000 + Mg Mg211 1.0 0.28124 0.35807 0.58749 1.0000 + Mg Mg212 1.0 0.28124 0.48307 0.58749 1.0000 + Mg Mg213 1.0 0.28124 0.60807 0.58749 1.0000 + Mg Mg214 1.0 0.28124 0.73307 0.58749 1.0000 + Mg Mg215 1.0 0.28124 0.85807 0.58749 1.0000 + Mg Mg216 1.0 0.28124 0.98307 0.58749 1.0000 + Mg Mg217 1.0 0.40624 0.10807 0.58749 1.0000 + Mg Mg218 1.0 0.40624 0.23307 0.58749 1.0000 + Mg Mg219 1.0 0.40624 0.35807 0.58749 1.0000 + Mg Mg220 1.0 0.40624 0.48307 0.58749 1.0000 + Mg Mg221 1.0 0.40624 0.60807 0.58749 1.0000 + Mg Mg222 1.0 0.40624 0.73307 0.58749 1.0000 + Mg Mg223 1.0 0.40624 0.85807 0.58749 1.0000 + Mg Mg224 1.0 0.40624 0.98307 0.58749 1.0000 + Mg Mg225 1.0 0.53124 0.10807 0.58749 1.0000 + Mg Mg226 1.0 0.53124 0.23307 0.58749 1.0000 + Mg Mg227 1.0 0.53124 0.35807 0.58749 1.0000 + Mg Mg228 1.0 0.53124 0.48307 0.58749 1.0000 + Mg Mg229 1.0 0.53124 0.60807 0.58749 1.0000 + Mg Mg230 1.0 0.53124 0.73307 0.58749 1.0000 + Mg Mg231 1.0 0.53124 0.85807 0.58749 1.0000 + Mg Mg232 1.0 0.53124 0.98307 0.58749 1.0000 + Mg Mg233 1.0 0.65624 0.10807 0.58749 1.0000 + Mg Mg234 1.0 0.65624 0.23307 0.58749 1.0000 + Mg Mg235 1.0 0.65624 0.35807 0.58749 1.0000 + Mg Mg236 1.0 0.65624 0.48307 0.58749 1.0000 + Mg Mg237 1.0 0.65624 0.60807 0.58749 1.0000 + Mg Mg238 1.0 0.65624 0.73307 0.58749 1.0000 + Mg Mg239 1.0 0.65624 0.85807 0.58749 1.0000 + Mg Mg240 1.0 0.65624 0.98307 0.58749 1.0000 + Mg Mg241 1.0 0.78124 0.10807 0.58749 1.0000 + Mg Mg242 1.0 0.78124 0.23307 0.58749 1.0000 + Mg Mg243 1.0 0.78124 0.35807 0.58749 1.0000 + Mg Mg244 1.0 0.78124 0.48307 0.58749 1.0000 + Mg Mg245 1.0 0.78124 0.60807 0.58749 1.0000 + Mg Mg246 1.0 0.78124 0.73307 0.58749 1.0000 + Mg Mg247 1.0 0.78124 0.85807 0.58749 1.0000 + Mg Mg248 1.0 0.78124 0.98307 0.58749 1.0000 + Mg Mg249 1.0 0.90624 0.10807 0.58749 1.0000 + Mg Mg250 1.0 0.90624 0.23307 0.58749 1.0000 + Mg Mg251 1.0 0.90624 0.35807 0.58749 1.0000 + Mg Mg252 1.0 0.90624 0.48307 0.58749 1.0000 + Mg Mg253 1.0 0.90624 0.60807 0.58749 1.0000 + Mg Mg254 1.0 0.90624 0.73307 0.58749 1.0000 + Mg Mg255 1.0 0.90624 0.85807 0.58749 1.0000 + Mg Mg256 1.0 0.90624 0.98307 0.58749 1.0000 + Sb Sb1 1.0 0.07137 0.05183 0.30958 1.0000 + Sb Sb2 1.0 0.07137 0.17683 0.30958 1.0000 + Sb Sb3 1.0 0.07137 0.30183 0.30958 1.0000 + Sb Sb4 1.0 0.07137 0.42683 0.30958 1.0000 + Sb Sb5 1.0 0.07137 0.55183 0.30958 1.0000 + Sb Sb6 1.0 0.07137 0.67683 0.30958 1.0000 + Sb Sb7 1.0 0.07137 0.80183 0.30958 1.0000 + Sb Sb8 1.0 0.07137 0.92683 0.30958 1.0000 + Sb Sb9 1.0 0.19637 0.05183 0.30958 1.0000 + Sb Sb10 1.0 0.19637 0.17683 0.30958 1.0000 + Sb Sb11 1.0 0.19637 0.30183 0.30958 1.0000 + Sb Sb12 1.0 0.19637 0.42683 0.30958 1.0000 + Sb Sb13 1.0 0.19637 0.55183 0.30958 1.0000 + Sb Sb14 1.0 0.19637 0.67683 0.30958 1.0000 + Sb Sb15 1.0 0.19637 0.80183 0.30958 1.0000 + Sb Sb16 1.0 0.19637 0.92683 0.30958 1.0000 + Sb Sb17 1.0 0.32137 0.05183 0.30958 1.0000 + Sb Sb18 1.0 0.32137 0.17683 0.30958 1.0000 + Sb Sb19 1.0 0.32137 0.30183 0.30958 1.0000 + Sb Sb20 1.0 0.32137 0.42683 0.30958 1.0000 + Sb Sb21 1.0 0.32137 0.55183 0.30958 1.0000 + Sb Sb22 1.0 0.32137 0.67683 0.30958 1.0000 + Sb Sb23 1.0 0.32137 0.80183 0.30958 1.0000 + Sb Sb24 1.0 0.32137 0.92683 0.30958 1.0000 + Sb Sb25 1.0 0.44637 0.05183 0.30958 1.0000 + Sb Sb26 1.0 0.44637 0.17683 0.30958 1.0000 + Sb Sb27 1.0 0.44637 0.30183 0.30958 1.0000 + Sb Sb28 1.0 0.44637 0.42683 0.30958 1.0000 + Sb Sb29 1.0 0.44637 0.55183 0.30958 1.0000 + Sb Sb30 1.0 0.44637 0.67683 0.30958 1.0000 + Sb Sb31 1.0 0.44637 0.80183 0.30958 1.0000 + Sb Sb32 1.0 0.44637 0.92683 0.30958 1.0000 + Sb Sb33 1.0 0.57137 0.05183 0.30958 1.0000 + Sb Sb34 1.0 0.57137 0.17683 0.30958 1.0000 + Sb Sb35 1.0 0.57137 0.30183 0.30958 1.0000 + Sb Sb36 1.0 0.57137 0.42683 0.30958 1.0000 + Sb Sb37 1.0 0.57137 0.55183 0.30958 1.0000 + Sb Sb38 1.0 0.57137 0.67683 0.30958 1.0000 + Sb Sb39 1.0 0.57137 0.80183 0.30958 1.0000 + Sb Sb40 1.0 0.57137 0.92683 0.30958 1.0000 + Sb Sb41 1.0 0.69637 0.05183 0.30958 1.0000 + Sb Sb42 1.0 0.69637 0.17683 0.30958 1.0000 + Sb Sb43 1.0 0.69637 0.30183 0.30958 1.0000 + Sb Sb44 1.0 0.69637 0.42683 0.30958 1.0000 + Sb Sb45 1.0 0.69637 0.55183 0.30958 1.0000 + Sb Sb46 1.0 0.69637 0.67683 0.30958 1.0000 + Sb Sb47 1.0 0.69637 0.80183 0.30958 1.0000 + Sb Sb48 1.0 0.69637 0.92683 0.30958 1.0000 + Sb Sb49 1.0 0.82137 0.05183 0.30958 1.0000 + Sb Sb50 1.0 0.82137 0.17683 0.30958 1.0000 + Sb Sb51 1.0 0.82137 0.30183 0.30958 1.0000 + Sb Sb52 1.0 0.82137 0.42683 0.30958 1.0000 + Sb Sb53 1.0 0.82137 0.55183 0.30958 1.0000 + Sb Sb54 1.0 0.82137 0.67683 0.30958 1.0000 + Sb Sb55 1.0 0.82137 0.80183 0.30958 1.0000 + Sb Sb56 1.0 0.82137 0.92683 0.30958 1.0000 + Sb Sb57 1.0 0.94637 0.05183 0.30958 1.0000 + Sb Sb58 1.0 0.94637 0.17683 0.30958 1.0000 + Sb Sb59 1.0 0.94637 0.30183 0.30958 1.0000 + Sb Sb60 1.0 0.94637 0.42683 0.30958 1.0000 + Sb Sb61 1.0 0.94637 0.55183 0.30958 1.0000 + Sb Sb62 1.0 0.94637 0.67683 0.30958 1.0000 + Sb Sb63 1.0 0.94637 0.80183 0.30958 1.0000 + Sb Sb64 1.0 0.94637 0.92683 0.30958 1.0000 + Sb Sb65 1.0 0.00886 0.01067 0.30960 1.0000 + Sb Sb66 1.0 0.00886 0.13567 0.30960 1.0000 + Sb Sb67 1.0 0.00886 0.26067 0.30960 1.0000 + Sb Sb68 1.0 0.00886 0.38567 0.30960 1.0000 + Sb Sb69 1.0 0.00886 0.51067 0.30960 1.0000 + Sb Sb70 1.0 0.00886 0.63567 0.30960 1.0000 + Sb Sb71 1.0 0.00886 0.76067 0.30960 1.0000 + Sb Sb72 1.0 0.00886 0.88567 0.30960 1.0000 + Sb Sb73 1.0 0.13386 0.01067 0.30960 1.0000 + Sb Sb74 1.0 0.13386 0.13567 0.30960 1.0000 + Sb Sb75 1.0 0.13386 0.26067 0.30960 1.0000 + Sb Sb76 1.0 0.13386 0.38567 0.30960 1.0000 + Sb Sb77 1.0 0.13386 0.51067 0.30960 1.0000 + Sb Sb78 1.0 0.13386 0.63567 0.30960 1.0000 + Sb Sb79 1.0 0.13386 0.76067 0.30960 1.0000 + Sb Sb80 1.0 0.13386 0.88567 0.30960 1.0000 + Sb Sb81 1.0 0.25886 0.01067 0.30960 1.0000 + Sb Sb82 1.0 0.25886 0.13567 0.30960 1.0000 + Sb Sb83 1.0 0.25886 0.26067 0.30960 1.0000 + Sb Sb84 1.0 0.25886 0.38567 0.30960 1.0000 + Sb Sb85 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0.69043 1.0000 + Sb Sb151 1.0 0.25887 0.82317 0.69043 1.0000 + Sb Sb152 1.0 0.25887 0.94817 0.69043 1.0000 + Sb Sb153 1.0 0.38387 0.07317 0.69043 1.0000 + Sb Sb154 1.0 0.38387 0.19817 0.69043 1.0000 + Sb Sb155 1.0 0.38387 0.32317 0.69043 1.0000 + Sb Sb156 1.0 0.38387 0.44817 0.69043 1.0000 + Sb Sb157 1.0 0.38387 0.57317 0.69043 1.0000 + Sb Sb158 1.0 0.38387 0.69817 0.69043 1.0000 + Sb Sb159 1.0 0.38387 0.82317 0.69043 1.0000 + Sb Sb160 1.0 0.38387 0.94817 0.69043 1.0000 + Sb Sb161 1.0 0.50887 0.07317 0.69043 1.0000 + Sb Sb162 1.0 0.50887 0.19817 0.69043 1.0000 + Sb Sb163 1.0 0.50887 0.32317 0.69043 1.0000 + Sb Sb164 1.0 0.50887 0.44817 0.69043 1.0000 + Sb Sb165 1.0 0.50887 0.57317 0.69043 1.0000 + Sb Sb166 1.0 0.50887 0.69817 0.69043 1.0000 + Sb Sb167 1.0 0.50887 0.82317 0.69043 1.0000 + Sb Sb168 1.0 0.50887 0.94817 0.69043 1.0000 + Sb Sb169 1.0 0.63387 0.07317 0.69043 1.0000 + Sb Sb170 1.0 0.63387 0.19817 0.69043 1.0000 + Sb Sb171 1.0 0.63387 0.32317 0.69043 1.0000 + Sb Sb172 1.0 0.63387 0.44817 0.69043 1.0000 + Sb Sb173 1.0 0.63387 0.57317 0.69043 1.0000 + Sb Sb174 1.0 0.63387 0.69817 0.69043 1.0000 + Sb Sb175 1.0 0.63387 0.82317 0.69043 1.0000 + Sb Sb176 1.0 0.63387 0.94817 0.69043 1.0000 + Sb Sb177 1.0 0.75887 0.07317 0.69043 1.0000 + Sb Sb178 1.0 0.75887 0.19817 0.69043 1.0000 + Sb Sb179 1.0 0.75887 0.32317 0.69043 1.0000 + Sb Sb180 1.0 0.75887 0.44817 0.69043 1.0000 + Sb Sb181 1.0 0.75887 0.57317 0.69043 1.0000 + Sb Sb182 1.0 0.75887 0.69817 0.69043 1.0000 + Sb Sb183 1.0 0.75887 0.82317 0.69043 1.0000 + Sb Sb184 1.0 0.75887 0.94817 0.69043 1.0000 + Sb Sb185 1.0 0.88387 0.07317 0.69043 1.0000 + Sb Sb186 1.0 0.88387 0.19817 0.69043 1.0000 + Sb Sb187 1.0 0.88387 0.32317 0.69043 1.0000 + Sb Sb188 1.0 0.88387 0.44817 0.69043 1.0000 + Sb Sb189 1.0 0.88387 0.57317 0.69043 1.0000 + Sb Sb190 1.0 0.88387 0.69817 0.69043 1.0000 + Sb Sb191 1.0 0.88387 0.82317 0.69043 1.0000 + Sb Sb192 1.0 0.88387 0.94817 0.69043 1.0000 + Sb Sb193 1.0 0.05363 0.01067 0.30958 1.0000 + Sb Sb194 1.0 0.05363 0.13567 0.30958 1.0000 + Sb Sb195 1.0 0.05363 0.26067 0.30958 1.0000 + Sb Sb196 1.0 0.05363 0.38567 0.30958 1.0000 + Sb Sb197 1.0 0.05363 0.51067 0.30958 1.0000 + Sb Sb198 1.0 0.05363 0.63567 0.30958 1.0000 + Sb Sb199 1.0 0.05363 0.76067 0.30958 1.0000 + Sb Sb200 1.0 0.05363 0.88567 0.30958 1.0000 + Sb Sb201 1.0 0.17863 0.01067 0.30958 1.0000 + Sb Sb202 1.0 0.17863 0.13567 0.30958 1.0000 + Sb Sb203 1.0 0.17863 0.26067 0.30958 1.0000 + Sb Sb204 1.0 0.17863 0.38567 0.30958 1.0000 + Sb Sb205 1.0 0.17863 0.51067 0.30958 1.0000 + Sb Sb206 1.0 0.17863 0.63567 0.30958 1.0000 + Sb Sb207 1.0 0.17863 0.76067 0.30958 1.0000 + Sb Sb208 1.0 0.17863 0.88567 0.30958 1.0000 + Sb Sb209 1.0 0.30363 0.01067 0.30958 1.0000 + Sb Sb210 1.0 0.30363 0.13567 0.30958 1.0000 + Sb Sb211 1.0 0.30363 0.26067 0.30958 1.0000 + Sb Sb212 1.0 0.30363 0.38567 0.30958 1.0000 + Sb Sb213 1.0 0.30363 0.51067 0.30958 1.0000 + Sb Sb214 1.0 0.30363 0.63567 0.30958 1.0000 + Sb Sb215 1.0 0.30363 0.76067 0.30958 1.0000 + Sb Sb216 1.0 0.30363 0.88567 0.30958 1.0000 + Sb Sb217 1.0 0.42863 0.01067 0.30958 1.0000 + Sb Sb218 1.0 0.42863 0.13567 0.30958 1.0000 + Sb Sb219 1.0 0.42863 0.26067 0.30958 1.0000 + Sb Sb220 1.0 0.42863 0.38567 0.30958 1.0000 + Sb Sb221 1.0 0.42863 0.51067 0.30958 1.0000 + Sb Sb222 1.0 0.42863 0.63567 0.30958 1.0000 + Sb Sb223 1.0 0.42863 0.76067 0.30958 1.0000 + Sb Sb224 1.0 0.42863 0.88567 0.30958 1.0000 + Sb Sb225 1.0 0.55363 0.01067 0.30958 1.0000 + Sb Sb226 1.0 0.55363 0.13567 0.30958 1.0000 + Sb Sb227 1.0 0.55363 0.26067 0.30958 1.0000 + Sb Sb228 1.0 0.55363 0.38567 0.30958 1.0000 + Sb Sb229 1.0 0.55363 0.51067 0.30958 1.0000 + Sb Sb230 1.0 0.55363 0.63567 0.30958 1.0000 + Sb Sb231 1.0 0.55363 0.76067 0.30958 1.0000 + Sb Sb232 1.0 0.55363 0.88567 0.30958 1.0000 + Sb Sb233 1.0 0.67863 0.01067 0.30958 1.0000 + Sb Sb234 1.0 0.67863 0.13567 0.30958 1.0000 + Sb Sb235 1.0 0.67863 0.26067 0.30958 1.0000 + Sb Sb236 1.0 0.67863 0.38567 0.30958 1.0000 + Sb Sb237 1.0 0.67863 0.51067 0.30958 1.0000 + Sb Sb238 1.0 0.67863 0.63567 0.30958 1.0000 + Sb Sb239 1.0 0.67863 0.76067 0.30958 1.0000 + Sb Sb240 1.0 0.67863 0.88567 0.30958 1.0000 + Sb Sb241 1.0 0.80363 0.01067 0.30958 1.0000 + Sb Sb242 1.0 0.80363 0.13567 0.30958 1.0000 + Sb Sb243 1.0 0.80363 0.26067 0.30958 1.0000 + Sb Sb244 1.0 0.80363 0.38567 0.30958 1.0000 + Sb Sb245 1.0 0.80363 0.51067 0.30958 1.0000 + Sb Sb246 1.0 0.80363 0.63567 0.30958 1.0000 + Sb Sb247 1.0 0.80363 0.76067 0.30958 1.0000 + Sb Sb248 1.0 0.80363 0.88567 0.30958 1.0000 + Sb Sb249 1.0 0.92863 0.01067 0.30958 1.0000 + Sb Sb250 1.0 0.92863 0.13567 0.30958 1.0000 + Sb Sb251 1.0 0.92863 0.26067 0.30958 1.0000 + Sb Sb252 1.0 0.92863 0.38567 0.30958 1.0000 + Sb Sb253 1.0 0.92863 0.51067 0.30958 1.0000 + Sb Sb254 1.0 0.92863 0.63567 0.30958 1.0000 + Sb Sb255 1.0 0.92863 0.76067 0.30958 1.0000 + Sb Sb256 1.0 0.92863 0.88567 0.30958 1.0000 + Sb Sb257 1.0 0.05363 0.07317 0.69042 1.0000 + Sb Sb258 1.0 0.05363 0.19817 0.69042 1.0000 + Sb Sb259 1.0 0.05363 0.32317 0.69042 1.0000 + Sb Sb260 1.0 0.05363 0.44817 0.69042 1.0000 + Sb Sb261 1.0 0.05363 0.57317 0.69042 1.0000 + Sb Sb262 1.0 0.05363 0.69817 0.69042 1.0000 + Sb Sb263 1.0 0.05363 0.82317 0.69042 1.0000 + Sb Sb264 1.0 0.05363 0.94817 0.69042 1.0000 + Sb Sb265 1.0 0.17863 0.07317 0.69042 1.0000 + Sb Sb266 1.0 0.17863 0.19817 0.69042 1.0000 + Sb Sb267 1.0 0.17863 0.32317 0.69042 1.0000 + Sb Sb268 1.0 0.17863 0.44817 0.69042 1.0000 + Sb Sb269 1.0 0.17863 0.57317 0.69042 1.0000 + Sb Sb270 1.0 0.17863 0.69817 0.69042 1.0000 + Sb Sb271 1.0 0.17863 0.82317 0.69042 1.0000 + Sb Sb272 1.0 0.17863 0.94817 0.69042 1.0000 + Sb Sb273 1.0 0.30363 0.07317 0.69042 1.0000 + Sb Sb274 1.0 0.30363 0.19817 0.69042 1.0000 + Sb Sb275 1.0 0.30363 0.32317 0.69042 1.0000 + Sb Sb276 1.0 0.30363 0.44817 0.69042 1.0000 + Sb Sb277 1.0 0.30363 0.57317 0.69042 1.0000 + Sb Sb278 1.0 0.30363 0.69817 0.69042 1.0000 + Sb Sb279 1.0 0.30363 0.82317 0.69042 1.0000 + Sb Sb280 1.0 0.30363 0.94817 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Sb Sb324 1.0 0.11613 0.42683 0.30957 1.0000 + Sb Sb325 1.0 0.11613 0.55183 0.30957 1.0000 + Sb Sb326 1.0 0.11613 0.67683 0.30957 1.0000 + Sb Sb327 1.0 0.11613 0.80183 0.30957 1.0000 + Sb Sb328 1.0 0.11613 0.92683 0.30957 1.0000 + Sb Sb329 1.0 0.24113 0.05183 0.30957 1.0000 + Sb Sb330 1.0 0.24113 0.17683 0.30957 1.0000 + Sb Sb331 1.0 0.24113 0.30183 0.30957 1.0000 + Sb Sb332 1.0 0.24113 0.42683 0.30957 1.0000 + Sb Sb333 1.0 0.24113 0.55183 0.30957 1.0000 + Sb Sb334 1.0 0.24113 0.67683 0.30957 1.0000 + Sb Sb335 1.0 0.24113 0.80183 0.30957 1.0000 + Sb Sb336 1.0 0.24113 0.92683 0.30957 1.0000 + Sb Sb337 1.0 0.36613 0.05183 0.30957 1.0000 + Sb Sb338 1.0 0.36613 0.17683 0.30957 1.0000 + Sb Sb339 1.0 0.36613 0.30183 0.30957 1.0000 + Sb Sb340 1.0 0.36613 0.42683 0.30957 1.0000 + Sb Sb341 1.0 0.36613 0.55183 0.30957 1.0000 + Sb Sb342 1.0 0.36613 0.67683 0.30957 1.0000 + Sb Sb343 1.0 0.36613 0.80183 0.30957 1.0000 + Sb Sb344 1.0 0.36613 0.92683 0.30957 1.0000 + Sb Sb345 1.0 0.49113 0.05183 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Sb Sb389 1.0 0.11614 0.61433 0.69040 1.0000 + Sb Sb390 1.0 0.11614 0.73933 0.69040 1.0000 + Sb Sb391 1.0 0.11614 0.86433 0.69040 1.0000 + Sb Sb392 1.0 0.11614 0.98933 0.69040 1.0000 + Sb Sb393 1.0 0.24114 0.11433 0.69040 1.0000 + Sb Sb394 1.0 0.24114 0.23933 0.69040 1.0000 + Sb Sb395 1.0 0.24114 0.36433 0.69040 1.0000 + Sb Sb396 1.0 0.24114 0.48933 0.69040 1.0000 + Sb Sb397 1.0 0.24114 0.61433 0.69040 1.0000 + Sb Sb398 1.0 0.24114 0.73933 0.69040 1.0000 + Sb Sb399 1.0 0.24114 0.86433 0.69040 1.0000 + Sb Sb400 1.0 0.24114 0.98933 0.69040 1.0000 + Sb Sb401 1.0 0.36614 0.11433 0.69040 1.0000 + Sb Sb402 1.0 0.36614 0.23933 0.69040 1.0000 + Sb Sb403 1.0 0.36614 0.36433 0.69040 1.0000 + Sb Sb404 1.0 0.36614 0.48933 0.69040 1.0000 + Sb Sb405 1.0 0.36614 0.61433 0.69040 1.0000 + Sb Sb406 1.0 0.36614 0.73933 0.69040 1.0000 + Sb Sb407 1.0 0.36614 0.86433 0.69040 1.0000 + Sb Sb408 1.0 0.36614 0.98933 0.69040 1.0000 + Sb Sb409 1.0 0.49114 0.11433 0.69040 1.0000 + Sb Sb410 1.0 0.49114 0.23933 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O54 1.0 0.86081 0.68884 0.56834 1.0000 + O O55 1.0 0.86081 0.81384 0.56834 1.0000 + O O56 1.0 0.86081 0.93884 0.56834 1.0000 + O O57 1.0 0.98581 0.06384 0.56834 1.0000 + O O58 1.0 0.98581 0.18884 0.56834 1.0000 + O O59 1.0 0.98581 0.31384 0.56834 1.0000 + O O60 1.0 0.98581 0.43884 0.56834 1.0000 + O O61 1.0 0.98581 0.56384 0.56834 1.0000 + O O62 1.0 0.98581 0.68884 0.56834 1.0000 + O O63 1.0 0.98581 0.81384 0.56834 1.0000 + O O64 1.0 0.98581 0.93884 0.56834 1.0000 + O O65 1.0 0.01419 0.06116 0.43166 1.0000 + O O66 1.0 0.01419 0.18616 0.43166 1.0000 + O O67 1.0 0.01419 0.31116 0.43166 1.0000 + O O68 1.0 0.01419 0.43616 0.43166 1.0000 + O O69 1.0 0.01419 0.56116 0.43166 1.0000 + O O70 1.0 0.01419 0.68616 0.43166 1.0000 + O O71 1.0 0.01419 0.81116 0.43166 1.0000 + O O72 1.0 0.01419 0.93616 0.43166 1.0000 + O O73 1.0 0.13919 0.06116 0.43166 1.0000 + O O74 1.0 0.13919 0.18616 0.43166 1.0000 + O O75 1.0 0.13919 0.31116 0.43166 1.0000 + O O76 1.0 0.13919 0.43616 0.43166 1.0000 + O O77 1.0 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0000000000000000000000000000000000000000..1856ba5014e8670e20beb8434ba8a0c0f6743367 --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-5100_supercell_12x12x1.cif @@ -0,0 +1,1897 @@ +data_image0 +_chemical_formula_structural Zn288Sn432O1152 +_chemical_formula_sum "Zn288 Sn432 O1152" +_cell_length_a 65.7137 +_cell_length_b 76.2073 +_cell_length_c 6.81106 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Zn Zn1 1.0 0.02904 0.04167 0.70636 1.0000 + Zn Zn2 1.0 0.02904 0.12500 0.70636 1.0000 + Zn Zn3 1.0 0.02904 0.20833 0.70636 1.0000 + Zn Zn4 1.0 0.02904 0.29167 0.70636 1.0000 + Zn Zn5 1.0 0.02904 0.37500 0.70636 1.0000 + Zn Zn6 1.0 0.02904 0.45833 0.70636 1.0000 + Zn Zn7 1.0 0.02904 0.54167 0.70636 1.0000 + Zn Zn8 1.0 0.02904 0.62500 0.70636 1.0000 + Zn Zn9 1.0 0.02904 0.70833 0.70636 1.0000 + Zn Zn10 1.0 0.02904 0.79167 0.70636 1.0000 + Zn Zn11 1.0 0.02904 0.87500 0.70636 1.0000 + Zn Zn12 1.0 0.02904 0.95833 0.70636 1.0000 + Zn Zn13 1.0 0.11237 0.04167 0.70636 1.0000 + Zn Zn14 1.0 0.11237 0.12500 0.70636 1.0000 + Zn Zn15 1.0 0.11237 0.20833 0.70636 1.0000 + Zn Zn16 1.0 0.11237 0.29167 0.70636 1.0000 + Zn Zn17 1.0 0.11237 0.37500 0.70636 1.0000 + Zn Zn18 1.0 0.11237 0.45833 0.70636 1.0000 + Zn Zn19 1.0 0.11237 0.54167 0.70636 1.0000 + Zn Zn20 1.0 0.11237 0.62500 0.70636 1.0000 + Zn Zn21 1.0 0.11237 0.70833 0.70636 1.0000 + Zn Zn22 1.0 0.11237 0.79167 0.70636 1.0000 + Zn Zn23 1.0 0.11237 0.87500 0.70636 1.0000 + Zn Zn24 1.0 0.11237 0.95833 0.70636 1.0000 + Zn Zn25 1.0 0.19570 0.04167 0.70636 1.0000 + Zn Zn26 1.0 0.19570 0.12500 0.70636 1.0000 + Zn Zn27 1.0 0.19570 0.20833 0.70636 1.0000 + Zn Zn28 1.0 0.19570 0.29167 0.70636 1.0000 + Zn Zn29 1.0 0.19570 0.37500 0.70636 1.0000 + Zn Zn30 1.0 0.19570 0.45833 0.70636 1.0000 + Zn Zn31 1.0 0.19570 0.54167 0.70636 1.0000 + Zn Zn32 1.0 0.19570 0.62500 0.70636 1.0000 + Zn Zn33 1.0 0.19570 0.70833 0.70636 1.0000 + Zn Zn34 1.0 0.19570 0.79167 0.70636 1.0000 + Zn Zn35 1.0 0.19570 0.87500 0.70636 1.0000 + Zn Zn36 1.0 0.19570 0.95833 0.70636 1.0000 + Zn Zn37 1.0 0.27904 0.04167 0.70636 1.0000 + Zn Zn38 1.0 0.27904 0.12500 0.70636 1.0000 + Zn Zn39 1.0 0.27904 0.20833 0.70636 1.0000 + Zn Zn40 1.0 0.27904 0.29167 0.70636 1.0000 + Zn Zn41 1.0 0.27904 0.37500 0.70636 1.0000 + Zn Zn42 1.0 0.27904 0.45833 0.70636 1.0000 + Zn Zn43 1.0 0.27904 0.54167 0.70636 1.0000 + Zn Zn44 1.0 0.27904 0.62500 0.70636 1.0000 + Zn Zn45 1.0 0.27904 0.70833 0.70636 1.0000 + Zn Zn46 1.0 0.27904 0.79167 0.70636 1.0000 + Zn Zn47 1.0 0.27904 0.87500 0.70636 1.0000 + Zn Zn48 1.0 0.27904 0.95833 0.70636 1.0000 + Zn Zn49 1.0 0.36237 0.04167 0.70636 1.0000 + Zn Zn50 1.0 0.36237 0.12500 0.70636 1.0000 + Zn Zn51 1.0 0.36237 0.20833 0.70636 1.0000 + Zn Zn52 1.0 0.36237 0.29167 0.70636 1.0000 + Zn Zn53 1.0 0.36237 0.37500 0.70636 1.0000 + Zn Zn54 1.0 0.36237 0.45833 0.70636 1.0000 + Zn Zn55 1.0 0.36237 0.54167 0.70636 1.0000 + Zn Zn56 1.0 0.36237 0.62500 0.70636 1.0000 + Zn Zn57 1.0 0.36237 0.70833 0.70636 1.0000 + Zn Zn58 1.0 0.36237 0.79167 0.70636 1.0000 + Zn Zn59 1.0 0.36237 0.87500 0.70636 1.0000 + Zn Zn60 1.0 0.36237 0.95833 0.70636 1.0000 + Zn Zn61 1.0 0.44570 0.04167 0.70636 1.0000 + Zn Zn62 1.0 0.44570 0.12500 0.70636 1.0000 + Zn Zn63 1.0 0.44570 0.20833 0.70636 1.0000 + Zn Zn64 1.0 0.44570 0.29167 0.70636 1.0000 + Zn Zn65 1.0 0.44570 0.37500 0.70636 1.0000 + Zn Zn66 1.0 0.44570 0.45833 0.70636 1.0000 + Zn Zn67 1.0 0.44570 0.54167 0.70636 1.0000 + Zn Zn68 1.0 0.44570 0.62500 0.70636 1.0000 + Zn Zn69 1.0 0.44570 0.70833 0.70636 1.0000 + Zn Zn70 1.0 0.44570 0.79167 0.70636 1.0000 + Zn Zn71 1.0 0.44570 0.87500 0.70636 1.0000 + Zn Zn72 1.0 0.44570 0.95833 0.70636 1.0000 + Zn Zn73 1.0 0.52904 0.04167 0.70636 1.0000 + Zn Zn74 1.0 0.52904 0.12500 0.70636 1.0000 + Zn Zn75 1.0 0.52904 0.20833 0.70636 1.0000 + Zn Zn76 1.0 0.52904 0.29167 0.70636 1.0000 + Zn Zn77 1.0 0.52904 0.37500 0.70636 1.0000 + Zn Zn78 1.0 0.52904 0.45833 0.70636 1.0000 + Zn Zn79 1.0 0.52904 0.54167 0.70636 1.0000 + Zn Zn80 1.0 0.52904 0.62500 0.70636 1.0000 + Zn Zn81 1.0 0.52904 0.70833 0.70636 1.0000 + Zn Zn82 1.0 0.52904 0.79167 0.70636 1.0000 + Zn Zn83 1.0 0.52904 0.87500 0.70636 1.0000 + Zn Zn84 1.0 0.52904 0.95833 0.70636 1.0000 + Zn Zn85 1.0 0.61237 0.04167 0.70636 1.0000 + Zn Zn86 1.0 0.61237 0.12500 0.70636 1.0000 + Zn Zn87 1.0 0.61237 0.20833 0.70636 1.0000 + Zn Zn88 1.0 0.61237 0.29167 0.70636 1.0000 + Zn Zn89 1.0 0.61237 0.37500 0.70636 1.0000 + Zn Zn90 1.0 0.61237 0.45833 0.70636 1.0000 + Zn Zn91 1.0 0.61237 0.54167 0.70636 1.0000 + Zn Zn92 1.0 0.61237 0.62500 0.70636 1.0000 + Zn Zn93 1.0 0.61237 0.70833 0.70636 1.0000 + Zn Zn94 1.0 0.61237 0.79167 0.70636 1.0000 + Zn Zn95 1.0 0.61237 0.87500 0.70636 1.0000 + Zn Zn96 1.0 0.61237 0.95833 0.70636 1.0000 + Zn Zn97 1.0 0.69570 0.04167 0.70636 1.0000 + Zn Zn98 1.0 0.69570 0.12500 0.70636 1.0000 + Zn Zn99 1.0 0.69570 0.20833 0.70636 1.0000 + Zn Zn100 1.0 0.69570 0.29167 0.70636 1.0000 + Zn Zn101 1.0 0.69570 0.37500 0.70636 1.0000 + Zn Zn102 1.0 0.69570 0.45833 0.70636 1.0000 + Zn Zn103 1.0 0.69570 0.54167 0.70636 1.0000 + Zn Zn104 1.0 0.69570 0.62500 0.70636 1.0000 + Zn Zn105 1.0 0.69570 0.70833 0.70636 1.0000 + Zn Zn106 1.0 0.69570 0.79167 0.70636 1.0000 + Zn Zn107 1.0 0.69570 0.87500 0.70636 1.0000 + Zn Zn108 1.0 0.69570 0.95833 0.70636 1.0000 + Zn Zn109 1.0 0.77904 0.04167 0.70636 1.0000 + Zn Zn110 1.0 0.77904 0.12500 0.70636 1.0000 + Zn Zn111 1.0 0.77904 0.20833 0.70636 1.0000 + Zn Zn112 1.0 0.77904 0.29167 0.70636 1.0000 + Zn Zn113 1.0 0.77904 0.37500 0.70636 1.0000 + Zn Zn114 1.0 0.77904 0.45833 0.70636 1.0000 + Zn Zn115 1.0 0.77904 0.54167 0.70636 1.0000 + Zn Zn116 1.0 0.77904 0.62500 0.70636 1.0000 + Zn Zn117 1.0 0.77904 0.70833 0.70636 1.0000 + Zn Zn118 1.0 0.77904 0.79167 0.70636 1.0000 + Zn Zn119 1.0 0.77904 0.87500 0.70636 1.0000 + Zn Zn120 1.0 0.77904 0.95833 0.70636 1.0000 + Zn Zn121 1.0 0.86237 0.04167 0.70636 1.0000 + Zn Zn122 1.0 0.86237 0.12500 0.70636 1.0000 + Zn Zn123 1.0 0.86237 0.20833 0.70636 1.0000 + Zn Zn124 1.0 0.86237 0.29167 0.70636 1.0000 + Zn Zn125 1.0 0.86237 0.37500 0.70636 1.0000 + Zn Zn126 1.0 0.86237 0.45833 0.70636 1.0000 + Zn Zn127 1.0 0.86237 0.54167 0.70636 1.0000 + Zn Zn128 1.0 0.86237 0.62500 0.70636 1.0000 + Zn Zn129 1.0 0.86237 0.70833 0.70636 1.0000 + Zn Zn130 1.0 0.86237 0.79167 0.70636 1.0000 + Zn Zn131 1.0 0.86237 0.87500 0.70636 1.0000 + Zn Zn132 1.0 0.86237 0.95833 0.70636 1.0000 + Zn Zn133 1.0 0.94570 0.04167 0.70636 1.0000 + Zn Zn134 1.0 0.94570 0.12500 0.70636 1.0000 + Zn Zn135 1.0 0.94570 0.20833 0.70636 1.0000 + Zn Zn136 1.0 0.94570 0.29167 0.70636 1.0000 + Zn Zn137 1.0 0.94570 0.37500 0.70636 1.0000 + Zn Zn138 1.0 0.94570 0.45833 0.70636 1.0000 + Zn Zn139 1.0 0.94570 0.54167 0.70636 1.0000 + Zn Zn140 1.0 0.94570 0.62500 0.70636 1.0000 + Zn Zn141 1.0 0.94570 0.70833 0.70636 1.0000 + Zn Zn142 1.0 0.94570 0.79167 0.70636 1.0000 + Zn Zn143 1.0 0.94570 0.87500 0.70636 1.0000 + Zn Zn144 1.0 0.94570 0.95833 0.70636 1.0000 + Zn Zn145 1.0 0.02902 0.04167 0.29364 1.0000 + Zn Zn146 1.0 0.02902 0.12500 0.29364 1.0000 + Zn Zn147 1.0 0.02902 0.20833 0.29364 1.0000 + Zn Zn148 1.0 0.02902 0.29167 0.29364 1.0000 + Zn Zn149 1.0 0.02902 0.37500 0.29364 1.0000 + Zn Zn150 1.0 0.02902 0.45833 0.29364 1.0000 + Zn Zn151 1.0 0.02902 0.54167 0.29364 1.0000 + Zn Zn152 1.0 0.02902 0.62500 0.29364 1.0000 + Zn Zn153 1.0 0.02902 0.70833 0.29364 1.0000 + Zn Zn154 1.0 0.02902 0.79167 0.29364 1.0000 + Zn Zn155 1.0 0.02902 0.87500 0.29364 1.0000 + Zn Zn156 1.0 0.02902 0.95833 0.29364 1.0000 + Zn Zn157 1.0 0.11235 0.04167 0.29364 1.0000 + Zn Zn158 1.0 0.11235 0.12500 0.29364 1.0000 + Zn Zn159 1.0 0.11235 0.20833 0.29364 1.0000 + Zn Zn160 1.0 0.11235 0.29167 0.29364 1.0000 + Zn Zn161 1.0 0.11235 0.37500 0.29364 1.0000 + Zn Zn162 1.0 0.11235 0.45833 0.29364 1.0000 + Zn Zn163 1.0 0.11235 0.54167 0.29364 1.0000 + Zn Zn164 1.0 0.11235 0.62500 0.29364 1.0000 + Zn Zn165 1.0 0.11235 0.70833 0.29364 1.0000 + Zn Zn166 1.0 0.11235 0.79167 0.29364 1.0000 + Zn Zn167 1.0 0.11235 0.87500 0.29364 1.0000 + Zn Zn168 1.0 0.11235 0.95833 0.29364 1.0000 + Zn Zn169 1.0 0.19568 0.04167 0.29364 1.0000 + Zn Zn170 1.0 0.19568 0.12500 0.29364 1.0000 + Zn Zn171 1.0 0.19568 0.20833 0.29364 1.0000 + Zn Zn172 1.0 0.19568 0.29167 0.29364 1.0000 + Zn Zn173 1.0 0.19568 0.37500 0.29364 1.0000 + Zn Zn174 1.0 0.19568 0.45833 0.29364 1.0000 + Zn Zn175 1.0 0.19568 0.54167 0.29364 1.0000 + Zn Zn176 1.0 0.19568 0.62500 0.29364 1.0000 + Zn Zn177 1.0 0.19568 0.70833 0.29364 1.0000 + Zn Zn178 1.0 0.19568 0.79167 0.29364 1.0000 + Zn Zn179 1.0 0.19568 0.87500 0.29364 1.0000 + Zn Zn180 1.0 0.19568 0.95833 0.29364 1.0000 + Zn Zn181 1.0 0.27902 0.04167 0.29364 1.0000 + Zn Zn182 1.0 0.27902 0.12500 0.29364 1.0000 + Zn Zn183 1.0 0.27902 0.20833 0.29364 1.0000 + Zn Zn184 1.0 0.27902 0.29167 0.29364 1.0000 + Zn Zn185 1.0 0.27902 0.37500 0.29364 1.0000 + Zn Zn186 1.0 0.27902 0.45833 0.29364 1.0000 + Zn Zn187 1.0 0.27902 0.54167 0.29364 1.0000 + Zn Zn188 1.0 0.27902 0.62500 0.29364 1.0000 + Zn Zn189 1.0 0.27902 0.70833 0.29364 1.0000 + Zn Zn190 1.0 0.27902 0.79167 0.29364 1.0000 + Zn Zn191 1.0 0.27902 0.87500 0.29364 1.0000 + Zn Zn192 1.0 0.27902 0.95833 0.29364 1.0000 + Zn Zn193 1.0 0.36235 0.04167 0.29364 1.0000 + Zn Zn194 1.0 0.36235 0.12500 0.29364 1.0000 + Zn Zn195 1.0 0.36235 0.20833 0.29364 1.0000 + Zn Zn196 1.0 0.36235 0.29167 0.29364 1.0000 + Zn Zn197 1.0 0.36235 0.37500 0.29364 1.0000 + Zn Zn198 1.0 0.36235 0.45833 0.29364 1.0000 + Zn Zn199 1.0 0.36235 0.54167 0.29364 1.0000 + Zn Zn200 1.0 0.36235 0.62500 0.29364 1.0000 + Zn Zn201 1.0 0.36235 0.70833 0.29364 1.0000 + Zn Zn202 1.0 0.36235 0.79167 0.29364 1.0000 + Zn Zn203 1.0 0.36235 0.87500 0.29364 1.0000 + Zn Zn204 1.0 0.36235 0.95833 0.29364 1.0000 + Zn Zn205 1.0 0.44568 0.04167 0.29364 1.0000 + Zn Zn206 1.0 0.44568 0.12500 0.29364 1.0000 + Zn Zn207 1.0 0.44568 0.20833 0.29364 1.0000 + Zn Zn208 1.0 0.44568 0.29167 0.29364 1.0000 + Zn Zn209 1.0 0.44568 0.37500 0.29364 1.0000 + Zn Zn210 1.0 0.44568 0.45833 0.29364 1.0000 + Zn Zn211 1.0 0.44568 0.54167 0.29364 1.0000 + Zn Zn212 1.0 0.44568 0.62500 0.29364 1.0000 + Zn Zn213 1.0 0.44568 0.70833 0.29364 1.0000 + Zn Zn214 1.0 0.44568 0.79167 0.29364 1.0000 + Zn Zn215 1.0 0.44568 0.87500 0.29364 1.0000 + Zn Zn216 1.0 0.44568 0.95833 0.29364 1.0000 + Zn Zn217 1.0 0.52902 0.04167 0.29364 1.0000 + Zn Zn218 1.0 0.52902 0.12500 0.29364 1.0000 + Zn Zn219 1.0 0.52902 0.20833 0.29364 1.0000 + Zn Zn220 1.0 0.52902 0.29167 0.29364 1.0000 + Zn Zn221 1.0 0.52902 0.37500 0.29364 1.0000 + Zn Zn222 1.0 0.52902 0.45833 0.29364 1.0000 + Zn Zn223 1.0 0.52902 0.54167 0.29364 1.0000 + Zn Zn224 1.0 0.52902 0.62500 0.29364 1.0000 + Zn Zn225 1.0 0.52902 0.70833 0.29364 1.0000 + Zn Zn226 1.0 0.52902 0.79167 0.29364 1.0000 + Zn Zn227 1.0 0.52902 0.87500 0.29364 1.0000 + Zn Zn228 1.0 0.52902 0.95833 0.29364 1.0000 + Zn Zn229 1.0 0.61235 0.04167 0.29364 1.0000 + Zn Zn230 1.0 0.61235 0.12500 0.29364 1.0000 + Zn Zn231 1.0 0.61235 0.20833 0.29364 1.0000 + Zn Zn232 1.0 0.61235 0.29167 0.29364 1.0000 + Zn Zn233 1.0 0.61235 0.37500 0.29364 1.0000 + Zn Zn234 1.0 0.61235 0.45833 0.29364 1.0000 + Zn Zn235 1.0 0.61235 0.54167 0.29364 1.0000 + Zn Zn236 1.0 0.61235 0.62500 0.29364 1.0000 + Zn Zn237 1.0 0.61235 0.70833 0.29364 1.0000 + Zn Zn238 1.0 0.61235 0.79167 0.29364 1.0000 + Zn Zn239 1.0 0.61235 0.87500 0.29364 1.0000 + Zn Zn240 1.0 0.61235 0.95833 0.29364 1.0000 + Zn Zn241 1.0 0.69568 0.04167 0.29364 1.0000 + Zn Zn242 1.0 0.69568 0.12500 0.29364 1.0000 + Zn Zn243 1.0 0.69568 0.20833 0.29364 1.0000 + Zn Zn244 1.0 0.69568 0.29167 0.29364 1.0000 + Zn Zn245 1.0 0.69568 0.37500 0.29364 1.0000 + Zn Zn246 1.0 0.69568 0.45833 0.29364 1.0000 + Zn Zn247 1.0 0.69568 0.54167 0.29364 1.0000 + Zn Zn248 1.0 0.69568 0.62500 0.29364 1.0000 + Zn Zn249 1.0 0.69568 0.70833 0.29364 1.0000 + Zn Zn250 1.0 0.69568 0.79167 0.29364 1.0000 + Zn Zn251 1.0 0.69568 0.87500 0.29364 1.0000 + Zn Zn252 1.0 0.69568 0.95833 0.29364 1.0000 + Zn Zn253 1.0 0.77902 0.04167 0.29364 1.0000 + Zn Zn254 1.0 0.77902 0.12500 0.29364 1.0000 + Zn Zn255 1.0 0.77902 0.20833 0.29364 1.0000 + Zn Zn256 1.0 0.77902 0.29167 0.29364 1.0000 + Zn Zn257 1.0 0.77902 0.37500 0.29364 1.0000 + Zn Zn258 1.0 0.77902 0.45833 0.29364 1.0000 + Zn Zn259 1.0 0.77902 0.54167 0.29364 1.0000 + Zn Zn260 1.0 0.77902 0.62500 0.29364 1.0000 + Zn Zn261 1.0 0.77902 0.70833 0.29364 1.0000 + Zn Zn262 1.0 0.77902 0.79167 0.29364 1.0000 + Zn Zn263 1.0 0.77902 0.87500 0.29364 1.0000 + Zn Zn264 1.0 0.77902 0.95833 0.29364 1.0000 + Zn Zn265 1.0 0.86235 0.04167 0.29364 1.0000 + Zn Zn266 1.0 0.86235 0.12500 0.29364 1.0000 + Zn Zn267 1.0 0.86235 0.20833 0.29364 1.0000 + Zn Zn268 1.0 0.86235 0.29167 0.29364 1.0000 + Zn Zn269 1.0 0.86235 0.37500 0.29364 1.0000 + Zn Zn270 1.0 0.86235 0.45833 0.29364 1.0000 + Zn Zn271 1.0 0.86235 0.54167 0.29364 1.0000 + Zn Zn272 1.0 0.86235 0.62500 0.29364 1.0000 + Zn Zn273 1.0 0.86235 0.70833 0.29364 1.0000 + Zn Zn274 1.0 0.86235 0.79167 0.29364 1.0000 + Zn Zn275 1.0 0.86235 0.87500 0.29364 1.0000 + Zn Zn276 1.0 0.86235 0.95833 0.29364 1.0000 + Zn Zn277 1.0 0.94568 0.04167 0.29364 1.0000 + Zn Zn278 1.0 0.94568 0.12500 0.29364 1.0000 + Zn Zn279 1.0 0.94568 0.20833 0.29364 1.0000 + Zn Zn280 1.0 0.94568 0.29167 0.29364 1.0000 + Zn Zn281 1.0 0.94568 0.37500 0.29364 1.0000 + Zn Zn282 1.0 0.94568 0.45833 0.29364 1.0000 + Zn Zn283 1.0 0.94568 0.54167 0.29364 1.0000 + Zn Zn284 1.0 0.94568 0.62500 0.29364 1.0000 + Zn Zn285 1.0 0.94568 0.70833 0.29364 1.0000 + Zn Zn286 1.0 0.94568 0.79167 0.29364 1.0000 + Zn Zn287 1.0 0.94568 0.87500 0.29364 1.0000 + Zn Zn288 1.0 0.94568 0.95833 0.29364 1.0000 + Sn Sn1 1.0 0.02903 0.00000 0.50000 1.0000 + Sn Sn2 1.0 0.02903 0.08333 0.50000 1.0000 + Sn Sn3 1.0 0.02903 0.16667 0.50000 1.0000 + Sn Sn4 1.0 0.02903 0.25000 0.50000 1.0000 + Sn Sn5 1.0 0.02903 0.33333 0.50000 1.0000 + Sn Sn6 1.0 0.02903 0.41667 0.50000 1.0000 + Sn Sn7 1.0 0.02903 0.50000 0.50000 1.0000 + Sn Sn8 1.0 0.02903 0.58333 0.50000 1.0000 + Sn Sn9 1.0 0.02903 0.66667 0.50000 1.0000 + Sn Sn10 1.0 0.02903 0.75000 0.50000 1.0000 + Sn Sn11 1.0 0.02903 0.83333 0.50000 1.0000 + Sn Sn12 1.0 0.02903 0.91667 0.50000 1.0000 + Sn Sn13 1.0 0.11236 0.00000 0.50000 1.0000 + Sn Sn14 1.0 0.11236 0.08333 0.50000 1.0000 + Sn Sn15 1.0 0.11236 0.16667 0.50000 1.0000 + Sn Sn16 1.0 0.11236 0.25000 0.50000 1.0000 + Sn Sn17 1.0 0.11236 0.33333 0.50000 1.0000 + Sn Sn18 1.0 0.11236 0.41667 0.50000 1.0000 + Sn Sn19 1.0 0.11236 0.50000 0.50000 1.0000 + Sn Sn20 1.0 0.11236 0.58333 0.50000 1.0000 + Sn Sn21 1.0 0.11236 0.66667 0.50000 1.0000 + Sn Sn22 1.0 0.11236 0.75000 0.50000 1.0000 + Sn Sn23 1.0 0.11236 0.83333 0.50000 1.0000 + Sn Sn24 1.0 0.11236 0.91667 0.50000 1.0000 + Sn Sn25 1.0 0.19569 0.00000 0.50000 1.0000 + Sn Sn26 1.0 0.19569 0.08333 0.50000 1.0000 + Sn Sn27 1.0 0.19569 0.16667 0.50000 1.0000 + Sn Sn28 1.0 0.19569 0.25000 0.50000 1.0000 + Sn Sn29 1.0 0.19569 0.33333 0.50000 1.0000 + Sn Sn30 1.0 0.19569 0.41667 0.50000 1.0000 + Sn Sn31 1.0 0.19569 0.50000 0.50000 1.0000 + Sn Sn32 1.0 0.19569 0.58333 0.50000 1.0000 + Sn Sn33 1.0 0.19569 0.66667 0.50000 1.0000 + Sn Sn34 1.0 0.19569 0.75000 0.50000 1.0000 + Sn Sn35 1.0 0.19569 0.83333 0.50000 1.0000 + Sn Sn36 1.0 0.19569 0.91667 0.50000 1.0000 + Sn Sn37 1.0 0.27903 0.00000 0.50000 1.0000 + Sn Sn38 1.0 0.27903 0.08333 0.50000 1.0000 + Sn Sn39 1.0 0.27903 0.16667 0.50000 1.0000 + Sn Sn40 1.0 0.27903 0.25000 0.50000 1.0000 + Sn Sn41 1.0 0.27903 0.33333 0.50000 1.0000 + Sn Sn42 1.0 0.27903 0.41667 0.50000 1.0000 + Sn Sn43 1.0 0.27903 0.50000 0.50000 1.0000 + Sn Sn44 1.0 0.27903 0.58333 0.50000 1.0000 + Sn Sn45 1.0 0.27903 0.66667 0.50000 1.0000 + Sn Sn46 1.0 0.27903 0.75000 0.50000 1.0000 + Sn Sn47 1.0 0.27903 0.83333 0.50000 1.0000 + Sn Sn48 1.0 0.27903 0.91667 0.50000 1.0000 + Sn Sn49 1.0 0.36236 0.00000 0.50000 1.0000 + Sn Sn50 1.0 0.36236 0.08333 0.50000 1.0000 + Sn Sn51 1.0 0.36236 0.16667 0.50000 1.0000 + Sn Sn52 1.0 0.36236 0.25000 0.50000 1.0000 + Sn Sn53 1.0 0.36236 0.33333 0.50000 1.0000 + Sn Sn54 1.0 0.36236 0.41667 0.50000 1.0000 + Sn Sn55 1.0 0.36236 0.50000 0.50000 1.0000 + Sn Sn56 1.0 0.36236 0.58333 0.50000 1.0000 + Sn Sn57 1.0 0.36236 0.66667 0.50000 1.0000 + Sn Sn58 1.0 0.36236 0.75000 0.50000 1.0000 + Sn Sn59 1.0 0.36236 0.83333 0.50000 1.0000 + Sn Sn60 1.0 0.36236 0.91667 0.50000 1.0000 + Sn Sn61 1.0 0.44569 0.00000 0.50000 1.0000 + Sn Sn62 1.0 0.44569 0.08333 0.50000 1.0000 + Sn Sn63 1.0 0.44569 0.16667 0.50000 1.0000 + Sn Sn64 1.0 0.44569 0.25000 0.50000 1.0000 + Sn Sn65 1.0 0.44569 0.33333 0.50000 1.0000 + Sn Sn66 1.0 0.44569 0.41667 0.50000 1.0000 + Sn Sn67 1.0 0.44569 0.50000 0.50000 1.0000 + Sn Sn68 1.0 0.44569 0.58333 0.50000 1.0000 + Sn Sn69 1.0 0.44569 0.66667 0.50000 1.0000 + Sn Sn70 1.0 0.44569 0.75000 0.50000 1.0000 + Sn Sn71 1.0 0.44569 0.83333 0.50000 1.0000 + Sn Sn72 1.0 0.44569 0.91667 0.50000 1.0000 + Sn Sn73 1.0 0.52903 0.00000 0.50000 1.0000 + Sn Sn74 1.0 0.52903 0.08333 0.50000 1.0000 + Sn Sn75 1.0 0.52903 0.16667 0.50000 1.0000 + Sn Sn76 1.0 0.52903 0.25000 0.50000 1.0000 + Sn Sn77 1.0 0.52903 0.33333 0.50000 1.0000 + Sn Sn78 1.0 0.52903 0.41667 0.50000 1.0000 + Sn Sn79 1.0 0.52903 0.50000 0.50000 1.0000 + Sn Sn80 1.0 0.52903 0.58333 0.50000 1.0000 + Sn Sn81 1.0 0.52903 0.66667 0.50000 1.0000 + Sn Sn82 1.0 0.52903 0.75000 0.50000 1.0000 + Sn Sn83 1.0 0.52903 0.83333 0.50000 1.0000 + Sn Sn84 1.0 0.52903 0.91667 0.50000 1.0000 + Sn Sn85 1.0 0.61236 0.00000 0.50000 1.0000 + Sn Sn86 1.0 0.61236 0.08333 0.50000 1.0000 + Sn Sn87 1.0 0.61236 0.16667 0.50000 1.0000 + Sn Sn88 1.0 0.61236 0.25000 0.50000 1.0000 + Sn Sn89 1.0 0.61236 0.33333 0.50000 1.0000 + Sn Sn90 1.0 0.61236 0.41667 0.50000 1.0000 + Sn Sn91 1.0 0.61236 0.50000 0.50000 1.0000 + Sn Sn92 1.0 0.61236 0.58333 0.50000 1.0000 + Sn Sn93 1.0 0.61236 0.66667 0.50000 1.0000 + Sn Sn94 1.0 0.61236 0.75000 0.50000 1.0000 + Sn Sn95 1.0 0.61236 0.83333 0.50000 1.0000 + Sn Sn96 1.0 0.61236 0.91667 0.50000 1.0000 + Sn Sn97 1.0 0.69569 0.00000 0.50000 1.0000 + Sn Sn98 1.0 0.69569 0.08333 0.50000 1.0000 + Sn Sn99 1.0 0.69569 0.16667 0.50000 1.0000 + Sn Sn100 1.0 0.69569 0.25000 0.50000 1.0000 + Sn Sn101 1.0 0.69569 0.33333 0.50000 1.0000 + Sn Sn102 1.0 0.69569 0.41667 0.50000 1.0000 + Sn Sn103 1.0 0.69569 0.50000 0.50000 1.0000 + Sn Sn104 1.0 0.69569 0.58333 0.50000 1.0000 + Sn Sn105 1.0 0.69569 0.66667 0.50000 1.0000 + Sn Sn106 1.0 0.69569 0.75000 0.50000 1.0000 + Sn Sn107 1.0 0.69569 0.83333 0.50000 1.0000 + Sn Sn108 1.0 0.69569 0.91667 0.50000 1.0000 + Sn Sn109 1.0 0.77903 0.00000 0.50000 1.0000 + Sn Sn110 1.0 0.77903 0.08333 0.50000 1.0000 + Sn Sn111 1.0 0.77903 0.16667 0.50000 1.0000 + Sn Sn112 1.0 0.77903 0.25000 0.50000 1.0000 + Sn Sn113 1.0 0.77903 0.33333 0.50000 1.0000 + Sn Sn114 1.0 0.77903 0.41667 0.50000 1.0000 + Sn Sn115 1.0 0.77903 0.50000 0.50000 1.0000 + Sn Sn116 1.0 0.77903 0.58333 0.50000 1.0000 + Sn Sn117 1.0 0.77903 0.66667 0.50000 1.0000 + Sn Sn118 1.0 0.77903 0.75000 0.50000 1.0000 + Sn Sn119 1.0 0.77903 0.83333 0.50000 1.0000 + Sn Sn120 1.0 0.77903 0.91667 0.50000 1.0000 + Sn Sn121 1.0 0.86236 0.00000 0.50000 1.0000 + Sn Sn122 1.0 0.86236 0.08333 0.50000 1.0000 + Sn Sn123 1.0 0.86236 0.16667 0.50000 1.0000 + Sn Sn124 1.0 0.86236 0.25000 0.50000 1.0000 + Sn Sn125 1.0 0.86236 0.33333 0.50000 1.0000 + Sn Sn126 1.0 0.86236 0.41667 0.50000 1.0000 + Sn Sn127 1.0 0.86236 0.50000 0.50000 1.0000 + Sn Sn128 1.0 0.86236 0.58333 0.50000 1.0000 + Sn Sn129 1.0 0.86236 0.66667 0.50000 1.0000 + Sn Sn130 1.0 0.86236 0.75000 0.50000 1.0000 + Sn Sn131 1.0 0.86236 0.83333 0.50000 1.0000 + Sn Sn132 1.0 0.86236 0.91667 0.50000 1.0000 + Sn Sn133 1.0 0.94569 0.00000 0.50000 1.0000 + Sn Sn134 1.0 0.94569 0.08333 0.50000 1.0000 + Sn Sn135 1.0 0.94569 0.16667 0.50000 1.0000 + Sn Sn136 1.0 0.94569 0.25000 0.50000 1.0000 + Sn Sn137 1.0 0.94569 0.33333 0.50000 1.0000 + Sn Sn138 1.0 0.94569 0.41667 0.50000 1.0000 + Sn Sn139 1.0 0.94569 0.50000 0.50000 1.0000 + Sn Sn140 1.0 0.94569 0.58333 0.50000 1.0000 + Sn Sn141 1.0 0.94569 0.66667 0.50000 1.0000 + Sn Sn142 1.0 0.94569 0.75000 0.50000 1.0000 + Sn Sn143 1.0 0.94569 0.83333 0.50000 1.0000 + Sn Sn144 1.0 0.94569 0.91667 0.50000 1.0000 + Sn Sn145 1.0 0.07069 0.02119 0.50000 1.0000 + Sn Sn146 1.0 0.07069 0.10452 0.50000 1.0000 + Sn Sn147 1.0 0.07069 0.18786 0.50000 1.0000 + Sn Sn148 1.0 0.07069 0.27119 0.50000 1.0000 + Sn Sn149 1.0 0.07069 0.35452 0.50000 1.0000 + Sn Sn150 1.0 0.07069 0.43786 0.50000 1.0000 + Sn Sn151 1.0 0.07069 0.52119 0.50000 1.0000 + Sn Sn152 1.0 0.07069 0.60452 0.50000 1.0000 + Sn Sn153 1.0 0.07069 0.68786 0.50000 1.0000 + Sn Sn154 1.0 0.07069 0.77119 0.50000 1.0000 + Sn Sn155 1.0 0.07069 0.85452 0.50000 1.0000 + Sn Sn156 1.0 0.07069 0.93786 0.50000 1.0000 + Sn Sn157 1.0 0.15403 0.02119 0.50000 1.0000 + Sn Sn158 1.0 0.15403 0.10452 0.50000 1.0000 + Sn Sn159 1.0 0.15403 0.18786 0.50000 1.0000 + Sn Sn160 1.0 0.15403 0.27119 0.50000 1.0000 + Sn Sn161 1.0 0.15403 0.35452 0.50000 1.0000 + Sn Sn162 1.0 0.15403 0.43786 0.50000 1.0000 + Sn Sn163 1.0 0.15403 0.52119 0.50000 1.0000 + Sn Sn164 1.0 0.15403 0.60452 0.50000 1.0000 + Sn Sn165 1.0 0.15403 0.68786 0.50000 1.0000 + Sn Sn166 1.0 0.15403 0.77119 0.50000 1.0000 + Sn Sn167 1.0 0.15403 0.85452 0.50000 1.0000 + Sn Sn168 1.0 0.15403 0.93786 0.50000 1.0000 + Sn Sn169 1.0 0.23736 0.02119 0.50000 1.0000 + Sn Sn170 1.0 0.23736 0.10452 0.50000 1.0000 + Sn Sn171 1.0 0.23736 0.18786 0.50000 1.0000 + Sn Sn172 1.0 0.23736 0.27119 0.50000 1.0000 + Sn Sn173 1.0 0.23736 0.35452 0.50000 1.0000 + Sn Sn174 1.0 0.23736 0.43786 0.50000 1.0000 + Sn Sn175 1.0 0.23736 0.52119 0.50000 1.0000 + Sn Sn176 1.0 0.23736 0.60452 0.50000 1.0000 + Sn Sn177 1.0 0.23736 0.68786 0.50000 1.0000 + Sn Sn178 1.0 0.23736 0.77119 0.50000 1.0000 + Sn Sn179 1.0 0.23736 0.85452 0.50000 1.0000 + Sn Sn180 1.0 0.23736 0.93786 0.50000 1.0000 + Sn Sn181 1.0 0.32069 0.02119 0.50000 1.0000 + Sn Sn182 1.0 0.32069 0.10452 0.50000 1.0000 + Sn Sn183 1.0 0.32069 0.18786 0.50000 1.0000 + Sn Sn184 1.0 0.32069 0.27119 0.50000 1.0000 + Sn Sn185 1.0 0.32069 0.35452 0.50000 1.0000 + Sn Sn186 1.0 0.32069 0.43786 0.50000 1.0000 + Sn Sn187 1.0 0.32069 0.52119 0.50000 1.0000 + Sn Sn188 1.0 0.32069 0.60452 0.50000 1.0000 + Sn Sn189 1.0 0.32069 0.68786 0.50000 1.0000 + Sn Sn190 1.0 0.32069 0.77119 0.50000 1.0000 + Sn Sn191 1.0 0.32069 0.85452 0.50000 1.0000 + Sn Sn192 1.0 0.32069 0.93786 0.50000 1.0000 + Sn Sn193 1.0 0.40403 0.02119 0.50000 1.0000 + Sn Sn194 1.0 0.40403 0.10452 0.50000 1.0000 + Sn Sn195 1.0 0.40403 0.18786 0.50000 1.0000 + Sn Sn196 1.0 0.40403 0.27119 0.50000 1.0000 + Sn Sn197 1.0 0.40403 0.35452 0.50000 1.0000 + Sn Sn198 1.0 0.40403 0.43786 0.50000 1.0000 + Sn Sn199 1.0 0.40403 0.52119 0.50000 1.0000 + Sn Sn200 1.0 0.40403 0.60452 0.50000 1.0000 + Sn Sn201 1.0 0.40403 0.68786 0.50000 1.0000 + Sn Sn202 1.0 0.40403 0.77119 0.50000 1.0000 + Sn Sn203 1.0 0.40403 0.85452 0.50000 1.0000 + Sn Sn204 1.0 0.40403 0.93786 0.50000 1.0000 + Sn Sn205 1.0 0.48736 0.02119 0.50000 1.0000 + Sn Sn206 1.0 0.48736 0.10452 0.50000 1.0000 + Sn Sn207 1.0 0.48736 0.18786 0.50000 1.0000 + Sn Sn208 1.0 0.48736 0.27119 0.50000 1.0000 + Sn Sn209 1.0 0.48736 0.35452 0.50000 1.0000 + Sn Sn210 1.0 0.48736 0.43786 0.50000 1.0000 + Sn Sn211 1.0 0.48736 0.52119 0.50000 1.0000 + Sn Sn212 1.0 0.48736 0.60452 0.50000 1.0000 + Sn Sn213 1.0 0.48736 0.68786 0.50000 1.0000 + Sn Sn214 1.0 0.48736 0.77119 0.50000 1.0000 + Sn Sn215 1.0 0.48736 0.85452 0.50000 1.0000 + Sn Sn216 1.0 0.48736 0.93786 0.50000 1.0000 + Sn Sn217 1.0 0.57069 0.02119 0.50000 1.0000 + Sn Sn218 1.0 0.57069 0.10452 0.50000 1.0000 + Sn Sn219 1.0 0.57069 0.18786 0.50000 1.0000 + Sn Sn220 1.0 0.57069 0.27119 0.50000 1.0000 + Sn Sn221 1.0 0.57069 0.35452 0.50000 1.0000 + Sn Sn222 1.0 0.57069 0.43786 0.50000 1.0000 + Sn Sn223 1.0 0.57069 0.52119 0.50000 1.0000 + Sn Sn224 1.0 0.57069 0.60452 0.50000 1.0000 + Sn Sn225 1.0 0.57069 0.68786 0.50000 1.0000 + Sn Sn226 1.0 0.57069 0.77119 0.50000 1.0000 + Sn Sn227 1.0 0.57069 0.85452 0.50000 1.0000 + Sn Sn228 1.0 0.57069 0.93786 0.50000 1.0000 + Sn Sn229 1.0 0.65403 0.02119 0.50000 1.0000 + Sn Sn230 1.0 0.65403 0.10452 0.50000 1.0000 + Sn Sn231 1.0 0.65403 0.18786 0.50000 1.0000 + Sn Sn232 1.0 0.65403 0.27119 0.50000 1.0000 + Sn Sn233 1.0 0.65403 0.35452 0.50000 1.0000 + Sn Sn234 1.0 0.65403 0.43786 0.50000 1.0000 + Sn Sn235 1.0 0.65403 0.52119 0.50000 1.0000 + Sn Sn236 1.0 0.65403 0.60452 0.50000 1.0000 + Sn Sn237 1.0 0.65403 0.68786 0.50000 1.0000 + Sn Sn238 1.0 0.65403 0.77119 0.50000 1.0000 + Sn Sn239 1.0 0.65403 0.85452 0.50000 1.0000 + Sn Sn240 1.0 0.65403 0.93786 0.50000 1.0000 + Sn Sn241 1.0 0.73736 0.02119 0.50000 1.0000 + Sn Sn242 1.0 0.73736 0.10452 0.50000 1.0000 + Sn Sn243 1.0 0.73736 0.18786 0.50000 1.0000 + Sn Sn244 1.0 0.73736 0.27119 0.50000 1.0000 + Sn Sn245 1.0 0.73736 0.35452 0.50000 1.0000 + Sn Sn246 1.0 0.73736 0.43786 0.50000 1.0000 + Sn Sn247 1.0 0.73736 0.52119 0.50000 1.0000 + Sn Sn248 1.0 0.73736 0.60452 0.50000 1.0000 + Sn Sn249 1.0 0.73736 0.68786 0.50000 1.0000 + Sn Sn250 1.0 0.73736 0.77119 0.50000 1.0000 + Sn Sn251 1.0 0.73736 0.85452 0.50000 1.0000 + Sn Sn252 1.0 0.73736 0.93786 0.50000 1.0000 + Sn Sn253 1.0 0.82069 0.02119 0.50000 1.0000 + Sn Sn254 1.0 0.82069 0.10452 0.50000 1.0000 + Sn Sn255 1.0 0.82069 0.18786 0.50000 1.0000 + Sn Sn256 1.0 0.82069 0.27119 0.50000 1.0000 + Sn Sn257 1.0 0.82069 0.35452 0.50000 1.0000 + Sn Sn258 1.0 0.82069 0.43786 0.50000 1.0000 + Sn Sn259 1.0 0.82069 0.52119 0.50000 1.0000 + Sn Sn260 1.0 0.82069 0.60452 0.50000 1.0000 + Sn Sn261 1.0 0.82069 0.68786 0.50000 1.0000 + Sn Sn262 1.0 0.82069 0.77119 0.50000 1.0000 + Sn Sn263 1.0 0.82069 0.85452 0.50000 1.0000 + Sn Sn264 1.0 0.82069 0.93786 0.50000 1.0000 + Sn Sn265 1.0 0.90403 0.02119 0.50000 1.0000 + Sn Sn266 1.0 0.90403 0.10452 0.50000 1.0000 + Sn Sn267 1.0 0.90403 0.18786 0.50000 1.0000 + Sn Sn268 1.0 0.90403 0.27119 0.50000 1.0000 + Sn Sn269 1.0 0.90403 0.35452 0.50000 1.0000 + Sn Sn270 1.0 0.90403 0.43786 0.50000 1.0000 + Sn Sn271 1.0 0.90403 0.52119 0.50000 1.0000 + Sn Sn272 1.0 0.90403 0.60452 0.50000 1.0000 + Sn Sn273 1.0 0.90403 0.68786 0.50000 1.0000 + Sn Sn274 1.0 0.90403 0.77119 0.50000 1.0000 + Sn Sn275 1.0 0.90403 0.85452 0.50000 1.0000 + Sn Sn276 1.0 0.90403 0.93786 0.50000 1.0000 + Sn Sn277 1.0 0.98736 0.02119 0.50000 1.0000 + Sn Sn278 1.0 0.98736 0.10452 0.50000 1.0000 + Sn Sn279 1.0 0.98736 0.18786 0.50000 1.0000 + Sn Sn280 1.0 0.98736 0.27119 0.50000 1.0000 + Sn Sn281 1.0 0.98736 0.35452 0.50000 1.0000 + Sn Sn282 1.0 0.98736 0.43786 0.50000 1.0000 + Sn Sn283 1.0 0.98736 0.52119 0.50000 1.0000 + Sn Sn284 1.0 0.98736 0.60452 0.50000 1.0000 + Sn Sn285 1.0 0.98736 0.68786 0.50000 1.0000 + Sn Sn286 1.0 0.98736 0.77119 0.50000 1.0000 + Sn Sn287 1.0 0.98736 0.85452 0.50000 1.0000 + Sn Sn288 1.0 0.98736 0.93786 0.50000 1.0000 + Sn Sn289 1.0 0.07069 0.06214 0.50000 1.0000 + Sn Sn290 1.0 0.07069 0.14548 0.50000 1.0000 + Sn Sn291 1.0 0.07069 0.22881 0.50000 1.0000 + Sn Sn292 1.0 0.07069 0.31214 0.50000 1.0000 + Sn Sn293 1.0 0.07069 0.39548 0.50000 1.0000 + Sn Sn294 1.0 0.07069 0.47881 0.50000 1.0000 + Sn Sn295 1.0 0.07069 0.56214 0.50000 1.0000 + Sn Sn296 1.0 0.07069 0.64548 0.50000 1.0000 + Sn Sn297 1.0 0.07069 0.72881 0.50000 1.0000 + Sn Sn298 1.0 0.07069 0.81214 0.50000 1.0000 + Sn Sn299 1.0 0.07069 0.89548 0.50000 1.0000 + Sn Sn300 1.0 0.07069 0.97881 0.50000 1.0000 + Sn Sn301 1.0 0.15403 0.06214 0.50000 1.0000 + Sn Sn302 1.0 0.15403 0.14548 0.50000 1.0000 + Sn Sn303 1.0 0.15403 0.22881 0.50000 1.0000 + Sn Sn304 1.0 0.15403 0.31214 0.50000 1.0000 + Sn Sn305 1.0 0.15403 0.39548 0.50000 1.0000 + Sn Sn306 1.0 0.15403 0.47881 0.50000 1.0000 + Sn Sn307 1.0 0.15403 0.56214 0.50000 1.0000 + Sn Sn308 1.0 0.15403 0.64548 0.50000 1.0000 + Sn Sn309 1.0 0.15403 0.72881 0.50000 1.0000 + Sn Sn310 1.0 0.15403 0.81214 0.50000 1.0000 + Sn Sn311 1.0 0.15403 0.89548 0.50000 1.0000 + Sn Sn312 1.0 0.15403 0.97881 0.50000 1.0000 + Sn Sn313 1.0 0.23736 0.06214 0.50000 1.0000 + Sn Sn314 1.0 0.23736 0.14548 0.50000 1.0000 + Sn Sn315 1.0 0.23736 0.22881 0.50000 1.0000 + Sn Sn316 1.0 0.23736 0.31214 0.50000 1.0000 + Sn Sn317 1.0 0.23736 0.39548 0.50000 1.0000 + Sn Sn318 1.0 0.23736 0.47881 0.50000 1.0000 + Sn Sn319 1.0 0.23736 0.56214 0.50000 1.0000 + Sn Sn320 1.0 0.23736 0.64548 0.50000 1.0000 + Sn Sn321 1.0 0.23736 0.72881 0.50000 1.0000 + Sn Sn322 1.0 0.23736 0.81214 0.50000 1.0000 + Sn Sn323 1.0 0.23736 0.89548 0.50000 1.0000 + Sn Sn324 1.0 0.23736 0.97881 0.50000 1.0000 + Sn Sn325 1.0 0.32069 0.06214 0.50000 1.0000 + Sn Sn326 1.0 0.32069 0.14548 0.50000 1.0000 + Sn Sn327 1.0 0.32069 0.22881 0.50000 1.0000 + Sn Sn328 1.0 0.32069 0.31214 0.50000 1.0000 + Sn Sn329 1.0 0.32069 0.39548 0.50000 1.0000 + Sn Sn330 1.0 0.32069 0.47881 0.50000 1.0000 + Sn Sn331 1.0 0.32069 0.56214 0.50000 1.0000 + Sn Sn332 1.0 0.32069 0.64548 0.50000 1.0000 + Sn Sn333 1.0 0.32069 0.72881 0.50000 1.0000 + Sn Sn334 1.0 0.32069 0.81214 0.50000 1.0000 + Sn Sn335 1.0 0.32069 0.89548 0.50000 1.0000 + Sn Sn336 1.0 0.32069 0.97881 0.50000 1.0000 + Sn Sn337 1.0 0.40403 0.06214 0.50000 1.0000 + Sn Sn338 1.0 0.40403 0.14548 0.50000 1.0000 + Sn Sn339 1.0 0.40403 0.22881 0.50000 1.0000 + Sn Sn340 1.0 0.40403 0.31214 0.50000 1.0000 + Sn Sn341 1.0 0.40403 0.39548 0.50000 1.0000 + Sn Sn342 1.0 0.40403 0.47881 0.50000 1.0000 + Sn Sn343 1.0 0.40403 0.56214 0.50000 1.0000 + Sn Sn344 1.0 0.40403 0.64548 0.50000 1.0000 + Sn Sn345 1.0 0.40403 0.72881 0.50000 1.0000 + Sn Sn346 1.0 0.40403 0.81214 0.50000 1.0000 + Sn Sn347 1.0 0.40403 0.89548 0.50000 1.0000 + Sn Sn348 1.0 0.40403 0.97881 0.50000 1.0000 + Sn Sn349 1.0 0.48736 0.06214 0.50000 1.0000 + Sn Sn350 1.0 0.48736 0.14548 0.50000 1.0000 + Sn Sn351 1.0 0.48736 0.22881 0.50000 1.0000 + Sn Sn352 1.0 0.48736 0.31214 0.50000 1.0000 + Sn Sn353 1.0 0.48736 0.39548 0.50000 1.0000 + Sn Sn354 1.0 0.48736 0.47881 0.50000 1.0000 + Sn Sn355 1.0 0.48736 0.56214 0.50000 1.0000 + Sn Sn356 1.0 0.48736 0.64548 0.50000 1.0000 + Sn Sn357 1.0 0.48736 0.72881 0.50000 1.0000 + Sn Sn358 1.0 0.48736 0.81214 0.50000 1.0000 + Sn Sn359 1.0 0.48736 0.89548 0.50000 1.0000 + Sn Sn360 1.0 0.48736 0.97881 0.50000 1.0000 + Sn Sn361 1.0 0.57069 0.06214 0.50000 1.0000 + Sn Sn362 1.0 0.57069 0.14548 0.50000 1.0000 + Sn Sn363 1.0 0.57069 0.22881 0.50000 1.0000 + Sn Sn364 1.0 0.57069 0.31214 0.50000 1.0000 + Sn Sn365 1.0 0.57069 0.39548 0.50000 1.0000 + Sn Sn366 1.0 0.57069 0.47881 0.50000 1.0000 + Sn Sn367 1.0 0.57069 0.56214 0.50000 1.0000 + Sn Sn368 1.0 0.57069 0.64548 0.50000 1.0000 + Sn Sn369 1.0 0.57069 0.72881 0.50000 1.0000 + Sn Sn370 1.0 0.57069 0.81214 0.50000 1.0000 + Sn Sn371 1.0 0.57069 0.89548 0.50000 1.0000 + Sn Sn372 1.0 0.57069 0.97881 0.50000 1.0000 + Sn Sn373 1.0 0.65403 0.06214 0.50000 1.0000 + Sn Sn374 1.0 0.65403 0.14548 0.50000 1.0000 + Sn Sn375 1.0 0.65403 0.22881 0.50000 1.0000 + Sn Sn376 1.0 0.65403 0.31214 0.50000 1.0000 + Sn Sn377 1.0 0.65403 0.39548 0.50000 1.0000 + Sn Sn378 1.0 0.65403 0.47881 0.50000 1.0000 + Sn Sn379 1.0 0.65403 0.56214 0.50000 1.0000 + Sn Sn380 1.0 0.65403 0.64548 0.50000 1.0000 + Sn Sn381 1.0 0.65403 0.72881 0.50000 1.0000 + Sn Sn382 1.0 0.65403 0.81214 0.50000 1.0000 + Sn Sn383 1.0 0.65403 0.89548 0.50000 1.0000 + Sn Sn384 1.0 0.65403 0.97881 0.50000 1.0000 + Sn Sn385 1.0 0.73736 0.06214 0.50000 1.0000 + Sn Sn386 1.0 0.73736 0.14548 0.50000 1.0000 + Sn Sn387 1.0 0.73736 0.22881 0.50000 1.0000 + Sn Sn388 1.0 0.73736 0.31214 0.50000 1.0000 + Sn Sn389 1.0 0.73736 0.39548 0.50000 1.0000 + Sn Sn390 1.0 0.73736 0.47881 0.50000 1.0000 + Sn Sn391 1.0 0.73736 0.56214 0.50000 1.0000 + Sn Sn392 1.0 0.73736 0.64548 0.50000 1.0000 + Sn Sn393 1.0 0.73736 0.72881 0.50000 1.0000 + Sn Sn394 1.0 0.73736 0.81214 0.50000 1.0000 + Sn Sn395 1.0 0.73736 0.89548 0.50000 1.0000 + Sn Sn396 1.0 0.73736 0.97881 0.50000 1.0000 + Sn Sn397 1.0 0.82069 0.06214 0.50000 1.0000 + Sn Sn398 1.0 0.82069 0.14548 0.50000 1.0000 + Sn Sn399 1.0 0.82069 0.22881 0.50000 1.0000 + Sn Sn400 1.0 0.82069 0.31214 0.50000 1.0000 + Sn Sn401 1.0 0.82069 0.39548 0.50000 1.0000 + Sn Sn402 1.0 0.82069 0.47881 0.50000 1.0000 + Sn Sn403 1.0 0.82069 0.56214 0.50000 1.0000 + Sn Sn404 1.0 0.82069 0.64548 0.50000 1.0000 + Sn Sn405 1.0 0.82069 0.72881 0.50000 1.0000 + Sn Sn406 1.0 0.82069 0.81214 0.50000 1.0000 + Sn Sn407 1.0 0.82069 0.89548 0.50000 1.0000 + Sn Sn408 1.0 0.82069 0.97881 0.50000 1.0000 + Sn Sn409 1.0 0.90403 0.06214 0.50000 1.0000 + Sn Sn410 1.0 0.90403 0.14548 0.50000 1.0000 + Sn Sn411 1.0 0.90403 0.22881 0.50000 1.0000 + Sn Sn412 1.0 0.90403 0.31214 0.50000 1.0000 + Sn Sn413 1.0 0.90403 0.39548 0.50000 1.0000 + Sn Sn414 1.0 0.90403 0.47881 0.50000 1.0000 + Sn Sn415 1.0 0.90403 0.56214 0.50000 1.0000 + Sn Sn416 1.0 0.90403 0.64548 0.50000 1.0000 + Sn Sn417 1.0 0.90403 0.72881 0.50000 1.0000 + Sn Sn418 1.0 0.90403 0.81214 0.50000 1.0000 + Sn Sn419 1.0 0.90403 0.89548 0.50000 1.0000 + Sn Sn420 1.0 0.90403 0.97881 0.50000 1.0000 + Sn Sn421 1.0 0.98736 0.06214 0.50000 1.0000 + Sn Sn422 1.0 0.98736 0.14548 0.50000 1.0000 + Sn Sn423 1.0 0.98736 0.22881 0.50000 1.0000 + Sn Sn424 1.0 0.98736 0.31214 0.50000 1.0000 + Sn Sn425 1.0 0.98736 0.39548 0.50000 1.0000 + Sn Sn426 1.0 0.98736 0.47881 0.50000 1.0000 + Sn Sn427 1.0 0.98736 0.56214 0.50000 1.0000 + Sn Sn428 1.0 0.98736 0.64548 0.50000 1.0000 + Sn Sn429 1.0 0.98736 0.72881 0.50000 1.0000 + Sn Sn430 1.0 0.98736 0.81214 0.50000 1.0000 + Sn Sn431 1.0 0.98736 0.89548 0.50000 1.0000 + Sn Sn432 1.0 0.98736 0.97881 0.50000 1.0000 + O O1 1.0 0.05832 0.04167 0.33273 1.0000 + O O2 1.0 0.05832 0.12500 0.33273 1.0000 + O O3 1.0 0.05832 0.20833 0.33273 1.0000 + O O4 1.0 0.05832 0.29167 0.33273 1.0000 + O O5 1.0 0.05832 0.37500 0.33273 1.0000 + O O6 1.0 0.05832 0.45833 0.33273 1.0000 + O O7 1.0 0.05832 0.54167 0.33273 1.0000 + O O8 1.0 0.05832 0.62500 0.33273 1.0000 + O O9 1.0 0.05832 0.70833 0.33273 1.0000 + O O10 1.0 0.05832 0.79167 0.33273 1.0000 + O O11 1.0 0.05832 0.87500 0.33273 1.0000 + O O12 1.0 0.05832 0.95833 0.33273 1.0000 + O O13 1.0 0.14165 0.04167 0.33273 1.0000 + O O14 1.0 0.14165 0.12500 0.33273 1.0000 + O O15 1.0 0.14165 0.20833 0.33273 1.0000 + O O16 1.0 0.14165 0.29167 0.33273 1.0000 + O O17 1.0 0.14165 0.37500 0.33273 1.0000 + O O18 1.0 0.14165 0.45833 0.33273 1.0000 + O O19 1.0 0.14165 0.54167 0.33273 1.0000 + O O20 1.0 0.14165 0.62500 0.33273 1.0000 + O O21 1.0 0.14165 0.70833 0.33273 1.0000 + O O22 1.0 0.14165 0.79167 0.33273 1.0000 + O O23 1.0 0.14165 0.87500 0.33273 1.0000 + O O24 1.0 0.14165 0.95833 0.33273 1.0000 + O O25 1.0 0.22498 0.04167 0.33273 1.0000 + O O26 1.0 0.22498 0.12500 0.33273 1.0000 + O O27 1.0 0.22498 0.20833 0.33273 1.0000 + O O28 1.0 0.22498 0.29167 0.33273 1.0000 + O O29 1.0 0.22498 0.37500 0.33273 1.0000 + O O30 1.0 0.22498 0.45833 0.33273 1.0000 + O O31 1.0 0.22498 0.54167 0.33273 1.0000 + O O32 1.0 0.22498 0.62500 0.33273 1.0000 + O O33 1.0 0.22498 0.70833 0.33273 1.0000 + O O34 1.0 0.22498 0.79167 0.33273 1.0000 + O O35 1.0 0.22498 0.87500 0.33273 1.0000 + O O36 1.0 0.22498 0.95833 0.33273 1.0000 + O O37 1.0 0.30832 0.04167 0.33273 1.0000 + O O38 1.0 0.30832 0.12500 0.33273 1.0000 + O O39 1.0 0.30832 0.20833 0.33273 1.0000 + O O40 1.0 0.30832 0.29167 0.33273 1.0000 + O O41 1.0 0.30832 0.37500 0.33273 1.0000 + O O42 1.0 0.30832 0.45833 0.33273 1.0000 + O O43 1.0 0.30832 0.54167 0.33273 1.0000 + O O44 1.0 0.30832 0.62500 0.33273 1.0000 + O O45 1.0 0.30832 0.70833 0.33273 1.0000 + O O46 1.0 0.30832 0.79167 0.33273 1.0000 + O O47 1.0 0.30832 0.87500 0.33273 1.0000 + O O48 1.0 0.30832 0.95833 0.33273 1.0000 + O O49 1.0 0.39165 0.04167 0.33273 1.0000 + O O50 1.0 0.39165 0.12500 0.33273 1.0000 + O O51 1.0 0.39165 0.20833 0.33273 1.0000 + O O52 1.0 0.39165 0.29167 0.33273 1.0000 + O O53 1.0 0.39165 0.37500 0.33273 1.0000 + O O54 1.0 0.39165 0.45833 0.33273 1.0000 + O O55 1.0 0.39165 0.54167 0.33273 1.0000 + O O56 1.0 0.39165 0.62500 0.33273 1.0000 + O O57 1.0 0.39165 0.70833 0.33273 1.0000 + O O58 1.0 0.39165 0.79167 0.33273 1.0000 + O O59 1.0 0.39165 0.87500 0.33273 1.0000 + O O60 1.0 0.39165 0.95833 0.33273 1.0000 + O O61 1.0 0.47498 0.04167 0.33273 1.0000 + O O62 1.0 0.47498 0.12500 0.33273 1.0000 + O O63 1.0 0.47498 0.20833 0.33273 1.0000 + O O64 1.0 0.47498 0.29167 0.33273 1.0000 + O O65 1.0 0.47498 0.37500 0.33273 1.0000 + O O66 1.0 0.47498 0.45833 0.33273 1.0000 + O O67 1.0 0.47498 0.54167 0.33273 1.0000 + O O68 1.0 0.47498 0.62500 0.33273 1.0000 + O O69 1.0 0.47498 0.70833 0.33273 1.0000 + O O70 1.0 0.47498 0.79167 0.33273 1.0000 + O O71 1.0 0.47498 0.87500 0.33273 1.0000 + O O72 1.0 0.47498 0.95833 0.33273 1.0000 + O O73 1.0 0.55832 0.04167 0.33273 1.0000 + O O74 1.0 0.55832 0.12500 0.33273 1.0000 + O O75 1.0 0.55832 0.20833 0.33273 1.0000 + O O76 1.0 0.55832 0.29167 0.33273 1.0000 + O O77 1.0 0.55832 0.37500 0.33273 1.0000 + O O78 1.0 0.55832 0.45833 0.33273 1.0000 + O O79 1.0 0.55832 0.54167 0.33273 1.0000 + O O80 1.0 0.55832 0.62500 0.33273 1.0000 + O O81 1.0 0.55832 0.70833 0.33273 1.0000 + O O82 1.0 0.55832 0.79167 0.33273 1.0000 + O O83 1.0 0.55832 0.87500 0.33273 1.0000 + O O84 1.0 0.55832 0.95833 0.33273 1.0000 + O O85 1.0 0.64165 0.04167 0.33273 1.0000 + O O86 1.0 0.64165 0.12500 0.33273 1.0000 + O O87 1.0 0.64165 0.20833 0.33273 1.0000 + O O88 1.0 0.64165 0.29167 0.33273 1.0000 + O O89 1.0 0.64165 0.37500 0.33273 1.0000 + O O90 1.0 0.64165 0.45833 0.33273 1.0000 + O O91 1.0 0.64165 0.54167 0.33273 1.0000 + O O92 1.0 0.64165 0.62500 0.33273 1.0000 + O O93 1.0 0.64165 0.70833 0.33273 1.0000 + O O94 1.0 0.64165 0.79167 0.33273 1.0000 + O O95 1.0 0.64165 0.87500 0.33273 1.0000 + O O96 1.0 0.64165 0.95833 0.33273 1.0000 + O O97 1.0 0.72498 0.04167 0.33273 1.0000 + O O98 1.0 0.72498 0.12500 0.33273 1.0000 + O O99 1.0 0.72498 0.20833 0.33273 1.0000 + O O100 1.0 0.72498 0.29167 0.33273 1.0000 + O O101 1.0 0.72498 0.37500 0.33273 1.0000 + O O102 1.0 0.72498 0.45833 0.33273 1.0000 + O O103 1.0 0.72498 0.54167 0.33273 1.0000 + O O104 1.0 0.72498 0.62500 0.33273 1.0000 + O O105 1.0 0.72498 0.70833 0.33273 1.0000 + O O106 1.0 0.72498 0.79167 0.33273 1.0000 + O O107 1.0 0.72498 0.87500 0.33273 1.0000 + O O108 1.0 0.72498 0.95833 0.33273 1.0000 + O O109 1.0 0.80832 0.04167 0.33273 1.0000 + O O110 1.0 0.80832 0.12500 0.33273 1.0000 + O O111 1.0 0.80832 0.20833 0.33273 1.0000 + O O112 1.0 0.80832 0.29167 0.33273 1.0000 + O O113 1.0 0.80832 0.37500 0.33273 1.0000 + O O114 1.0 0.80832 0.45833 0.33273 1.0000 + O O115 1.0 0.80832 0.54167 0.33273 1.0000 + O O116 1.0 0.80832 0.62500 0.33273 1.0000 + O O117 1.0 0.80832 0.70833 0.33273 1.0000 + O O118 1.0 0.80832 0.79167 0.33273 1.0000 + O O119 1.0 0.80832 0.87500 0.33273 1.0000 + O O120 1.0 0.80832 0.95833 0.33273 1.0000 + O O121 1.0 0.89165 0.04167 0.33273 1.0000 + O O122 1.0 0.89165 0.12500 0.33273 1.0000 + O O123 1.0 0.89165 0.20833 0.33273 1.0000 + O O124 1.0 0.89165 0.29167 0.33273 1.0000 + O O125 1.0 0.89165 0.37500 0.33273 1.0000 + O O126 1.0 0.89165 0.45833 0.33273 1.0000 + O O127 1.0 0.89165 0.54167 0.33273 1.0000 + O O128 1.0 0.89165 0.62500 0.33273 1.0000 + O O129 1.0 0.89165 0.70833 0.33273 1.0000 + O O130 1.0 0.89165 0.79167 0.33273 1.0000 + O O131 1.0 0.89165 0.87500 0.33273 1.0000 + O O132 1.0 0.89165 0.95833 0.33273 1.0000 + O O133 1.0 0.97498 0.04167 0.33273 1.0000 + O O134 1.0 0.97498 0.12500 0.33273 1.0000 + O O135 1.0 0.97498 0.20833 0.33273 1.0000 + O O136 1.0 0.97498 0.29167 0.33273 1.0000 + O O137 1.0 0.97498 0.37500 0.33273 1.0000 + O O138 1.0 0.97498 0.45833 0.33273 1.0000 + O O139 1.0 0.97498 0.54167 0.33273 1.0000 + O O140 1.0 0.97498 0.62500 0.33273 1.0000 + O O141 1.0 0.97498 0.70833 0.33273 1.0000 + O O142 1.0 0.97498 0.79167 0.33273 1.0000 + O O143 1.0 0.97498 0.87500 0.33273 1.0000 + O O144 1.0 0.97498 0.95833 0.33273 1.0000 + O O145 1.0 0.08307 0.04167 0.66727 1.0000 + O O146 1.0 0.08307 0.12500 0.66727 1.0000 + O O147 1.0 0.08307 0.20833 0.66727 1.0000 + O O148 1.0 0.08307 0.29167 0.66727 1.0000 + O O149 1.0 0.08307 0.37500 0.66727 1.0000 + O O150 1.0 0.08307 0.45833 0.66727 1.0000 + O O151 1.0 0.08307 0.54167 0.66727 1.0000 + O O152 1.0 0.08307 0.62500 0.66727 1.0000 + O O153 1.0 0.08307 0.70833 0.66727 1.0000 + O O154 1.0 0.08307 0.79167 0.66727 1.0000 + O O155 1.0 0.08307 0.87500 0.66727 1.0000 + O O156 1.0 0.08307 0.95833 0.66727 1.0000 + O O157 1.0 0.16641 0.04167 0.66727 1.0000 + O O158 1.0 0.16641 0.12500 0.66727 1.0000 + O O159 1.0 0.16641 0.20833 0.66727 1.0000 + O O160 1.0 0.16641 0.29167 0.66727 1.0000 + O O161 1.0 0.16641 0.37500 0.66727 1.0000 + O O162 1.0 0.16641 0.45833 0.66727 1.0000 + O O163 1.0 0.16641 0.54167 0.66727 1.0000 + O O164 1.0 0.16641 0.62500 0.66727 1.0000 + O O165 1.0 0.16641 0.70833 0.66727 1.0000 + O O166 1.0 0.16641 0.79167 0.66727 1.0000 + O O167 1.0 0.16641 0.87500 0.66727 1.0000 + O O168 1.0 0.16641 0.95833 0.66727 1.0000 + O O169 1.0 0.24974 0.04167 0.66727 1.0000 + O O170 1.0 0.24974 0.12500 0.66727 1.0000 + O O171 1.0 0.24974 0.20833 0.66727 1.0000 + O O172 1.0 0.24974 0.29167 0.66727 1.0000 + O O173 1.0 0.24974 0.37500 0.66727 1.0000 + O O174 1.0 0.24974 0.45833 0.66727 1.0000 + O O175 1.0 0.24974 0.54167 0.66727 1.0000 + O O176 1.0 0.24974 0.62500 0.66727 1.0000 + O O177 1.0 0.24974 0.70833 0.66727 1.0000 + O O178 1.0 0.24974 0.79167 0.66727 1.0000 + O O179 1.0 0.24974 0.87500 0.66727 1.0000 + O O180 1.0 0.24974 0.95833 0.66727 1.0000 + O O181 1.0 0.33307 0.04167 0.66727 1.0000 + O O182 1.0 0.33307 0.12500 0.66727 1.0000 + O O183 1.0 0.33307 0.20833 0.66727 1.0000 + O O184 1.0 0.33307 0.29167 0.66727 1.0000 + O O185 1.0 0.33307 0.37500 0.66727 1.0000 + O O186 1.0 0.33307 0.45833 0.66727 1.0000 + O O187 1.0 0.33307 0.54167 0.66727 1.0000 + O O188 1.0 0.33307 0.62500 0.66727 1.0000 + O O189 1.0 0.33307 0.70833 0.66727 1.0000 + O O190 1.0 0.33307 0.79167 0.66727 1.0000 + O O191 1.0 0.33307 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0.29944 1.0000 + F F489 1.0 0.93592 0.50000 0.29944 1.0000 + F F490 1.0 0.93592 0.56250 0.29944 1.0000 + F F491 1.0 0.93592 0.62500 0.29944 1.0000 + F F492 1.0 0.93592 0.68750 0.29944 1.0000 + F F493 1.0 0.93592 0.75000 0.29944 1.0000 + F F494 1.0 0.93592 0.81250 0.29944 1.0000 + F F495 1.0 0.93592 0.87500 0.29944 1.0000 + F F496 1.0 0.93592 0.93750 0.29944 1.0000 + F F497 1.0 0.99842 0.00000 0.29944 1.0000 + F F498 1.0 0.99842 0.06250 0.29944 1.0000 + F F499 1.0 0.99842 0.12500 0.29944 1.0000 + F F500 1.0 0.99842 0.18750 0.29944 1.0000 + F F501 1.0 0.99842 0.25000 0.29944 1.0000 + F F502 1.0 0.99842 0.31250 0.29944 1.0000 + F F503 1.0 0.99842 0.37500 0.29944 1.0000 + F F504 1.0 0.99842 0.43750 0.29944 1.0000 + F F505 1.0 0.99842 0.50000 0.29944 1.0000 + F F506 1.0 0.99842 0.56250 0.29944 1.0000 + F F507 1.0 0.99842 0.62500 0.29944 1.0000 + F F508 1.0 0.99842 0.68750 0.29944 1.0000 + F F509 1.0 0.99842 0.75000 0.29944 1.0000 + F F510 1.0 0.99842 0.81250 0.29944 1.0000 + F F511 1.0 0.99842 0.87500 0.29944 1.0000 + F F512 1.0 0.99842 0.93750 0.29944 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-5117_supercell_12x12x1.cif b/tier3/cif_file/orthogonal_2dm-5117_supercell_12x12x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..53e9ba0ebb5393471c61d189b6d510c4292883b0 --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-5117_supercell_12x12x1.cif @@ -0,0 +1,3481 @@ +data_image0 +_chemical_formula_structural Cr144Co432O1152Cr144Co432O1152 +_chemical_formula_sum "Cr288 Co864 O2304" +_cell_length_a 118.859 +_cell_length_b 68.623 +_cell_length_c 5.89625 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Cr Cr1 1.0 0.00000 0.00000 0.50000 1.0000 + Cr Cr2 1.0 0.04167 0.04167 0.50000 1.0000 + Cr Cr3 1.0 0.08333 0.08333 0.50000 1.0000 + Cr Cr4 1.0 0.12500 0.12500 0.50000 1.0000 + Cr Cr5 1.0 0.16667 0.16667 0.50000 1.0000 + Cr Cr6 1.0 0.20833 0.20833 0.50000 1.0000 + Cr Cr7 1.0 0.25000 0.25000 0.50000 1.0000 + Cr Cr8 1.0 0.29167 0.29167 0.50000 1.0000 + Cr Cr9 1.0 0.33333 0.33333 0.50000 1.0000 + Cr Cr10 1.0 0.37500 0.37500 0.50000 1.0000 + Cr Cr11 1.0 0.41667 0.41667 0.50000 1.0000 + Cr Cr12 1.0 0.45833 0.45833 0.50000 1.0000 + Cr Cr13 1.0 0.04167 0.95833 0.50000 1.0000 + Cr Cr14 1.0 0.08333 0.00000 0.50000 1.0000 + Cr Cr15 1.0 0.12500 0.04167 0.50000 1.0000 + Cr Cr16 1.0 0.16667 0.08333 0.50000 1.0000 + Cr Cr17 1.0 0.20833 0.12500 0.50000 1.0000 + Cr Cr18 1.0 0.25000 0.16667 0.50000 1.0000 + Cr Cr19 1.0 0.29167 0.20833 0.50000 1.0000 + Cr Cr20 1.0 0.33333 0.25000 0.50000 1.0000 + Cr Cr21 1.0 0.37500 0.29167 0.50000 1.0000 + Cr Cr22 1.0 0.41667 0.33333 0.50000 1.0000 + Cr Cr23 1.0 0.45833 0.37500 0.50000 1.0000 + Cr Cr24 1.0 0.50000 0.41667 0.50000 1.0000 + Cr Cr25 1.0 0.08333 0.91667 0.50000 1.0000 + Cr Cr26 1.0 0.12500 0.95833 0.50000 1.0000 + Cr Cr27 1.0 0.16667 0.00000 0.50000 1.0000 + Cr Cr28 1.0 0.20833 0.04167 0.50000 1.0000 + Cr Cr29 1.0 0.25000 0.08333 0.50000 1.0000 + Cr Cr30 1.0 0.29167 0.12500 0.50000 1.0000 + Cr Cr31 1.0 0.33333 0.16667 0.50000 1.0000 + Cr Cr32 1.0 0.37500 0.20833 0.50000 1.0000 + Cr Cr33 1.0 0.41667 0.25000 0.50000 1.0000 + Cr Cr34 1.0 0.45833 0.29167 0.50000 1.0000 + Cr Cr35 1.0 0.50000 0.33333 0.50000 1.0000 + Cr Cr36 1.0 0.54167 0.37500 0.50000 1.0000 + Cr Cr37 1.0 0.12500 0.87500 0.50000 1.0000 + Cr Cr38 1.0 0.16667 0.91667 0.50000 1.0000 + Cr Cr39 1.0 0.20833 0.95833 0.50000 1.0000 + Cr Cr40 1.0 0.25000 0.00000 0.50000 1.0000 + Cr Cr41 1.0 0.29167 0.04167 0.50000 1.0000 + Cr Cr42 1.0 0.33333 0.08333 0.50000 1.0000 + Cr Cr43 1.0 0.37500 0.12500 0.50000 1.0000 + Cr Cr44 1.0 0.41667 0.16667 0.50000 1.0000 + Cr Cr45 1.0 0.45833 0.20833 0.50000 1.0000 + Cr Cr46 1.0 0.50000 0.25000 0.50000 1.0000 + Cr Cr47 1.0 0.54167 0.29167 0.50000 1.0000 + Cr Cr48 1.0 0.58333 0.33333 0.50000 1.0000 + Cr Cr49 1.0 0.16667 0.83333 0.50000 1.0000 + Cr Cr50 1.0 0.20833 0.87500 0.50000 1.0000 + Cr Cr51 1.0 0.25000 0.91667 0.50000 1.0000 + Cr Cr52 1.0 0.29167 0.95833 0.50000 1.0000 + Cr Cr53 1.0 0.33333 0.00000 0.50000 1.0000 + Cr Cr54 1.0 0.37500 0.04167 0.50000 1.0000 + Cr Cr55 1.0 0.41667 0.08333 0.50000 1.0000 + Cr Cr56 1.0 0.45833 0.12500 0.50000 1.0000 + Cr Cr57 1.0 0.50000 0.16667 0.50000 1.0000 + Cr Cr58 1.0 0.54167 0.20833 0.50000 1.0000 + Cr Cr59 1.0 0.58333 0.25000 0.50000 1.0000 + Cr Cr60 1.0 0.62500 0.29167 0.50000 1.0000 + Cr Cr61 1.0 0.20833 0.79167 0.50000 1.0000 + Cr Cr62 1.0 0.25000 0.83333 0.50000 1.0000 + Cr Cr63 1.0 0.29167 0.87500 0.50000 1.0000 + Cr Cr64 1.0 0.33333 0.91667 0.50000 1.0000 + Cr Cr65 1.0 0.37500 0.95833 0.50000 1.0000 + Cr Cr66 1.0 0.41667 0.00000 0.50000 1.0000 + Cr Cr67 1.0 0.45833 0.04167 0.50000 1.0000 + Cr Cr68 1.0 0.50000 0.08333 0.50000 1.0000 + Cr Cr69 1.0 0.54167 0.12500 0.50000 1.0000 + Cr Cr70 1.0 0.58333 0.16667 0.50000 1.0000 + Cr Cr71 1.0 0.62500 0.20833 0.50000 1.0000 + Cr Cr72 1.0 0.66667 0.25000 0.50000 1.0000 + Cr Cr73 1.0 0.25000 0.75000 0.50000 1.0000 + Cr Cr74 1.0 0.29167 0.79167 0.50000 1.0000 + Cr Cr75 1.0 0.33333 0.83333 0.50000 1.0000 + Cr Cr76 1.0 0.37500 0.87500 0.50000 1.0000 + Cr Cr77 1.0 0.41667 0.91667 0.50000 1.0000 + Cr Cr78 1.0 0.45833 0.95833 0.50000 1.0000 + Cr Cr79 1.0 0.50000 0.00000 0.50000 1.0000 + Cr Cr80 1.0 0.54167 0.04167 0.50000 1.0000 + Cr Cr81 1.0 0.58333 0.08333 0.50000 1.0000 + Cr Cr82 1.0 0.62500 0.12500 0.50000 1.0000 + Cr Cr83 1.0 0.66667 0.16667 0.50000 1.0000 + Cr Cr84 1.0 0.70833 0.20833 0.50000 1.0000 + Cr Cr85 1.0 0.29167 0.70833 0.50000 1.0000 + Cr Cr86 1.0 0.33333 0.75000 0.50000 1.0000 + Cr Cr87 1.0 0.37500 0.79167 0.50000 1.0000 + Cr Cr88 1.0 0.41667 0.83333 0.50000 1.0000 + Cr Cr89 1.0 0.45833 0.87500 0.50000 1.0000 + Cr Cr90 1.0 0.50000 0.91667 0.50000 1.0000 + Cr Cr91 1.0 0.54167 0.95833 0.50000 1.0000 + Cr Cr92 1.0 0.58333 1.00000 0.50000 1.0000 + Cr Cr93 1.0 0.62500 0.04167 0.50000 1.0000 + Cr Cr94 1.0 0.66667 0.08333 0.50000 1.0000 + Cr Cr95 1.0 0.70833 0.12500 0.50000 1.0000 + Cr Cr96 1.0 0.75000 0.16667 0.50000 1.0000 + Cr Cr97 1.0 0.33333 0.66667 0.50000 1.0000 + Cr Cr98 1.0 0.37500 0.70833 0.50000 1.0000 + Cr Cr99 1.0 0.41667 0.75000 0.50000 1.0000 + Cr Cr100 1.0 0.45833 0.79167 0.50000 1.0000 + Cr Cr101 1.0 0.50000 0.83333 0.50000 1.0000 + Cr Cr102 1.0 0.54167 0.87500 0.50000 1.0000 + Cr Cr103 1.0 0.58333 0.91667 0.50000 1.0000 + Cr Cr104 1.0 0.62500 0.95833 0.50000 1.0000 + Cr Cr105 1.0 0.66667 0.00000 0.50000 1.0000 + Cr Cr106 1.0 0.70833 0.04167 0.50000 1.0000 + Cr Cr107 1.0 0.75000 0.08333 0.50000 1.0000 + Cr Cr108 1.0 0.79167 0.12500 0.50000 1.0000 + Cr Cr109 1.0 0.37500 0.62500 0.50000 1.0000 + Cr Cr110 1.0 0.41667 0.66667 0.50000 1.0000 + Cr Cr111 1.0 0.45833 0.70833 0.50000 1.0000 + Cr Cr112 1.0 0.50000 0.75000 0.50000 1.0000 + Cr Cr113 1.0 0.54167 0.79167 0.50000 1.0000 + Cr Cr114 1.0 0.58333 0.83333 0.50000 1.0000 + Cr Cr115 1.0 0.62500 0.87500 0.50000 1.0000 + Cr Cr116 1.0 0.66667 0.91667 0.50000 1.0000 + Cr Cr117 1.0 0.70833 0.95833 0.50000 1.0000 + Cr Cr118 1.0 0.75000 1.00000 0.50000 1.0000 + Cr Cr119 1.0 0.79167 0.04167 0.50000 1.0000 + Cr Cr120 1.0 0.83333 0.08333 0.50000 1.0000 + Cr Cr121 1.0 0.41667 0.58333 0.50000 1.0000 + Cr Cr122 1.0 0.45833 0.62500 0.50000 1.0000 + Cr Cr123 1.0 0.50000 0.66667 0.50000 1.0000 + Cr Cr124 1.0 0.54167 0.70833 0.50000 1.0000 + Cr Cr125 1.0 0.58333 0.75000 0.50000 1.0000 + Cr Cr126 1.0 0.62500 0.79167 0.50000 1.0000 + Cr Cr127 1.0 0.66667 0.83333 0.50000 1.0000 + Cr Cr128 1.0 0.70833 0.87500 0.50000 1.0000 + Cr Cr129 1.0 0.75000 0.91667 0.50000 1.0000 + Cr Cr130 1.0 0.79167 0.95833 0.50000 1.0000 + Cr Cr131 1.0 0.83333 1.00000 0.50000 1.0000 + Cr Cr132 1.0 0.87500 0.04167 0.50000 1.0000 + Cr Cr133 1.0 0.45833 0.54167 0.50000 1.0000 + Cr Cr134 1.0 0.50000 0.58333 0.50000 1.0000 + Cr Cr135 1.0 0.54167 0.62500 0.50000 1.0000 + Cr Cr136 1.0 0.58333 0.66667 0.50000 1.0000 + Cr Cr137 1.0 0.62500 0.70833 0.50000 1.0000 + Cr Cr138 1.0 0.66667 0.75000 0.50000 1.0000 + Cr Cr139 1.0 0.70833 0.79167 0.50000 1.0000 + Cr Cr140 1.0 0.75000 0.83333 0.50000 1.0000 + Cr Cr141 1.0 0.79167 0.87500 0.50000 1.0000 + Cr Cr142 1.0 0.83333 0.91667 0.50000 1.0000 + Cr Cr143 1.0 0.87500 0.95833 0.50000 1.0000 + Cr Cr144 1.0 0.91667 0.00000 0.50000 1.0000 + Co Co1 1.0 0.04167 0.00000 0.50000 1.0000 + Co Co2 1.0 0.08333 0.04167 0.50000 1.0000 + Co Co3 1.0 0.12500 0.08333 0.50000 1.0000 + Co Co4 1.0 0.16667 0.12500 0.50000 1.0000 + Co Co5 1.0 0.20833 0.16667 0.50000 1.0000 + Co Co6 1.0 0.25000 0.20833 0.50000 1.0000 + Co Co7 1.0 0.29167 0.25000 0.50000 1.0000 + Co Co8 1.0 0.33333 0.29167 0.50000 1.0000 + Co Co9 1.0 0.37500 0.33333 0.50000 1.0000 + Co Co10 1.0 0.41667 0.37500 0.50000 1.0000 + Co Co11 1.0 0.45833 0.41667 0.50000 1.0000 + Co Co12 1.0 0.50000 0.45833 0.50000 1.0000 + Co Co13 1.0 0.08333 0.95833 0.50000 1.0000 + Co Co14 1.0 0.12500 0.00000 0.50000 1.0000 + Co Co15 1.0 0.16667 0.04167 0.50000 1.0000 + Co Co16 1.0 0.20833 0.08333 0.50000 1.0000 + Co Co17 1.0 0.25000 0.12500 0.50000 1.0000 + Co Co18 1.0 0.29167 0.16667 0.50000 1.0000 + Co Co19 1.0 0.33333 0.20833 0.50000 1.0000 + Co Co20 1.0 0.37500 0.25000 0.50000 1.0000 + Co Co21 1.0 0.41667 0.29167 0.50000 1.0000 + Co Co22 1.0 0.45833 0.33333 0.50000 1.0000 + Co Co23 1.0 0.50000 0.37500 0.50000 1.0000 + Co Co24 1.0 0.54167 0.41667 0.50000 1.0000 + Co Co25 1.0 0.12500 0.91667 0.50000 1.0000 + Co Co26 1.0 0.16667 0.95833 0.50000 1.0000 + Co Co27 1.0 0.20833 0.00000 0.50000 1.0000 + Co Co28 1.0 0.25000 0.04167 0.50000 1.0000 + Co Co29 1.0 0.29167 0.08333 0.50000 1.0000 + Co Co30 1.0 0.33333 0.12500 0.50000 1.0000 + Co Co31 1.0 0.37500 0.16667 0.50000 1.0000 + Co Co32 1.0 0.41667 0.20833 0.50000 1.0000 + Co Co33 1.0 0.45833 0.25000 0.50000 1.0000 + Co Co34 1.0 0.50000 0.29167 0.50000 1.0000 + Co Co35 1.0 0.54167 0.33333 0.50000 1.0000 + Co Co36 1.0 0.58333 0.37500 0.50000 1.0000 + Co Co37 1.0 0.16667 0.87500 0.50000 1.0000 + Co Co38 1.0 0.20833 0.91667 0.50000 1.0000 + Co Co39 1.0 0.25000 0.95833 0.50000 1.0000 + Co Co40 1.0 0.29167 0.00000 0.50000 1.0000 + Co Co41 1.0 0.33333 0.04167 0.50000 1.0000 + Co Co42 1.0 0.37500 0.08333 0.50000 1.0000 + Co Co43 1.0 0.41667 0.12500 0.50000 1.0000 + Co Co44 1.0 0.45833 0.16667 0.50000 1.0000 + Co Co45 1.0 0.50000 0.20833 0.50000 1.0000 + Co Co46 1.0 0.54167 0.25000 0.50000 1.0000 + Co Co47 1.0 0.58333 0.29167 0.50000 1.0000 + Co Co48 1.0 0.62500 0.33333 0.50000 1.0000 + Co Co49 1.0 0.20833 0.83333 0.50000 1.0000 + Co Co50 1.0 0.25000 0.87500 0.50000 1.0000 + Co Co51 1.0 0.29167 0.91667 0.50000 1.0000 + Co Co52 1.0 0.33333 0.95833 0.50000 1.0000 + Co Co53 1.0 0.37500 0.00000 0.50000 1.0000 + Co Co54 1.0 0.41667 0.04167 0.50000 1.0000 + Co Co55 1.0 0.45833 0.08333 0.50000 1.0000 + Co Co56 1.0 0.50000 0.12500 0.50000 1.0000 + Co Co57 1.0 0.54167 0.16667 0.50000 1.0000 + Co Co58 1.0 0.58333 0.20833 0.50000 1.0000 + Co Co59 1.0 0.62500 0.25000 0.50000 1.0000 + Co Co60 1.0 0.66667 0.29167 0.50000 1.0000 + Co Co61 1.0 0.25000 0.79167 0.50000 1.0000 + Co Co62 1.0 0.29167 0.83333 0.50000 1.0000 + Co Co63 1.0 0.33333 0.87500 0.50000 1.0000 + Co Co64 1.0 0.37500 0.91667 0.50000 1.0000 + Co Co65 1.0 0.41667 0.95833 0.50000 1.0000 + Co Co66 1.0 0.45833 0.00000 0.50000 1.0000 + Co Co67 1.0 0.50000 0.04167 0.50000 1.0000 + Co Co68 1.0 0.54167 0.08333 0.50000 1.0000 + Co Co69 1.0 0.58333 0.12500 0.50000 1.0000 + Co Co70 1.0 0.62500 0.16667 0.50000 1.0000 + Co Co71 1.0 0.66667 0.20833 0.50000 1.0000 + Co Co72 1.0 0.70833 0.25000 0.50000 1.0000 + Co Co73 1.0 0.29167 0.75000 0.50000 1.0000 + Co Co74 1.0 0.33333 0.79167 0.50000 1.0000 + Co Co75 1.0 0.37500 0.83333 0.50000 1.0000 + Co Co76 1.0 0.41667 0.87500 0.50000 1.0000 + Co Co77 1.0 0.45833 0.91667 0.50000 1.0000 + Co Co78 1.0 0.50000 0.95833 0.50000 1.0000 + 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0.33333 0.50000 1.0000 + Cr Cr207 1.0 0.79167 0.37500 0.50000 1.0000 + Cr Cr208 1.0 0.83333 0.41667 0.50000 1.0000 + Cr Cr209 1.0 0.87500 0.45833 0.50000 1.0000 + Cr Cr210 1.0 0.91667 0.50000 0.50000 1.0000 + Cr Cr211 1.0 0.95833 0.54167 0.50000 1.0000 + Cr Cr212 1.0 0.00000 0.58333 0.50000 1.0000 + Cr Cr213 1.0 0.04167 0.62500 0.50000 1.0000 + Cr Cr214 1.0 0.08333 0.66667 0.50000 1.0000 + Cr Cr215 1.0 0.12500 0.70833 0.50000 1.0000 + Cr Cr216 1.0 0.16667 0.75000 0.50000 1.0000 + Cr Cr217 1.0 0.75000 0.25000 0.50000 1.0000 + Cr Cr218 1.0 0.79167 0.29167 0.50000 1.0000 + Cr Cr219 1.0 0.83333 0.33333 0.50000 1.0000 + Cr Cr220 1.0 0.87500 0.37500 0.50000 1.0000 + Cr Cr221 1.0 0.91667 0.41667 0.50000 1.0000 + Cr Cr222 1.0 0.95833 0.45833 0.50000 1.0000 + Cr Cr223 1.0 0.00000 0.50000 0.50000 1.0000 + Cr Cr224 1.0 0.04167 0.54167 0.50000 1.0000 + Cr Cr225 1.0 0.08333 0.58333 0.50000 1.0000 + Cr Cr226 1.0 0.12500 0.62500 0.50000 1.0000 + Cr Cr227 1.0 0.16667 0.66667 0.50000 1.0000 + Cr Cr228 1.0 0.20833 0.70833 0.50000 1.0000 + Cr Cr229 1.0 0.79167 0.20833 0.50000 1.0000 + Cr Cr230 1.0 0.83333 0.25000 0.50000 1.0000 + Cr Cr231 1.0 0.87500 0.29167 0.50000 1.0000 + Cr Cr232 1.0 0.91667 0.33333 0.50000 1.0000 + Cr Cr233 1.0 0.95833 0.37500 0.50000 1.0000 + Cr Cr234 1.0 0.00000 0.41667 0.50000 1.0000 + Cr Cr235 1.0 0.04167 0.45833 0.50000 1.0000 + Cr Cr236 1.0 0.08333 0.50000 0.50000 1.0000 + Cr Cr237 1.0 0.12500 0.54167 0.50000 1.0000 + Cr Cr238 1.0 0.16667 0.58333 0.50000 1.0000 + Cr Cr239 1.0 0.20833 0.62500 0.50000 1.0000 + Cr Cr240 1.0 0.25000 0.66667 0.50000 1.0000 + Cr Cr241 1.0 0.83333 0.16667 0.50000 1.0000 + Cr Cr242 1.0 0.87500 0.20833 0.50000 1.0000 + Cr Cr243 1.0 0.91667 0.25000 0.50000 1.0000 + Cr Cr244 1.0 0.95833 0.29167 0.50000 1.0000 + Cr Cr245 1.0 0.00000 0.33333 0.50000 1.0000 + Cr Cr246 1.0 0.04167 0.37500 0.50000 1.0000 + Cr Cr247 1.0 0.08333 0.41667 0.50000 1.0000 + Cr Cr248 1.0 0.12500 0.45833 0.50000 1.0000 + Cr Cr249 1.0 0.16667 0.50000 0.50000 1.0000 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0.50000 1.0000 + Cr Cr272 1.0 0.20833 0.37500 0.50000 1.0000 + Cr Cr273 1.0 0.25000 0.41667 0.50000 1.0000 + Cr Cr274 1.0 0.29167 0.45833 0.50000 1.0000 + Cr Cr275 1.0 0.33333 0.50000 0.50000 1.0000 + Cr Cr276 1.0 0.37500 0.54167 0.50000 1.0000 + Cr Cr277 1.0 0.95833 0.04167 0.50000 1.0000 + Cr Cr278 1.0 0.00000 0.08333 0.50000 1.0000 + Cr Cr279 1.0 0.04167 0.12500 0.50000 1.0000 + Cr Cr280 1.0 0.08333 0.16667 0.50000 1.0000 + Cr Cr281 1.0 0.12500 0.20833 0.50000 1.0000 + Cr Cr282 1.0 0.16667 0.25000 0.50000 1.0000 + Cr Cr283 1.0 0.20833 0.29167 0.50000 1.0000 + Cr Cr284 1.0 0.25000 0.33333 0.50000 1.0000 + Cr Cr285 1.0 0.29167 0.37500 0.50000 1.0000 + Cr Cr286 1.0 0.33333 0.41667 0.50000 1.0000 + Cr Cr287 1.0 0.37500 0.45833 0.50000 1.0000 + Cr Cr288 1.0 0.41667 0.50000 0.50000 1.0000 + Co Co433 1.0 0.54167 0.50000 0.50000 1.0000 + Co Co434 1.0 0.58333 0.54167 0.50000 1.0000 + Co Co435 1.0 0.62500 0.58333 0.50000 1.0000 + Co Co436 1.0 0.66667 0.62500 0.50000 1.0000 + Co Co437 1.0 0.70833 0.66667 0.50000 1.0000 + Co Co438 1.0 0.75000 0.70833 0.50000 1.0000 + Co Co439 1.0 0.79167 0.75000 0.50000 1.0000 + Co Co440 1.0 0.83333 0.79167 0.50000 1.0000 + Co Co441 1.0 0.87500 0.83333 0.50000 1.0000 + Co Co442 1.0 0.91667 0.87500 0.50000 1.0000 + Co Co443 1.0 0.95833 0.91667 0.50000 1.0000 + Co Co444 1.0 0.00000 0.95833 0.50000 1.0000 + Co Co445 1.0 0.58333 0.45833 0.50000 1.0000 + Co Co446 1.0 0.62500 0.50000 0.50000 1.0000 + Co Co447 1.0 0.66667 0.54167 0.50000 1.0000 + Co Co448 1.0 0.70833 0.58333 0.50000 1.0000 + Co Co449 1.0 0.75000 0.62500 0.50000 1.0000 + Co Co450 1.0 0.79167 0.66667 0.50000 1.0000 + Co Co451 1.0 0.83333 0.70833 0.50000 1.0000 + Co Co452 1.0 0.87500 0.75000 0.50000 1.0000 + Co Co453 1.0 0.91667 0.79167 0.50000 1.0000 + Co Co454 1.0 0.95833 0.83333 0.50000 1.0000 + Co Co455 1.0 0.00000 0.87500 0.50000 1.0000 + Co Co456 1.0 0.04167 0.91667 0.50000 1.0000 + Co Co457 1.0 0.62500 0.41667 0.50000 1.0000 + Co Co458 1.0 0.66667 0.45833 0.50000 1.0000 + Co Co459 1.0 0.70833 0.50000 0.50000 1.0000 + Co Co460 1.0 0.75000 0.54167 0.50000 1.0000 + Co Co461 1.0 0.79167 0.58333 0.50000 1.0000 + Co Co462 1.0 0.83333 0.62500 0.50000 1.0000 + Co Co463 1.0 0.87500 0.66667 0.50000 1.0000 + Co Co464 1.0 0.91667 0.70833 0.50000 1.0000 + Co Co465 1.0 0.95833 0.75000 0.50000 1.0000 + Co Co466 1.0 1.00000 0.79167 0.50000 1.0000 + Co Co467 1.0 0.04167 0.83333 0.50000 1.0000 + Co Co468 1.0 0.08333 0.87500 0.50000 1.0000 + Co Co469 1.0 0.66667 0.37500 0.50000 1.0000 + Co Co470 1.0 0.70833 0.41667 0.50000 1.0000 + Co Co471 1.0 0.75000 0.45833 0.50000 1.0000 + Co Co472 1.0 0.79167 0.50000 0.50000 1.0000 + Co Co473 1.0 0.83333 0.54167 0.50000 1.0000 + Co Co474 1.0 0.87500 0.58333 0.50000 1.0000 + Co Co475 1.0 0.91667 0.62500 0.50000 1.0000 + Co Co476 1.0 0.95833 0.66667 0.50000 1.0000 + Co Co477 1.0 0.00000 0.70833 0.50000 1.0000 + Co Co478 1.0 0.04167 0.75000 0.50000 1.0000 + Co Co479 1.0 0.08333 0.79167 0.50000 1.0000 + Co Co480 1.0 0.12500 0.83333 0.50000 1.0000 + Co Co481 1.0 0.70833 0.33333 0.50000 1.0000 + Co Co482 1.0 0.75000 0.37500 0.50000 1.0000 + Co Co483 1.0 0.79167 0.41667 0.50000 1.0000 + Co Co484 1.0 0.83333 0.45833 0.50000 1.0000 + Co Co485 1.0 0.87500 0.50000 0.50000 1.0000 + Co Co486 1.0 0.91667 0.54167 0.50000 1.0000 + Co Co487 1.0 0.95833 0.58333 0.50000 1.0000 + Co Co488 1.0 0.00000 0.62500 0.50000 1.0000 + Co Co489 1.0 0.04167 0.66667 0.50000 1.0000 + Co Co490 1.0 0.08333 0.70833 0.50000 1.0000 + Co Co491 1.0 0.12500 0.75000 0.50000 1.0000 + Co Co492 1.0 0.16667 0.79167 0.50000 1.0000 + Co Co493 1.0 0.75000 0.29167 0.50000 1.0000 + Co Co494 1.0 0.79167 0.33333 0.50000 1.0000 + Co Co495 1.0 0.83333 0.37500 0.50000 1.0000 + Co Co496 1.0 0.87500 0.41667 0.50000 1.0000 + Co Co497 1.0 0.91667 0.45833 0.50000 1.0000 + Co Co498 1.0 0.95833 0.50000 0.50000 1.0000 + Co Co499 1.0 0.00000 0.54167 0.50000 1.0000 + Co Co500 1.0 0.04167 0.58333 0.50000 1.0000 + Co Co501 1.0 0.08333 0.62500 0.50000 1.0000 + Co Co502 1.0 0.12500 0.66667 0.50000 1.0000 + Co Co503 1.0 0.16667 0.70833 0.50000 1.0000 + Co Co504 1.0 0.20833 0.75000 0.50000 1.0000 + Co Co505 1.0 0.79167 0.25000 0.50000 1.0000 + Co Co506 1.0 0.83333 0.29167 0.50000 1.0000 + Co Co507 1.0 0.87500 0.33333 0.50000 1.0000 + Co Co508 1.0 0.91667 0.37500 0.50000 1.0000 + Co Co509 1.0 0.95833 0.41667 0.50000 1.0000 + Co Co510 1.0 1.00000 0.45833 0.50000 1.0000 + Co Co511 1.0 0.04167 0.50000 0.50000 1.0000 + Co Co512 1.0 0.08333 0.54167 0.50000 1.0000 + Co Co513 1.0 0.12500 0.58333 0.50000 1.0000 + Co Co514 1.0 0.16667 0.62500 0.50000 1.0000 + Co Co515 1.0 0.20833 0.66667 0.50000 1.0000 + Co Co516 1.0 0.25000 0.70833 0.50000 1.0000 + Co Co517 1.0 0.83333 0.20833 0.50000 1.0000 + Co Co518 1.0 0.87500 0.25000 0.50000 1.0000 + Co Co519 1.0 0.91667 0.29167 0.50000 1.0000 + Co Co520 1.0 0.95833 0.33333 0.50000 1.0000 + Co Co521 1.0 0.00000 0.37500 0.50000 1.0000 + Co Co522 1.0 0.04167 0.41667 0.50000 1.0000 + Co Co523 1.0 0.08333 0.45833 0.50000 1.0000 + Co Co524 1.0 0.12500 0.50000 0.50000 1.0000 + Co Co525 1.0 0.16667 0.54167 0.50000 1.0000 + Co Co526 1.0 0.20833 0.58333 0.50000 1.0000 + Co Co527 1.0 0.25000 0.62500 0.50000 1.0000 + Co Co528 1.0 0.29167 0.66667 0.50000 1.0000 + Co Co529 1.0 0.87500 0.16667 0.50000 1.0000 + Co Co530 1.0 0.91667 0.20833 0.50000 1.0000 + Co Co531 1.0 0.95833 0.25000 0.50000 1.0000 + Co Co532 1.0 0.00000 0.29167 0.50000 1.0000 + Co Co533 1.0 0.04167 0.33333 0.50000 1.0000 + Co Co534 1.0 0.08333 0.37500 0.50000 1.0000 + Co Co535 1.0 0.12500 0.41667 0.50000 1.0000 + Co Co536 1.0 0.16667 0.45833 0.50000 1.0000 + Co Co537 1.0 0.20833 0.50000 0.50000 1.0000 + Co Co538 1.0 0.25000 0.54167 0.50000 1.0000 + Co Co539 1.0 0.29167 0.58333 0.50000 1.0000 + Co Co540 1.0 0.33333 0.62500 0.50000 1.0000 + Co Co541 1.0 0.91667 0.12500 0.50000 1.0000 + Co Co542 1.0 0.95833 0.16667 0.50000 1.0000 + Co Co543 1.0 1.00000 0.20833 0.50000 1.0000 + Co Co544 1.0 0.04167 0.25000 0.50000 1.0000 + Co Co545 1.0 0.08333 0.29167 0.50000 1.0000 + Co Co546 1.0 0.12500 0.33333 0.50000 1.0000 + Co Co547 1.0 0.16667 0.37500 0.50000 1.0000 + Co Co548 1.0 0.20833 0.41667 0.50000 1.0000 + Co Co549 1.0 0.25000 0.45833 0.50000 1.0000 + Co Co550 1.0 0.29167 0.50000 0.50000 1.0000 + Co Co551 1.0 0.33333 0.54167 0.50000 1.0000 + Co Co552 1.0 0.37500 0.58333 0.50000 1.0000 + Co Co553 1.0 0.95833 0.08333 0.50000 1.0000 + Co Co554 1.0 0.00000 0.12500 0.50000 1.0000 + Co Co555 1.0 0.04167 0.16667 0.50000 1.0000 + Co Co556 1.0 0.08333 0.20833 0.50000 1.0000 + Co Co557 1.0 0.12500 0.25000 0.50000 1.0000 + Co Co558 1.0 0.16667 0.29167 0.50000 1.0000 + Co Co559 1.0 0.20833 0.33333 0.50000 1.0000 + Co Co560 1.0 0.25000 0.37500 0.50000 1.0000 + Co Co561 1.0 0.29167 0.41667 0.50000 1.0000 + Co Co562 1.0 0.33333 0.45833 0.50000 1.0000 + Co Co563 1.0 0.37500 0.50000 0.50000 1.0000 + Co Co564 1.0 0.41667 0.54167 0.50000 1.0000 + Co Co565 1.0 0.00000 0.04167 0.50000 1.0000 + Co Co566 1.0 0.04167 0.08333 0.50000 1.0000 + Co Co567 1.0 0.08333 0.12500 0.50000 1.0000 + Co Co568 1.0 0.12500 0.16667 0.50000 1.0000 + Co Co569 1.0 0.16667 0.20833 0.50000 1.0000 + Co Co570 1.0 0.20833 0.25000 0.50000 1.0000 + Co Co571 1.0 0.25000 0.29167 0.50000 1.0000 + Co Co572 1.0 0.29167 0.33333 0.50000 1.0000 + Co Co573 1.0 0.33333 0.37500 0.50000 1.0000 + Co Co574 1.0 0.37500 0.41667 0.50000 1.0000 + Co Co575 1.0 0.41667 0.45833 0.50000 1.0000 + Co Co576 1.0 0.45833 0.50000 0.50000 1.0000 + Co Co577 1.0 0.52083 0.47917 0.50000 1.0000 + Co Co578 1.0 0.56250 0.52083 0.50000 1.0000 + Co Co579 1.0 0.60417 0.56250 0.50000 1.0000 + Co Co580 1.0 0.64583 0.60417 0.50000 1.0000 + Co Co581 1.0 0.68750 0.64583 0.50000 1.0000 + Co Co582 1.0 0.72917 0.68750 0.50000 1.0000 + Co Co583 1.0 0.77083 0.72917 0.50000 1.0000 + Co Co584 1.0 0.81250 0.77083 0.50000 1.0000 + Co Co585 1.0 0.85417 0.81250 0.50000 1.0000 + Co Co586 1.0 0.89583 0.85417 0.50000 1.0000 + Co Co587 1.0 0.93750 0.89583 0.50000 1.0000 + Co Co588 1.0 0.97917 0.93750 0.50000 1.0000 + Co Co589 1.0 0.56250 0.43750 0.50000 1.0000 + Co Co590 1.0 0.60417 0.47917 0.50000 1.0000 + Co Co591 1.0 0.64583 0.52083 0.50000 1.0000 + Co Co592 1.0 0.68750 0.56250 0.50000 1.0000 + Co Co593 1.0 0.72917 0.60417 0.50000 1.0000 + Co Co594 1.0 0.77083 0.64583 0.50000 1.0000 + Co Co595 1.0 0.81250 0.68750 0.50000 1.0000 + Co Co596 1.0 0.85417 0.72917 0.50000 1.0000 + Co Co597 1.0 0.89583 0.77083 0.50000 1.0000 + Co Co598 1.0 0.93750 0.81250 0.50000 1.0000 + Co Co599 1.0 0.97917 0.85417 0.50000 1.0000 + Co Co600 1.0 0.02083 0.89583 0.50000 1.0000 + Co Co601 1.0 0.60417 0.39583 0.50000 1.0000 + Co Co602 1.0 0.64583 0.43750 0.50000 1.0000 + Co Co603 1.0 0.68750 0.47917 0.50000 1.0000 + Co Co604 1.0 0.72917 0.52083 0.50000 1.0000 + Co Co605 1.0 0.77083 0.56250 0.50000 1.0000 + Co Co606 1.0 0.81250 0.60417 0.50000 1.0000 + Co Co607 1.0 0.85417 0.64583 0.50000 1.0000 + Co Co608 1.0 0.89583 0.68750 0.50000 1.0000 + Co Co609 1.0 0.93750 0.72917 0.50000 1.0000 + Co Co610 1.0 0.97917 0.77083 0.50000 1.0000 + Co Co611 1.0 0.02083 0.81250 0.50000 1.0000 + Co Co612 1.0 0.06250 0.85417 0.50000 1.0000 + Co Co613 1.0 0.64583 0.35417 0.50000 1.0000 + Co Co614 1.0 0.68750 0.39583 0.50000 1.0000 + Co Co615 1.0 0.72917 0.43750 0.50000 1.0000 + Co Co616 1.0 0.77083 0.47917 0.50000 1.0000 + Co Co617 1.0 0.81250 0.52083 0.50000 1.0000 + Co Co618 1.0 0.85417 0.56250 0.50000 1.0000 + Co Co619 1.0 0.89583 0.60417 0.50000 1.0000 + Co Co620 1.0 0.93750 0.64583 0.50000 1.0000 + Co Co621 1.0 0.97917 0.68750 0.50000 1.0000 + Co Co622 1.0 0.02083 0.72917 0.50000 1.0000 + Co Co623 1.0 0.06250 0.77083 0.50000 1.0000 + Co Co624 1.0 0.10417 0.81250 0.50000 1.0000 + Co Co625 1.0 0.68750 0.31250 0.50000 1.0000 + Co Co626 1.0 0.72917 0.35417 0.50000 1.0000 + Co Co627 1.0 0.77083 0.39583 0.50000 1.0000 + Co Co628 1.0 0.81250 0.43750 0.50000 1.0000 + Co Co629 1.0 0.85417 0.47917 0.50000 1.0000 + Co Co630 1.0 0.89583 0.52083 0.50000 1.0000 + Co Co631 1.0 0.93750 0.56250 0.50000 1.0000 + Co Co632 1.0 0.97917 0.60417 0.50000 1.0000 + Co Co633 1.0 0.02083 0.64583 0.50000 1.0000 + Co Co634 1.0 0.06250 0.68750 0.50000 1.0000 + Co Co635 1.0 0.10417 0.72917 0.50000 1.0000 + Co Co636 1.0 0.14583 0.77083 0.50000 1.0000 + Co Co637 1.0 0.72917 0.27083 0.50000 1.0000 + Co Co638 1.0 0.77083 0.31250 0.50000 1.0000 + Co Co639 1.0 0.81250 0.35417 0.50000 1.0000 + Co Co640 1.0 0.85417 0.39583 0.50000 1.0000 + Co Co641 1.0 0.89583 0.43750 0.50000 1.0000 + Co Co642 1.0 0.93750 0.47917 0.50000 1.0000 + Co Co643 1.0 0.97917 0.52083 0.50000 1.0000 + Co Co644 1.0 0.02083 0.56250 0.50000 1.0000 + Co Co645 1.0 0.06250 0.60417 0.50000 1.0000 + Co Co646 1.0 0.10417 0.64583 0.50000 1.0000 + Co Co647 1.0 0.14583 0.68750 0.50000 1.0000 + Co Co648 1.0 0.18750 0.72917 0.50000 1.0000 + Co Co649 1.0 0.77083 0.22917 0.50000 1.0000 + Co Co650 1.0 0.81250 0.27083 0.50000 1.0000 + Co Co651 1.0 0.85417 0.31250 0.50000 1.0000 + Co Co652 1.0 0.89583 0.35417 0.50000 1.0000 + Co Co653 1.0 0.93750 0.39583 0.50000 1.0000 + Co Co654 1.0 0.97917 0.43750 0.50000 1.0000 + Co Co655 1.0 0.02083 0.47917 0.50000 1.0000 + Co Co656 1.0 0.06250 0.52083 0.50000 1.0000 + Co Co657 1.0 0.10417 0.56250 0.50000 1.0000 + Co Co658 1.0 0.14583 0.60417 0.50000 1.0000 + Co Co659 1.0 0.18750 0.64583 0.50000 1.0000 + Co Co660 1.0 0.22917 0.68750 0.50000 1.0000 + Co Co661 1.0 0.81250 0.18750 0.50000 1.0000 + Co Co662 1.0 0.85417 0.22917 0.50000 1.0000 + Co Co663 1.0 0.89583 0.27083 0.50000 1.0000 + Co Co664 1.0 0.93750 0.31250 0.50000 1.0000 + Co Co665 1.0 0.97917 0.35417 0.50000 1.0000 + Co Co666 1.0 0.02083 0.39583 0.50000 1.0000 + Co Co667 1.0 0.06250 0.43750 0.50000 1.0000 + Co Co668 1.0 0.10417 0.47917 0.50000 1.0000 + Co Co669 1.0 0.14583 0.52083 0.50000 1.0000 + Co Co670 1.0 0.18750 0.56250 0.50000 1.0000 + Co Co671 1.0 0.22917 0.60417 0.50000 1.0000 + Co Co672 1.0 0.27083 0.64583 0.50000 1.0000 + Co Co673 1.0 0.85417 0.14583 0.50000 1.0000 + Co Co674 1.0 0.89583 0.18750 0.50000 1.0000 + Co Co675 1.0 0.93750 0.22917 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0.71264 1.0000 + Li Li180 1.0 0.54167 0.37500 0.71264 1.0000 + Li Li181 1.0 0.12500 0.87500 0.71264 1.0000 + Li Li182 1.0 0.16667 0.91667 0.71264 1.0000 + Li Li183 1.0 0.20833 0.95833 0.71264 1.0000 + Li Li184 1.0 0.25000 1.00000 0.71264 1.0000 + Li Li185 1.0 0.29167 0.04167 0.71264 1.0000 + Li Li186 1.0 0.33333 0.08333 0.71264 1.0000 + Li Li187 1.0 0.37500 0.12500 0.71264 1.0000 + Li Li188 1.0 0.41667 0.16667 0.71264 1.0000 + Li Li189 1.0 0.45833 0.20833 0.71264 1.0000 + Li Li190 1.0 0.50000 0.25000 0.71264 1.0000 + Li Li191 1.0 0.54167 0.29167 0.71264 1.0000 + Li Li192 1.0 0.58333 0.33333 0.71264 1.0000 + Li Li193 1.0 0.16667 0.83333 0.71264 1.0000 + Li Li194 1.0 0.20833 0.87500 0.71264 1.0000 + Li Li195 1.0 0.25000 0.91667 0.71264 1.0000 + Li Li196 1.0 0.29167 0.95833 0.71264 1.0000 + Li Li197 1.0 0.33333 1.00000 0.71264 1.0000 + Li Li198 1.0 0.37500 0.04167 0.71264 1.0000 + Li Li199 1.0 0.41667 0.08333 0.71264 1.0000 + Li Li200 1.0 0.45833 0.12500 0.71264 1.0000 + Li Li201 1.0 0.50000 0.16667 0.71264 1.0000 + Li Li202 1.0 0.54167 0.20833 0.71264 1.0000 + Li Li203 1.0 0.58333 0.25000 0.71264 1.0000 + Li Li204 1.0 0.62500 0.29167 0.71264 1.0000 + Li Li205 1.0 0.20833 0.79167 0.71264 1.0000 + Li Li206 1.0 0.25000 0.83333 0.71264 1.0000 + Li Li207 1.0 0.29167 0.87500 0.71264 1.0000 + Li Li208 1.0 0.33333 0.91667 0.71264 1.0000 + Li Li209 1.0 0.37500 0.95833 0.71264 1.0000 + Li Li210 1.0 0.41667 1.00000 0.71264 1.0000 + Li Li211 1.0 0.45833 0.04167 0.71264 1.0000 + Li Li212 1.0 0.50000 0.08333 0.71264 1.0000 + Li Li213 1.0 0.54167 0.12500 0.71264 1.0000 + Li Li214 1.0 0.58333 0.16667 0.71264 1.0000 + Li Li215 1.0 0.62500 0.20833 0.71264 1.0000 + Li Li216 1.0 0.66667 0.25000 0.71264 1.0000 + Li Li217 1.0 0.25000 0.75000 0.71264 1.0000 + Li Li218 1.0 0.29167 0.79167 0.71264 1.0000 + Li Li219 1.0 0.33333 0.83333 0.71264 1.0000 + Li Li220 1.0 0.37500 0.87500 0.71264 1.0000 + Li Li221 1.0 0.41667 0.91667 0.71264 1.0000 + Li Li222 1.0 0.45833 0.95833 0.71264 1.0000 + Li Li223 1.0 0.50000 1.00000 0.71264 1.0000 + Li Li224 1.0 0.54167 0.04167 0.71264 1.0000 + Li Li225 1.0 0.58333 0.08333 0.71264 1.0000 + Li Li226 1.0 0.62500 0.12500 0.71264 1.0000 + Li Li227 1.0 0.66667 0.16667 0.71264 1.0000 + Li Li228 1.0 0.70833 0.20833 0.71264 1.0000 + Li Li229 1.0 0.29167 0.70833 0.71264 1.0000 + Li Li230 1.0 0.33333 0.75000 0.71264 1.0000 + Li Li231 1.0 0.37500 0.79167 0.71264 1.0000 + Li Li232 1.0 0.41667 0.83333 0.71264 1.0000 + Li Li233 1.0 0.45833 0.87500 0.71264 1.0000 + Li Li234 1.0 0.50000 0.91667 0.71264 1.0000 + Li Li235 1.0 0.54167 0.95833 0.71264 1.0000 + Li Li236 1.0 0.58333 1.00000 0.71264 1.0000 + Li Li237 1.0 0.62500 0.04167 0.71264 1.0000 + Li Li238 1.0 0.66667 0.08333 0.71264 1.0000 + Li Li239 1.0 0.70833 0.12500 0.71264 1.0000 + Li Li240 1.0 0.75000 0.16667 0.71264 1.0000 + Li Li241 1.0 0.33333 0.66667 0.71264 1.0000 + Li Li242 1.0 0.37500 0.70833 0.71264 1.0000 + Li Li243 1.0 0.41667 0.75000 0.71264 1.0000 + Li Li244 1.0 0.45833 0.79167 0.71264 1.0000 + Li Li245 1.0 0.50000 0.83333 0.71264 1.0000 + Li Li246 1.0 0.54167 0.87500 0.71264 1.0000 + Li Li247 1.0 0.58333 0.91667 0.71264 1.0000 + Li Li248 1.0 0.62500 0.95833 0.71264 1.0000 + Li Li249 1.0 0.66667 1.00000 0.71264 1.0000 + Li Li250 1.0 0.70833 0.04167 0.71264 1.0000 + Li Li251 1.0 0.75000 0.08333 0.71264 1.0000 + Li Li252 1.0 0.79167 0.12500 0.71264 1.0000 + Li Li253 1.0 0.37500 0.62500 0.71264 1.0000 + Li Li254 1.0 0.41667 0.66667 0.71264 1.0000 + Li Li255 1.0 0.45833 0.70833 0.71264 1.0000 + Li Li256 1.0 0.50000 0.75000 0.71264 1.0000 + Li Li257 1.0 0.54167 0.79167 0.71264 1.0000 + Li Li258 1.0 0.58333 0.83333 0.71264 1.0000 + Li Li259 1.0 0.62500 0.87500 0.71264 1.0000 + Li Li260 1.0 0.66667 0.91667 0.71264 1.0000 + Li Li261 1.0 0.70833 0.95833 0.71264 1.0000 + Li Li262 1.0 0.75000 1.00000 0.71264 1.0000 + Li Li263 1.0 0.79167 0.04167 0.71264 1.0000 + Li Li264 1.0 0.83333 0.08333 0.71264 1.0000 + Li Li265 1.0 0.41667 0.58333 0.71264 1.0000 + Li Li266 1.0 0.45833 0.62500 0.71264 1.0000 + Li Li267 1.0 0.50000 0.66667 0.71264 1.0000 + Li Li268 1.0 0.54167 0.70833 0.71264 1.0000 + Li Li269 1.0 0.58333 0.75000 0.71264 1.0000 + Li Li270 1.0 0.62500 0.79167 0.71264 1.0000 + Li Li271 1.0 0.66667 0.83333 0.71264 1.0000 + Li Li272 1.0 0.70833 0.87500 0.71264 1.0000 + Li Li273 1.0 0.75000 0.91667 0.71264 1.0000 + Li Li274 1.0 0.79167 0.95833 0.71264 1.0000 + Li Li275 1.0 0.83333 1.00000 0.71264 1.0000 + Li Li276 1.0 0.87500 0.04167 0.71264 1.0000 + Li Li277 1.0 0.45833 0.54167 0.71264 1.0000 + Li Li278 1.0 0.50000 0.58333 0.71264 1.0000 + Li Li279 1.0 0.54167 0.62500 0.71264 1.0000 + Li Li280 1.0 0.58333 0.66667 0.71264 1.0000 + Li Li281 1.0 0.62500 0.70833 0.71264 1.0000 + Li Li282 1.0 0.66667 0.75000 0.71264 1.0000 + Li Li283 1.0 0.70833 0.79167 0.71264 1.0000 + Li Li284 1.0 0.75000 0.83333 0.71264 1.0000 + Li Li285 1.0 0.79167 0.87500 0.71264 1.0000 + Li Li286 1.0 0.83333 0.91667 0.71264 1.0000 + Li Li287 1.0 0.87500 0.95833 0.71264 1.0000 + Li Li288 1.0 0.91667 1.00000 0.71264 1.0000 + Mn Mn1 1.0 0.02083 0.97917 0.50000 1.0000 + Mn Mn2 1.0 0.06250 0.02083 0.50000 1.0000 + Mn Mn3 1.0 0.10417 0.06250 0.50000 1.0000 + Mn Mn4 1.0 0.14583 0.10417 0.50000 1.0000 + Mn Mn5 1.0 0.18750 0.14583 0.50000 1.0000 + Mn Mn6 1.0 0.22917 0.18750 0.50000 1.0000 + Mn Mn7 1.0 0.27083 0.22917 0.50000 1.0000 + Mn Mn8 1.0 0.31250 0.27083 0.50000 1.0000 + Mn Mn9 1.0 0.35417 0.31250 0.50000 1.0000 + Mn Mn10 1.0 0.39583 0.35417 0.50000 1.0000 + Mn Mn11 1.0 0.43750 0.39583 0.50000 1.0000 + Mn Mn12 1.0 0.47917 0.43750 0.50000 1.0000 + Mn Mn13 1.0 0.06250 0.93750 0.50000 1.0000 + Mn Mn14 1.0 0.10417 0.97917 0.50000 1.0000 + Mn Mn15 1.0 0.14583 0.02083 0.50000 1.0000 + Mn Mn16 1.0 0.18750 0.06250 0.50000 1.0000 + Mn Mn17 1.0 0.22917 0.10417 0.50000 1.0000 + Mn Mn18 1.0 0.27083 0.14583 0.50000 1.0000 + Mn Mn19 1.0 0.31250 0.18750 0.50000 1.0000 + Mn Mn20 1.0 0.35417 0.22917 0.50000 1.0000 + Mn Mn21 1.0 0.39583 0.27083 0.50000 1.0000 + Mn Mn22 1.0 0.43750 0.31250 0.50000 1.0000 + Mn Mn23 1.0 0.47917 0.35417 0.50000 1.0000 + Mn Mn24 1.0 0.52083 0.39583 0.50000 1.0000 + Mn Mn25 1.0 0.10417 0.89583 0.50000 1.0000 + Mn Mn26 1.0 0.14583 0.93750 0.50000 1.0000 + Mn Mn27 1.0 0.18750 0.97917 0.50000 1.0000 + Mn Mn28 1.0 0.22917 0.02083 0.50000 1.0000 + Mn Mn29 1.0 0.27083 0.06250 0.50000 1.0000 + Mn Mn30 1.0 0.31250 0.10417 0.50000 1.0000 + Mn Mn31 1.0 0.35417 0.14583 0.50000 1.0000 + Mn Mn32 1.0 0.39583 0.18750 0.50000 1.0000 + Mn Mn33 1.0 0.43750 0.22917 0.50000 1.0000 + Mn Mn34 1.0 0.47917 0.27083 0.50000 1.0000 + Mn Mn35 1.0 0.52083 0.31250 0.50000 1.0000 + Mn Mn36 1.0 0.56250 0.35417 0.50000 1.0000 + Mn Mn37 1.0 0.14583 0.85417 0.50000 1.0000 + Mn Mn38 1.0 0.18750 0.89583 0.50000 1.0000 + Mn Mn39 1.0 0.22917 0.93750 0.50000 1.0000 + Mn Mn40 1.0 0.27083 0.97917 0.50000 1.0000 + Mn Mn41 1.0 0.31250 0.02083 0.50000 1.0000 + Mn Mn42 1.0 0.35417 0.06250 0.50000 1.0000 + Mn Mn43 1.0 0.39583 0.10417 0.50000 1.0000 + Mn Mn44 1.0 0.43750 0.14583 0.50000 1.0000 + Mn Mn45 1.0 0.47917 0.18750 0.50000 1.0000 + Mn Mn46 1.0 0.52083 0.22917 0.50000 1.0000 + Mn Mn47 1.0 0.56250 0.27083 0.50000 1.0000 + Mn Mn48 1.0 0.60417 0.31250 0.50000 1.0000 + Mn Mn49 1.0 0.18750 0.81250 0.50000 1.0000 + Mn Mn50 1.0 0.22917 0.85417 0.50000 1.0000 + Mn Mn51 1.0 0.27083 0.89583 0.50000 1.0000 + Mn Mn52 1.0 0.31250 0.93750 0.50000 1.0000 + Mn Mn53 1.0 0.35417 0.97917 0.50000 1.0000 + Mn Mn54 1.0 0.39583 0.02083 0.50000 1.0000 + Mn Mn55 1.0 0.43750 0.06250 0.50000 1.0000 + Mn Mn56 1.0 0.47917 0.10417 0.50000 1.0000 + Mn Mn57 1.0 0.52083 0.14583 0.50000 1.0000 + Mn Mn58 1.0 0.56250 0.18750 0.50000 1.0000 + Mn Mn59 1.0 0.60417 0.22917 0.50000 1.0000 + Mn Mn60 1.0 0.64583 0.27083 0.50000 1.0000 + Mn Mn61 1.0 0.22917 0.77083 0.50000 1.0000 + Mn Mn62 1.0 0.27083 0.81250 0.50000 1.0000 + Mn Mn63 1.0 0.31250 0.85417 0.50000 1.0000 + Mn Mn64 1.0 0.35417 0.89583 0.50000 1.0000 + Mn Mn65 1.0 0.39583 0.93750 0.50000 1.0000 + Mn Mn66 1.0 0.43750 0.97917 0.50000 1.0000 + Mn Mn67 1.0 0.47917 0.02083 0.50000 1.0000 + Mn Mn68 1.0 0.52083 0.06250 0.50000 1.0000 + Mn Mn69 1.0 0.56250 0.10417 0.50000 1.0000 + Mn Mn70 1.0 0.60417 0.14583 0.50000 1.0000 + Mn Mn71 1.0 0.64583 0.18750 0.50000 1.0000 + Mn Mn72 1.0 0.68750 0.22917 0.50000 1.0000 + Mn Mn73 1.0 0.27083 0.72917 0.50000 1.0000 + Mn Mn74 1.0 0.31250 0.77083 0.50000 1.0000 + Mn Mn75 1.0 0.35417 0.81250 0.50000 1.0000 + Mn Mn76 1.0 0.39583 0.85417 0.50000 1.0000 + Mn Mn77 1.0 0.43750 0.89583 0.50000 1.0000 + Mn Mn78 1.0 0.47917 0.93750 0.50000 1.0000 + Mn Mn79 1.0 0.52083 0.97917 0.50000 1.0000 + Mn Mn80 1.0 0.56250 0.02083 0.50000 1.0000 + Mn Mn81 1.0 0.60417 0.06250 0.50000 1.0000 + Mn Mn82 1.0 0.64583 0.10417 0.50000 1.0000 + Mn Mn83 1.0 0.68750 0.14583 0.50000 1.0000 + Mn Mn84 1.0 0.72917 0.18750 0.50000 1.0000 + Mn Mn85 1.0 0.31250 0.68750 0.50000 1.0000 + Mn Mn86 1.0 0.35417 0.72917 0.50000 1.0000 + Mn Mn87 1.0 0.39583 0.77083 0.50000 1.0000 + Mn Mn88 1.0 0.43750 0.81250 0.50000 1.0000 + Mn Mn89 1.0 0.47917 0.85417 0.50000 1.0000 + Mn Mn90 1.0 0.52083 0.89583 0.50000 1.0000 + Mn Mn91 1.0 0.56250 0.93750 0.50000 1.0000 + Mn Mn92 1.0 0.60417 0.97917 0.50000 1.0000 + Mn Mn93 1.0 0.64583 0.02083 0.50000 1.0000 + Mn Mn94 1.0 0.68750 0.06250 0.50000 1.0000 + Mn Mn95 1.0 0.72917 0.10417 0.50000 1.0000 + Mn Mn96 1.0 0.77083 0.14583 0.50000 1.0000 + Mn Mn97 1.0 0.35417 0.64583 0.50000 1.0000 + Mn Mn98 1.0 0.39583 0.68750 0.50000 1.0000 + Mn Mn99 1.0 0.43750 0.72917 0.50000 1.0000 + Mn Mn100 1.0 0.47917 0.77083 0.50000 1.0000 + Mn Mn101 1.0 0.52083 0.81250 0.50000 1.0000 + Mn Mn102 1.0 0.56250 0.85417 0.50000 1.0000 + Mn Mn103 1.0 0.60417 0.89583 0.50000 1.0000 + Mn Mn104 1.0 0.64583 0.93750 0.50000 1.0000 + Mn Mn105 1.0 0.68750 0.97917 0.50000 1.0000 + Mn Mn106 1.0 0.72917 0.02083 0.50000 1.0000 + Mn Mn107 1.0 0.77083 0.06250 0.50000 1.0000 + Mn Mn108 1.0 0.81250 0.10417 0.50000 1.0000 + Mn Mn109 1.0 0.39583 0.60417 0.50000 1.0000 + Mn Mn110 1.0 0.43750 0.64583 0.50000 1.0000 + Mn Mn111 1.0 0.47917 0.68750 0.50000 1.0000 + Mn Mn112 1.0 0.52083 0.72917 0.50000 1.0000 + Mn Mn113 1.0 0.56250 0.77083 0.50000 1.0000 + Mn Mn114 1.0 0.60417 0.81250 0.50000 1.0000 + Mn Mn115 1.0 0.64583 0.85417 0.50000 1.0000 + Mn Mn116 1.0 0.68750 0.89583 0.50000 1.0000 + Mn Mn117 1.0 0.72917 0.93750 0.50000 1.0000 + Mn Mn118 1.0 0.77083 0.97917 0.50000 1.0000 + Mn Mn119 1.0 0.81250 0.02083 0.50000 1.0000 + Mn Mn120 1.0 0.85417 0.06250 0.50000 1.0000 + Mn Mn121 1.0 0.43750 0.56250 0.50000 1.0000 + Mn Mn122 1.0 0.47917 0.60417 0.50000 1.0000 + Mn Mn123 1.0 0.52083 0.64583 0.50000 1.0000 + Mn Mn124 1.0 0.56250 0.68750 0.50000 1.0000 + Mn Mn125 1.0 0.60417 0.72917 0.50000 1.0000 + Mn Mn126 1.0 0.64583 0.77083 0.50000 1.0000 + Mn Mn127 1.0 0.68750 0.81250 0.50000 1.0000 + Mn Mn128 1.0 0.72917 0.85417 0.50000 1.0000 + Mn Mn129 1.0 0.77083 0.89583 0.50000 1.0000 + Mn Mn130 1.0 0.81250 0.93750 0.50000 1.0000 + Mn Mn131 1.0 0.85417 0.97917 0.50000 1.0000 + Mn Mn132 1.0 0.89583 0.02083 0.50000 1.0000 + Mn Mn133 1.0 0.47917 0.52083 0.50000 1.0000 + Mn Mn134 1.0 0.52083 0.56250 0.50000 1.0000 + Mn Mn135 1.0 0.56250 0.60417 0.50000 1.0000 + Mn Mn136 1.0 0.60417 0.64583 0.50000 1.0000 + Mn Mn137 1.0 0.64583 0.68750 0.50000 1.0000 + Mn Mn138 1.0 0.68750 0.72917 0.50000 1.0000 + Mn Mn139 1.0 0.72917 0.77083 0.50000 1.0000 + Mn Mn140 1.0 0.77083 0.81250 0.50000 1.0000 + Mn Mn141 1.0 0.81250 0.85417 0.50000 1.0000 + Mn Mn142 1.0 0.85417 0.89583 0.50000 1.0000 + Mn Mn143 1.0 0.89583 0.93750 0.50000 1.0000 + Mn Mn144 1.0 0.93750 0.97917 0.50000 1.0000 + Mn Mn145 1.0 0.04167 0.00000 0.50000 1.0000 + Mn Mn146 1.0 0.08333 0.04167 0.50000 1.0000 + Mn Mn147 1.0 0.12500 0.08333 0.50000 1.0000 + Mn Mn148 1.0 0.16667 0.12500 0.50000 1.0000 + Mn Mn149 1.0 0.20833 0.16667 0.50000 1.0000 + Mn Mn150 1.0 0.25000 0.20833 0.50000 1.0000 + Mn Mn151 1.0 0.29167 0.25000 0.50000 1.0000 + Mn Mn152 1.0 0.33333 0.29167 0.50000 1.0000 + Mn Mn153 1.0 0.37500 0.33333 0.50000 1.0000 + Mn Mn154 1.0 0.41667 0.37500 0.50000 1.0000 + Mn Mn155 1.0 0.45833 0.41667 0.50000 1.0000 + Mn Mn156 1.0 0.50000 0.45833 0.50000 1.0000 + Mn Mn157 1.0 0.08333 0.95833 0.50000 1.0000 + Mn Mn158 1.0 0.12500 0.00000 0.50000 1.0000 + Mn Mn159 1.0 0.16667 0.04167 0.50000 1.0000 + Mn Mn160 1.0 0.20833 0.08333 0.50000 1.0000 + Mn Mn161 1.0 0.25000 0.12500 0.50000 1.0000 + Mn Mn162 1.0 0.29167 0.16667 0.50000 1.0000 + Mn Mn163 1.0 0.33333 0.20833 0.50000 1.0000 + Mn Mn164 1.0 0.37500 0.25000 0.50000 1.0000 + Mn Mn165 1.0 0.41667 0.29167 0.50000 1.0000 + Mn Mn166 1.0 0.45833 0.33333 0.50000 1.0000 + Mn Mn167 1.0 0.50000 0.37500 0.50000 1.0000 + Mn Mn168 1.0 0.54167 0.41667 0.50000 1.0000 + Mn Mn169 1.0 0.12500 0.91667 0.50000 1.0000 + Mn Mn170 1.0 0.16667 0.95833 0.50000 1.0000 + Mn Mn171 1.0 0.20833 1.00000 0.50000 1.0000 + Mn Mn172 1.0 0.25000 0.04167 0.50000 1.0000 + Mn Mn173 1.0 0.29167 0.08333 0.50000 1.0000 + Mn Mn174 1.0 0.33333 0.12500 0.50000 1.0000 + Mn Mn175 1.0 0.37500 0.16667 0.50000 1.0000 + Mn Mn176 1.0 0.41667 0.20833 0.50000 1.0000 + Mn Mn177 1.0 0.45833 0.25000 0.50000 1.0000 + Mn Mn178 1.0 0.50000 0.29167 0.50000 1.0000 + Mn Mn179 1.0 0.54167 0.33333 0.50000 1.0000 + Mn Mn180 1.0 0.58333 0.37500 0.50000 1.0000 + Mn Mn181 1.0 0.16667 0.87500 0.50000 1.0000 + Mn Mn182 1.0 0.20833 0.91667 0.50000 1.0000 + Mn Mn183 1.0 0.25000 0.95833 0.50000 1.0000 + Mn Mn184 1.0 0.29167 1.00000 0.50000 1.0000 + Mn Mn185 1.0 0.33333 0.04167 0.50000 1.0000 + Mn Mn186 1.0 0.37500 0.08333 0.50000 1.0000 + Mn Mn187 1.0 0.41667 0.12500 0.50000 1.0000 + Mn Mn188 1.0 0.45833 0.16667 0.50000 1.0000 + Mn Mn189 1.0 0.50000 0.20833 0.50000 1.0000 + Mn Mn190 1.0 0.54167 0.25000 0.50000 1.0000 + Mn Mn191 1.0 0.58333 0.29167 0.50000 1.0000 + Mn Mn192 1.0 0.62500 0.33333 0.50000 1.0000 + Mn Mn193 1.0 0.20833 0.83333 0.50000 1.0000 + Mn Mn194 1.0 0.25000 0.87500 0.50000 1.0000 + Mn Mn195 1.0 0.29167 0.91667 0.50000 1.0000 + Mn Mn196 1.0 0.33333 0.95833 0.50000 1.0000 + Mn Mn197 1.0 0.37500 1.00000 0.50000 1.0000 + Mn Mn198 1.0 0.41667 0.04167 0.50000 1.0000 + Mn Mn199 1.0 0.45833 0.08333 0.50000 1.0000 + Mn Mn200 1.0 0.50000 0.12500 0.50000 1.0000 + Mn Mn201 1.0 0.54167 0.16667 0.50000 1.0000 + Mn Mn202 1.0 0.58333 0.20833 0.50000 1.0000 + Mn Mn203 1.0 0.62500 0.25000 0.50000 1.0000 + Mn Mn204 1.0 0.66667 0.29167 0.50000 1.0000 + Mn Mn205 1.0 0.25000 0.79167 0.50000 1.0000 + Mn Mn206 1.0 0.29167 0.83333 0.50000 1.0000 + Mn Mn207 1.0 0.33333 0.87500 0.50000 1.0000 + Mn Mn208 1.0 0.37500 0.91667 0.50000 1.0000 + Mn Mn209 1.0 0.41667 0.95833 0.50000 1.0000 + Mn Mn210 1.0 0.45833 1.00000 0.50000 1.0000 + Mn Mn211 1.0 0.50000 0.04167 0.50000 1.0000 + Mn Mn212 1.0 0.54167 0.08333 0.50000 1.0000 + Mn Mn213 1.0 0.58333 0.12500 0.50000 1.0000 + Mn Mn214 1.0 0.62500 0.16667 0.50000 1.0000 + Mn Mn215 1.0 0.66667 0.20833 0.50000 1.0000 + Mn Mn216 1.0 0.70833 0.25000 0.50000 1.0000 + Mn Mn217 1.0 0.29167 0.75000 0.50000 1.0000 + Mn Mn218 1.0 0.33333 0.79167 0.50000 1.0000 + Mn Mn219 1.0 0.37500 0.83333 0.50000 1.0000 + Mn Mn220 1.0 0.41667 0.87500 0.50000 1.0000 + Mn Mn221 1.0 0.45833 0.91667 0.50000 1.0000 + Mn Mn222 1.0 0.50000 0.95833 0.50000 1.0000 + Mn Mn223 1.0 0.54167 1.00000 0.50000 1.0000 + Mn Mn224 1.0 0.58333 0.04167 0.50000 1.0000 + Mn Mn225 1.0 0.62500 0.08333 0.50000 1.0000 + Mn Mn226 1.0 0.66667 0.12500 0.50000 1.0000 + Mn Mn227 1.0 0.70833 0.16667 0.50000 1.0000 + Mn Mn228 1.0 0.75000 0.20833 0.50000 1.0000 + Mn Mn229 1.0 0.33333 0.70833 0.50000 1.0000 + Mn Mn230 1.0 0.37500 0.75000 0.50000 1.0000 + Mn Mn231 1.0 0.41667 0.79167 0.50000 1.0000 + Mn Mn232 1.0 0.45833 0.83333 0.50000 1.0000 + Mn Mn233 1.0 0.50000 0.87500 0.50000 1.0000 + Mn Mn234 1.0 0.54167 0.91667 0.50000 1.0000 + Mn Mn235 1.0 0.58333 0.95833 0.50000 1.0000 + Mn Mn236 1.0 0.62500 1.00000 0.50000 1.0000 + Mn Mn237 1.0 0.66667 0.04167 0.50000 1.0000 + Mn Mn238 1.0 0.70833 0.08333 0.50000 1.0000 + Mn Mn239 1.0 0.75000 0.12500 0.50000 1.0000 + Mn Mn240 1.0 0.79167 0.16667 0.50000 1.0000 + Mn Mn241 1.0 0.37500 0.66667 0.50000 1.0000 + Mn Mn242 1.0 0.41667 0.70833 0.50000 1.0000 + Mn Mn243 1.0 0.45833 0.75000 0.50000 1.0000 + Mn Mn244 1.0 0.50000 0.79167 0.50000 1.0000 + Mn Mn245 1.0 0.54167 0.83333 0.50000 1.0000 + Mn Mn246 1.0 0.58333 0.87500 0.50000 1.0000 + Mn Mn247 1.0 0.62500 0.91667 0.50000 1.0000 + Mn Mn248 1.0 0.66667 0.95833 0.50000 1.0000 + Mn Mn249 1.0 0.70833 1.00000 0.50000 1.0000 + Mn Mn250 1.0 0.75000 0.04167 0.50000 1.0000 + Mn Mn251 1.0 0.79167 0.08333 0.50000 1.0000 + Mn Mn252 1.0 0.83333 0.12500 0.50000 1.0000 + Mn Mn253 1.0 0.41667 0.62500 0.50000 1.0000 + Mn Mn254 1.0 0.45833 0.66667 0.50000 1.0000 + Mn Mn255 1.0 0.50000 0.70833 0.50000 1.0000 + Mn Mn256 1.0 0.54167 0.75000 0.50000 1.0000 + Mn Mn257 1.0 0.58333 0.79167 0.50000 1.0000 + Mn Mn258 1.0 0.62500 0.83333 0.50000 1.0000 + Mn Mn259 1.0 0.66667 0.87500 0.50000 1.0000 + Mn Mn260 1.0 0.70833 0.91667 0.50000 1.0000 + Mn Mn261 1.0 0.75000 0.95833 0.50000 1.0000 + Mn Mn262 1.0 0.79167 1.00000 0.50000 1.0000 + Mn Mn263 1.0 0.83333 0.04167 0.50000 1.0000 + Mn Mn264 1.0 0.87500 0.08333 0.50000 1.0000 + Mn Mn265 1.0 0.45833 0.58333 0.50000 1.0000 + Mn Mn266 1.0 0.50000 0.62500 0.50000 1.0000 + Mn Mn267 1.0 0.54167 0.66667 0.50000 1.0000 + Mn Mn268 1.0 0.58333 0.70833 0.50000 1.0000 + Mn Mn269 1.0 0.62500 0.75000 0.50000 1.0000 + Mn Mn270 1.0 0.66667 0.79167 0.50000 1.0000 + Mn Mn271 1.0 0.70833 0.83333 0.50000 1.0000 + Mn Mn272 1.0 0.75000 0.87500 0.50000 1.0000 + Mn Mn273 1.0 0.79167 0.91667 0.50000 1.0000 + Mn Mn274 1.0 0.83333 0.95833 0.50000 1.0000 + Mn Mn275 1.0 0.87500 1.00000 0.50000 1.0000 + Mn Mn276 1.0 0.91667 0.04167 0.50000 1.0000 + Mn Mn277 1.0 0.50000 0.54167 0.50000 1.0000 + Mn Mn278 1.0 0.54167 0.58333 0.50000 1.0000 + Mn Mn279 1.0 0.58333 0.62500 0.50000 1.0000 + Mn Mn280 1.0 0.62500 0.66667 0.50000 1.0000 + Mn Mn281 1.0 0.66667 0.70833 0.50000 1.0000 + Mn Mn282 1.0 0.70833 0.75000 0.50000 1.0000 + Mn Mn283 1.0 0.75000 0.79167 0.50000 1.0000 + Mn Mn284 1.0 0.79167 0.83333 0.50000 1.0000 + Mn Mn285 1.0 0.83333 0.87500 0.50000 1.0000 + Mn Mn286 1.0 0.87500 0.91667 0.50000 1.0000 + Mn Mn287 1.0 0.91667 0.95833 0.50000 1.0000 + Mn Mn288 1.0 0.95833 1.00000 0.50000 1.0000 + Mn Mn289 1.0 0.02083 0.02083 0.50000 1.0000 + Mn Mn290 1.0 0.06250 0.06250 0.50000 1.0000 + Mn Mn291 1.0 0.10417 0.10417 0.50000 1.0000 + Mn Mn292 1.0 0.64583 0.64583 0.50000 1.0000 + Mn Mn293 1.0 0.18750 0.18750 0.50000 1.0000 + Mn Mn294 1.0 0.22917 0.22917 0.50000 1.0000 + Mn Mn295 1.0 0.27083 0.27083 0.50000 1.0000 + Mn Mn296 1.0 0.31250 0.31250 0.50000 1.0000 + Mn Mn297 1.0 0.35417 0.35417 0.50000 1.0000 + Mn Mn298 1.0 0.39583 0.39583 0.50000 1.0000 + Mn Mn299 1.0 0.43750 0.43750 0.50000 1.0000 + Mn Mn300 1.0 0.47917 0.47917 0.50000 1.0000 + Mn Mn301 1.0 0.06250 0.97917 0.50000 1.0000 + Mn Mn302 1.0 0.10417 0.02083 0.50000 1.0000 + Mn Mn303 1.0 0.14583 0.06250 0.50000 1.0000 + Mn Mn304 1.0 0.18750 0.10417 0.50000 1.0000 + Mn Mn305 1.0 0.22917 0.14583 0.50000 1.0000 + Mn Mn306 1.0 0.27083 0.18750 0.50000 1.0000 + Mn Mn307 1.0 0.31250 0.22917 0.50000 1.0000 + Mn Mn308 1.0 0.35417 0.27083 0.50000 1.0000 + Mn Mn309 1.0 0.39583 0.31250 0.50000 1.0000 + Mn Mn310 1.0 0.43750 0.35417 0.50000 1.0000 + Mn Mn311 1.0 0.47917 0.39583 0.50000 1.0000 + Mn Mn312 1.0 0.52083 0.43750 0.50000 1.0000 + Mn Mn313 1.0 0.10417 0.93750 0.50000 1.0000 + Mn Mn314 1.0 0.14583 0.97917 0.50000 1.0000 + Mn Mn315 1.0 0.18750 0.02083 0.50000 1.0000 + Mn Mn316 1.0 0.22917 0.06250 0.50000 1.0000 + Mn Mn317 1.0 0.27083 0.10417 0.50000 1.0000 + Mn Mn318 1.0 0.31250 0.14583 0.50000 1.0000 + Mn Mn319 1.0 0.35417 0.18750 0.50000 1.0000 + Mn Mn320 1.0 0.39583 0.22917 0.50000 1.0000 + Mn Mn321 1.0 0.43750 0.27083 0.50000 1.0000 + Mn Mn322 1.0 0.47917 0.31250 0.50000 1.0000 + Mn Mn323 1.0 0.52083 0.35417 0.50000 1.0000 + Mn Mn324 1.0 0.56250 0.39583 0.50000 1.0000 + Mn Mn325 1.0 0.14583 0.89583 0.50000 1.0000 + Mn Mn326 1.0 0.18750 0.93750 0.50000 1.0000 + Mn Mn327 1.0 0.22917 0.97917 0.50000 1.0000 + Mn Mn328 1.0 0.27083 0.02083 0.50000 1.0000 + Mn Mn329 1.0 0.31250 0.06250 0.50000 1.0000 + Mn Mn330 1.0 0.35417 0.10417 0.50000 1.0000 + Mn Mn331 1.0 0.39583 0.14583 0.50000 1.0000 + Mn Mn332 1.0 0.43750 0.18750 0.50000 1.0000 + Mn Mn333 1.0 0.47917 0.22917 0.50000 1.0000 + Mn Mn334 1.0 0.52083 0.27083 0.50000 1.0000 + Mn Mn335 1.0 0.56250 0.31250 0.50000 1.0000 + Mn Mn336 1.0 0.60417 0.35417 0.50000 1.0000 + Mn Mn337 1.0 0.18750 0.85417 0.50000 1.0000 + Mn Mn338 1.0 0.22917 0.89583 0.50000 1.0000 + Mn Mn339 1.0 0.27083 0.93750 0.50000 1.0000 + Mn Mn340 1.0 0.31250 0.97917 0.50000 1.0000 + Mn Mn341 1.0 0.35417 0.02083 0.50000 1.0000 + Mn Mn342 1.0 0.39583 0.06250 0.50000 1.0000 + Mn Mn343 1.0 0.43750 0.10417 0.50000 1.0000 + Mn Mn344 1.0 0.47917 0.14583 0.50000 1.0000 + Mn Mn345 1.0 0.52083 0.18750 0.50000 1.0000 + Mn Mn346 1.0 0.56250 0.22917 0.50000 1.0000 + Mn Mn347 1.0 0.60417 0.27083 0.50000 1.0000 + Mn Mn348 1.0 0.64583 0.31250 0.50000 1.0000 + Mn Mn349 1.0 0.22917 0.81250 0.50000 1.0000 + Mn Mn350 1.0 0.27083 0.85417 0.50000 1.0000 + Mn Mn351 1.0 0.31250 0.89583 0.50000 1.0000 + Mn Mn352 1.0 0.35417 0.93750 0.50000 1.0000 + Mn Mn353 1.0 0.39583 0.97917 0.50000 1.0000 + Mn Mn354 1.0 0.43750 0.02083 0.50000 1.0000 + Mn Mn355 1.0 0.47917 0.06250 0.50000 1.0000 + Mn Mn356 1.0 0.52083 0.10417 0.50000 1.0000 + Mn Mn357 1.0 0.56250 0.14583 0.50000 1.0000 + Mn Mn358 1.0 0.60417 0.18750 0.50000 1.0000 + Mn Mn359 1.0 0.64583 0.22917 0.50000 1.0000 + Mn Mn360 1.0 0.68750 0.27083 0.50000 1.0000 + Mn Mn361 1.0 0.27083 0.77083 0.50000 1.0000 + Mn Mn362 1.0 0.31250 0.81250 0.50000 1.0000 + Mn Mn363 1.0 0.35417 0.85417 0.50000 1.0000 + Mn Mn364 1.0 0.39583 0.89583 0.50000 1.0000 + Mn Mn365 1.0 0.43750 0.93750 0.50000 1.0000 + Mn Mn366 1.0 0.47917 0.97917 0.50000 1.0000 + Mn Mn367 1.0 0.52083 0.02083 0.50000 1.0000 + Mn Mn368 1.0 0.56250 0.06250 0.50000 1.0000 + Mn Mn369 1.0 0.60417 0.10417 0.50000 1.0000 + Mn Mn370 1.0 0.64583 0.14583 0.50000 1.0000 + Mn Mn371 1.0 0.68750 0.18750 0.50000 1.0000 + Mn Mn372 1.0 0.72917 0.22917 0.50000 1.0000 + Mn Mn373 1.0 0.31250 0.72917 0.50000 1.0000 + Mn Mn374 1.0 0.35417 0.77083 0.50000 1.0000 + Mn Mn375 1.0 0.39583 0.81250 0.50000 1.0000 + Mn Mn376 1.0 0.43750 0.85417 0.50000 1.0000 + Mn Mn377 1.0 0.47917 0.89583 0.50000 1.0000 + Mn Mn378 1.0 0.52083 0.93750 0.50000 1.0000 + Mn Mn379 1.0 0.56250 0.97917 0.50000 1.0000 + Mn Mn380 1.0 0.60417 0.02083 0.50000 1.0000 + Mn Mn381 1.0 0.64583 0.06250 0.50000 1.0000 + Mn Mn382 1.0 0.68750 0.10417 0.50000 1.0000 + Mn Mn383 1.0 0.72917 0.14583 0.50000 1.0000 + Mn Mn384 1.0 0.77083 0.18750 0.50000 1.0000 + Mn Mn385 1.0 0.35417 0.68750 0.50000 1.0000 + Mn Mn386 1.0 0.39583 0.72917 0.50000 1.0000 + Mn Mn387 1.0 0.43750 0.77083 0.50000 1.0000 + Mn Mn388 1.0 0.47917 0.81250 0.50000 1.0000 + Mn Mn389 1.0 0.52083 0.85417 0.50000 1.0000 + Mn Mn390 1.0 0.56250 0.89583 0.50000 1.0000 + Mn Mn391 1.0 0.60417 0.93750 0.50000 1.0000 + Mn Mn392 1.0 0.64583 0.97917 0.50000 1.0000 + Mn Mn393 1.0 0.68750 0.02083 0.50000 1.0000 + Mn Mn394 1.0 0.72917 0.06250 0.50000 1.0000 + Mn Mn395 1.0 0.77083 0.10417 0.50000 1.0000 + Mn Mn396 1.0 0.81250 0.14583 0.50000 1.0000 + Mn Mn397 1.0 0.39583 0.64583 0.50000 1.0000 + Mn Mn398 1.0 0.43750 0.68750 0.50000 1.0000 + Mn Mn399 1.0 0.47917 0.72917 0.50000 1.0000 + Mn Mn400 1.0 0.52083 0.77083 0.50000 1.0000 + Mn Mn401 1.0 0.56250 0.81250 0.50000 1.0000 + Mn Mn402 1.0 0.60417 0.85417 0.50000 1.0000 + Mn Mn403 1.0 0.64583 0.89583 0.50000 1.0000 + Mn Mn404 1.0 0.68750 0.93750 0.50000 1.0000 + Mn Mn405 1.0 0.72917 0.97917 0.50000 1.0000 + Mn Mn406 1.0 0.77083 0.02083 0.50000 1.0000 + Mn Mn407 1.0 0.81250 0.06250 0.50000 1.0000 + Mn Mn408 1.0 0.85417 0.10417 0.50000 1.0000 + Mn Mn409 1.0 0.43750 0.60417 0.50000 1.0000 + Mn Mn410 1.0 0.47917 0.64583 0.50000 1.0000 + Mn Mn411 1.0 0.52083 0.68750 0.50000 1.0000 + Mn Mn412 1.0 0.56250 0.72917 0.50000 1.0000 + Mn Mn413 1.0 0.60417 0.77083 0.50000 1.0000 + Mn Mn414 1.0 0.64583 0.81250 0.50000 1.0000 + Mn Mn415 1.0 0.68750 0.85417 0.50000 1.0000 + Mn Mn416 1.0 0.72917 0.89583 0.50000 1.0000 + Mn Mn417 1.0 0.77083 0.93750 0.50000 1.0000 + Mn Mn418 1.0 0.81250 0.97917 0.50000 1.0000 + Mn Mn419 1.0 0.85417 0.02083 0.50000 1.0000 + Mn Mn420 1.0 0.89583 0.06250 0.50000 1.0000 + Mn Mn421 1.0 0.47917 0.56250 0.50000 1.0000 + Mn Mn422 1.0 0.52083 0.60417 0.50000 1.0000 + Mn Mn423 1.0 0.56250 0.64583 0.50000 1.0000 + Mn Mn424 1.0 0.60417 0.68750 0.50000 1.0000 + Mn Mn425 1.0 0.64583 0.72917 0.50000 1.0000 + Mn Mn426 1.0 0.68750 0.77083 0.50000 1.0000 + Mn Mn427 1.0 0.72917 0.81250 0.50000 1.0000 + Mn Mn428 1.0 0.77083 0.85417 0.50000 1.0000 + Mn Mn429 1.0 0.81250 0.89583 0.50000 1.0000 + Mn Mn430 1.0 0.85417 0.93750 0.50000 1.0000 + Mn Mn431 1.0 0.89583 0.97917 0.50000 1.0000 + Mn Mn432 1.0 0.93750 0.02083 0.50000 1.0000 + F F1 1.0 0.03476 0.97905 0.65539 1.0000 + F F2 1.0 0.07643 0.02072 0.65539 1.0000 + F F3 1.0 0.11809 0.06239 0.65539 1.0000 + F F4 1.0 0.15976 0.10405 0.65539 1.0000 + F F5 1.0 0.20143 0.14572 0.65539 1.0000 + F F6 1.0 0.24309 0.18739 0.65539 1.0000 + F F7 1.0 0.28476 0.22905 0.65539 1.0000 + F F8 1.0 0.32643 0.27072 0.65539 1.0000 + F F9 1.0 0.36809 0.31239 0.65539 1.0000 + F F10 1.0 0.40976 0.35405 0.65539 1.0000 + F F11 1.0 0.45143 0.39572 0.65539 1.0000 + F F12 1.0 0.49309 0.43739 0.65539 1.0000 + F F13 1.0 0.07643 0.93739 0.65539 1.0000 + F F14 1.0 0.11809 0.97905 0.65539 1.0000 + F F15 1.0 0.15976 0.02072 0.65539 1.0000 + F F16 1.0 0.20143 0.06239 0.65539 1.0000 + F F17 1.0 0.24309 0.10405 0.65539 1.0000 + F F18 1.0 0.28476 0.14572 0.65539 1.0000 + F F19 1.0 0.32643 0.18739 0.65539 1.0000 + F F20 1.0 0.36809 0.22905 0.65539 1.0000 + F F21 1.0 0.40976 0.27072 0.65539 1.0000 + F F22 1.0 0.45143 0.31239 0.65539 1.0000 + F F23 1.0 0.49309 0.35405 0.65539 1.0000 + F F24 1.0 0.53476 0.39572 0.65539 1.0000 + F F25 1.0 0.11809 0.89572 0.65539 1.0000 + F F26 1.0 0.15976 0.93739 0.65539 1.0000 + F F27 1.0 0.20143 0.97905 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0.71264 1.0000 + Li Li469 1.0 0.62500 0.37500 0.71264 1.0000 + Li Li470 1.0 0.66667 0.41667 0.71264 1.0000 + Li Li471 1.0 0.70833 0.45833 0.71264 1.0000 + Li Li472 1.0 0.75000 0.50000 0.71264 1.0000 + Li Li473 1.0 0.79167 0.54167 0.71264 1.0000 + Li Li474 1.0 0.83333 0.58333 0.71264 1.0000 + Li Li475 1.0 0.87500 0.62500 0.71264 1.0000 + Li Li476 1.0 0.91667 0.66667 0.71264 1.0000 + Li Li477 1.0 0.95833 0.70833 0.71264 1.0000 + Li Li478 1.0 0.00000 0.75000 0.71264 1.0000 + Li Li479 1.0 0.04167 0.79167 0.71264 1.0000 + Li Li480 1.0 0.08333 0.83333 0.71264 1.0000 + Li Li481 1.0 0.66667 0.33333 0.71264 1.0000 + Li Li482 1.0 0.70833 0.37500 0.71264 1.0000 + Li Li483 1.0 0.75000 0.41667 0.71264 1.0000 + Li Li484 1.0 0.79167 0.45833 0.71264 1.0000 + Li Li485 1.0 0.83333 0.50000 0.71264 1.0000 + Li Li486 1.0 0.87500 0.54167 0.71264 1.0000 + Li Li487 1.0 0.91667 0.58333 0.71264 1.0000 + Li Li488 1.0 0.95833 0.62500 0.71264 1.0000 + Li Li489 1.0 0.00000 0.66667 0.71264 1.0000 + Li Li490 1.0 0.04167 0.70833 0.71264 1.0000 + Li Li491 1.0 0.08333 0.75000 0.71264 1.0000 + Li Li492 1.0 0.12500 0.79167 0.71264 1.0000 + Li Li493 1.0 0.70833 0.29167 0.71264 1.0000 + Li Li494 1.0 0.75000 0.33333 0.71264 1.0000 + Li Li495 1.0 0.79167 0.37500 0.71264 1.0000 + Li Li496 1.0 0.83333 0.41667 0.71264 1.0000 + Li Li497 1.0 0.87500 0.45833 0.71264 1.0000 + Li Li498 1.0 0.91667 0.50000 0.71264 1.0000 + Li Li499 1.0 0.95833 0.54167 0.71264 1.0000 + Li Li500 1.0 0.00000 0.58333 0.71264 1.0000 + Li Li501 1.0 0.04167 0.62500 0.71264 1.0000 + Li Li502 1.0 0.08333 0.66667 0.71264 1.0000 + Li Li503 1.0 0.12500 0.70833 0.71264 1.0000 + Li Li504 1.0 0.16667 0.75000 0.71264 1.0000 + Li Li505 1.0 0.75000 0.25000 0.71264 1.0000 + Li Li506 1.0 0.79167 0.29167 0.71264 1.0000 + Li Li507 1.0 0.83333 0.33333 0.71264 1.0000 + Li Li508 1.0 0.87500 0.37500 0.71264 1.0000 + Li Li509 1.0 0.91667 0.41667 0.71264 1.0000 + Li Li510 1.0 0.95833 0.45833 0.71264 1.0000 + Li Li511 1.0 0.00000 0.50000 0.71264 1.0000 + Li Li512 1.0 0.04167 0.54167 0.71264 1.0000 + Li Li513 1.0 0.08333 0.58333 0.71264 1.0000 + Li Li514 1.0 0.12500 0.62500 0.71264 1.0000 + Li Li515 1.0 0.16667 0.66667 0.71264 1.0000 + Li Li516 1.0 0.20833 0.70833 0.71264 1.0000 + Li Li517 1.0 0.79167 0.20833 0.71264 1.0000 + Li Li518 1.0 0.83333 0.25000 0.71264 1.0000 + Li Li519 1.0 0.87500 0.29167 0.71264 1.0000 + Li Li520 1.0 0.91667 0.33333 0.71264 1.0000 + Li Li521 1.0 0.95833 0.37500 0.71264 1.0000 + Li Li522 1.0 0.00000 0.41667 0.71264 1.0000 + Li Li523 1.0 0.04167 0.45833 0.71264 1.0000 + Li Li524 1.0 0.08333 0.50000 0.71264 1.0000 + Li Li525 1.0 0.12500 0.54167 0.71264 1.0000 + Li Li526 1.0 0.16667 0.58333 0.71264 1.0000 + Li Li527 1.0 0.20833 0.62500 0.71264 1.0000 + Li Li528 1.0 0.25000 0.66667 0.71264 1.0000 + Li Li529 1.0 0.83333 0.16667 0.71264 1.0000 + Li Li530 1.0 0.87500 0.20833 0.71264 1.0000 + Li Li531 1.0 0.91667 0.25000 0.71264 1.0000 + Li Li532 1.0 0.95833 0.29167 0.71264 1.0000 + Li Li533 1.0 0.00000 0.33333 0.71264 1.0000 + Li Li534 1.0 0.04167 0.37500 0.71264 1.0000 + Li Li535 1.0 0.08333 0.41667 0.71264 1.0000 + Li Li536 1.0 0.12500 0.45833 0.71264 1.0000 + Li Li537 1.0 0.16667 0.50000 0.71264 1.0000 + Li Li538 1.0 0.20833 0.54167 0.71264 1.0000 + Li Li539 1.0 0.25000 0.58333 0.71264 1.0000 + Li Li540 1.0 0.29167 0.62500 0.71264 1.0000 + Li Li541 1.0 0.87500 0.12500 0.71264 1.0000 + Li Li542 1.0 0.91667 0.16667 0.71264 1.0000 + Li Li543 1.0 0.95833 0.20833 0.71264 1.0000 + Li Li544 1.0 0.00000 0.25000 0.71264 1.0000 + Li Li545 1.0 0.04167 0.29167 0.71264 1.0000 + Li Li546 1.0 0.08333 0.33333 0.71264 1.0000 + Li Li547 1.0 0.12500 0.37500 0.71264 1.0000 + Li Li548 1.0 0.16667 0.41667 0.71264 1.0000 + Li Li549 1.0 0.20833 0.45833 0.71264 1.0000 + Li Li550 1.0 0.25000 0.50000 0.71264 1.0000 + Li Li551 1.0 0.29167 0.54167 0.71264 1.0000 + Li Li552 1.0 0.33333 0.58333 0.71264 1.0000 + Li Li553 1.0 0.91667 0.08333 0.71264 1.0000 + Li Li554 1.0 0.95833 0.12500 0.71264 1.0000 + Li Li555 1.0 0.00000 0.16667 0.71264 1.0000 + Li Li556 1.0 0.04167 0.20833 0.71264 1.0000 + Li Li557 1.0 0.08333 0.25000 0.71264 1.0000 + Li Li558 1.0 0.12500 0.29167 0.71264 1.0000 + Li Li559 1.0 0.16667 0.33333 0.71264 1.0000 + Li Li560 1.0 0.20833 0.37500 0.71264 1.0000 + Li Li561 1.0 0.25000 0.41667 0.71264 1.0000 + Li Li562 1.0 0.29167 0.45833 0.71264 1.0000 + Li Li563 1.0 0.33333 0.50000 0.71264 1.0000 + Li Li564 1.0 0.37500 0.54167 0.71264 1.0000 + Li Li565 1.0 0.95833 0.04167 0.71264 1.0000 + Li Li566 1.0 0.00000 0.08333 0.71264 1.0000 + Li Li567 1.0 0.04167 0.12500 0.71264 1.0000 + Li Li568 1.0 0.08333 0.16667 0.71264 1.0000 + Li Li569 1.0 0.12500 0.20833 0.71264 1.0000 + Li Li570 1.0 0.16667 0.25000 0.71264 1.0000 + Li Li571 1.0 0.20833 0.29167 0.71264 1.0000 + Li Li572 1.0 0.25000 0.33333 0.71264 1.0000 + Li Li573 1.0 0.29167 0.37500 0.71264 1.0000 + Li Li574 1.0 0.33333 0.41667 0.71264 1.0000 + Li Li575 1.0 0.37500 0.45833 0.71264 1.0000 + Li Li576 1.0 0.41667 0.50000 0.71264 1.0000 + Mn Mn433 1.0 0.52083 0.47917 0.50000 1.0000 + Mn Mn434 1.0 0.56250 0.52083 0.50000 1.0000 + Mn Mn435 1.0 0.60417 0.56250 0.50000 1.0000 + Mn Mn436 1.0 0.64583 0.60417 0.50000 1.0000 + Mn Mn437 1.0 0.68750 0.64583 0.50000 1.0000 + Mn Mn438 1.0 0.72917 0.68750 0.50000 1.0000 + Mn Mn439 1.0 0.77083 0.72917 0.50000 1.0000 + Mn Mn440 1.0 0.81250 0.77083 0.50000 1.0000 + Mn Mn441 1.0 0.85417 0.81250 0.50000 1.0000 + Mn Mn442 1.0 0.89583 0.85417 0.50000 1.0000 + Mn Mn443 1.0 0.93750 0.89583 0.50000 1.0000 + Mn Mn444 1.0 0.97917 0.93750 0.50000 1.0000 + Mn Mn445 1.0 0.56250 0.43750 0.50000 1.0000 + Mn Mn446 1.0 0.60417 0.47917 0.50000 1.0000 + Mn Mn447 1.0 0.64583 0.52083 0.50000 1.0000 + Mn Mn448 1.0 0.68750 0.56250 0.50000 1.0000 + Mn Mn449 1.0 0.72917 0.60417 0.50000 1.0000 + Mn Mn450 1.0 0.77083 0.64583 0.50000 1.0000 + Mn Mn451 1.0 0.81250 0.68750 0.50000 1.0000 + Mn Mn452 1.0 0.85417 0.72917 0.50000 1.0000 + Mn Mn453 1.0 0.89583 0.77083 0.50000 1.0000 + Mn Mn454 1.0 0.93750 0.81250 0.50000 1.0000 + Mn Mn455 1.0 0.97917 0.85417 0.50000 1.0000 + Mn Mn456 1.0 0.02083 0.89583 0.50000 1.0000 + Mn Mn457 1.0 0.60417 0.39583 0.50000 1.0000 + Mn Mn458 1.0 0.64583 0.43750 0.50000 1.0000 + Mn Mn459 1.0 0.68750 0.47917 0.50000 1.0000 + Mn Mn460 1.0 0.72917 0.52083 0.50000 1.0000 + Mn Mn461 1.0 0.77083 0.56250 0.50000 1.0000 + Mn Mn462 1.0 0.81250 0.60417 0.50000 1.0000 + Mn Mn463 1.0 0.85417 0.64583 0.50000 1.0000 + Mn Mn464 1.0 0.89583 0.68750 0.50000 1.0000 + Mn Mn465 1.0 0.93750 0.72917 0.50000 1.0000 + Mn Mn466 1.0 0.97917 0.77083 0.50000 1.0000 + Mn Mn467 1.0 0.02083 0.81250 0.50000 1.0000 + Mn Mn468 1.0 0.06250 0.85417 0.50000 1.0000 + Mn Mn469 1.0 0.64583 0.35417 0.50000 1.0000 + Mn Mn470 1.0 0.68750 0.39583 0.50000 1.0000 + Mn Mn471 1.0 0.72917 0.43750 0.50000 1.0000 + Mn Mn472 1.0 0.77083 0.47917 0.50000 1.0000 + Mn Mn473 1.0 0.81250 0.52083 0.50000 1.0000 + Mn Mn474 1.0 0.85417 0.56250 0.50000 1.0000 + Mn Mn475 1.0 0.89583 0.60417 0.50000 1.0000 + Mn Mn476 1.0 0.93750 0.64583 0.50000 1.0000 + Mn Mn477 1.0 0.97917 0.68750 0.50000 1.0000 + Mn Mn478 1.0 0.02083 0.72917 0.50000 1.0000 + Mn Mn479 1.0 0.06250 0.77083 0.50000 1.0000 + Mn Mn480 1.0 0.10417 0.81250 0.50000 1.0000 + Mn Mn481 1.0 0.68750 0.31250 0.50000 1.0000 + Mn Mn482 1.0 0.72917 0.35417 0.50000 1.0000 + Mn Mn483 1.0 0.77083 0.39583 0.50000 1.0000 + Mn Mn484 1.0 0.81250 0.43750 0.50000 1.0000 + Mn Mn485 1.0 0.85417 0.47917 0.50000 1.0000 + Mn Mn486 1.0 0.89583 0.52083 0.50000 1.0000 + Mn Mn487 1.0 0.93750 0.56250 0.50000 1.0000 + Mn Mn488 1.0 0.97917 0.60417 0.50000 1.0000 + Mn Mn489 1.0 0.02083 0.64583 0.50000 1.0000 + Mn Mn490 1.0 0.06250 0.68750 0.50000 1.0000 + Mn Mn491 1.0 0.10417 0.72917 0.50000 1.0000 + Mn Mn492 1.0 0.14583 0.77083 0.50000 1.0000 + Mn Mn493 1.0 0.72917 0.27083 0.50000 1.0000 + Mn Mn494 1.0 0.77083 0.31250 0.50000 1.0000 + Mn Mn495 1.0 0.81250 0.35417 0.50000 1.0000 + Mn Mn496 1.0 0.85417 0.39583 0.50000 1.0000 + Mn Mn497 1.0 0.89583 0.43750 0.50000 1.0000 + Mn Mn498 1.0 0.93750 0.47917 0.50000 1.0000 + Mn Mn499 1.0 0.97917 0.52083 0.50000 1.0000 + Mn Mn500 1.0 0.02083 0.56250 0.50000 1.0000 + Mn Mn501 1.0 0.06250 0.60417 0.50000 1.0000 + Mn Mn502 1.0 0.10417 0.64583 0.50000 1.0000 + Mn Mn503 1.0 0.14583 0.68750 0.50000 1.0000 + Mn Mn504 1.0 0.18750 0.72917 0.50000 1.0000 + Mn Mn505 1.0 0.77083 0.22917 0.50000 1.0000 + Mn Mn506 1.0 0.81250 0.27083 0.50000 1.0000 + Mn Mn507 1.0 0.85417 0.31250 0.50000 1.0000 + Mn Mn508 1.0 0.89583 0.35417 0.50000 1.0000 + Mn Mn509 1.0 0.93750 0.39583 0.50000 1.0000 + Mn Mn510 1.0 0.97917 0.43750 0.50000 1.0000 + Mn Mn511 1.0 0.02083 0.47917 0.50000 1.0000 + Mn Mn512 1.0 0.06250 0.52083 0.50000 1.0000 + Mn Mn513 1.0 0.10417 0.56250 0.50000 1.0000 + Mn Mn514 1.0 0.14583 0.60417 0.50000 1.0000 + Mn Mn515 1.0 0.18750 0.64583 0.50000 1.0000 + Mn Mn516 1.0 0.22917 0.68750 0.50000 1.0000 + Mn Mn517 1.0 0.81250 0.18750 0.50000 1.0000 + Mn Mn518 1.0 0.85417 0.22917 0.50000 1.0000 + Mn Mn519 1.0 0.89583 0.27083 0.50000 1.0000 + Mn Mn520 1.0 0.93750 0.31250 0.50000 1.0000 + Mn Mn521 1.0 0.97917 0.35417 0.50000 1.0000 + Mn Mn522 1.0 0.02083 0.39583 0.50000 1.0000 + Mn Mn523 1.0 0.06250 0.43750 0.50000 1.0000 + Mn Mn524 1.0 0.10417 0.47917 0.50000 1.0000 + Mn Mn525 1.0 0.14583 0.52083 0.50000 1.0000 + Mn Mn526 1.0 0.18750 0.56250 0.50000 1.0000 + Mn Mn527 1.0 0.22917 0.60417 0.50000 1.0000 + Mn Mn528 1.0 0.27083 0.64583 0.50000 1.0000 + Mn Mn529 1.0 0.85417 0.14583 0.50000 1.0000 + Mn Mn530 1.0 0.89583 0.18750 0.50000 1.0000 + Mn Mn531 1.0 0.93750 0.22917 0.50000 1.0000 + Mn Mn532 1.0 0.97917 0.27083 0.50000 1.0000 + Mn Mn533 1.0 0.02083 0.31250 0.50000 1.0000 + Mn Mn534 1.0 0.06250 0.35417 0.50000 1.0000 + Mn Mn535 1.0 0.10417 0.39583 0.50000 1.0000 + Mn Mn536 1.0 0.14583 0.43750 0.50000 1.0000 + Mn Mn537 1.0 0.18750 0.47917 0.50000 1.0000 + Mn Mn538 1.0 0.22917 0.52083 0.50000 1.0000 + Mn Mn539 1.0 0.27083 0.56250 0.50000 1.0000 + Mn Mn540 1.0 0.31250 0.60417 0.50000 1.0000 + Mn Mn541 1.0 0.89583 0.10417 0.50000 1.0000 + Mn Mn542 1.0 0.93750 0.14583 0.50000 1.0000 + Mn Mn543 1.0 0.97917 0.18750 0.50000 1.0000 + Mn Mn544 1.0 0.02083 0.22917 0.50000 1.0000 + Mn Mn545 1.0 0.06250 0.27083 0.50000 1.0000 + Mn Mn546 1.0 0.10417 0.31250 0.50000 1.0000 + Mn Mn547 1.0 0.14583 0.35417 0.50000 1.0000 + Mn Mn548 1.0 0.18750 0.39583 0.50000 1.0000 + Mn Mn549 1.0 0.22917 0.43750 0.50000 1.0000 + Mn Mn550 1.0 0.27083 0.47917 0.50000 1.0000 + Mn Mn551 1.0 0.31250 0.52083 0.50000 1.0000 + Mn Mn552 1.0 0.35417 0.56250 0.50000 1.0000 + Mn Mn553 1.0 0.93750 0.06250 0.50000 1.0000 + Mn Mn554 1.0 0.97917 0.10417 0.50000 1.0000 + Mn Mn555 1.0 0.02083 0.14583 0.50000 1.0000 + Mn Mn556 1.0 0.06250 0.18750 0.50000 1.0000 + Mn Mn557 1.0 0.10417 0.22917 0.50000 1.0000 + Mn Mn558 1.0 0.14583 0.27083 0.50000 1.0000 + Mn Mn559 1.0 0.18750 0.31250 0.50000 1.0000 + Mn Mn560 1.0 0.22917 0.35417 0.50000 1.0000 + Mn Mn561 1.0 0.27083 0.39583 0.50000 1.0000 + Mn Mn562 1.0 0.31250 0.43750 0.50000 1.0000 + Mn Mn563 1.0 0.35417 0.47917 0.50000 1.0000 + Mn Mn564 1.0 0.39583 0.52083 0.50000 1.0000 + Mn Mn565 1.0 0.97917 0.02083 0.50000 1.0000 + Mn Mn566 1.0 0.02083 0.06250 0.50000 1.0000 + Mn Mn567 1.0 0.06250 0.10417 0.50000 1.0000 + Mn Mn568 1.0 0.10417 0.14583 0.50000 1.0000 + Mn Mn569 1.0 0.14583 0.18750 0.50000 1.0000 + Mn Mn570 1.0 0.18750 0.22917 0.50000 1.0000 + Mn Mn571 1.0 0.22917 0.27083 0.50000 1.0000 + Mn Mn572 1.0 0.27083 0.31250 0.50000 1.0000 + Mn Mn573 1.0 0.31250 0.35417 0.50000 1.0000 + Mn Mn574 1.0 0.35417 0.39583 0.50000 1.0000 + Mn Mn575 1.0 0.39583 0.43750 0.50000 1.0000 + Mn Mn576 1.0 0.43750 0.47917 0.50000 1.0000 + Mn Mn577 1.0 0.54167 0.50000 0.50000 1.0000 + Mn Mn578 1.0 0.58333 0.54167 0.50000 1.0000 + Mn Mn579 1.0 0.62500 0.58333 0.50000 1.0000 + Mn Mn580 1.0 0.66667 0.62500 0.50000 1.0000 + Mn Mn581 1.0 0.70833 0.66667 0.50000 1.0000 + Mn Mn582 1.0 0.75000 0.70833 0.50000 1.0000 + Mn Mn583 1.0 0.79167 0.75000 0.50000 1.0000 + Mn Mn584 1.0 0.83333 0.79167 0.50000 1.0000 + Mn Mn585 1.0 0.87500 0.83333 0.50000 1.0000 + Mn Mn586 1.0 0.91667 0.87500 0.50000 1.0000 + Mn Mn587 1.0 0.95833 0.91667 0.50000 1.0000 + Mn Mn588 1.0 0.00000 0.95833 0.50000 1.0000 + Mn Mn589 1.0 0.58333 0.45833 0.50000 1.0000 + Mn Mn590 1.0 0.62500 0.50000 0.50000 1.0000 + Mn Mn591 1.0 0.66667 0.54167 0.50000 1.0000 + Mn Mn592 1.0 0.70833 0.58333 0.50000 1.0000 + Mn Mn593 1.0 0.75000 0.62500 0.50000 1.0000 + Mn Mn594 1.0 0.79167 0.66667 0.50000 1.0000 + Mn Mn595 1.0 0.83333 0.70833 0.50000 1.0000 + Mn Mn596 1.0 0.87500 0.75000 0.50000 1.0000 + Mn Mn597 1.0 0.91667 0.79167 0.50000 1.0000 + Mn Mn598 1.0 0.95833 0.83333 0.50000 1.0000 + Mn Mn599 1.0 0.00000 0.87500 0.50000 1.0000 + Mn Mn600 1.0 0.04167 0.91667 0.50000 1.0000 + Mn Mn601 1.0 0.62500 0.41667 0.50000 1.0000 + Mn Mn602 1.0 0.66667 0.45833 0.50000 1.0000 + Mn Mn603 1.0 0.70833 0.50000 0.50000 1.0000 + Mn Mn604 1.0 0.75000 0.54167 0.50000 1.0000 + Mn Mn605 1.0 0.79167 0.58333 0.50000 1.0000 + Mn Mn606 1.0 0.83333 0.62500 0.50000 1.0000 + Mn Mn607 1.0 0.87500 0.66667 0.50000 1.0000 + Mn Mn608 1.0 0.91667 0.70833 0.50000 1.0000 + Mn Mn609 1.0 0.95833 0.75000 0.50000 1.0000 + Mn Mn610 1.0 0.00000 0.79167 0.50000 1.0000 + Mn Mn611 1.0 0.04167 0.83333 0.50000 1.0000 + Mn Mn612 1.0 0.08333 0.87500 0.50000 1.0000 + Mn Mn613 1.0 0.66667 0.37500 0.50000 1.0000 + Mn Mn614 1.0 0.70833 0.41667 0.50000 1.0000 + Mn Mn615 1.0 0.75000 0.45833 0.50000 1.0000 + Mn Mn616 1.0 0.79167 0.50000 0.50000 1.0000 + Mn Mn617 1.0 0.83333 0.54167 0.50000 1.0000 + Mn Mn618 1.0 0.87500 0.58333 0.50000 1.0000 + Mn Mn619 1.0 0.91667 0.62500 0.50000 1.0000 + Mn Mn620 1.0 0.95833 0.66667 0.50000 1.0000 + Mn Mn621 1.0 0.00000 0.70833 0.50000 1.0000 + Mn Mn622 1.0 0.04167 0.75000 0.50000 1.0000 + Mn Mn623 1.0 0.08333 0.79167 0.50000 1.0000 + Mn Mn624 1.0 0.12500 0.83333 0.50000 1.0000 + Mn Mn625 1.0 0.70833 0.33333 0.50000 1.0000 + Mn Mn626 1.0 0.75000 0.37500 0.50000 1.0000 + Mn Mn627 1.0 0.79167 0.41667 0.50000 1.0000 + Mn Mn628 1.0 0.83333 0.45833 0.50000 1.0000 + Mn Mn629 1.0 0.87500 0.50000 0.50000 1.0000 + Mn Mn630 1.0 0.91667 0.54167 0.50000 1.0000 + Mn Mn631 1.0 0.95833 0.58333 0.50000 1.0000 + Mn Mn632 1.0 0.00000 0.62500 0.50000 1.0000 + Mn Mn633 1.0 0.04167 0.66667 0.50000 1.0000 + Mn Mn634 1.0 0.08333 0.70833 0.50000 1.0000 + Mn Mn635 1.0 0.12500 0.75000 0.50000 1.0000 + Mn Mn636 1.0 0.16667 0.79167 0.50000 1.0000 + Mn Mn637 1.0 0.75000 0.29167 0.50000 1.0000 + Mn Mn638 1.0 0.79167 0.33333 0.50000 1.0000 + Mn Mn639 1.0 0.83333 0.37500 0.50000 1.0000 + Mn Mn640 1.0 0.87500 0.41667 0.50000 1.0000 + Mn Mn641 1.0 0.91667 0.45833 0.50000 1.0000 + Mn Mn642 1.0 0.95833 0.50000 0.50000 1.0000 + Mn Mn643 1.0 0.00000 0.54167 0.50000 1.0000 + Mn Mn644 1.0 0.04167 0.58333 0.50000 1.0000 + Mn Mn645 1.0 0.08333 0.62500 0.50000 1.0000 + Mn Mn646 1.0 0.12500 0.66667 0.50000 1.0000 + Mn Mn647 1.0 0.16667 0.70833 0.50000 1.0000 + Mn Mn648 1.0 0.20833 0.75000 0.50000 1.0000 + Mn Mn649 1.0 0.79167 0.25000 0.50000 1.0000 + Mn Mn650 1.0 0.83333 0.29167 0.50000 1.0000 + Mn Mn651 1.0 0.87500 0.33333 0.50000 1.0000 + Mn Mn652 1.0 0.91667 0.37500 0.50000 1.0000 + Mn Mn653 1.0 0.95833 0.41667 0.50000 1.0000 + Mn Mn654 1.0 0.00000 0.45833 0.50000 1.0000 + Mn Mn655 1.0 0.04167 0.50000 0.50000 1.0000 + Mn Mn656 1.0 0.08333 0.54167 0.50000 1.0000 + Mn Mn657 1.0 0.12500 0.58333 0.50000 1.0000 + Mn Mn658 1.0 0.16667 0.62500 0.50000 1.0000 + Mn Mn659 1.0 0.20833 0.66667 0.50000 1.0000 + Mn Mn660 1.0 0.25000 0.70833 0.50000 1.0000 + Mn Mn661 1.0 0.83333 0.20833 0.50000 1.0000 + Mn Mn662 1.0 0.87500 0.25000 0.50000 1.0000 + Mn Mn663 1.0 0.91667 0.29167 0.50000 1.0000 + Mn Mn664 1.0 0.95833 0.33333 0.50000 1.0000 + Mn Mn665 1.0 0.00000 0.37500 0.50000 1.0000 + Mn Mn666 1.0 0.04167 0.41667 0.50000 1.0000 + Mn Mn667 1.0 0.08333 0.45833 0.50000 1.0000 + Mn Mn668 1.0 0.12500 0.50000 0.50000 1.0000 + Mn Mn669 1.0 0.16667 0.54167 0.50000 1.0000 + Mn Mn670 1.0 0.20833 0.58333 0.50000 1.0000 + Mn Mn671 1.0 0.25000 0.62500 0.50000 1.0000 + Mn Mn672 1.0 0.29167 0.66667 0.50000 1.0000 + Mn Mn673 1.0 0.87500 0.16667 0.50000 1.0000 + Mn Mn674 1.0 0.91667 0.20833 0.50000 1.0000 + Mn Mn675 1.0 0.95833 0.25000 0.50000 1.0000 + Mn Mn676 1.0 0.00000 0.29167 0.50000 1.0000 + Mn Mn677 1.0 0.04167 0.33333 0.50000 1.0000 + Mn Mn678 1.0 0.08333 0.37500 0.50000 1.0000 + Mn Mn679 1.0 0.12500 0.41667 0.50000 1.0000 + Mn Mn680 1.0 0.16667 0.45833 0.50000 1.0000 + Mn Mn681 1.0 0.20833 0.50000 0.50000 1.0000 + Mn Mn682 1.0 0.25000 0.54167 0.50000 1.0000 + Mn Mn683 1.0 0.29167 0.58333 0.50000 1.0000 + Mn Mn684 1.0 0.33333 0.62500 0.50000 1.0000 + Mn Mn685 1.0 0.91667 0.12500 0.50000 1.0000 + Mn Mn686 1.0 0.95833 0.16667 0.50000 1.0000 + Mn Mn687 1.0 0.00000 0.20833 0.50000 1.0000 + Mn Mn688 1.0 0.04167 0.25000 0.50000 1.0000 + Mn Mn689 1.0 0.08333 0.29167 0.50000 1.0000 + Mn Mn690 1.0 0.12500 0.33333 0.50000 1.0000 + Mn Mn691 1.0 0.16667 0.37500 0.50000 1.0000 + Mn Mn692 1.0 0.20833 0.41667 0.50000 1.0000 + Mn Mn693 1.0 0.25000 0.45833 0.50000 1.0000 + Mn Mn694 1.0 0.29167 0.50000 0.50000 1.0000 + Mn Mn695 1.0 0.33333 0.54167 0.50000 1.0000 + Mn Mn696 1.0 0.37500 0.58333 0.50000 1.0000 + Mn Mn697 1.0 0.95833 0.08333 0.50000 1.0000 + Mn Mn698 1.0 0.00000 0.12500 0.50000 1.0000 + Mn Mn699 1.0 0.04167 0.16667 0.50000 1.0000 + Mn Mn700 1.0 0.08333 0.20833 0.50000 1.0000 + Mn Mn701 1.0 0.12500 0.25000 0.50000 1.0000 + Mn Mn702 1.0 0.16667 0.29167 0.50000 1.0000 + Mn Mn703 1.0 0.20833 0.33333 0.50000 1.0000 + Mn Mn704 1.0 0.25000 0.37500 0.50000 1.0000 + Mn Mn705 1.0 0.29167 0.41667 0.50000 1.0000 + Mn Mn706 1.0 0.33333 0.45833 0.50000 1.0000 + Mn Mn707 1.0 0.37500 0.50000 0.50000 1.0000 + Mn Mn708 1.0 0.41667 0.54167 0.50000 1.0000 + Mn Mn709 1.0 0.00000 0.04167 0.50000 1.0000 + Mn Mn710 1.0 0.04167 0.08333 0.50000 1.0000 + Mn Mn711 1.0 0.08333 0.12500 0.50000 1.0000 + Mn Mn712 1.0 0.12500 0.16667 0.50000 1.0000 + Mn Mn713 1.0 0.16667 0.20833 0.50000 1.0000 + Mn Mn714 1.0 0.20833 0.25000 0.50000 1.0000 + Mn Mn715 1.0 0.25000 0.29167 0.50000 1.0000 + Mn Mn716 1.0 0.29167 0.33333 0.50000 1.0000 + Mn Mn717 1.0 0.33333 0.37500 0.50000 1.0000 + Mn Mn718 1.0 0.37500 0.41667 0.50000 1.0000 + Mn Mn719 1.0 0.41667 0.45833 0.50000 1.0000 + Mn Mn720 1.0 0.45833 0.50000 0.50000 1.0000 + Mn Mn721 1.0 0.52083 0.52083 0.50000 1.0000 + Mn Mn722 1.0 0.56250 0.56250 0.50000 1.0000 + Mn Mn723 1.0 0.60417 0.60417 0.50000 1.0000 + Mn Mn724 1.0 0.14583 0.14583 0.50000 1.0000 + Mn Mn725 1.0 0.68750 0.68750 0.50000 1.0000 + Mn Mn726 1.0 0.72917 0.72917 0.50000 1.0000 + Mn Mn727 1.0 0.77083 0.77083 0.50000 1.0000 + Mn Mn728 1.0 0.81250 0.81250 0.50000 1.0000 + Mn Mn729 1.0 0.85417 0.85417 0.50000 1.0000 + Mn Mn730 1.0 0.89583 0.89583 0.50000 1.0000 + Mn Mn731 1.0 0.93750 0.93750 0.50000 1.0000 + Mn Mn732 1.0 0.97917 0.97917 0.50000 1.0000 + Mn Mn733 1.0 0.56250 0.47917 0.50000 1.0000 + Mn Mn734 1.0 0.60417 0.52083 0.50000 1.0000 + Mn Mn735 1.0 0.64583 0.56250 0.50000 1.0000 + Mn Mn736 1.0 0.68750 0.60417 0.50000 1.0000 + Mn Mn737 1.0 0.72917 0.64583 0.50000 1.0000 + Mn Mn738 1.0 0.77083 0.68750 0.50000 1.0000 + Mn Mn739 1.0 0.81250 0.72917 0.50000 1.0000 + Mn Mn740 1.0 0.85417 0.77083 0.50000 1.0000 + Mn Mn741 1.0 0.89583 0.81250 0.50000 1.0000 + Mn Mn742 1.0 0.93750 0.85417 0.50000 1.0000 + Mn Mn743 1.0 0.97917 0.89583 0.50000 1.0000 + Mn Mn744 1.0 0.02083 0.93750 0.50000 1.0000 + Mn Mn745 1.0 0.60417 0.43750 0.50000 1.0000 + Mn Mn746 1.0 0.64583 0.47917 0.50000 1.0000 + Mn Mn747 1.0 0.68750 0.52083 0.50000 1.0000 + Mn Mn748 1.0 0.72917 0.56250 0.50000 1.0000 + Mn Mn749 1.0 0.77083 0.60417 0.50000 1.0000 + Mn Mn750 1.0 0.81250 0.64583 0.50000 1.0000 + Mn Mn751 1.0 0.85417 0.68750 0.50000 1.0000 + Mn Mn752 1.0 0.89583 0.72917 0.50000 1.0000 + Mn Mn753 1.0 0.93750 0.77083 0.50000 1.0000 + Mn Mn754 1.0 0.97917 0.81250 0.50000 1.0000 + Mn Mn755 1.0 0.02083 0.85417 0.50000 1.0000 + Mn Mn756 1.0 0.06250 0.89583 0.50000 1.0000 + Mn Mn757 1.0 0.64583 0.39583 0.50000 1.0000 + Mn Mn758 1.0 0.68750 0.43750 0.50000 1.0000 + Mn Mn759 1.0 0.72917 0.47917 0.50000 1.0000 + Mn Mn760 1.0 0.77083 0.52083 0.50000 1.0000 + Mn Mn761 1.0 0.81250 0.56250 0.50000 1.0000 + Mn Mn762 1.0 0.85417 0.60417 0.50000 1.0000 + Mn Mn763 1.0 0.89583 0.64583 0.50000 1.0000 + Mn Mn764 1.0 0.93750 0.68750 0.50000 1.0000 + Mn Mn765 1.0 0.97917 0.72917 0.50000 1.0000 + Mn Mn766 1.0 0.02083 0.77083 0.50000 1.0000 + Mn Mn767 1.0 0.06250 0.81250 0.50000 1.0000 + Mn Mn768 1.0 0.10417 0.85417 0.50000 1.0000 + Mn Mn769 1.0 0.68750 0.35417 0.50000 1.0000 + Mn Mn770 1.0 0.72917 0.39583 0.50000 1.0000 + Mn Mn771 1.0 0.77083 0.43750 0.50000 1.0000 + Mn Mn772 1.0 0.81250 0.47917 0.50000 1.0000 + Mn Mn773 1.0 0.85417 0.52083 0.50000 1.0000 + Mn Mn774 1.0 0.89583 0.56250 0.50000 1.0000 + Mn Mn775 1.0 0.93750 0.60417 0.50000 1.0000 + Mn Mn776 1.0 0.97917 0.64583 0.50000 1.0000 + Mn Mn777 1.0 0.02083 0.68750 0.50000 1.0000 + Mn Mn778 1.0 0.06250 0.72917 0.50000 1.0000 + Mn Mn779 1.0 0.10417 0.77083 0.50000 1.0000 + Mn Mn780 1.0 0.14583 0.81250 0.50000 1.0000 + Mn Mn781 1.0 0.72917 0.31250 0.50000 1.0000 + Mn Mn782 1.0 0.77083 0.35417 0.50000 1.0000 + Mn Mn783 1.0 0.81250 0.39583 0.50000 1.0000 + Mn Mn784 1.0 0.85417 0.43750 0.50000 1.0000 + Mn Mn785 1.0 0.89583 0.47917 0.50000 1.0000 + Mn Mn786 1.0 0.93750 0.52083 0.50000 1.0000 + Mn Mn787 1.0 0.97917 0.56250 0.50000 1.0000 + Mn Mn788 1.0 0.02083 0.60417 0.50000 1.0000 + Mn Mn789 1.0 0.06250 0.64583 0.50000 1.0000 + Mn Mn790 1.0 0.10417 0.68750 0.50000 1.0000 + Mn Mn791 1.0 0.14583 0.72917 0.50000 1.0000 + Mn Mn792 1.0 0.18750 0.77083 0.50000 1.0000 + Mn Mn793 1.0 0.77083 0.27083 0.50000 1.0000 + Mn Mn794 1.0 0.81250 0.31250 0.50000 1.0000 + Mn Mn795 1.0 0.85417 0.35417 0.50000 1.0000 + Mn Mn796 1.0 0.89583 0.39583 0.50000 1.0000 + Mn Mn797 1.0 0.93750 0.43750 0.50000 1.0000 + Mn Mn798 1.0 0.97917 0.47917 0.50000 1.0000 + Mn Mn799 1.0 0.02083 0.52083 0.50000 1.0000 + Mn Mn800 1.0 0.06250 0.56250 0.50000 1.0000 + Mn Mn801 1.0 0.10417 0.60417 0.50000 1.0000 + Mn Mn802 1.0 0.14583 0.64583 0.50000 1.0000 + Mn Mn803 1.0 0.18750 0.68750 0.50000 1.0000 + Mn Mn804 1.0 0.22917 0.72917 0.50000 1.0000 + Mn Mn805 1.0 0.81250 0.22917 0.50000 1.0000 + Mn Mn806 1.0 0.85417 0.27083 0.50000 1.0000 + Mn Mn807 1.0 0.89583 0.31250 0.50000 1.0000 + Mn Mn808 1.0 0.93750 0.35417 0.50000 1.0000 + Mn Mn809 1.0 0.97917 0.39583 0.50000 1.0000 + Mn Mn810 1.0 0.02083 0.43750 0.50000 1.0000 + Mn Mn811 1.0 0.06250 0.47917 0.50000 1.0000 + Mn Mn812 1.0 0.10417 0.52083 0.50000 1.0000 + Mn Mn813 1.0 0.14583 0.56250 0.50000 1.0000 + Mn Mn814 1.0 0.18750 0.60417 0.50000 1.0000 + Mn Mn815 1.0 0.22917 0.64583 0.50000 1.0000 + Mn Mn816 1.0 0.27083 0.68750 0.50000 1.0000 + Mn Mn817 1.0 0.85417 0.18750 0.50000 1.0000 + Mn Mn818 1.0 0.89583 0.22917 0.50000 1.0000 + Mn Mn819 1.0 0.93750 0.27083 0.50000 1.0000 + Mn Mn820 1.0 0.97917 0.31250 0.50000 1.0000 + Mn Mn821 1.0 0.02083 0.35417 0.50000 1.0000 + Mn Mn822 1.0 0.06250 0.39583 0.50000 1.0000 + Mn Mn823 1.0 0.10417 0.43750 0.50000 1.0000 + Mn Mn824 1.0 0.14583 0.47917 0.50000 1.0000 + Mn Mn825 1.0 0.18750 0.52083 0.50000 1.0000 + Mn Mn826 1.0 0.22917 0.56250 0.50000 1.0000 + Mn Mn827 1.0 0.27083 0.60417 0.50000 1.0000 + Mn Mn828 1.0 0.31250 0.64583 0.50000 1.0000 + Mn Mn829 1.0 0.89583 0.14583 0.50000 1.0000 + Mn Mn830 1.0 0.93750 0.18750 0.50000 1.0000 + Mn Mn831 1.0 0.97917 0.22917 0.50000 1.0000 + Mn Mn832 1.0 0.02083 0.27083 0.50000 1.0000 + Mn Mn833 1.0 0.06250 0.31250 0.50000 1.0000 + Mn Mn834 1.0 0.10417 0.35417 0.50000 1.0000 + Mn Mn835 1.0 0.14583 0.39583 0.50000 1.0000 + Mn Mn836 1.0 0.18750 0.43750 0.50000 1.0000 + Mn Mn837 1.0 0.22917 0.47917 0.50000 1.0000 + Mn Mn838 1.0 0.27083 0.52083 0.50000 1.0000 + Mn Mn839 1.0 0.31250 0.56250 0.50000 1.0000 + Mn Mn840 1.0 0.35417 0.60417 0.50000 1.0000 + Mn Mn841 1.0 0.93750 0.10417 0.50000 1.0000 + Mn Mn842 1.0 0.97917 0.14583 0.50000 1.0000 + Mn Mn843 1.0 0.02083 0.18750 0.50000 1.0000 + Mn Mn844 1.0 0.06250 0.22917 0.50000 1.0000 + Mn Mn845 1.0 0.10417 0.27083 0.50000 1.0000 + Mn Mn846 1.0 0.14583 0.31250 0.50000 1.0000 + Mn Mn847 1.0 0.18750 0.35417 0.50000 1.0000 + Mn Mn848 1.0 0.22917 0.39583 0.50000 1.0000 + Mn Mn849 1.0 0.27083 0.43750 0.50000 1.0000 + Mn Mn850 1.0 0.31250 0.47917 0.50000 1.0000 + Mn Mn851 1.0 0.35417 0.52083 0.50000 1.0000 + Mn Mn852 1.0 0.39583 0.56250 0.50000 1.0000 + Mn Mn853 1.0 0.97917 0.06250 0.50000 1.0000 + Mn Mn854 1.0 0.02083 0.10417 0.50000 1.0000 + Mn Mn855 1.0 0.06250 0.14583 0.50000 1.0000 + Mn Mn856 1.0 0.10417 0.18750 0.50000 1.0000 + Mn Mn857 1.0 0.14583 0.22917 0.50000 1.0000 + Mn Mn858 1.0 0.18750 0.27083 0.50000 1.0000 + Mn Mn859 1.0 0.22917 0.31250 0.50000 1.0000 + Mn Mn860 1.0 0.27083 0.35417 0.50000 1.0000 + Mn Mn861 1.0 0.31250 0.39583 0.50000 1.0000 + Mn Mn862 1.0 0.35417 0.43750 0.50000 1.0000 + Mn Mn863 1.0 0.39583 0.47917 0.50000 1.0000 + Mn Mn864 1.0 0.43750 0.52083 0.50000 1.0000 + F F1153 1.0 0.53476 0.47905 0.65539 1.0000 + F F1154 1.0 0.57643 0.52072 0.65539 1.0000 + F F1155 1.0 0.61809 0.56239 0.65539 1.0000 + F F1156 1.0 0.65976 0.60405 0.65539 1.0000 + F F1157 1.0 0.70143 0.64572 0.65539 1.0000 + F F1158 1.0 0.74309 0.68739 0.65539 1.0000 + F F1159 1.0 0.78476 0.72905 0.65539 1.0000 + F F1160 1.0 0.82643 0.77072 0.65539 1.0000 + F F1161 1.0 0.86809 0.81239 0.65539 1.0000 + F F1162 1.0 0.90976 0.85405 0.65539 1.0000 + F F1163 1.0 0.95143 0.89572 0.65539 1.0000 + F F1164 1.0 0.99309 0.93739 0.65539 1.0000 + F F1165 1.0 0.57643 0.43739 0.65539 1.0000 + F F1166 1.0 0.61809 0.47905 0.65539 1.0000 + F F1167 1.0 0.65976 0.52072 0.65539 1.0000 + F F1168 1.0 0.70143 0.56239 0.65539 1.0000 + F F1169 1.0 0.74309 0.60405 0.65539 1.0000 + F F1170 1.0 0.78476 0.64572 0.65539 1.0000 + F F1171 1.0 0.82643 0.68739 0.65539 1.0000 + F F1172 1.0 0.86809 0.72905 0.65539 1.0000 + F F1173 1.0 0.90976 0.77072 0.65539 1.0000 + F F1174 1.0 0.95143 0.81239 0.65539 1.0000 + F F1175 1.0 0.99309 0.85405 0.65539 1.0000 + F F1176 1.0 0.03476 0.89572 0.65539 1.0000 + F F1177 1.0 0.61809 0.39572 0.65539 1.0000 + F F1178 1.0 0.65976 0.43739 0.65539 1.0000 + F F1179 1.0 0.70143 0.47905 0.65539 1.0000 + F F1180 1.0 0.74309 0.52072 0.65539 1.0000 + F F1181 1.0 0.78476 0.56239 0.65539 1.0000 + F F1182 1.0 0.82643 0.60405 0.65539 1.0000 + F F1183 1.0 0.86809 0.64572 0.65539 1.0000 + F F1184 1.0 0.90976 0.68739 0.65539 1.0000 + F F1185 1.0 0.95143 0.72905 0.65539 1.0000 + F F1186 1.0 0.99309 0.77072 0.65539 1.0000 + F F1187 1.0 0.03476 0.81239 0.65539 1.0000 + F F1188 1.0 0.07643 0.85405 0.65539 1.0000 + F F1189 1.0 0.65976 0.35405 0.65539 1.0000 + F F1190 1.0 0.70143 0.39572 0.65539 1.0000 + F F1191 1.0 0.74309 0.43739 0.65539 1.0000 + F F1192 1.0 0.78476 0.47905 0.65539 1.0000 + F F1193 1.0 0.82643 0.52072 0.65539 1.0000 + F F1194 1.0 0.86809 0.56239 0.65539 1.0000 + F F1195 1.0 0.90976 0.60405 0.65539 1.0000 + F F1196 1.0 0.95143 0.64572 0.65539 1.0000 + F F1197 1.0 0.99309 0.68739 0.65539 1.0000 + F F1198 1.0 0.03476 0.72905 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0.34461 1.0000 + F F2198 1.0 0.71524 0.43761 0.34461 1.0000 + F F2199 1.0 0.75691 0.47928 0.34461 1.0000 + F F2200 1.0 0.79857 0.52095 0.34461 1.0000 + F F2201 1.0 0.84024 0.56261 0.34461 1.0000 + F F2202 1.0 0.88191 0.60428 0.34461 1.0000 + F F2203 1.0 0.92357 0.64595 0.34461 1.0000 + F F2204 1.0 0.96524 0.68761 0.34461 1.0000 + F F2205 1.0 0.00691 0.72928 0.34461 1.0000 + F F2206 1.0 0.04857 0.77095 0.34461 1.0000 + F F2207 1.0 0.09024 0.81261 0.34461 1.0000 + F F2208 1.0 0.13191 0.85428 0.34461 1.0000 + F F2209 1.0 0.71524 0.35428 0.34461 1.0000 + F F2210 1.0 0.75691 0.39595 0.34461 1.0000 + F F2211 1.0 0.79857 0.43761 0.34461 1.0000 + F F2212 1.0 0.84024 0.47928 0.34461 1.0000 + F F2213 1.0 0.88191 0.52095 0.34461 1.0000 + F F2214 1.0 0.92357 0.56261 0.34461 1.0000 + F F2215 1.0 0.96524 0.60428 0.34461 1.0000 + F F2216 1.0 0.00691 0.64595 0.34461 1.0000 + F F2217 1.0 0.04857 0.68761 0.34461 1.0000 + F F2218 1.0 0.09024 0.72928 0.34461 1.0000 + F F2219 1.0 0.13191 0.77095 0.34461 1.0000 + F F2220 1.0 0.17357 0.81261 0.34461 1.0000 + F F2221 1.0 0.75691 0.31261 0.34461 1.0000 + F F2222 1.0 0.79857 0.35428 0.34461 1.0000 + F F2223 1.0 0.84024 0.39595 0.34461 1.0000 + F F2224 1.0 0.88191 0.43761 0.34461 1.0000 + F F2225 1.0 0.92357 0.47928 0.34461 1.0000 + F F2226 1.0 0.96524 0.52095 0.34461 1.0000 + F F2227 1.0 0.00691 0.56261 0.34461 1.0000 + F F2228 1.0 0.04857 0.60428 0.34461 1.0000 + F F2229 1.0 0.09024 0.64595 0.34461 1.0000 + F F2230 1.0 0.13191 0.68761 0.34461 1.0000 + F F2231 1.0 0.17357 0.72928 0.34461 1.0000 + F F2232 1.0 0.21524 0.77095 0.34461 1.0000 + F F2233 1.0 0.79857 0.27095 0.34461 1.0000 + F F2234 1.0 0.84024 0.31261 0.34461 1.0000 + F F2235 1.0 0.88191 0.35428 0.34461 1.0000 + F F2236 1.0 0.92357 0.39595 0.34461 1.0000 + F F2237 1.0 0.96524 0.43761 0.34461 1.0000 + F F2238 1.0 0.00691 0.47928 0.34461 1.0000 + F F2239 1.0 0.04857 0.52095 0.34461 1.0000 + F F2240 1.0 0.09024 0.56261 0.34461 1.0000 + F F2241 1.0 0.13191 0.60428 0.34461 1.0000 + F F2242 1.0 0.17357 0.64595 0.34461 1.0000 + F F2243 1.0 0.21524 0.68761 0.34461 1.0000 + F F2244 1.0 0.25691 0.72928 0.34461 1.0000 + F F2245 1.0 0.84024 0.22928 0.34461 1.0000 + F F2246 1.0 0.88191 0.27095 0.34461 1.0000 + F F2247 1.0 0.92357 0.31261 0.34461 1.0000 + F F2248 1.0 0.96524 0.35428 0.34461 1.0000 + F F2249 1.0 0.00691 0.39595 0.34461 1.0000 + F F2250 1.0 0.04857 0.43761 0.34461 1.0000 + F F2251 1.0 0.09024 0.47928 0.34461 1.0000 + F F2252 1.0 0.13191 0.52095 0.34461 1.0000 + F F2253 1.0 0.17357 0.56261 0.34461 1.0000 + F F2254 1.0 0.21524 0.60428 0.34461 1.0000 + F F2255 1.0 0.25691 0.64595 0.34461 1.0000 + F F2256 1.0 0.29857 0.68761 0.34461 1.0000 + F F2257 1.0 0.88191 0.18761 0.34461 1.0000 + F F2258 1.0 0.92357 0.22928 0.34461 1.0000 + F F2259 1.0 0.96524 0.27095 0.34461 1.0000 + F F2260 1.0 0.00691 0.31261 0.34461 1.0000 + F F2261 1.0 0.04857 0.35428 0.34461 1.0000 + F F2262 1.0 0.09024 0.39595 0.34461 1.0000 + F F2263 1.0 0.13191 0.43761 0.34461 1.0000 + F F2264 1.0 0.17357 0.47928 0.34461 1.0000 + F F2265 1.0 0.21524 0.52095 0.34461 1.0000 + F F2266 1.0 0.25691 0.56261 0.34461 1.0000 + F F2267 1.0 0.29857 0.60428 0.34461 1.0000 + F F2268 1.0 0.34024 0.64595 0.34461 1.0000 + F F2269 1.0 0.92357 0.14595 0.34461 1.0000 + F F2270 1.0 0.96524 0.18761 0.34461 1.0000 + F F2271 1.0 0.00691 0.22928 0.34461 1.0000 + F F2272 1.0 0.04857 0.27095 0.34461 1.0000 + F F2273 1.0 0.09024 0.31261 0.34461 1.0000 + F F2274 1.0 0.13191 0.35428 0.34461 1.0000 + F F2275 1.0 0.17357 0.39595 0.34461 1.0000 + F F2276 1.0 0.21524 0.43761 0.34461 1.0000 + F F2277 1.0 0.25691 0.47928 0.34461 1.0000 + F F2278 1.0 0.29857 0.52095 0.34461 1.0000 + F F2279 1.0 0.34024 0.56261 0.34461 1.0000 + F F2280 1.0 0.38191 0.60428 0.34461 1.0000 + F F2281 1.0 0.96524 0.10428 0.34461 1.0000 + F F2282 1.0 0.00691 0.14595 0.34461 1.0000 + F F2283 1.0 0.04857 0.18761 0.34461 1.0000 + F F2284 1.0 0.09024 0.22928 0.34461 1.0000 + F F2285 1.0 0.13191 0.27095 0.34461 1.0000 + F F2286 1.0 0.17357 0.31261 0.34461 1.0000 + F F2287 1.0 0.21524 0.35428 0.34461 1.0000 + F F2288 1.0 0.25691 0.39595 0.34461 1.0000 + F F2289 1.0 0.29857 0.43761 0.34461 1.0000 + F F2290 1.0 0.34024 0.47928 0.34461 1.0000 + F F2291 1.0 0.38191 0.52095 0.34461 1.0000 + F F2292 1.0 0.42357 0.56261 0.34461 1.0000 + F F2293 1.0 0.00691 0.06261 0.34461 1.0000 + F F2294 1.0 0.04857 0.10428 0.34461 1.0000 + F F2295 1.0 0.09024 0.14595 0.34461 1.0000 + F F2296 1.0 0.13191 0.18761 0.34461 1.0000 + F F2297 1.0 0.17357 0.22928 0.34461 1.0000 + F F2298 1.0 0.21524 0.27095 0.34461 1.0000 + F F2299 1.0 0.25691 0.31261 0.34461 1.0000 + F F2300 1.0 0.29857 0.35428 0.34461 1.0000 + F F2301 1.0 0.34024 0.39595 0.34461 1.0000 + F F2302 1.0 0.38191 0.43761 0.34461 1.0000 + F F2303 1.0 0.42357 0.47928 0.34461 1.0000 + F F2304 1.0 0.46524 0.52095 0.34461 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-5164_supercell_12x12x1.cif b/tier3/cif_file/orthogonal_2dm-5164_supercell_12x12x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..1e2eeb8dc30c4d19b1ce464d1a4a2bf9908e6bb6 --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-5164_supercell_12x12x1.cif @@ -0,0 +1,3481 @@ +data_image0 +_chemical_formula_structural Mn432V144O1152Mn432V144O1152 +_chemical_formula_sum "Mn864 V288 O2304" +_cell_length_a 121.445 +_cell_length_b 70.4948 +_cell_length_c 5.93534 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Mn Mn1 1.0 0.02083 0.97917 0.50000 1.0000 + Mn Mn2 1.0 0.06250 0.02083 0.50000 1.0000 + Mn Mn3 1.0 0.10417 0.06250 0.50000 1.0000 + Mn Mn4 1.0 0.14583 0.10417 0.50000 1.0000 + Mn Mn5 1.0 0.18750 0.14583 0.50000 1.0000 + Mn Mn6 1.0 0.22917 0.18750 0.50000 1.0000 + Mn Mn7 1.0 0.27083 0.22917 0.50000 1.0000 + Mn Mn8 1.0 0.31250 0.27083 0.50000 1.0000 + Mn Mn9 1.0 0.35417 0.31250 0.50000 1.0000 + Mn Mn10 1.0 0.39583 0.35417 0.50000 1.0000 + Mn Mn11 1.0 0.43750 0.39583 0.50000 1.0000 + Mn Mn12 1.0 0.47917 0.43750 0.50000 1.0000 + Mn Mn13 1.0 0.06250 0.93750 0.50000 1.0000 + Mn Mn14 1.0 0.10417 0.97917 0.50000 1.0000 + Mn Mn15 1.0 0.14583 0.02083 0.50000 1.0000 + Mn Mn16 1.0 0.18750 0.06250 0.50000 1.0000 + Mn Mn17 1.0 0.22917 0.10417 0.50000 1.0000 + Mn Mn18 1.0 0.27083 0.14583 0.50000 1.0000 + Mn Mn19 1.0 0.31250 0.18750 0.50000 1.0000 + Mn Mn20 1.0 0.35417 0.22917 0.50000 1.0000 + Mn Mn21 1.0 0.39583 0.27083 0.50000 1.0000 + Mn Mn22 1.0 0.43750 0.31250 0.50000 1.0000 + Mn Mn23 1.0 0.47917 0.35417 0.50000 1.0000 + Mn Mn24 1.0 0.52083 0.39583 0.50000 1.0000 + Mn Mn25 1.0 0.10417 0.89583 0.50000 1.0000 + Mn Mn26 1.0 0.14583 0.93750 0.50000 1.0000 + Mn Mn27 1.0 0.18750 0.97917 0.50000 1.0000 + Mn Mn28 1.0 0.22917 0.02083 0.50000 1.0000 + Mn Mn29 1.0 0.27083 0.06250 0.50000 1.0000 + Mn Mn30 1.0 0.31250 0.10417 0.50000 1.0000 + Mn Mn31 1.0 0.35417 0.14583 0.50000 1.0000 + Mn Mn32 1.0 0.39583 0.18750 0.50000 1.0000 + Mn Mn33 1.0 0.43750 0.22917 0.50000 1.0000 + Mn Mn34 1.0 0.47917 0.27083 0.50000 1.0000 + Mn Mn35 1.0 0.52083 0.31250 0.50000 1.0000 + Mn Mn36 1.0 0.56250 0.35417 0.50000 1.0000 + Mn Mn37 1.0 0.14583 0.85417 0.50000 1.0000 + Mn Mn38 1.0 0.18750 0.89583 0.50000 1.0000 + Mn Mn39 1.0 0.22917 0.93750 0.50000 1.0000 + Mn Mn40 1.0 0.27083 0.97917 0.50000 1.0000 + Mn Mn41 1.0 0.31250 0.02083 0.50000 1.0000 + Mn Mn42 1.0 0.35417 0.06250 0.50000 1.0000 + Mn Mn43 1.0 0.39583 0.10417 0.50000 1.0000 + Mn Mn44 1.0 0.43750 0.14583 0.50000 1.0000 + Mn Mn45 1.0 0.47917 0.18750 0.50000 1.0000 + Mn Mn46 1.0 0.52083 0.22917 0.50000 1.0000 + Mn Mn47 1.0 0.56250 0.27083 0.50000 1.0000 + Mn Mn48 1.0 0.60417 0.31250 0.50000 1.0000 + Mn Mn49 1.0 0.18750 0.81250 0.50000 1.0000 + Mn Mn50 1.0 0.22917 0.85417 0.50000 1.0000 + Mn Mn51 1.0 0.27083 0.89583 0.50000 1.0000 + Mn Mn52 1.0 0.31250 0.93750 0.50000 1.0000 + Mn Mn53 1.0 0.35417 0.97917 0.50000 1.0000 + Mn Mn54 1.0 0.39583 0.02083 0.50000 1.0000 + Mn Mn55 1.0 0.43750 0.06250 0.50000 1.0000 + Mn Mn56 1.0 0.47917 0.10417 0.50000 1.0000 + Mn Mn57 1.0 0.52083 0.14583 0.50000 1.0000 + Mn Mn58 1.0 0.56250 0.18750 0.50000 1.0000 + Mn Mn59 1.0 0.60417 0.22917 0.50000 1.0000 + Mn Mn60 1.0 0.64583 0.27083 0.50000 1.0000 + Mn Mn61 1.0 0.22917 0.77083 0.50000 1.0000 + Mn Mn62 1.0 0.27083 0.81250 0.50000 1.0000 + Mn Mn63 1.0 0.31250 0.85417 0.50000 1.0000 + Mn Mn64 1.0 0.35417 0.89583 0.50000 1.0000 + Mn Mn65 1.0 0.39583 0.93750 0.50000 1.0000 + Mn Mn66 1.0 0.43750 0.97917 0.50000 1.0000 + Mn Mn67 1.0 0.47917 0.02083 0.50000 1.0000 + Mn Mn68 1.0 0.52083 0.06250 0.50000 1.0000 + Mn Mn69 1.0 0.56250 0.10417 0.50000 1.0000 + Mn Mn70 1.0 0.60417 0.14583 0.50000 1.0000 + Mn Mn71 1.0 0.64583 0.18750 0.50000 1.0000 + Mn Mn72 1.0 0.68750 0.22917 0.50000 1.0000 + Mn Mn73 1.0 0.27083 0.72917 0.50000 1.0000 + Mn Mn74 1.0 0.31250 0.77083 0.50000 1.0000 + Mn Mn75 1.0 0.35417 0.81250 0.50000 1.0000 + Mn Mn76 1.0 0.39583 0.85417 0.50000 1.0000 + Mn Mn77 1.0 0.43750 0.89583 0.50000 1.0000 + Mn Mn78 1.0 0.47917 0.93750 0.50000 1.0000 + Mn Mn79 1.0 0.52083 0.97917 0.50000 1.0000 + Mn Mn80 1.0 0.56250 0.02083 0.50000 1.0000 + Mn Mn81 1.0 0.60417 0.06250 0.50000 1.0000 + Mn Mn82 1.0 0.64583 0.10417 0.50000 1.0000 + Mn Mn83 1.0 0.68750 0.14583 0.50000 1.0000 + Mn Mn84 1.0 0.72917 0.18750 0.50000 1.0000 + Mn Mn85 1.0 0.31250 0.68750 0.50000 1.0000 + Mn Mn86 1.0 0.35417 0.72917 0.50000 1.0000 + Mn Mn87 1.0 0.39583 0.77083 0.50000 1.0000 + Mn Mn88 1.0 0.43750 0.81250 0.50000 1.0000 + Mn Mn89 1.0 0.47917 0.85417 0.50000 1.0000 + Mn Mn90 1.0 0.52083 0.89583 0.50000 1.0000 + Mn Mn91 1.0 0.56250 0.93750 0.50000 1.0000 + Mn Mn92 1.0 0.60417 0.97917 0.50000 1.0000 + Mn Mn93 1.0 0.64583 0.02083 0.50000 1.0000 + Mn Mn94 1.0 0.68750 0.06250 0.50000 1.0000 + Mn Mn95 1.0 0.72917 0.10417 0.50000 1.0000 + Mn Mn96 1.0 0.77083 0.14583 0.50000 1.0000 + Mn Mn97 1.0 0.35417 0.64583 0.50000 1.0000 + Mn Mn98 1.0 0.39583 0.68750 0.50000 1.0000 + Mn Mn99 1.0 0.43750 0.72917 0.50000 1.0000 + Mn Mn100 1.0 0.47917 0.77083 0.50000 1.0000 + Mn Mn101 1.0 0.52083 0.81250 0.50000 1.0000 + Mn Mn102 1.0 0.56250 0.85417 0.50000 1.0000 + Mn Mn103 1.0 0.60417 0.89583 0.50000 1.0000 + Mn Mn104 1.0 0.64583 0.93750 0.50000 1.0000 + Mn Mn105 1.0 0.68750 0.97917 0.50000 1.0000 + Mn Mn106 1.0 0.72917 0.02083 0.50000 1.0000 + Mn Mn107 1.0 0.77083 0.06250 0.50000 1.0000 + Mn Mn108 1.0 0.81250 0.10417 0.50000 1.0000 + Mn Mn109 1.0 0.39583 0.60417 0.50000 1.0000 + Mn Mn110 1.0 0.43750 0.64583 0.50000 1.0000 + Mn Mn111 1.0 0.47917 0.68750 0.50000 1.0000 + Mn Mn112 1.0 0.52083 0.72917 0.50000 1.0000 + Mn Mn113 1.0 0.56250 0.77083 0.50000 1.0000 + Mn Mn114 1.0 0.60417 0.81250 0.50000 1.0000 + Mn Mn115 1.0 0.64583 0.85417 0.50000 1.0000 + Mn Mn116 1.0 0.68750 0.89583 0.50000 1.0000 + Mn Mn117 1.0 0.72917 0.93750 0.50000 1.0000 + Mn Mn118 1.0 0.77083 0.97917 0.50000 1.0000 + Mn Mn119 1.0 0.81250 0.02083 0.50000 1.0000 + Mn Mn120 1.0 0.85417 0.06250 0.50000 1.0000 + Mn Mn121 1.0 0.43750 0.56250 0.50000 1.0000 + Mn Mn122 1.0 0.47917 0.60417 0.50000 1.0000 + Mn Mn123 1.0 0.52083 0.64583 0.50000 1.0000 + Mn Mn124 1.0 0.56250 0.68750 0.50000 1.0000 + Mn Mn125 1.0 0.60417 0.72917 0.50000 1.0000 + Mn Mn126 1.0 0.64583 0.77083 0.50000 1.0000 + Mn Mn127 1.0 0.68750 0.81250 0.50000 1.0000 + Mn Mn128 1.0 0.72917 0.85417 0.50000 1.0000 + Mn Mn129 1.0 0.77083 0.89583 0.50000 1.0000 + Mn Mn130 1.0 0.81250 0.93750 0.50000 1.0000 + Mn Mn131 1.0 0.85417 0.97917 0.50000 1.0000 + Mn Mn132 1.0 0.89583 0.02083 0.50000 1.0000 + Mn Mn133 1.0 0.47917 0.52083 0.50000 1.0000 + Mn Mn134 1.0 0.52083 0.56250 0.50000 1.0000 + Mn Mn135 1.0 0.56250 0.60417 0.50000 1.0000 + Mn Mn136 1.0 0.60417 0.64583 0.50000 1.0000 + Mn Mn137 1.0 0.64583 0.68750 0.50000 1.0000 + Mn Mn138 1.0 0.68750 0.72917 0.50000 1.0000 + Mn Mn139 1.0 0.72917 0.77083 0.50000 1.0000 + Mn Mn140 1.0 0.77083 0.81250 0.50000 1.0000 + Mn Mn141 1.0 0.81250 0.85417 0.50000 1.0000 + Mn Mn142 1.0 0.85417 0.89583 0.50000 1.0000 + Mn Mn143 1.0 0.89583 0.93750 0.50000 1.0000 + Mn Mn144 1.0 0.93750 0.97917 0.50000 1.0000 + Mn Mn145 1.0 0.04167 0.00000 0.50000 1.0000 + Mn Mn146 1.0 0.08333 0.04167 0.50000 1.0000 + Mn Mn147 1.0 0.12500 0.08333 0.50000 1.0000 + Mn Mn148 1.0 0.16667 0.12500 0.50000 1.0000 + Mn Mn149 1.0 0.20833 0.16667 0.50000 1.0000 + Mn Mn150 1.0 0.25000 0.20833 0.50000 1.0000 + Mn Mn151 1.0 0.29167 0.25000 0.50000 1.0000 + Mn Mn152 1.0 0.33333 0.29167 0.50000 1.0000 + Mn Mn153 1.0 0.37500 0.33333 0.50000 1.0000 + Mn Mn154 1.0 0.41667 0.37500 0.50000 1.0000 + Mn Mn155 1.0 0.45833 0.41667 0.50000 1.0000 + Mn Mn156 1.0 0.50000 0.45833 0.50000 1.0000 + Mn Mn157 1.0 0.08333 0.95833 0.50000 1.0000 + Mn Mn158 1.0 0.12500 0.00000 0.50000 1.0000 + Mn Mn159 1.0 0.16667 0.04167 0.50000 1.0000 + Mn Mn160 1.0 0.20833 0.08333 0.50000 1.0000 + Mn Mn161 1.0 0.25000 0.12500 0.50000 1.0000 + Mn Mn162 1.0 0.29167 0.16667 0.50000 1.0000 + Mn Mn163 1.0 0.33333 0.20833 0.50000 1.0000 + Mn Mn164 1.0 0.37500 0.25000 0.50000 1.0000 + Mn Mn165 1.0 0.41667 0.29167 0.50000 1.0000 + Mn Mn166 1.0 0.45833 0.33333 0.50000 1.0000 + Mn Mn167 1.0 0.50000 0.37500 0.50000 1.0000 + Mn Mn168 1.0 0.54167 0.41667 0.50000 1.0000 + Mn Mn169 1.0 0.12500 0.91667 0.50000 1.0000 + Mn Mn170 1.0 0.16667 0.95833 0.50000 1.0000 + Mn Mn171 1.0 0.20833 0.00000 0.50000 1.0000 + Mn Mn172 1.0 0.25000 0.04167 0.50000 1.0000 + Mn Mn173 1.0 0.29167 0.08333 0.50000 1.0000 + Mn Mn174 1.0 0.33333 0.12500 0.50000 1.0000 + Mn Mn175 1.0 0.37500 0.16667 0.50000 1.0000 + Mn Mn176 1.0 0.41667 0.20833 0.50000 1.0000 + Mn Mn177 1.0 0.45833 0.25000 0.50000 1.0000 + Mn Mn178 1.0 0.50000 0.29167 0.50000 1.0000 + Mn Mn179 1.0 0.54167 0.33333 0.50000 1.0000 + Mn Mn180 1.0 0.58333 0.37500 0.50000 1.0000 + Mn Mn181 1.0 0.16667 0.87500 0.50000 1.0000 + Mn Mn182 1.0 0.20833 0.91667 0.50000 1.0000 + Mn Mn183 1.0 0.25000 0.95833 0.50000 1.0000 + Mn Mn184 1.0 0.29167 0.00000 0.50000 1.0000 + Mn Mn185 1.0 0.33333 0.04167 0.50000 1.0000 + Mn Mn186 1.0 0.37500 0.08333 0.50000 1.0000 + Mn Mn187 1.0 0.41667 0.12500 0.50000 1.0000 + Mn Mn188 1.0 0.45833 0.16667 0.50000 1.0000 + Mn Mn189 1.0 0.50000 0.20833 0.50000 1.0000 + Mn Mn190 1.0 0.54167 0.25000 0.50000 1.0000 + Mn Mn191 1.0 0.58333 0.29167 0.50000 1.0000 + Mn Mn192 1.0 0.62500 0.33333 0.50000 1.0000 + Mn Mn193 1.0 0.20833 0.83333 0.50000 1.0000 + Mn Mn194 1.0 0.25000 0.87500 0.50000 1.0000 + Mn Mn195 1.0 0.29167 0.91667 0.50000 1.0000 + Mn Mn196 1.0 0.33333 0.95833 0.50000 1.0000 + Mn Mn197 1.0 0.37500 0.00000 0.50000 1.0000 + Mn Mn198 1.0 0.41667 0.04167 0.50000 1.0000 + Mn Mn199 1.0 0.45833 0.08333 0.50000 1.0000 + Mn Mn200 1.0 0.50000 0.12500 0.50000 1.0000 + Mn Mn201 1.0 0.54167 0.16667 0.50000 1.0000 + Mn Mn202 1.0 0.58333 0.20833 0.50000 1.0000 + Mn Mn203 1.0 0.62500 0.25000 0.50000 1.0000 + Mn Mn204 1.0 0.66667 0.29167 0.50000 1.0000 + Mn Mn205 1.0 0.25000 0.79167 0.50000 1.0000 + Mn Mn206 1.0 0.29167 0.83333 0.50000 1.0000 + Mn Mn207 1.0 0.33333 0.87500 0.50000 1.0000 + Mn Mn208 1.0 0.37500 0.91667 0.50000 1.0000 + Mn Mn209 1.0 0.41667 0.95833 0.50000 1.0000 + Mn Mn210 1.0 0.45833 0.00000 0.50000 1.0000 + Mn Mn211 1.0 0.50000 0.04167 0.50000 1.0000 + Mn Mn212 1.0 0.54167 0.08333 0.50000 1.0000 + Mn Mn213 1.0 0.58333 0.12500 0.50000 1.0000 + Mn Mn214 1.0 0.62500 0.16667 0.50000 1.0000 + Mn Mn215 1.0 0.66667 0.20833 0.50000 1.0000 + Mn Mn216 1.0 0.70833 0.25000 0.50000 1.0000 + Mn Mn217 1.0 0.29167 0.75000 0.50000 1.0000 + Mn Mn218 1.0 0.33333 0.79167 0.50000 1.0000 + Mn Mn219 1.0 0.37500 0.83333 0.50000 1.0000 + Mn Mn220 1.0 0.41667 0.87500 0.50000 1.0000 + Mn Mn221 1.0 0.45833 0.91667 0.50000 1.0000 + Mn Mn222 1.0 0.50000 0.95833 0.50000 1.0000 + Mn Mn223 1.0 0.54167 0.00000 0.50000 1.0000 + Mn Mn224 1.0 0.58333 0.04167 0.50000 1.0000 + Mn Mn225 1.0 0.62500 0.08333 0.50000 1.0000 + Mn Mn226 1.0 0.66667 0.12500 0.50000 1.0000 + Mn Mn227 1.0 0.70833 0.16667 0.50000 1.0000 + Mn Mn228 1.0 0.75000 0.20833 0.50000 1.0000 + Mn Mn229 1.0 0.33333 0.70833 0.50000 1.0000 + Mn Mn230 1.0 0.37500 0.75000 0.50000 1.0000 + Mn Mn231 1.0 0.41667 0.79167 0.50000 1.0000 + Mn Mn232 1.0 0.45833 0.83333 0.50000 1.0000 + Mn Mn233 1.0 0.50000 0.87500 0.50000 1.0000 + Mn Mn234 1.0 0.54167 0.91667 0.50000 1.0000 + Mn Mn235 1.0 0.58333 0.95833 0.50000 1.0000 + Mn Mn236 1.0 0.62500 0.00000 0.50000 1.0000 + Mn Mn237 1.0 0.66667 0.04167 0.50000 1.0000 + Mn Mn238 1.0 0.70833 0.08333 0.50000 1.0000 + Mn Mn239 1.0 0.75000 0.12500 0.50000 1.0000 + Mn Mn240 1.0 0.79167 0.16667 0.50000 1.0000 + Mn Mn241 1.0 0.37500 0.66667 0.50000 1.0000 + Mn Mn242 1.0 0.41667 0.70833 0.50000 1.0000 + Mn Mn243 1.0 0.45833 0.75000 0.50000 1.0000 + Mn Mn244 1.0 0.50000 0.79167 0.50000 1.0000 + Mn Mn245 1.0 0.54167 0.83333 0.50000 1.0000 + Mn Mn246 1.0 0.58333 0.87500 0.50000 1.0000 + Mn Mn247 1.0 0.62500 0.91667 0.50000 1.0000 + Mn Mn248 1.0 0.66667 0.95833 0.50000 1.0000 + Mn Mn249 1.0 0.70833 1.00000 0.50000 1.0000 + Mn Mn250 1.0 0.75000 0.04167 0.50000 1.0000 + Mn Mn251 1.0 0.79167 0.08333 0.50000 1.0000 + Mn Mn252 1.0 0.83333 0.12500 0.50000 1.0000 + Mn Mn253 1.0 0.41667 0.62500 0.50000 1.0000 + Mn Mn254 1.0 0.45833 0.66667 0.50000 1.0000 + Mn Mn255 1.0 0.50000 0.70833 0.50000 1.0000 + Mn Mn256 1.0 0.54167 0.75000 0.50000 1.0000 + Mn Mn257 1.0 0.58333 0.79167 0.50000 1.0000 + Mn Mn258 1.0 0.62500 0.83333 0.50000 1.0000 + Mn Mn259 1.0 0.66667 0.87500 0.50000 1.0000 + Mn Mn260 1.0 0.70833 0.91667 0.50000 1.0000 + Mn Mn261 1.0 0.75000 0.95833 0.50000 1.0000 + Mn Mn262 1.0 0.79167 0.00000 0.50000 1.0000 + Mn Mn263 1.0 0.83333 0.04167 0.50000 1.0000 + Mn Mn264 1.0 0.87500 0.08333 0.50000 1.0000 + Mn Mn265 1.0 0.45833 0.58333 0.50000 1.0000 + Mn Mn266 1.0 0.50000 0.62500 0.50000 1.0000 + Mn Mn267 1.0 0.54167 0.66667 0.50000 1.0000 + Mn Mn268 1.0 0.58333 0.70833 0.50000 1.0000 + Mn Mn269 1.0 0.62500 0.75000 0.50000 1.0000 + Mn Mn270 1.0 0.66667 0.79167 0.50000 1.0000 + Mn Mn271 1.0 0.70833 0.83333 0.50000 1.0000 + Mn Mn272 1.0 0.75000 0.87500 0.50000 1.0000 + Mn Mn273 1.0 0.79167 0.91667 0.50000 1.0000 + Mn Mn274 1.0 0.83333 0.95833 0.50000 1.0000 + Mn Mn275 1.0 0.87500 0.00000 0.50000 1.0000 + Mn Mn276 1.0 0.91667 0.04167 0.50000 1.0000 + Mn Mn277 1.0 0.50000 0.54167 0.50000 1.0000 + Mn Mn278 1.0 0.54167 0.58333 0.50000 1.0000 + Mn Mn279 1.0 0.58333 0.62500 0.50000 1.0000 + Mn Mn280 1.0 0.62500 0.66667 0.50000 1.0000 + Mn Mn281 1.0 0.66667 0.70833 0.50000 1.0000 + Mn Mn282 1.0 0.70833 0.75000 0.50000 1.0000 + Mn Mn283 1.0 0.75000 0.79167 0.50000 1.0000 + Mn Mn284 1.0 0.79167 0.83333 0.50000 1.0000 + Mn Mn285 1.0 0.83333 0.87500 0.50000 1.0000 + Mn Mn286 1.0 0.87500 0.91667 0.50000 1.0000 + Mn Mn287 1.0 0.91667 0.95833 0.50000 1.0000 + Mn Mn288 1.0 0.95833 0.00000 0.50000 1.0000 + Mn Mn289 1.0 0.02083 0.02083 0.50000 1.0000 + Mn Mn290 1.0 0.06250 0.06250 0.50000 1.0000 + Mn Mn291 1.0 0.60417 0.60417 0.50000 1.0000 + Mn Mn292 1.0 0.14583 0.14583 0.50000 1.0000 + Mn Mn293 1.0 0.68750 0.68750 0.50000 1.0000 + Mn Mn294 1.0 0.22917 0.22917 0.50000 1.0000 + Mn Mn295 1.0 0.27083 0.27083 0.50000 1.0000 + Mn Mn296 1.0 0.31250 0.31250 0.50000 1.0000 + Mn Mn297 1.0 0.35417 0.35417 0.50000 1.0000 + Mn Mn298 1.0 0.39583 0.39583 0.50000 1.0000 + Mn Mn299 1.0 0.43750 0.43750 0.50000 1.0000 + Mn Mn300 1.0 0.47917 0.47917 0.50000 1.0000 + Mn Mn301 1.0 0.06250 0.97917 0.50000 1.0000 + Mn Mn302 1.0 0.10417 0.02083 0.50000 1.0000 + Mn Mn303 1.0 0.14583 0.06250 0.50000 1.0000 + Mn Mn304 1.0 0.18750 0.10417 0.50000 1.0000 + Mn Mn305 1.0 0.22917 0.14583 0.50000 1.0000 + Mn Mn306 1.0 0.27083 0.18750 0.50000 1.0000 + Mn Mn307 1.0 0.31250 0.22917 0.50000 1.0000 + Mn Mn308 1.0 0.35417 0.27083 0.50000 1.0000 + Mn Mn309 1.0 0.39583 0.31250 0.50000 1.0000 + Mn Mn310 1.0 0.43750 0.35417 0.50000 1.0000 + Mn Mn311 1.0 0.47917 0.39583 0.50000 1.0000 + Mn Mn312 1.0 0.52083 0.43750 0.50000 1.0000 + Mn Mn313 1.0 0.10417 0.93750 0.50000 1.0000 + Mn Mn314 1.0 0.14583 0.97917 0.50000 1.0000 + Mn Mn315 1.0 0.18750 0.02083 0.50000 1.0000 + Mn Mn316 1.0 0.22917 0.06250 0.50000 1.0000 + Mn Mn317 1.0 0.27083 0.10417 0.50000 1.0000 + Mn Mn318 1.0 0.31250 0.14583 0.50000 1.0000 + Mn Mn319 1.0 0.35417 0.18750 0.50000 1.0000 + Mn Mn320 1.0 0.39583 0.22917 0.50000 1.0000 + Mn Mn321 1.0 0.43750 0.27083 0.50000 1.0000 + Mn Mn322 1.0 0.47917 0.31250 0.50000 1.0000 + Mn Mn323 1.0 0.52083 0.35417 0.50000 1.0000 + Mn Mn324 1.0 0.56250 0.39583 0.50000 1.0000 + Mn Mn325 1.0 0.14583 0.89583 0.50000 1.0000 + Mn Mn326 1.0 0.18750 0.93750 0.50000 1.0000 + Mn Mn327 1.0 0.22917 0.97917 0.50000 1.0000 + Mn Mn328 1.0 0.27083 0.02083 0.50000 1.0000 + Mn Mn329 1.0 0.31250 0.06250 0.50000 1.0000 + Mn Mn330 1.0 0.35417 0.10417 0.50000 1.0000 + Mn Mn331 1.0 0.39583 0.14583 0.50000 1.0000 + Mn Mn332 1.0 0.43750 0.18750 0.50000 1.0000 + Mn Mn333 1.0 0.47917 0.22917 0.50000 1.0000 + Mn Mn334 1.0 0.52083 0.27083 0.50000 1.0000 + Mn Mn335 1.0 0.56250 0.31250 0.50000 1.0000 + Mn Mn336 1.0 0.60417 0.35417 0.50000 1.0000 + Mn Mn337 1.0 0.18750 0.85417 0.50000 1.0000 + Mn Mn338 1.0 0.22917 0.89583 0.50000 1.0000 + Mn Mn339 1.0 0.27083 0.93750 0.50000 1.0000 + Mn Mn340 1.0 0.31250 0.97917 0.50000 1.0000 + Mn Mn341 1.0 0.35417 0.02083 0.50000 1.0000 + Mn Mn342 1.0 0.39583 0.06250 0.50000 1.0000 + Mn Mn343 1.0 0.43750 0.10417 0.50000 1.0000 + Mn Mn344 1.0 0.47917 0.14583 0.50000 1.0000 + Mn Mn345 1.0 0.52083 0.18750 0.50000 1.0000 + Mn Mn346 1.0 0.56250 0.22917 0.50000 1.0000 + Mn Mn347 1.0 0.60417 0.27083 0.50000 1.0000 + Mn Mn348 1.0 0.64583 0.31250 0.50000 1.0000 + Mn Mn349 1.0 0.22917 0.81250 0.50000 1.0000 + Mn Mn350 1.0 0.27083 0.85417 0.50000 1.0000 + Mn Mn351 1.0 0.31250 0.89583 0.50000 1.0000 + Mn Mn352 1.0 0.35417 0.93750 0.50000 1.0000 + Mn Mn353 1.0 0.39583 0.97917 0.50000 1.0000 + Mn Mn354 1.0 0.43750 0.02083 0.50000 1.0000 + Mn Mn355 1.0 0.47917 0.06250 0.50000 1.0000 + Mn Mn356 1.0 0.52083 0.10417 0.50000 1.0000 + Mn Mn357 1.0 0.56250 0.14583 0.50000 1.0000 + Mn Mn358 1.0 0.60417 0.18750 0.50000 1.0000 + Mn Mn359 1.0 0.64583 0.22917 0.50000 1.0000 + Mn Mn360 1.0 0.68750 0.27083 0.50000 1.0000 + Mn Mn361 1.0 0.27083 0.77083 0.50000 1.0000 + Mn Mn362 1.0 0.31250 0.81250 0.50000 1.0000 + Mn Mn363 1.0 0.35417 0.85417 0.50000 1.0000 + Mn Mn364 1.0 0.39583 0.89583 0.50000 1.0000 + Mn Mn365 1.0 0.43750 0.93750 0.50000 1.0000 + Mn Mn366 1.0 0.47917 0.97917 0.50000 1.0000 + Mn Mn367 1.0 0.52083 0.02083 0.50000 1.0000 + Mn Mn368 1.0 0.56250 0.06250 0.50000 1.0000 + Mn Mn369 1.0 0.60417 0.10417 0.50000 1.0000 + Mn Mn370 1.0 0.64583 0.14583 0.50000 1.0000 + Mn Mn371 1.0 0.68750 0.18750 0.50000 1.0000 + Mn Mn372 1.0 0.72917 0.22917 0.50000 1.0000 + Mn Mn373 1.0 0.31250 0.72917 0.50000 1.0000 + Mn Mn374 1.0 0.35417 0.77083 0.50000 1.0000 + Mn Mn375 1.0 0.39583 0.81250 0.50000 1.0000 + Mn Mn376 1.0 0.43750 0.85417 0.50000 1.0000 + Mn Mn377 1.0 0.47917 0.89583 0.50000 1.0000 + Mn Mn378 1.0 0.52083 0.93750 0.50000 1.0000 + Mn Mn379 1.0 0.56250 0.97917 0.50000 1.0000 + Mn Mn380 1.0 0.60417 0.02083 0.50000 1.0000 + Mn Mn381 1.0 0.64583 0.06250 0.50000 1.0000 + Mn Mn382 1.0 0.68750 0.10417 0.50000 1.0000 + Mn Mn383 1.0 0.72917 0.14583 0.50000 1.0000 + Mn Mn384 1.0 0.77083 0.18750 0.50000 1.0000 + Mn Mn385 1.0 0.35417 0.68750 0.50000 1.0000 + Mn Mn386 1.0 0.39583 0.72917 0.50000 1.0000 + Mn Mn387 1.0 0.43750 0.77083 0.50000 1.0000 + Mn Mn388 1.0 0.47917 0.81250 0.50000 1.0000 + Mn Mn389 1.0 0.52083 0.85417 0.50000 1.0000 + Mn Mn390 1.0 0.56250 0.89583 0.50000 1.0000 + Mn Mn391 1.0 0.60417 0.93750 0.50000 1.0000 + Mn Mn392 1.0 0.64583 0.97917 0.50000 1.0000 + Mn Mn393 1.0 0.68750 0.02083 0.50000 1.0000 + Mn Mn394 1.0 0.72917 0.06250 0.50000 1.0000 + Mn Mn395 1.0 0.77083 0.10417 0.50000 1.0000 + Mn Mn396 1.0 0.81250 0.14583 0.50000 1.0000 + Mn Mn397 1.0 0.39583 0.64583 0.50000 1.0000 + Mn Mn398 1.0 0.43750 0.68750 0.50000 1.0000 + Mn Mn399 1.0 0.47917 0.72917 0.50000 1.0000 + Mn Mn400 1.0 0.52083 0.77083 0.50000 1.0000 + Mn Mn401 1.0 0.56250 0.81250 0.50000 1.0000 + Mn Mn402 1.0 0.60417 0.85417 0.50000 1.0000 + Mn Mn403 1.0 0.64583 0.89583 0.50000 1.0000 + Mn Mn404 1.0 0.68750 0.93750 0.50000 1.0000 + Mn Mn405 1.0 0.72917 0.97917 0.50000 1.0000 + Mn Mn406 1.0 0.77083 0.02083 0.50000 1.0000 + Mn Mn407 1.0 0.81250 0.06250 0.50000 1.0000 + Mn Mn408 1.0 0.85417 0.10417 0.50000 1.0000 + Mn Mn409 1.0 0.43750 0.60417 0.50000 1.0000 + Mn Mn410 1.0 0.47917 0.64583 0.50000 1.0000 + Mn Mn411 1.0 0.52083 0.68750 0.50000 1.0000 + Mn Mn412 1.0 0.56250 0.72917 0.50000 1.0000 + Mn Mn413 1.0 0.60417 0.77083 0.50000 1.0000 + Mn Mn414 1.0 0.64583 0.81250 0.50000 1.0000 + Mn Mn415 1.0 0.68750 0.85417 0.50000 1.0000 + Mn Mn416 1.0 0.72917 0.89583 0.50000 1.0000 + Mn Mn417 1.0 0.77083 0.93750 0.50000 1.0000 + Mn Mn418 1.0 0.81250 0.97917 0.50000 1.0000 + Mn Mn419 1.0 0.85417 0.02083 0.50000 1.0000 + Mn Mn420 1.0 0.89583 0.06250 0.50000 1.0000 + Mn Mn421 1.0 0.47917 0.56250 0.50000 1.0000 + Mn Mn422 1.0 0.52083 0.60417 0.50000 1.0000 + Mn Mn423 1.0 0.56250 0.64583 0.50000 1.0000 + Mn Mn424 1.0 0.60417 0.68750 0.50000 1.0000 + Mn Mn425 1.0 0.64583 0.72917 0.50000 1.0000 + Mn Mn426 1.0 0.68750 0.77083 0.50000 1.0000 + Mn Mn427 1.0 0.72917 0.81250 0.50000 1.0000 + Mn Mn428 1.0 0.77083 0.85417 0.50000 1.0000 + Mn Mn429 1.0 0.81250 0.89583 0.50000 1.0000 + Mn Mn430 1.0 0.85417 0.93750 0.50000 1.0000 + Mn Mn431 1.0 0.89583 0.97917 0.50000 1.0000 + Mn Mn432 1.0 0.93750 0.02083 0.50000 1.0000 + V V1 1.0 0.00000 0.00000 0.50000 1.0000 + V V2 1.0 0.04167 0.04167 0.50000 1.0000 + V V3 1.0 0.08333 0.08333 0.50000 1.0000 + V V4 1.0 0.12500 0.12500 0.50000 1.0000 + V V5 1.0 0.16667 0.16667 0.50000 1.0000 + V V6 1.0 0.70833 0.70833 0.50000 1.0000 + V V7 1.0 0.25000 0.25000 0.50000 1.0000 + V V8 1.0 0.29167 0.29167 0.50000 1.0000 + V V9 1.0 0.33333 0.33333 0.50000 1.0000 + V V10 1.0 0.87500 0.87500 0.50000 1.0000 + V V11 1.0 0.41667 0.41667 0.50000 1.0000 + V V12 1.0 0.45833 0.45833 0.50000 1.0000 + V V13 1.0 0.04167 0.95833 0.50000 1.0000 + V V14 1.0 0.08333 0.00000 0.50000 1.0000 + V V15 1.0 0.12500 0.04167 0.50000 1.0000 + V V16 1.0 0.16667 0.08333 0.50000 1.0000 + V V17 1.0 0.20833 0.12500 0.50000 1.0000 + V V18 1.0 0.25000 0.16667 0.50000 1.0000 + V V19 1.0 0.29167 0.20833 0.50000 1.0000 + V V20 1.0 0.33333 0.25000 0.50000 1.0000 + V V21 1.0 0.37500 0.29167 0.50000 1.0000 + V V22 1.0 0.41667 0.33333 0.50000 1.0000 + V V23 1.0 0.45833 0.37500 0.50000 1.0000 + V V24 1.0 0.50000 0.41667 0.50000 1.0000 + V V25 1.0 0.08333 0.91667 0.50000 1.0000 + V V26 1.0 0.12500 0.95833 0.50000 1.0000 + V V27 1.0 0.16667 0.00000 0.50000 1.0000 + V V28 1.0 0.20833 0.04167 0.50000 1.0000 + V V29 1.0 0.25000 0.08333 0.50000 1.0000 + V V30 1.0 0.29167 0.12500 0.50000 1.0000 + V V31 1.0 0.33333 0.16667 0.50000 1.0000 + V V32 1.0 0.37500 0.20833 0.50000 1.0000 + V V33 1.0 0.41667 0.25000 0.50000 1.0000 + V V34 1.0 0.45833 0.29167 0.50000 1.0000 + V V35 1.0 0.50000 0.33333 0.50000 1.0000 + V V36 1.0 0.54167 0.37500 0.50000 1.0000 + V V37 1.0 0.12500 0.87500 0.50000 1.0000 + V V38 1.0 0.16667 0.91667 0.50000 1.0000 + V V39 1.0 0.20833 0.95833 0.50000 1.0000 + V V40 1.0 0.25000 0.00000 0.50000 1.0000 + V V41 1.0 0.29167 0.04167 0.50000 1.0000 + V V42 1.0 0.33333 0.08333 0.50000 1.0000 + V V43 1.0 0.37500 0.12500 0.50000 1.0000 + V V44 1.0 0.41667 0.16667 0.50000 1.0000 + V V45 1.0 0.45833 0.20833 0.50000 1.0000 + V V46 1.0 0.50000 0.25000 0.50000 1.0000 + V V47 1.0 0.54167 0.29167 0.50000 1.0000 + V V48 1.0 0.58333 0.33333 0.50000 1.0000 + V V49 1.0 0.16667 0.83333 0.50000 1.0000 + V V50 1.0 0.20833 0.87500 0.50000 1.0000 + V V51 1.0 0.25000 0.91667 0.50000 1.0000 + V V52 1.0 0.29167 0.95833 0.50000 1.0000 + V V53 1.0 0.33333 0.00000 0.50000 1.0000 + V V54 1.0 0.37500 0.04167 0.50000 1.0000 + V V55 1.0 0.41667 0.08333 0.50000 1.0000 + V V56 1.0 0.45833 0.12500 0.50000 1.0000 + V V57 1.0 0.50000 0.16667 0.50000 1.0000 + V V58 1.0 0.54167 0.20833 0.50000 1.0000 + V V59 1.0 0.58333 0.25000 0.50000 1.0000 + V V60 1.0 0.62500 0.29167 0.50000 1.0000 + V V61 1.0 0.20833 0.79167 0.50000 1.0000 + V V62 1.0 0.25000 0.83333 0.50000 1.0000 + V V63 1.0 0.29167 0.87500 0.50000 1.0000 + V V64 1.0 0.33333 0.91667 0.50000 1.0000 + V V65 1.0 0.37500 0.95833 0.50000 1.0000 + V V66 1.0 0.41667 0.00000 0.50000 1.0000 + V V67 1.0 0.45833 0.04167 0.50000 1.0000 + V V68 1.0 0.50000 0.08333 0.50000 1.0000 + V V69 1.0 0.54167 0.12500 0.50000 1.0000 + V V70 1.0 0.58333 0.16667 0.50000 1.0000 + V V71 1.0 0.62500 0.20833 0.50000 1.0000 + V V72 1.0 0.66667 0.25000 0.50000 1.0000 + V V73 1.0 0.25000 0.75000 0.50000 1.0000 + V V74 1.0 0.29167 0.79167 0.50000 1.0000 + V V75 1.0 0.33333 0.83333 0.50000 1.0000 + V V76 1.0 0.37500 0.87500 0.50000 1.0000 + V V77 1.0 0.41667 0.91667 0.50000 1.0000 + V V78 1.0 0.45833 0.95833 0.50000 1.0000 + V V79 1.0 0.50000 0.00000 0.50000 1.0000 + V V80 1.0 0.54167 0.04167 0.50000 1.0000 + V V81 1.0 0.58333 0.08333 0.50000 1.0000 + V V82 1.0 0.62500 0.12500 0.50000 1.0000 + V V83 1.0 0.66667 0.16667 0.50000 1.0000 + V V84 1.0 0.70833 0.20833 0.50000 1.0000 + V V85 1.0 0.29167 0.70833 0.50000 1.0000 + V V86 1.0 0.33333 0.75000 0.50000 1.0000 + V V87 1.0 0.37500 0.79167 0.50000 1.0000 + V V88 1.0 0.41667 0.83333 0.50000 1.0000 + V V89 1.0 0.45833 0.87500 0.50000 1.0000 + V V90 1.0 0.50000 0.91667 0.50000 1.0000 + V V91 1.0 0.54167 0.95833 0.50000 1.0000 + V V92 1.0 0.58333 1.00000 0.50000 1.0000 + V V93 1.0 0.62500 0.04167 0.50000 1.0000 + V V94 1.0 0.66667 0.08333 0.50000 1.0000 + V V95 1.0 0.70833 0.12500 0.50000 1.0000 + V V96 1.0 0.75000 0.16667 0.50000 1.0000 + V V97 1.0 0.33333 0.66667 0.50000 1.0000 + V V98 1.0 0.37500 0.70833 0.50000 1.0000 + V V99 1.0 0.41667 0.75000 0.50000 1.0000 + V V100 1.0 0.45833 0.79167 0.50000 1.0000 + V V101 1.0 0.50000 0.83333 0.50000 1.0000 + V V102 1.0 0.54167 0.87500 0.50000 1.0000 + V V103 1.0 0.58333 0.91667 0.50000 1.0000 + V V104 1.0 0.62500 0.95833 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0.66667 0.83333 0.50000 1.0000 + V V128 1.0 0.70833 0.87500 0.50000 1.0000 + V V129 1.0 0.75000 0.91667 0.50000 1.0000 + V V130 1.0 0.79167 0.95833 0.50000 1.0000 + V V131 1.0 0.83333 0.00000 0.50000 1.0000 + V V132 1.0 0.87500 0.04167 0.50000 1.0000 + V V133 1.0 0.45833 0.54167 0.50000 1.0000 + V V134 1.0 0.50000 0.58333 0.50000 1.0000 + V V135 1.0 0.54167 0.62500 0.50000 1.0000 + V V136 1.0 0.58333 0.66667 0.50000 1.0000 + V V137 1.0 0.62500 0.70833 0.50000 1.0000 + V V138 1.0 0.66667 0.75000 0.50000 1.0000 + V V139 1.0 0.70833 0.79167 0.50000 1.0000 + V V140 1.0 0.75000 0.83333 0.50000 1.0000 + V V141 1.0 0.79167 0.87500 0.50000 1.0000 + V V142 1.0 0.83333 0.91667 0.50000 1.0000 + V V143 1.0 0.87500 0.95833 0.50000 1.0000 + V V144 1.0 0.91667 1.00000 0.50000 1.0000 + O O1 1.0 0.02773 0.99988 0.66117 1.0000 + O O2 1.0 0.06939 0.04154 0.66117 1.0000 + O O3 1.0 0.11106 0.08321 0.66117 1.0000 + O O4 1.0 0.15273 0.12488 0.66117 1.0000 + O O5 1.0 0.19439 0.16654 0.66117 1.0000 + O O6 1.0 0.23606 0.20821 0.66117 1.0000 + O O7 1.0 0.27773 0.24988 0.66117 1.0000 + O O8 1.0 0.31939 0.29154 0.66117 1.0000 + O O9 1.0 0.36106 0.33321 0.66117 1.0000 + O O10 1.0 0.40273 0.37488 0.66117 1.0000 + O O11 1.0 0.44439 0.41654 0.66117 1.0000 + O O12 1.0 0.48606 0.45821 0.66117 1.0000 + O O13 1.0 0.06939 0.95821 0.66117 1.0000 + O O14 1.0 0.11106 0.99988 0.66117 1.0000 + O O15 1.0 0.15273 0.04154 0.66117 1.0000 + O O16 1.0 0.19439 0.08321 0.66117 1.0000 + O O17 1.0 0.23606 0.12488 0.66117 1.0000 + O O18 1.0 0.27773 0.16654 0.66117 1.0000 + O O19 1.0 0.31939 0.20821 0.66117 1.0000 + O O20 1.0 0.36106 0.24988 0.66117 1.0000 + O O21 1.0 0.40273 0.29154 0.66117 1.0000 + O O22 1.0 0.44439 0.33321 0.66117 1.0000 + O O23 1.0 0.48606 0.37488 0.66117 1.0000 + O O24 1.0 0.52773 0.41654 0.66117 1.0000 + O O25 1.0 0.11106 0.91654 0.66117 1.0000 + O O26 1.0 0.15273 0.95821 0.66117 1.0000 + O O27 1.0 0.19439 0.99988 0.66117 1.0000 + O O28 1.0 0.23606 0.04154 0.66117 1.0000 + O O29 1.0 0.27773 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0.33773 1.0000 + O O1117 1.0 0.40975 0.60435 0.33773 1.0000 + O O1118 1.0 0.45141 0.64602 0.33773 1.0000 + O O1119 1.0 0.49308 0.68768 0.33773 1.0000 + O O1120 1.0 0.53475 0.72935 0.33773 1.0000 + O O1121 1.0 0.57641 0.77102 0.33773 1.0000 + O O1122 1.0 0.61808 0.81268 0.33773 1.0000 + O O1123 1.0 0.65975 0.85435 0.33773 1.0000 + O O1124 1.0 0.70141 0.89602 0.33773 1.0000 + O O1125 1.0 0.74308 0.93768 0.33773 1.0000 + O O1126 1.0 0.78475 0.97935 0.33773 1.0000 + O O1127 1.0 0.82641 0.02102 0.33773 1.0000 + O O1128 1.0 0.86808 0.06268 0.33773 1.0000 + O O1129 1.0 0.45141 0.56268 0.33773 1.0000 + O O1130 1.0 0.49308 0.60435 0.33773 1.0000 + O O1131 1.0 0.53475 0.64602 0.33773 1.0000 + O O1132 1.0 0.57641 0.68768 0.33773 1.0000 + O O1133 1.0 0.61808 0.72935 0.33773 1.0000 + O O1134 1.0 0.65975 0.77102 0.33773 1.0000 + O O1135 1.0 0.70141 0.81268 0.33773 1.0000 + O O1136 1.0 0.74308 0.85435 0.33773 1.0000 + O O1137 1.0 0.78475 0.89602 0.33773 1.0000 + O O1138 1.0 0.82641 0.93768 0.33773 1.0000 + O O1139 1.0 0.86808 0.97935 0.33773 1.0000 + O O1140 1.0 0.90975 0.02102 0.33773 1.0000 + O O1141 1.0 0.49308 0.52102 0.33773 1.0000 + O O1142 1.0 0.53475 0.56268 0.33773 1.0000 + O O1143 1.0 0.57641 0.60435 0.33773 1.0000 + O O1144 1.0 0.61808 0.64602 0.33773 1.0000 + O O1145 1.0 0.65975 0.68768 0.33773 1.0000 + O O1146 1.0 0.70141 0.72935 0.33773 1.0000 + O O1147 1.0 0.74308 0.77102 0.33773 1.0000 + O O1148 1.0 0.78475 0.81268 0.33773 1.0000 + O O1149 1.0 0.82641 0.85435 0.33773 1.0000 + O O1150 1.0 0.86808 0.89602 0.33773 1.0000 + O O1151 1.0 0.90975 0.93768 0.33773 1.0000 + O O1152 1.0 0.95141 0.97935 0.33773 1.0000 + Mn Mn433 1.0 0.52083 0.47917 0.50000 1.0000 + Mn Mn434 1.0 0.56250 0.52083 0.50000 1.0000 + Mn Mn435 1.0 0.60417 0.56250 0.50000 1.0000 + Mn Mn436 1.0 0.64583 0.60417 0.50000 1.0000 + Mn Mn437 1.0 0.68750 0.64583 0.50000 1.0000 + Mn Mn438 1.0 0.72917 0.68750 0.50000 1.0000 + Mn Mn439 1.0 0.77083 0.72917 0.50000 1.0000 + Mn Mn440 1.0 0.81250 0.77083 0.50000 1.0000 + Mn Mn441 1.0 0.85417 0.81250 0.50000 1.0000 + Mn Mn442 1.0 0.89583 0.85417 0.50000 1.0000 + Mn Mn443 1.0 0.93750 0.89583 0.50000 1.0000 + Mn Mn444 1.0 0.97917 0.93750 0.50000 1.0000 + Mn Mn445 1.0 0.56250 0.43750 0.50000 1.0000 + Mn Mn446 1.0 0.60417 0.47917 0.50000 1.0000 + Mn Mn447 1.0 0.64583 0.52083 0.50000 1.0000 + Mn Mn448 1.0 0.68750 0.56250 0.50000 1.0000 + Mn Mn449 1.0 0.72917 0.60417 0.50000 1.0000 + Mn Mn450 1.0 0.77083 0.64583 0.50000 1.0000 + Mn Mn451 1.0 0.81250 0.68750 0.50000 1.0000 + Mn Mn452 1.0 0.85417 0.72917 0.50000 1.0000 + Mn Mn453 1.0 0.89583 0.77083 0.50000 1.0000 + Mn Mn454 1.0 0.93750 0.81250 0.50000 1.0000 + Mn Mn455 1.0 0.97917 0.85417 0.50000 1.0000 + Mn Mn456 1.0 0.02083 0.89583 0.50000 1.0000 + Mn Mn457 1.0 0.60417 0.39583 0.50000 1.0000 + Mn Mn458 1.0 0.64583 0.43750 0.50000 1.0000 + Mn Mn459 1.0 0.68750 0.47917 0.50000 1.0000 + Mn Mn460 1.0 0.72917 0.52083 0.50000 1.0000 + Mn Mn461 1.0 0.77083 0.56250 0.50000 1.0000 + Mn Mn462 1.0 0.81250 0.60417 0.50000 1.0000 + Mn Mn463 1.0 0.85417 0.64583 0.50000 1.0000 + Mn Mn464 1.0 0.89583 0.68750 0.50000 1.0000 + Mn Mn465 1.0 0.93750 0.72917 0.50000 1.0000 + Mn Mn466 1.0 0.97917 0.77083 0.50000 1.0000 + Mn Mn467 1.0 0.02083 0.81250 0.50000 1.0000 + Mn Mn468 1.0 0.06250 0.85417 0.50000 1.0000 + Mn Mn469 1.0 0.64583 0.35417 0.50000 1.0000 + Mn Mn470 1.0 0.68750 0.39583 0.50000 1.0000 + Mn Mn471 1.0 0.72917 0.43750 0.50000 1.0000 + Mn Mn472 1.0 0.77083 0.47917 0.50000 1.0000 + Mn Mn473 1.0 0.81250 0.52083 0.50000 1.0000 + Mn Mn474 1.0 0.85417 0.56250 0.50000 1.0000 + Mn Mn475 1.0 0.89583 0.60417 0.50000 1.0000 + Mn Mn476 1.0 0.93750 0.64583 0.50000 1.0000 + Mn Mn477 1.0 0.97917 0.68750 0.50000 1.0000 + Mn Mn478 1.0 0.02083 0.72917 0.50000 1.0000 + Mn Mn479 1.0 0.06250 0.77083 0.50000 1.0000 + Mn Mn480 1.0 0.10417 0.81250 0.50000 1.0000 + Mn Mn481 1.0 0.68750 0.31250 0.50000 1.0000 + Mn Mn482 1.0 0.72917 0.35417 0.50000 1.0000 + Mn Mn483 1.0 0.77083 0.39583 0.50000 1.0000 + Mn Mn484 1.0 0.81250 0.43750 0.50000 1.0000 + Mn Mn485 1.0 0.85417 0.47917 0.50000 1.0000 + Mn Mn486 1.0 0.89583 0.52083 0.50000 1.0000 + Mn Mn487 1.0 0.93750 0.56250 0.50000 1.0000 + Mn Mn488 1.0 0.97917 0.60417 0.50000 1.0000 + Mn Mn489 1.0 0.02083 0.64583 0.50000 1.0000 + Mn Mn490 1.0 0.06250 0.68750 0.50000 1.0000 + Mn Mn491 1.0 0.10417 0.72917 0.50000 1.0000 + Mn Mn492 1.0 0.14583 0.77083 0.50000 1.0000 + Mn Mn493 1.0 0.72917 0.27083 0.50000 1.0000 + Mn Mn494 1.0 0.77083 0.31250 0.50000 1.0000 + Mn Mn495 1.0 0.81250 0.35417 0.50000 1.0000 + Mn Mn496 1.0 0.85417 0.39583 0.50000 1.0000 + Mn Mn497 1.0 0.89583 0.43750 0.50000 1.0000 + Mn Mn498 1.0 0.93750 0.47917 0.50000 1.0000 + Mn Mn499 1.0 0.97917 0.52083 0.50000 1.0000 + Mn Mn500 1.0 0.02083 0.56250 0.50000 1.0000 + Mn Mn501 1.0 0.06250 0.60417 0.50000 1.0000 + Mn Mn502 1.0 0.10417 0.64583 0.50000 1.0000 + Mn Mn503 1.0 0.14583 0.68750 0.50000 1.0000 + Mn Mn504 1.0 0.18750 0.72917 0.50000 1.0000 + Mn Mn505 1.0 0.77083 0.22917 0.50000 1.0000 + Mn Mn506 1.0 0.81250 0.27083 0.50000 1.0000 + Mn Mn507 1.0 0.85417 0.31250 0.50000 1.0000 + Mn Mn508 1.0 0.89583 0.35417 0.50000 1.0000 + Mn Mn509 1.0 0.93750 0.39583 0.50000 1.0000 + Mn Mn510 1.0 0.97917 0.43750 0.50000 1.0000 + Mn Mn511 1.0 0.02083 0.47917 0.50000 1.0000 + Mn Mn512 1.0 0.06250 0.52083 0.50000 1.0000 + Mn Mn513 1.0 0.10417 0.56250 0.50000 1.0000 + Mn Mn514 1.0 0.14583 0.60417 0.50000 1.0000 + Mn Mn515 1.0 0.18750 0.64583 0.50000 1.0000 + Mn Mn516 1.0 0.22917 0.68750 0.50000 1.0000 + Mn Mn517 1.0 0.81250 0.18750 0.50000 1.0000 + Mn Mn518 1.0 0.85417 0.22917 0.50000 1.0000 + Mn Mn519 1.0 0.89583 0.27083 0.50000 1.0000 + Mn Mn520 1.0 0.93750 0.31250 0.50000 1.0000 + Mn Mn521 1.0 0.97917 0.35417 0.50000 1.0000 + Mn Mn522 1.0 0.02083 0.39583 0.50000 1.0000 + Mn Mn523 1.0 0.06250 0.43750 0.50000 1.0000 + Mn Mn524 1.0 0.10417 0.47917 0.50000 1.0000 + Mn Mn525 1.0 0.14583 0.52083 0.50000 1.0000 + Mn Mn526 1.0 0.18750 0.56250 0.50000 1.0000 + Mn Mn527 1.0 0.22917 0.60417 0.50000 1.0000 + Mn Mn528 1.0 0.27083 0.64583 0.50000 1.0000 + Mn Mn529 1.0 0.85417 0.14583 0.50000 1.0000 + Mn Mn530 1.0 0.89583 0.18750 0.50000 1.0000 + Mn Mn531 1.0 0.93750 0.22917 0.50000 1.0000 + Mn Mn532 1.0 0.97917 0.27083 0.50000 1.0000 + Mn Mn533 1.0 0.02083 0.31250 0.50000 1.0000 + Mn Mn534 1.0 0.06250 0.35417 0.50000 1.0000 + Mn Mn535 1.0 0.10417 0.39583 0.50000 1.0000 + Mn Mn536 1.0 0.14583 0.43750 0.50000 1.0000 + Mn Mn537 1.0 0.18750 0.47917 0.50000 1.0000 + Mn Mn538 1.0 0.22917 0.52083 0.50000 1.0000 + Mn Mn539 1.0 0.27083 0.56250 0.50000 1.0000 + Mn Mn540 1.0 0.31250 0.60417 0.50000 1.0000 + Mn Mn541 1.0 0.89583 0.10417 0.50000 1.0000 + Mn Mn542 1.0 0.93750 0.14583 0.50000 1.0000 + Mn Mn543 1.0 0.97917 0.18750 0.50000 1.0000 + Mn Mn544 1.0 0.02083 0.22917 0.50000 1.0000 + Mn Mn545 1.0 0.06250 0.27083 0.50000 1.0000 + Mn Mn546 1.0 0.10417 0.31250 0.50000 1.0000 + Mn Mn547 1.0 0.14583 0.35417 0.50000 1.0000 + Mn Mn548 1.0 0.18750 0.39583 0.50000 1.0000 + Mn Mn549 1.0 0.22917 0.43750 0.50000 1.0000 + Mn Mn550 1.0 0.27083 0.47917 0.50000 1.0000 + Mn Mn551 1.0 0.31250 0.52083 0.50000 1.0000 + Mn Mn552 1.0 0.35417 0.56250 0.50000 1.0000 + Mn Mn553 1.0 0.93750 0.06250 0.50000 1.0000 + Mn Mn554 1.0 0.97917 0.10417 0.50000 1.0000 + Mn Mn555 1.0 0.02083 0.14583 0.50000 1.0000 + Mn Mn556 1.0 0.06250 0.18750 0.50000 1.0000 + Mn Mn557 1.0 0.10417 0.22917 0.50000 1.0000 + Mn Mn558 1.0 0.14583 0.27083 0.50000 1.0000 + Mn Mn559 1.0 0.18750 0.31250 0.50000 1.0000 + Mn Mn560 1.0 0.22917 0.35417 0.50000 1.0000 + Mn Mn561 1.0 0.27083 0.39583 0.50000 1.0000 + Mn Mn562 1.0 0.31250 0.43750 0.50000 1.0000 + Mn Mn563 1.0 0.35417 0.47917 0.50000 1.0000 + Mn Mn564 1.0 0.39583 0.52083 0.50000 1.0000 + Mn Mn565 1.0 0.97917 0.02083 0.50000 1.0000 + Mn Mn566 1.0 0.02083 0.06250 0.50000 1.0000 + Mn Mn567 1.0 0.06250 0.10417 0.50000 1.0000 + Mn Mn568 1.0 0.10417 0.14583 0.50000 1.0000 + Mn Mn569 1.0 0.14583 0.18750 0.50000 1.0000 + Mn Mn570 1.0 0.18750 0.22917 0.50000 1.0000 + Mn Mn571 1.0 0.22917 0.27083 0.50000 1.0000 + Mn Mn572 1.0 0.27083 0.31250 0.50000 1.0000 + Mn Mn573 1.0 0.31250 0.35417 0.50000 1.0000 + Mn Mn574 1.0 0.35417 0.39583 0.50000 1.0000 + Mn Mn575 1.0 0.39583 0.43750 0.50000 1.0000 + Mn Mn576 1.0 0.43750 0.47917 0.50000 1.0000 + Mn Mn577 1.0 0.54167 0.50000 0.50000 1.0000 + Mn Mn578 1.0 0.58333 0.54167 0.50000 1.0000 + Mn Mn579 1.0 0.62500 0.58333 0.50000 1.0000 + Mn Mn580 1.0 0.66667 0.62500 0.50000 1.0000 + Mn Mn581 1.0 0.70833 0.66667 0.50000 1.0000 + Mn Mn582 1.0 0.75000 0.70833 0.50000 1.0000 + Mn Mn583 1.0 0.79167 0.75000 0.50000 1.0000 + Mn Mn584 1.0 0.83333 0.79167 0.50000 1.0000 + Mn Mn585 1.0 0.87500 0.83333 0.50000 1.0000 + Mn Mn586 1.0 0.91667 0.87500 0.50000 1.0000 + Mn Mn587 1.0 0.95833 0.91667 0.50000 1.0000 + Mn Mn588 1.0 0.00000 0.95833 0.50000 1.0000 + Mn Mn589 1.0 0.58333 0.45833 0.50000 1.0000 + Mn Mn590 1.0 0.62500 0.50000 0.50000 1.0000 + Mn Mn591 1.0 0.66667 0.54167 0.50000 1.0000 + Mn Mn592 1.0 0.70833 0.58333 0.50000 1.0000 + Mn Mn593 1.0 0.75000 0.62500 0.50000 1.0000 + Mn Mn594 1.0 0.79167 0.66667 0.50000 1.0000 + Mn Mn595 1.0 0.83333 0.70833 0.50000 1.0000 + Mn Mn596 1.0 0.87500 0.75000 0.50000 1.0000 + Mn Mn597 1.0 0.91667 0.79167 0.50000 1.0000 + Mn Mn598 1.0 0.95833 0.83333 0.50000 1.0000 + Mn Mn599 1.0 0.00000 0.87500 0.50000 1.0000 + Mn Mn600 1.0 0.04167 0.91667 0.50000 1.0000 + Mn Mn601 1.0 0.62500 0.41667 0.50000 1.0000 + Mn Mn602 1.0 0.66667 0.45833 0.50000 1.0000 + Mn Mn603 1.0 0.70833 0.50000 0.50000 1.0000 + Mn Mn604 1.0 0.75000 0.54167 0.50000 1.0000 + Mn Mn605 1.0 0.79167 0.58333 0.50000 1.0000 + Mn Mn606 1.0 0.83333 0.62500 0.50000 1.0000 + Mn Mn607 1.0 0.87500 0.66667 0.50000 1.0000 + Mn Mn608 1.0 0.91667 0.70833 0.50000 1.0000 + Mn Mn609 1.0 0.95833 0.75000 0.50000 1.0000 + Mn Mn610 1.0 0.00000 0.79167 0.50000 1.0000 + Mn Mn611 1.0 0.04167 0.83333 0.50000 1.0000 + Mn Mn612 1.0 0.08333 0.87500 0.50000 1.0000 + Mn Mn613 1.0 0.66667 0.37500 0.50000 1.0000 + Mn Mn614 1.0 0.70833 0.41667 0.50000 1.0000 + Mn Mn615 1.0 0.75000 0.45833 0.50000 1.0000 + Mn Mn616 1.0 0.79167 0.50000 0.50000 1.0000 + Mn Mn617 1.0 0.83333 0.54167 0.50000 1.0000 + Mn Mn618 1.0 0.87500 0.58333 0.50000 1.0000 + Mn Mn619 1.0 0.91667 0.62500 0.50000 1.0000 + Mn Mn620 1.0 0.95833 0.66667 0.50000 1.0000 + Mn Mn621 1.0 0.00000 0.70833 0.50000 1.0000 + Mn Mn622 1.0 0.04167 0.75000 0.50000 1.0000 + Mn Mn623 1.0 0.08333 0.79167 0.50000 1.0000 + Mn Mn624 1.0 0.12500 0.83333 0.50000 1.0000 + Mn Mn625 1.0 0.70833 0.33333 0.50000 1.0000 + Mn Mn626 1.0 0.75000 0.37500 0.50000 1.0000 + Mn Mn627 1.0 0.79167 0.41667 0.50000 1.0000 + Mn Mn628 1.0 0.83333 0.45833 0.50000 1.0000 + Mn Mn629 1.0 0.87500 0.50000 0.50000 1.0000 + Mn Mn630 1.0 0.91667 0.54167 0.50000 1.0000 + Mn Mn631 1.0 0.95833 0.58333 0.50000 1.0000 + Mn Mn632 1.0 0.00000 0.62500 0.50000 1.0000 + Mn Mn633 1.0 0.04167 0.66667 0.50000 1.0000 + Mn Mn634 1.0 0.08333 0.70833 0.50000 1.0000 + Mn Mn635 1.0 0.12500 0.75000 0.50000 1.0000 + Mn Mn636 1.0 0.16667 0.79167 0.50000 1.0000 + Mn Mn637 1.0 0.75000 0.29167 0.50000 1.0000 + Mn Mn638 1.0 0.79167 0.33333 0.50000 1.0000 + Mn Mn639 1.0 0.83333 0.37500 0.50000 1.0000 + Mn Mn640 1.0 0.87500 0.41667 0.50000 1.0000 + Mn Mn641 1.0 0.91667 0.45833 0.50000 1.0000 + Mn Mn642 1.0 0.95833 0.50000 0.50000 1.0000 + Mn Mn643 1.0 0.00000 0.54167 0.50000 1.0000 + Mn Mn644 1.0 0.04167 0.58333 0.50000 1.0000 + Mn Mn645 1.0 0.08333 0.62500 0.50000 1.0000 + Mn Mn646 1.0 0.12500 0.66667 0.50000 1.0000 + Mn Mn647 1.0 0.16667 0.70833 0.50000 1.0000 + Mn Mn648 1.0 0.20833 0.75000 0.50000 1.0000 + Mn Mn649 1.0 0.79167 0.25000 0.50000 1.0000 + Mn Mn650 1.0 0.83333 0.29167 0.50000 1.0000 + Mn Mn651 1.0 0.87500 0.33333 0.50000 1.0000 + Mn Mn652 1.0 0.91667 0.37500 0.50000 1.0000 + Mn Mn653 1.0 0.95833 0.41667 0.50000 1.0000 + Mn Mn654 1.0 0.00000 0.45833 0.50000 1.0000 + Mn Mn655 1.0 0.04167 0.50000 0.50000 1.0000 + Mn Mn656 1.0 0.08333 0.54167 0.50000 1.0000 + Mn Mn657 1.0 0.12500 0.58333 0.50000 1.0000 + Mn Mn658 1.0 0.16667 0.62500 0.50000 1.0000 + Mn Mn659 1.0 0.20833 0.66667 0.50000 1.0000 + Mn Mn660 1.0 0.25000 0.70833 0.50000 1.0000 + Mn Mn661 1.0 0.83333 0.20833 0.50000 1.0000 + Mn Mn662 1.0 0.87500 0.25000 0.50000 1.0000 + Mn Mn663 1.0 0.91667 0.29167 0.50000 1.0000 + Mn Mn664 1.0 0.95833 0.33333 0.50000 1.0000 + Mn Mn665 1.0 0.00000 0.37500 0.50000 1.0000 + Mn Mn666 1.0 0.04167 0.41667 0.50000 1.0000 + Mn Mn667 1.0 0.08333 0.45833 0.50000 1.0000 + Mn Mn668 1.0 0.12500 0.50000 0.50000 1.0000 + Mn Mn669 1.0 0.16667 0.54167 0.50000 1.0000 + Mn Mn670 1.0 0.20833 0.58333 0.50000 1.0000 + Mn Mn671 1.0 0.25000 0.62500 0.50000 1.0000 + Mn Mn672 1.0 0.29167 0.66667 0.50000 1.0000 + Mn Mn673 1.0 0.87500 0.16667 0.50000 1.0000 + Mn Mn674 1.0 0.91667 0.20833 0.50000 1.0000 + Mn Mn675 1.0 0.95833 0.25000 0.50000 1.0000 + Mn Mn676 1.0 0.00000 0.29167 0.50000 1.0000 + Mn Mn677 1.0 0.04167 0.33333 0.50000 1.0000 + Mn Mn678 1.0 0.08333 0.37500 0.50000 1.0000 + Mn Mn679 1.0 0.12500 0.41667 0.50000 1.0000 + Mn Mn680 1.0 0.16667 0.45833 0.50000 1.0000 + Mn Mn681 1.0 0.20833 0.50000 0.50000 1.0000 + Mn Mn682 1.0 0.25000 0.54167 0.50000 1.0000 + Mn Mn683 1.0 0.29167 0.58333 0.50000 1.0000 + Mn Mn684 1.0 0.33333 0.62500 0.50000 1.0000 + Mn Mn685 1.0 0.91667 0.12500 0.50000 1.0000 + Mn Mn686 1.0 0.95833 0.16667 0.50000 1.0000 + Mn Mn687 1.0 0.00000 0.20833 0.50000 1.0000 + Mn Mn688 1.0 0.04167 0.25000 0.50000 1.0000 + Mn Mn689 1.0 0.08333 0.29167 0.50000 1.0000 + Mn Mn690 1.0 0.12500 0.33333 0.50000 1.0000 + Mn Mn691 1.0 0.16667 0.37500 0.50000 1.0000 + Mn Mn692 1.0 0.20833 0.41667 0.50000 1.0000 + Mn Mn693 1.0 0.25000 0.45833 0.50000 1.0000 + Mn Mn694 1.0 0.29167 0.50000 0.50000 1.0000 + Mn Mn695 1.0 0.33333 0.54167 0.50000 1.0000 + Mn Mn696 1.0 0.37500 0.58333 0.50000 1.0000 + Mn Mn697 1.0 0.95833 0.08333 0.50000 1.0000 + Mn Mn698 1.0 0.00000 0.12500 0.50000 1.0000 + Mn Mn699 1.0 0.04167 0.16667 0.50000 1.0000 + Mn Mn700 1.0 0.08333 0.20833 0.50000 1.0000 + Mn Mn701 1.0 0.12500 0.25000 0.50000 1.0000 + Mn Mn702 1.0 0.16667 0.29167 0.50000 1.0000 + Mn Mn703 1.0 0.20833 0.33333 0.50000 1.0000 + Mn Mn704 1.0 0.25000 0.37500 0.50000 1.0000 + Mn Mn705 1.0 0.29167 0.41667 0.50000 1.0000 + Mn Mn706 1.0 0.33333 0.45833 0.50000 1.0000 + Mn Mn707 1.0 0.37500 0.50000 0.50000 1.0000 + Mn Mn708 1.0 0.41667 0.54167 0.50000 1.0000 + Mn Mn709 1.0 0.00000 0.04167 0.50000 1.0000 + Mn Mn710 1.0 0.04167 0.08333 0.50000 1.0000 + Mn Mn711 1.0 0.08333 0.12500 0.50000 1.0000 + Mn Mn712 1.0 0.12500 0.16667 0.50000 1.0000 + Mn Mn713 1.0 0.16667 0.20833 0.50000 1.0000 + Mn Mn714 1.0 0.20833 0.25000 0.50000 1.0000 + Mn Mn715 1.0 0.25000 0.29167 0.50000 1.0000 + Mn Mn716 1.0 0.29167 0.33333 0.50000 1.0000 + Mn Mn717 1.0 0.33333 0.37500 0.50000 1.0000 + Mn Mn718 1.0 0.37500 0.41667 0.50000 1.0000 + Mn Mn719 1.0 0.41667 0.45833 0.50000 1.0000 + Mn Mn720 1.0 0.45833 0.50000 0.50000 1.0000 + Mn Mn721 1.0 0.52083 0.52083 0.50000 1.0000 + Mn Mn722 1.0 0.56250 0.56250 0.50000 1.0000 + Mn Mn723 1.0 0.10417 0.10417 0.50000 1.0000 + Mn Mn724 1.0 0.64583 0.64583 0.50000 1.0000 + Mn Mn725 1.0 0.18750 0.18750 0.50000 1.0000 + Mn Mn726 1.0 0.72917 0.72917 0.50000 1.0000 + Mn Mn727 1.0 0.77083 0.77083 0.50000 1.0000 + Mn Mn728 1.0 0.81250 0.81250 0.50000 1.0000 + Mn Mn729 1.0 0.85417 0.85417 0.50000 1.0000 + Mn Mn730 1.0 0.89583 0.89583 0.50000 1.0000 + Mn Mn731 1.0 0.93750 0.93750 0.50000 1.0000 + Mn Mn732 1.0 0.97917 0.97917 0.50000 1.0000 + Mn Mn733 1.0 0.56250 0.47917 0.50000 1.0000 + Mn Mn734 1.0 0.60417 0.52083 0.50000 1.0000 + Mn Mn735 1.0 0.64583 0.56250 0.50000 1.0000 + Mn Mn736 1.0 0.68750 0.60417 0.50000 1.0000 + Mn Mn737 1.0 0.72917 0.64583 0.50000 1.0000 + Mn Mn738 1.0 0.77083 0.68750 0.50000 1.0000 + Mn Mn739 1.0 0.81250 0.72917 0.50000 1.0000 + Mn Mn740 1.0 0.85417 0.77083 0.50000 1.0000 + Mn Mn741 1.0 0.89583 0.81250 0.50000 1.0000 + Mn Mn742 1.0 0.93750 0.85417 0.50000 1.0000 + Mn Mn743 1.0 0.97917 0.89583 0.50000 1.0000 + Mn Mn744 1.0 0.02083 0.93750 0.50000 1.0000 + Mn Mn745 1.0 0.60417 0.43750 0.50000 1.0000 + Mn Mn746 1.0 0.64583 0.47917 0.50000 1.0000 + Mn Mn747 1.0 0.68750 0.52083 0.50000 1.0000 + Mn Mn748 1.0 0.72917 0.56250 0.50000 1.0000 + Mn Mn749 1.0 0.77083 0.60417 0.50000 1.0000 + Mn Mn750 1.0 0.81250 0.64583 0.50000 1.0000 + Mn Mn751 1.0 0.85417 0.68750 0.50000 1.0000 + Mn Mn752 1.0 0.89583 0.72917 0.50000 1.0000 + Mn Mn753 1.0 0.93750 0.77083 0.50000 1.0000 + Mn Mn754 1.0 0.97917 0.81250 0.50000 1.0000 + Mn Mn755 1.0 0.02083 0.85417 0.50000 1.0000 + Mn Mn756 1.0 0.06250 0.89583 0.50000 1.0000 + Mn Mn757 1.0 0.64583 0.39583 0.50000 1.0000 + Mn Mn758 1.0 0.68750 0.43750 0.50000 1.0000 + Mn Mn759 1.0 0.72917 0.47917 0.50000 1.0000 + Mn Mn760 1.0 0.77083 0.52083 0.50000 1.0000 + Mn Mn761 1.0 0.81250 0.56250 0.50000 1.0000 + Mn Mn762 1.0 0.85417 0.60417 0.50000 1.0000 + Mn Mn763 1.0 0.89583 0.64583 0.50000 1.0000 + Mn Mn764 1.0 0.93750 0.68750 0.50000 1.0000 + Mn Mn765 1.0 0.97917 0.72917 0.50000 1.0000 + Mn Mn766 1.0 0.02083 0.77083 0.50000 1.0000 + Mn Mn767 1.0 0.06250 0.81250 0.50000 1.0000 + Mn Mn768 1.0 0.10417 0.85417 0.50000 1.0000 + Mn Mn769 1.0 0.68750 0.35417 0.50000 1.0000 + Mn Mn770 1.0 0.72917 0.39583 0.50000 1.0000 + Mn Mn771 1.0 0.77083 0.43750 0.50000 1.0000 + Mn Mn772 1.0 0.81250 0.47917 0.50000 1.0000 + Mn Mn773 1.0 0.85417 0.52083 0.50000 1.0000 + Mn Mn774 1.0 0.89583 0.56250 0.50000 1.0000 + Mn Mn775 1.0 0.93750 0.60417 0.50000 1.0000 + Mn Mn776 1.0 0.97917 0.64583 0.50000 1.0000 + Mn Mn777 1.0 0.02083 0.68750 0.50000 1.0000 + Mn Mn778 1.0 0.06250 0.72917 0.50000 1.0000 + Mn Mn779 1.0 0.10417 0.77083 0.50000 1.0000 + Mn Mn780 1.0 0.14583 0.81250 0.50000 1.0000 + Mn Mn781 1.0 0.72917 0.31250 0.50000 1.0000 + Mn Mn782 1.0 0.77083 0.35417 0.50000 1.0000 + Mn Mn783 1.0 0.81250 0.39583 0.50000 1.0000 + Mn Mn784 1.0 0.85417 0.43750 0.50000 1.0000 + Mn Mn785 1.0 0.89583 0.47917 0.50000 1.0000 + Mn Mn786 1.0 0.93750 0.52083 0.50000 1.0000 + Mn Mn787 1.0 0.97917 0.56250 0.50000 1.0000 + Mn Mn788 1.0 0.02083 0.60417 0.50000 1.0000 + Mn Mn789 1.0 0.06250 0.64583 0.50000 1.0000 + Mn Mn790 1.0 0.10417 0.68750 0.50000 1.0000 + Mn Mn791 1.0 0.14583 0.72917 0.50000 1.0000 + Mn Mn792 1.0 0.18750 0.77083 0.50000 1.0000 + Mn Mn793 1.0 0.77083 0.27083 0.50000 1.0000 + Mn Mn794 1.0 0.81250 0.31250 0.50000 1.0000 + Mn Mn795 1.0 0.85417 0.35417 0.50000 1.0000 + Mn Mn796 1.0 0.89583 0.39583 0.50000 1.0000 + Mn Mn797 1.0 0.93750 0.43750 0.50000 1.0000 + Mn Mn798 1.0 0.97917 0.47917 0.50000 1.0000 + Mn Mn799 1.0 0.02083 0.52083 0.50000 1.0000 + Mn Mn800 1.0 0.06250 0.56250 0.50000 1.0000 + Mn Mn801 1.0 0.10417 0.60417 0.50000 1.0000 + Mn Mn802 1.0 0.14583 0.64583 0.50000 1.0000 + Mn Mn803 1.0 0.18750 0.68750 0.50000 1.0000 + Mn Mn804 1.0 0.22917 0.72917 0.50000 1.0000 + Mn Mn805 1.0 0.81250 0.22917 0.50000 1.0000 + Mn Mn806 1.0 0.85417 0.27083 0.50000 1.0000 + Mn Mn807 1.0 0.89583 0.31250 0.50000 1.0000 + Mn Mn808 1.0 0.93750 0.35417 0.50000 1.0000 + Mn Mn809 1.0 0.97917 0.39583 0.50000 1.0000 + Mn Mn810 1.0 0.02083 0.43750 0.50000 1.0000 + Mn Mn811 1.0 0.06250 0.47917 0.50000 1.0000 + Mn Mn812 1.0 0.10417 0.52083 0.50000 1.0000 + Mn Mn813 1.0 0.14583 0.56250 0.50000 1.0000 + Mn Mn814 1.0 0.18750 0.60417 0.50000 1.0000 + Mn Mn815 1.0 0.22917 0.64583 0.50000 1.0000 + Mn Mn816 1.0 0.27083 0.68750 0.50000 1.0000 + Mn Mn817 1.0 0.85417 0.18750 0.50000 1.0000 + Mn Mn818 1.0 0.89583 0.22917 0.50000 1.0000 + Mn Mn819 1.0 0.93750 0.27083 0.50000 1.0000 + Mn Mn820 1.0 0.97917 0.31250 0.50000 1.0000 + Mn Mn821 1.0 0.02083 0.35417 0.50000 1.0000 + Mn Mn822 1.0 0.06250 0.39583 0.50000 1.0000 + Mn Mn823 1.0 0.10417 0.43750 0.50000 1.0000 + Mn Mn824 1.0 0.14583 0.47917 0.50000 1.0000 + Mn Mn825 1.0 0.18750 0.52083 0.50000 1.0000 + Mn Mn826 1.0 0.22917 0.56250 0.50000 1.0000 + Mn Mn827 1.0 0.27083 0.60417 0.50000 1.0000 + Mn Mn828 1.0 0.31250 0.64583 0.50000 1.0000 + Mn Mn829 1.0 0.89583 0.14583 0.50000 1.0000 + Mn Mn830 1.0 0.93750 0.18750 0.50000 1.0000 + Mn Mn831 1.0 0.97917 0.22917 0.50000 1.0000 + Mn Mn832 1.0 0.02083 0.27083 0.50000 1.0000 + Mn Mn833 1.0 0.06250 0.31250 0.50000 1.0000 + Mn Mn834 1.0 0.10417 0.35417 0.50000 1.0000 + Mn Mn835 1.0 0.14583 0.39583 0.50000 1.0000 + Mn Mn836 1.0 0.18750 0.43750 0.50000 1.0000 + Mn Mn837 1.0 0.22917 0.47917 0.50000 1.0000 + Mn Mn838 1.0 0.27083 0.52083 0.50000 1.0000 + Mn Mn839 1.0 0.31250 0.56250 0.50000 1.0000 + Mn Mn840 1.0 0.35417 0.60417 0.50000 1.0000 + Mn Mn841 1.0 0.93750 0.10417 0.50000 1.0000 + Mn Mn842 1.0 0.97917 0.14583 0.50000 1.0000 + Mn Mn843 1.0 0.02083 0.18750 0.50000 1.0000 + Mn Mn844 1.0 0.06250 0.22917 0.50000 1.0000 + Mn Mn845 1.0 0.10417 0.27083 0.50000 1.0000 + Mn Mn846 1.0 0.14583 0.31250 0.50000 1.0000 + Mn Mn847 1.0 0.18750 0.35417 0.50000 1.0000 + Mn Mn848 1.0 0.22917 0.39583 0.50000 1.0000 + Mn Mn849 1.0 0.27083 0.43750 0.50000 1.0000 + Mn Mn850 1.0 0.31250 0.47917 0.50000 1.0000 + Mn Mn851 1.0 0.35417 0.52083 0.50000 1.0000 + Mn Mn852 1.0 0.39583 0.56250 0.50000 1.0000 + Mn Mn853 1.0 0.97917 0.06250 0.50000 1.0000 + Mn Mn854 1.0 0.02083 0.10417 0.50000 1.0000 + Mn Mn855 1.0 0.06250 0.14583 0.50000 1.0000 + Mn Mn856 1.0 0.10417 0.18750 0.50000 1.0000 + Mn Mn857 1.0 0.14583 0.22917 0.50000 1.0000 + Mn Mn858 1.0 0.18750 0.27083 0.50000 1.0000 + Mn Mn859 1.0 0.22917 0.31250 0.50000 1.0000 + Mn Mn860 1.0 0.27083 0.35417 0.50000 1.0000 + Mn Mn861 1.0 0.31250 0.39583 0.50000 1.0000 + Mn Mn862 1.0 0.35417 0.43750 0.50000 1.0000 + Mn Mn863 1.0 0.39583 0.47917 0.50000 1.0000 + Mn Mn864 1.0 0.43750 0.52083 0.50000 1.0000 + V V145 1.0 0.50000 0.50000 0.50000 1.0000 + V V146 1.0 0.54167 0.54167 0.50000 1.0000 + V V147 1.0 0.58333 0.58333 0.50000 1.0000 + V V148 1.0 0.62500 0.62500 0.50000 1.0000 + V V149 1.0 0.66667 0.66667 0.50000 1.0000 + V V150 1.0 0.20833 0.20833 0.50000 1.0000 + V V151 1.0 0.75000 0.75000 0.50000 1.0000 + V V152 1.0 0.79167 0.79167 0.50000 1.0000 + V V153 1.0 0.83333 0.83333 0.50000 1.0000 + V V154 1.0 0.37500 0.37500 0.50000 1.0000 + V V155 1.0 0.91667 0.91667 0.50000 1.0000 + V V156 1.0 0.95833 0.95833 0.50000 1.0000 + V V157 1.0 0.54167 0.45833 0.50000 1.0000 + V V158 1.0 0.58333 0.50000 0.50000 1.0000 + V V159 1.0 0.62500 0.54167 0.50000 1.0000 + V V160 1.0 0.66667 0.58333 0.50000 1.0000 + V V161 1.0 0.70833 0.62500 0.50000 1.0000 + V V162 1.0 0.75000 0.66667 0.50000 1.0000 + V V163 1.0 0.79167 0.70833 0.50000 1.0000 + V V164 1.0 0.83333 0.75000 0.50000 1.0000 + V V165 1.0 0.87500 0.79167 0.50000 1.0000 + V V166 1.0 0.91667 0.83333 0.50000 1.0000 + V V167 1.0 0.95833 0.87500 0.50000 1.0000 + V V168 1.0 0.00000 0.91667 0.50000 1.0000 + V V169 1.0 0.58333 0.41667 0.50000 1.0000 + V V170 1.0 0.62500 0.45833 0.50000 1.0000 + V V171 1.0 0.66667 0.50000 0.50000 1.0000 + V V172 1.0 0.70833 0.54167 0.50000 1.0000 + V V173 1.0 0.75000 0.58333 0.50000 1.0000 + V V174 1.0 0.79167 0.62500 0.50000 1.0000 + V V175 1.0 0.83333 0.66667 0.50000 1.0000 + V V176 1.0 0.87500 0.70833 0.50000 1.0000 + V V177 1.0 0.91667 0.75000 0.50000 1.0000 + V V178 1.0 0.95833 0.79167 0.50000 1.0000 + V V179 1.0 0.00000 0.83333 0.50000 1.0000 + V V180 1.0 0.04167 0.87500 0.50000 1.0000 + V V181 1.0 0.62500 0.37500 0.50000 1.0000 + V V182 1.0 0.66667 0.41667 0.50000 1.0000 + V V183 1.0 0.70833 0.45833 0.50000 1.0000 + V V184 1.0 0.75000 0.50000 0.50000 1.0000 + V V185 1.0 0.79167 0.54167 0.50000 1.0000 + V V186 1.0 0.83333 0.58333 0.50000 1.0000 + V V187 1.0 0.87500 0.62500 0.50000 1.0000 + V V188 1.0 0.91667 0.66667 0.50000 1.0000 + V V189 1.0 0.95833 0.70833 0.50000 1.0000 + V V190 1.0 0.00000 0.75000 0.50000 1.0000 + V V191 1.0 0.04167 0.79167 0.50000 1.0000 + V V192 1.0 0.08333 0.83333 0.50000 1.0000 + V V193 1.0 0.66667 0.33333 0.50000 1.0000 + V V194 1.0 0.70833 0.37500 0.50000 1.0000 + V V195 1.0 0.75000 0.41667 0.50000 1.0000 + V V196 1.0 0.79167 0.45833 0.50000 1.0000 + V V197 1.0 0.83333 0.50000 0.50000 1.0000 + V V198 1.0 0.87500 0.54167 0.50000 1.0000 + V V199 1.0 0.91667 0.58333 0.50000 1.0000 + V V200 1.0 0.95833 0.62500 0.50000 1.0000 + V V201 1.0 0.00000 0.66667 0.50000 1.0000 + V V202 1.0 0.04167 0.70833 0.50000 1.0000 + V V203 1.0 0.08333 0.75000 0.50000 1.0000 + V V204 1.0 0.12500 0.79167 0.50000 1.0000 + V V205 1.0 0.70833 0.29167 0.50000 1.0000 + V V206 1.0 0.75000 0.33333 0.50000 1.0000 + V V207 1.0 0.79167 0.37500 0.50000 1.0000 + V V208 1.0 0.83333 0.41667 0.50000 1.0000 + V V209 1.0 0.87500 0.45833 0.50000 1.0000 + V V210 1.0 0.91667 0.50000 0.50000 1.0000 + V V211 1.0 0.95833 0.54167 0.50000 1.0000 + V V212 1.0 0.00000 0.58333 0.50000 1.0000 + V V213 1.0 0.04167 0.62500 0.50000 1.0000 + V V214 1.0 0.08333 0.66667 0.50000 1.0000 + V V215 1.0 0.12500 0.70833 0.50000 1.0000 + V V216 1.0 0.16667 0.75000 0.50000 1.0000 + V V217 1.0 0.75000 0.25000 0.50000 1.0000 + V V218 1.0 0.79167 0.29167 0.50000 1.0000 + V V219 1.0 0.83333 0.33333 0.50000 1.0000 + V V220 1.0 0.87500 0.37500 0.50000 1.0000 + V V221 1.0 0.91667 0.41667 0.50000 1.0000 + V V222 1.0 0.95833 0.45833 0.50000 1.0000 + V V223 1.0 0.00000 0.50000 0.50000 1.0000 + V V224 1.0 0.04167 0.54167 0.50000 1.0000 + V V225 1.0 0.08333 0.58333 0.50000 1.0000 + V V226 1.0 0.12500 0.62500 0.50000 1.0000 + V V227 1.0 0.16667 0.66667 0.50000 1.0000 + V V228 1.0 0.20833 0.70833 0.50000 1.0000 + V V229 1.0 0.79167 0.20833 0.50000 1.0000 + V V230 1.0 0.83333 0.25000 0.50000 1.0000 + V V231 1.0 0.87500 0.29167 0.50000 1.0000 + V V232 1.0 0.91667 0.33333 0.50000 1.0000 + V V233 1.0 0.95833 0.37500 0.50000 1.0000 + V V234 1.0 0.00000 0.41667 0.50000 1.0000 + V V235 1.0 0.04167 0.45833 0.50000 1.0000 + V V236 1.0 0.08333 0.50000 0.50000 1.0000 + V V237 1.0 0.12500 0.54167 0.50000 1.0000 + V V238 1.0 0.16667 0.58333 0.50000 1.0000 + V V239 1.0 0.20833 0.62500 0.50000 1.0000 + V V240 1.0 0.25000 0.66667 0.50000 1.0000 + V V241 1.0 0.83333 0.16667 0.50000 1.0000 + V V242 1.0 0.87500 0.20833 0.50000 1.0000 + V V243 1.0 0.91667 0.25000 0.50000 1.0000 + V V244 1.0 0.95833 0.29167 0.50000 1.0000 + V V245 1.0 0.00000 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0000000000000000000000000000000000000000..c147709dd6a6a095e5f132944befbe79d275def1 --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-5185_supercell_12x12x1.cif @@ -0,0 +1,2617 @@ +data_image0 +_chemical_formula_structural Mn288C576O1728 +_chemical_formula_sum "Mn288 C576 O1728" +_cell_length_a 81.8338 +_cell_length_b 88.3221 +_cell_length_c 6.67983 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Mn Mn1 1.0 0.00000 0.00000 0.50000 1.0000 + Mn Mn2 1.0 0.00000 0.08333 0.50000 1.0000 + Mn Mn3 1.0 0.00000 0.16667 0.50000 1.0000 + Mn Mn4 1.0 0.00000 0.25000 0.50000 1.0000 + Mn Mn5 1.0 0.00000 0.33333 0.50000 1.0000 + Mn Mn6 1.0 0.00000 0.41667 0.50000 1.0000 + Mn Mn7 1.0 0.00000 0.50000 0.50000 1.0000 + Mn Mn8 1.0 0.00000 0.58333 0.50000 1.0000 + Mn Mn9 1.0 0.00000 0.66667 0.50000 1.0000 + Mn Mn10 1.0 0.00000 0.75000 0.50000 1.0000 + Mn Mn11 1.0 0.00000 0.83333 0.50000 1.0000 + Mn Mn12 1.0 0.00000 0.91667 0.50000 1.0000 + Mn Mn13 1.0 0.08333 0.00000 0.50000 1.0000 + Mn Mn14 1.0 0.08333 0.08333 0.50000 1.0000 + Mn Mn15 1.0 0.08333 0.16667 0.50000 1.0000 + Mn Mn16 1.0 0.08333 0.25000 0.50000 1.0000 + Mn Mn17 1.0 0.08333 0.33333 0.50000 1.0000 + Mn Mn18 1.0 0.08333 0.41667 0.50000 1.0000 + Mn Mn19 1.0 0.08333 0.50000 0.50000 1.0000 + Mn Mn20 1.0 0.08333 0.58333 0.50000 1.0000 + Mn Mn21 1.0 0.08333 0.66667 0.50000 1.0000 + Mn Mn22 1.0 0.08333 0.75000 0.50000 1.0000 + Mn Mn23 1.0 0.08333 0.83333 0.50000 1.0000 + Mn Mn24 1.0 0.08333 0.91667 0.50000 1.0000 + Mn Mn25 1.0 0.16667 0.00000 0.50000 1.0000 + Mn Mn26 1.0 0.16667 0.08333 0.50000 1.0000 + Mn Mn27 1.0 0.16667 0.16667 0.50000 1.0000 + Mn Mn28 1.0 0.16667 0.25000 0.50000 1.0000 + Mn Mn29 1.0 0.16667 0.33333 0.50000 1.0000 + Mn Mn30 1.0 0.16667 0.41667 0.50000 1.0000 + Mn Mn31 1.0 0.16667 0.50000 0.50000 1.0000 + Mn Mn32 1.0 0.16667 0.58333 0.50000 1.0000 + Mn Mn33 1.0 0.16667 0.66667 0.50000 1.0000 + Mn Mn34 1.0 0.16667 0.75000 0.50000 1.0000 + Mn Mn35 1.0 0.16667 0.83333 0.50000 1.0000 + Mn Mn36 1.0 0.16667 0.91667 0.50000 1.0000 + Mn Mn37 1.0 0.25000 0.00000 0.50000 1.0000 + Mn Mn38 1.0 0.25000 0.08333 0.50000 1.0000 + Mn Mn39 1.0 0.25000 0.16667 0.50000 1.0000 + Mn Mn40 1.0 0.25000 0.25000 0.50000 1.0000 + Mn Mn41 1.0 0.25000 0.33333 0.50000 1.0000 + Mn Mn42 1.0 0.25000 0.41667 0.50000 1.0000 + Mn Mn43 1.0 0.25000 0.50000 0.50000 1.0000 + Mn Mn44 1.0 0.25000 0.58333 0.50000 1.0000 + Mn Mn45 1.0 0.25000 0.66667 0.50000 1.0000 + Mn Mn46 1.0 0.25000 0.75000 0.50000 1.0000 + Mn Mn47 1.0 0.25000 0.83333 0.50000 1.0000 + Mn Mn48 1.0 0.25000 0.91667 0.50000 1.0000 + Mn Mn49 1.0 0.33333 0.00000 0.50000 1.0000 + Mn Mn50 1.0 0.33333 0.08333 0.50000 1.0000 + Mn Mn51 1.0 0.33333 0.16667 0.50000 1.0000 + Mn Mn52 1.0 0.33333 0.25000 0.50000 1.0000 + Mn Mn53 1.0 0.33333 0.33333 0.50000 1.0000 + Mn Mn54 1.0 0.33333 0.41667 0.50000 1.0000 + Mn Mn55 1.0 0.33333 0.50000 0.50000 1.0000 + Mn Mn56 1.0 0.33333 0.58333 0.50000 1.0000 + Mn Mn57 1.0 0.33333 0.66667 0.50000 1.0000 + Mn Mn58 1.0 0.33333 0.75000 0.50000 1.0000 + Mn Mn59 1.0 0.33333 0.83333 0.50000 1.0000 + Mn Mn60 1.0 0.33333 0.91667 0.50000 1.0000 + Mn Mn61 1.0 0.41667 0.00000 0.50000 1.0000 + Mn Mn62 1.0 0.41667 0.08333 0.50000 1.0000 + Mn Mn63 1.0 0.41667 0.16667 0.50000 1.0000 + Mn Mn64 1.0 0.41667 0.25000 0.50000 1.0000 + Mn Mn65 1.0 0.41667 0.33333 0.50000 1.0000 + Mn Mn66 1.0 0.41667 0.41667 0.50000 1.0000 + Mn Mn67 1.0 0.41667 0.50000 0.50000 1.0000 + Mn Mn68 1.0 0.41667 0.58333 0.50000 1.0000 + Mn Mn69 1.0 0.41667 0.66667 0.50000 1.0000 + Mn Mn70 1.0 0.41667 0.75000 0.50000 1.0000 + Mn Mn71 1.0 0.41667 0.83333 0.50000 1.0000 + Mn Mn72 1.0 0.41667 0.91667 0.50000 1.0000 + Mn Mn73 1.0 0.50000 0.00000 0.50000 1.0000 + Mn Mn74 1.0 0.50000 0.08333 0.50000 1.0000 + Mn Mn75 1.0 0.50000 0.16667 0.50000 1.0000 + Mn Mn76 1.0 0.50000 0.25000 0.50000 1.0000 + Mn Mn77 1.0 0.50000 0.33333 0.50000 1.0000 + Mn Mn78 1.0 0.50000 0.41667 0.50000 1.0000 + Mn Mn79 1.0 0.50000 0.50000 0.50000 1.0000 + Mn Mn80 1.0 0.50000 0.58333 0.50000 1.0000 + Mn Mn81 1.0 0.50000 0.66667 0.50000 1.0000 + Mn Mn82 1.0 0.50000 0.75000 0.50000 1.0000 + Mn Mn83 1.0 0.50000 0.83333 0.50000 1.0000 + Mn Mn84 1.0 0.50000 0.91667 0.50000 1.0000 + Mn Mn85 1.0 0.58333 0.00000 0.50000 1.0000 + Mn Mn86 1.0 0.58333 0.08333 0.50000 1.0000 + Mn Mn87 1.0 0.58333 0.16667 0.50000 1.0000 + Mn Mn88 1.0 0.58333 0.25000 0.50000 1.0000 + Mn Mn89 1.0 0.58333 0.33333 0.50000 1.0000 + Mn Mn90 1.0 0.58333 0.41667 0.50000 1.0000 + Mn Mn91 1.0 0.58333 0.50000 0.50000 1.0000 + Mn Mn92 1.0 0.58333 0.58333 0.50000 1.0000 + Mn Mn93 1.0 0.58333 0.66667 0.50000 1.0000 + Mn Mn94 1.0 0.58333 0.75000 0.50000 1.0000 + Mn Mn95 1.0 0.58333 0.83333 0.50000 1.0000 + Mn Mn96 1.0 0.58333 0.91667 0.50000 1.0000 + Mn Mn97 1.0 0.66667 0.00000 0.50000 1.0000 + Mn Mn98 1.0 0.66667 0.08333 0.50000 1.0000 + Mn Mn99 1.0 0.66667 0.16667 0.50000 1.0000 + Mn Mn100 1.0 0.66667 0.25000 0.50000 1.0000 + Mn Mn101 1.0 0.66667 0.33333 0.50000 1.0000 + Mn Mn102 1.0 0.66667 0.41667 0.50000 1.0000 + Mn Mn103 1.0 0.66667 0.50000 0.50000 1.0000 + Mn Mn104 1.0 0.66667 0.58333 0.50000 1.0000 + Mn Mn105 1.0 0.66667 0.66667 0.50000 1.0000 + Mn Mn106 1.0 0.66667 0.75000 0.50000 1.0000 + Mn Mn107 1.0 0.66667 0.83333 0.50000 1.0000 + Mn Mn108 1.0 0.66667 0.91667 0.50000 1.0000 + Mn Mn109 1.0 0.75000 0.00000 0.50000 1.0000 + Mn Mn110 1.0 0.75000 0.08333 0.50000 1.0000 + Mn Mn111 1.0 0.75000 0.16667 0.50000 1.0000 + Mn Mn112 1.0 0.75000 0.25000 0.50000 1.0000 + Mn Mn113 1.0 0.75000 0.33333 0.50000 1.0000 + Mn Mn114 1.0 0.75000 0.41667 0.50000 1.0000 + Mn Mn115 1.0 0.75000 0.50000 0.50000 1.0000 + Mn Mn116 1.0 0.75000 0.58333 0.50000 1.0000 + Mn Mn117 1.0 0.75000 0.66667 0.50000 1.0000 + Mn Mn118 1.0 0.75000 0.75000 0.50000 1.0000 + Mn Mn119 1.0 0.75000 0.83333 0.50000 1.0000 + Mn Mn120 1.0 0.75000 0.91667 0.50000 1.0000 + Mn Mn121 1.0 0.83333 0.00000 0.50000 1.0000 + Mn Mn122 1.0 0.83333 0.08333 0.50000 1.0000 + Mn Mn123 1.0 0.83333 0.16667 0.50000 1.0000 + Mn Mn124 1.0 0.83333 0.25000 0.50000 1.0000 + Mn Mn125 1.0 0.83333 0.33333 0.50000 1.0000 + Mn Mn126 1.0 0.83333 0.41667 0.50000 1.0000 + Mn Mn127 1.0 0.83333 0.50000 0.50000 1.0000 + Mn Mn128 1.0 0.83333 0.58333 0.50000 1.0000 + Mn Mn129 1.0 0.83333 0.66667 0.50000 1.0000 + Mn Mn130 1.0 0.83333 0.75000 0.50000 1.0000 + Mn Mn131 1.0 0.83333 0.83333 0.50000 1.0000 + Mn Mn132 1.0 0.83333 0.91667 0.50000 1.0000 + Mn Mn133 1.0 0.91667 0.00000 0.50000 1.0000 + Mn Mn134 1.0 0.91667 0.08333 0.50000 1.0000 + Mn Mn135 1.0 0.91667 0.16667 0.50000 1.0000 + Mn Mn136 1.0 0.91667 0.25000 0.50000 1.0000 + Mn Mn137 1.0 0.91667 0.33333 0.50000 1.0000 + Mn Mn138 1.0 0.91667 0.41667 0.50000 1.0000 + Mn Mn139 1.0 0.91667 0.50000 0.50000 1.0000 + Mn Mn140 1.0 0.91667 0.58333 0.50000 1.0000 + Mn Mn141 1.0 0.91667 0.66667 0.50000 1.0000 + Mn Mn142 1.0 0.91667 0.75000 0.50000 1.0000 + Mn Mn143 1.0 0.91667 0.83333 0.50000 1.0000 + Mn Mn144 1.0 0.91667 0.91667 0.50000 1.0000 + Mn Mn145 1.0 0.04167 0.04167 0.50000 1.0000 + Mn Mn146 1.0 0.04167 0.12500 0.50000 1.0000 + Mn Mn147 1.0 0.04167 0.20833 0.50000 1.0000 + Mn Mn148 1.0 0.04167 0.29167 0.50000 1.0000 + Mn Mn149 1.0 0.04167 0.37500 0.50000 1.0000 + Mn Mn150 1.0 0.04167 0.45833 0.50000 1.0000 + Mn Mn151 1.0 0.04167 0.54167 0.50000 1.0000 + Mn Mn152 1.0 0.04167 0.62500 0.50000 1.0000 + Mn Mn153 1.0 0.04167 0.70833 0.50000 1.0000 + Mn Mn154 1.0 0.04167 0.79167 0.50000 1.0000 + Mn Mn155 1.0 0.04167 0.87500 0.50000 1.0000 + Mn Mn156 1.0 0.04167 0.95833 0.50000 1.0000 + Mn Mn157 1.0 0.12500 0.04167 0.50000 1.0000 + Mn Mn158 1.0 0.12500 0.12500 0.50000 1.0000 + Mn Mn159 1.0 0.12500 0.20833 0.50000 1.0000 + Mn Mn160 1.0 0.12500 0.29167 0.50000 1.0000 + Mn Mn161 1.0 0.12500 0.37500 0.50000 1.0000 + Mn Mn162 1.0 0.12500 0.45833 0.50000 1.0000 + Mn Mn163 1.0 0.12500 0.54167 0.50000 1.0000 + Mn Mn164 1.0 0.12500 0.62500 0.50000 1.0000 + Mn Mn165 1.0 0.12500 0.70833 0.50000 1.0000 + Mn Mn166 1.0 0.12500 0.79167 0.50000 1.0000 + Mn Mn167 1.0 0.12500 0.87500 0.50000 1.0000 + Mn Mn168 1.0 0.12500 0.95833 0.50000 1.0000 + Mn Mn169 1.0 0.20833 0.04167 0.50000 1.0000 + Mn Mn170 1.0 0.20833 0.12500 0.50000 1.0000 + Mn Mn171 1.0 0.20833 0.20833 0.50000 1.0000 + Mn Mn172 1.0 0.20833 0.29167 0.50000 1.0000 + Mn Mn173 1.0 0.20833 0.37500 0.50000 1.0000 + Mn Mn174 1.0 0.20833 0.45833 0.50000 1.0000 + Mn Mn175 1.0 0.20833 0.54167 0.50000 1.0000 + Mn Mn176 1.0 0.20833 0.62500 0.50000 1.0000 + Mn Mn177 1.0 0.20833 0.70833 0.50000 1.0000 + Mn Mn178 1.0 0.20833 0.79167 0.50000 1.0000 + Mn Mn179 1.0 0.20833 0.87500 0.50000 1.0000 + Mn Mn180 1.0 0.20833 0.95833 0.50000 1.0000 + Mn Mn181 1.0 0.29167 0.04167 0.50000 1.0000 + Mn Mn182 1.0 0.29167 0.12500 0.50000 1.0000 + Mn Mn183 1.0 0.29167 0.20833 0.50000 1.0000 + Mn Mn184 1.0 0.29167 0.29167 0.50000 1.0000 + Mn Mn185 1.0 0.29167 0.37500 0.50000 1.0000 + Mn Mn186 1.0 0.29167 0.45833 0.50000 1.0000 + Mn Mn187 1.0 0.29167 0.54167 0.50000 1.0000 + Mn Mn188 1.0 0.29167 0.62500 0.50000 1.0000 + Mn Mn189 1.0 0.29167 0.70833 0.50000 1.0000 + Mn Mn190 1.0 0.29167 0.79167 0.50000 1.0000 + Mn Mn191 1.0 0.29167 0.87500 0.50000 1.0000 + Mn Mn192 1.0 0.29167 0.95833 0.50000 1.0000 + Mn Mn193 1.0 0.37500 0.04167 0.50000 1.0000 + Mn Mn194 1.0 0.37500 0.12500 0.50000 1.0000 + Mn Mn195 1.0 0.37500 0.20833 0.50000 1.0000 + Mn Mn196 1.0 0.37500 0.29167 0.50000 1.0000 + Mn Mn197 1.0 0.37500 0.37500 0.50000 1.0000 + Mn Mn198 1.0 0.37500 0.45833 0.50000 1.0000 + Mn Mn199 1.0 0.37500 0.54167 0.50000 1.0000 + Mn Mn200 1.0 0.37500 0.62500 0.50000 1.0000 + Mn Mn201 1.0 0.37500 0.70833 0.50000 1.0000 + Mn Mn202 1.0 0.37500 0.79167 0.50000 1.0000 + Mn Mn203 1.0 0.37500 0.87500 0.50000 1.0000 + Mn Mn204 1.0 0.37500 0.95833 0.50000 1.0000 + Mn Mn205 1.0 0.45833 0.04167 0.50000 1.0000 + Mn Mn206 1.0 0.45833 0.12500 0.50000 1.0000 + Mn Mn207 1.0 0.45833 0.20833 0.50000 1.0000 + Mn Mn208 1.0 0.45833 0.29167 0.50000 1.0000 + Mn Mn209 1.0 0.45833 0.37500 0.50000 1.0000 + Mn Mn210 1.0 0.45833 0.45833 0.50000 1.0000 + Mn Mn211 1.0 0.45833 0.54167 0.50000 1.0000 + Mn Mn212 1.0 0.45833 0.62500 0.50000 1.0000 + Mn Mn213 1.0 0.45833 0.70833 0.50000 1.0000 + Mn Mn214 1.0 0.45833 0.79167 0.50000 1.0000 + Mn Mn215 1.0 0.45833 0.87500 0.50000 1.0000 + Mn Mn216 1.0 0.45833 0.95833 0.50000 1.0000 + Mn Mn217 1.0 0.54167 0.04167 0.50000 1.0000 + Mn Mn218 1.0 0.54167 0.12500 0.50000 1.0000 + Mn Mn219 1.0 0.54167 0.20833 0.50000 1.0000 + Mn Mn220 1.0 0.54167 0.29167 0.50000 1.0000 + Mn Mn221 1.0 0.54167 0.37500 0.50000 1.0000 + Mn Mn222 1.0 0.54167 0.45833 0.50000 1.0000 + Mn Mn223 1.0 0.54167 0.54167 0.50000 1.0000 + Mn Mn224 1.0 0.54167 0.62500 0.50000 1.0000 + Mn Mn225 1.0 0.54167 0.70833 0.50000 1.0000 + Mn Mn226 1.0 0.54167 0.79167 0.50000 1.0000 + Mn Mn227 1.0 0.54167 0.87500 0.50000 1.0000 + Mn Mn228 1.0 0.54167 0.95833 0.50000 1.0000 + Mn Mn229 1.0 0.62500 0.04167 0.50000 1.0000 + Mn Mn230 1.0 0.62500 0.12500 0.50000 1.0000 + Mn Mn231 1.0 0.62500 0.20833 0.50000 1.0000 + Mn Mn232 1.0 0.62500 0.29167 0.50000 1.0000 + Mn Mn233 1.0 0.62500 0.37500 0.50000 1.0000 + Mn Mn234 1.0 0.62500 0.45833 0.50000 1.0000 + Mn Mn235 1.0 0.62500 0.54167 0.50000 1.0000 + Mn Mn236 1.0 0.62500 0.62500 0.50000 1.0000 + Mn Mn237 1.0 0.62500 0.70833 0.50000 1.0000 + Mn Mn238 1.0 0.62500 0.79167 0.50000 1.0000 + Mn Mn239 1.0 0.62500 0.87500 0.50000 1.0000 + Mn Mn240 1.0 0.62500 0.95833 0.50000 1.0000 + Mn Mn241 1.0 0.70833 0.04167 0.50000 1.0000 + Mn Mn242 1.0 0.70833 0.12500 0.50000 1.0000 + Mn Mn243 1.0 0.70833 0.20833 0.50000 1.0000 + Mn Mn244 1.0 0.70833 0.29167 0.50000 1.0000 + Mn Mn245 1.0 0.70833 0.37500 0.50000 1.0000 + Mn Mn246 1.0 0.70833 0.45833 0.50000 1.0000 + Mn Mn247 1.0 0.70833 0.54167 0.50000 1.0000 + Mn Mn248 1.0 0.70833 0.62500 0.50000 1.0000 + Mn Mn249 1.0 0.70833 0.70833 0.50000 1.0000 + Mn Mn250 1.0 0.70833 0.79167 0.50000 1.0000 + Mn Mn251 1.0 0.70833 0.87500 0.50000 1.0000 + Mn Mn252 1.0 0.70833 0.95833 0.50000 1.0000 + Mn Mn253 1.0 0.79167 0.04167 0.50000 1.0000 + Mn Mn254 1.0 0.79167 0.12500 0.50000 1.0000 + Mn Mn255 1.0 0.79167 0.20833 0.50000 1.0000 + Mn Mn256 1.0 0.79167 0.29167 0.50000 1.0000 + Mn Mn257 1.0 0.79167 0.37500 0.50000 1.0000 + Mn Mn258 1.0 0.79167 0.45833 0.50000 1.0000 + Mn Mn259 1.0 0.79167 0.54167 0.50000 1.0000 + Mn Mn260 1.0 0.79167 0.62500 0.50000 1.0000 + Mn Mn261 1.0 0.79167 0.70833 0.50000 1.0000 + Mn Mn262 1.0 0.79167 0.79167 0.50000 1.0000 + Mn Mn263 1.0 0.79167 0.87500 0.50000 1.0000 + Mn Mn264 1.0 0.79167 0.95833 0.50000 1.0000 + Mn Mn265 1.0 0.87500 0.04167 0.50000 1.0000 + Mn Mn266 1.0 0.87500 0.12500 0.50000 1.0000 + Mn Mn267 1.0 0.87500 0.20833 0.50000 1.0000 + Mn Mn268 1.0 0.87500 0.29167 0.50000 1.0000 + Mn Mn269 1.0 0.87500 0.37500 0.50000 1.0000 + Mn Mn270 1.0 0.87500 0.45833 0.50000 1.0000 + Mn Mn271 1.0 0.87500 0.54167 0.50000 1.0000 + Mn Mn272 1.0 0.87500 0.62500 0.50000 1.0000 + Mn Mn273 1.0 0.87500 0.70833 0.50000 1.0000 + Mn Mn274 1.0 0.87500 0.79167 0.50000 1.0000 + Mn Mn275 1.0 0.87500 0.87500 0.50000 1.0000 + Mn Mn276 1.0 0.87500 0.95833 0.50000 1.0000 + Mn Mn277 1.0 0.95833 0.04167 0.50000 1.0000 + Mn Mn278 1.0 0.95833 0.12500 0.50000 1.0000 + Mn Mn279 1.0 0.95833 0.20833 0.50000 1.0000 + Mn Mn280 1.0 0.95833 0.29167 0.50000 1.0000 + Mn Mn281 1.0 0.95833 0.37500 0.50000 1.0000 + Mn Mn282 1.0 0.95833 0.45833 0.50000 1.0000 + Mn Mn283 1.0 0.95833 0.54167 0.50000 1.0000 + Mn Mn284 1.0 0.95833 0.62500 0.50000 1.0000 + Mn Mn285 1.0 0.95833 0.70833 0.50000 1.0000 + Mn Mn286 1.0 0.95833 0.79167 0.50000 1.0000 + Mn Mn287 1.0 0.95833 0.87500 0.50000 1.0000 + Mn Mn288 1.0 0.95833 0.95833 0.50000 1.0000 + C C1 1.0 0.06864 0.02208 0.58556 1.0000 + C C2 1.0 0.06864 0.10541 0.58556 1.0000 + C C3 1.0 0.06864 0.18874 0.58556 1.0000 + 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a/tier3/cif_file/orthogonal_2dm-5186_supercell_12x12x1.cif b/tier3/cif_file/orthogonal_2dm-5186_supercell_12x12x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..d63463e6bff62a880fd1f2a3a91618e33743c4fe --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-5186_supercell_12x12x1.cif @@ -0,0 +1,3481 @@ +data_image0 +_chemical_formula_structural Co432Sb144O1152Co432Sb144O1152 +_chemical_formula_sum "Co864 Sb288 O2304" +_cell_length_a 124.708 +_cell_length_b 72.0001 +_cell_length_c 5.98902 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Co Co1 1.0 0.01389 0.00000 0.50000 1.0000 + Co Co2 1.0 0.05556 0.04167 0.50000 1.0000 + Co Co3 1.0 0.09722 0.08333 0.50000 1.0000 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Sb Sb275 1.0 0.38889 0.50000 0.50000 1.0000 + Sb Sb276 1.0 0.43056 0.54167 0.50000 1.0000 + Sb Sb277 1.0 0.01389 0.04167 0.50000 1.0000 + Sb Sb278 1.0 0.05556 0.08333 0.50000 1.0000 + Sb Sb279 1.0 0.09722 0.12500 0.50000 1.0000 + Sb Sb280 1.0 0.13889 0.16667 0.50000 1.0000 + Sb Sb281 1.0 0.18056 0.20833 0.50000 1.0000 + Sb Sb282 1.0 0.22222 0.25000 0.50000 1.0000 + Sb Sb283 1.0 0.26389 0.29167 0.50000 1.0000 + Sb Sb284 1.0 0.30556 0.33333 0.50000 1.0000 + Sb Sb285 1.0 0.34722 0.37500 0.50000 1.0000 + Sb Sb286 1.0 0.38889 0.41667 0.50000 1.0000 + Sb Sb287 1.0 0.43056 0.45833 0.50000 1.0000 + Sb Sb288 1.0 0.47222 0.50000 0.50000 1.0000 + O O1153 1.0 0.54852 0.52112 0.33394 1.0000 + O O1154 1.0 0.59018 0.56278 0.33394 1.0000 + O O1155 1.0 0.63185 0.60445 0.33394 1.0000 + O O1156 1.0 0.67352 0.64612 0.33394 1.0000 + O O1157 1.0 0.71518 0.68778 0.33394 1.0000 + O O1158 1.0 0.75685 0.72945 0.33394 1.0000 + O O1159 1.0 0.79852 0.77112 0.33394 1.0000 + O O1160 1.0 0.84018 0.81278 0.33394 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O1183 1.0 0.88185 0.68778 0.33394 1.0000 + O O1184 1.0 0.92352 0.72945 0.33394 1.0000 + O O1185 1.0 0.96518 0.77112 0.33394 1.0000 + O O1186 1.0 0.00685 0.81278 0.33394 1.0000 + O O1187 1.0 0.04852 0.85445 0.33394 1.0000 + O O1188 1.0 0.09018 0.89612 0.33394 1.0000 + O O1189 1.0 0.67352 0.39612 0.33394 1.0000 + O O1190 1.0 0.71518 0.43778 0.33394 1.0000 + O O1191 1.0 0.75685 0.47945 0.33394 1.0000 + O O1192 1.0 0.79852 0.52112 0.33394 1.0000 + O O1193 1.0 0.84018 0.56278 0.33394 1.0000 + O O1194 1.0 0.88185 0.60445 0.33394 1.0000 + O O1195 1.0 0.92352 0.64612 0.33394 1.0000 + O O1196 1.0 0.96518 0.68778 0.33394 1.0000 + O O1197 1.0 0.00685 0.72945 0.33394 1.0000 + O O1198 1.0 0.04852 0.77112 0.33394 1.0000 + O O1199 1.0 0.09018 0.81278 0.33394 1.0000 + O O1200 1.0 0.13185 0.85445 0.33394 1.0000 + O O1201 1.0 0.71518 0.35445 0.33394 1.0000 + O O1202 1.0 0.75685 0.39612 0.33394 1.0000 + O O1203 1.0 0.79852 0.43778 0.33394 1.0000 + O O1204 1.0 0.84018 0.47945 0.33394 1.0000 + O O1205 1.0 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O1294 1.0 0.38185 0.43778 0.33394 1.0000 + O O1295 1.0 0.42352 0.47945 0.33394 1.0000 + O O1296 1.0 0.46518 0.52112 0.33394 1.0000 + O O1297 1.0 0.54852 0.47888 0.33394 1.0000 + O O1298 1.0 0.59018 0.52055 0.33394 1.0000 + O O1299 1.0 0.63185 0.56222 0.33394 1.0000 + O O1300 1.0 0.67352 0.60388 0.33394 1.0000 + O O1301 1.0 0.71518 0.64555 0.33394 1.0000 + O O1302 1.0 0.75685 0.68722 0.33394 1.0000 + O O1303 1.0 0.79852 0.72888 0.33394 1.0000 + O O1304 1.0 0.84018 0.77055 0.33394 1.0000 + O O1305 1.0 0.88185 0.81222 0.33394 1.0000 + O O1306 1.0 0.92352 0.85388 0.33394 1.0000 + O O1307 1.0 0.96518 0.89555 0.33394 1.0000 + O O1308 1.0 0.00685 0.93722 0.33394 1.0000 + O O1309 1.0 0.59018 0.43722 0.33394 1.0000 + O O1310 1.0 0.63185 0.47888 0.33394 1.0000 + O O1311 1.0 0.67352 0.52055 0.33394 1.0000 + O O1312 1.0 0.71518 0.56222 0.33394 1.0000 + O O1313 1.0 0.75685 0.60388 0.33394 1.0000 + O O1314 1.0 0.79852 0.64555 0.33394 1.0000 + O O1315 1.0 0.84018 0.68722 0.33394 1.0000 + O O1316 1.0 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O2293 1.0 0.97926 0.06222 0.66606 1.0000 + O O2294 1.0 0.02093 0.10388 0.66606 1.0000 + O O2295 1.0 0.06259 0.14555 0.66606 1.0000 + O O2296 1.0 0.10426 0.18722 0.66606 1.0000 + O O2297 1.0 0.14593 0.22888 0.66606 1.0000 + O O2298 1.0 0.18759 0.27055 0.66606 1.0000 + O O2299 1.0 0.22926 0.31222 0.66606 1.0000 + O O2300 1.0 0.27093 0.35388 0.66606 1.0000 + O O2301 1.0 0.31259 0.39555 0.66606 1.0000 + O O2302 1.0 0.35426 0.43722 0.66606 1.0000 + O O2303 1.0 0.39593 0.47888 0.66606 1.0000 + O O2304 1.0 0.43759 0.52055 0.66606 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-5194_supercell_12x12x1.cif b/tier3/cif_file/orthogonal_2dm-5194_supercell_12x12x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..6861f8267f4f5d25523ff8fca0c89ec54e3ea11f --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-5194_supercell_12x12x1.cif @@ -0,0 +1,2617 @@ +data_image0 +_chemical_formula_structural Li288Mn144F864Li288Mn144F864 +_chemical_formula_sum "Li576 Mn288 F1728" 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Li Li276 1.0 0.94442 0.91667 0.67387 1.0000 + Li Li277 1.0 0.44442 0.50000 0.67387 1.0000 + Li Li278 1.0 0.40275 0.54167 0.67387 1.0000 + Li Li279 1.0 0.36109 0.58333 0.67387 1.0000 + Li Li280 1.0 0.31942 0.62500 0.67387 1.0000 + Li Li281 1.0 0.27775 0.66667 0.67387 1.0000 + Li Li282 1.0 0.23609 0.70833 0.67387 1.0000 + Li Li283 1.0 0.19442 0.75000 0.67387 1.0000 + Li Li284 1.0 0.15275 0.79167 0.67387 1.0000 + Li Li285 1.0 0.11109 0.83333 0.67387 1.0000 + Li Li286 1.0 0.06942 0.87500 0.67387 1.0000 + Li Li287 1.0 0.02775 0.91667 0.67387 1.0000 + Li Li288 1.0 0.98609 0.95833 0.67387 1.0000 + Mn Mn1 1.0 0.04165 0.04168 0.50000 1.0000 + Mn Mn2 1.0 0.99998 0.08334 0.50000 1.0000 + Mn Mn3 1.0 0.95831 0.12501 0.50000 1.0000 + Mn Mn4 1.0 0.91665 0.16668 0.50000 1.0000 + Mn Mn5 1.0 0.87498 0.20834 0.50000 1.0000 + Mn Mn6 1.0 0.83331 0.25001 0.50000 1.0000 + Mn Mn7 1.0 0.79165 0.29168 0.50000 1.0000 + Mn Mn8 1.0 0.74998 0.33334 0.50000 1.0000 + Mn Mn9 1.0 0.70831 0.37501 0.50000 1.0000 + Mn Mn10 1.0 0.66665 0.41668 0.50000 1.0000 + Mn Mn11 1.0 0.62498 0.45834 0.50000 1.0000 + Mn Mn12 1.0 0.58331 0.50001 0.50000 1.0000 + Mn Mn13 1.0 0.08331 0.08334 0.50000 1.0000 + Mn Mn14 1.0 0.04165 0.12501 0.50000 1.0000 + Mn Mn15 1.0 0.99998 0.16668 0.50000 1.0000 + Mn Mn16 1.0 0.95831 0.20834 0.50000 1.0000 + Mn Mn17 1.0 0.91665 0.25001 0.50000 1.0000 + Mn Mn18 1.0 0.87498 0.29168 0.50000 1.0000 + Mn Mn19 1.0 0.83331 0.33334 0.50000 1.0000 + Mn Mn20 1.0 0.79165 0.37501 0.50000 1.0000 + Mn Mn21 1.0 0.74998 0.41668 0.50000 1.0000 + Mn Mn22 1.0 0.70831 0.45834 0.50000 1.0000 + Mn Mn23 1.0 0.66665 0.50001 0.50000 1.0000 + Mn Mn24 1.0 0.62498 0.54168 0.50000 1.0000 + Mn Mn25 1.0 0.12498 0.12501 0.50000 1.0000 + Mn Mn26 1.0 0.08331 0.16668 0.50000 1.0000 + Mn Mn27 1.0 0.04165 0.20834 0.50000 1.0000 + Mn Mn28 1.0 0.99998 0.25001 0.50000 1.0000 + Mn Mn29 1.0 0.95831 0.29168 0.50000 1.0000 + Mn Mn30 1.0 0.91665 0.33334 0.50000 1.0000 + Mn Mn31 1.0 0.87498 0.37501 0.50000 1.0000 + Mn Mn32 1.0 0.83331 0.41668 0.50000 1.0000 + Mn Mn33 1.0 0.79165 0.45834 0.50000 1.0000 + Mn Mn34 1.0 0.74998 0.50001 0.50000 1.0000 + Mn Mn35 1.0 0.70831 0.54168 0.50000 1.0000 + Mn Mn36 1.0 0.66665 0.58334 0.50000 1.0000 + Mn Mn37 1.0 0.16665 0.16668 0.50000 1.0000 + Mn Mn38 1.0 0.12498 0.20834 0.50000 1.0000 + Mn Mn39 1.0 0.08331 0.25001 0.50000 1.0000 + Mn Mn40 1.0 0.04165 0.29168 0.50000 1.0000 + Mn Mn41 1.0 0.99998 0.33334 0.50000 1.0000 + Mn Mn42 1.0 0.95831 0.37501 0.50000 1.0000 + Mn Mn43 1.0 0.91665 0.41668 0.50000 1.0000 + Mn Mn44 1.0 0.87498 0.45834 0.50000 1.0000 + Mn Mn45 1.0 0.83331 0.50001 0.50000 1.0000 + Mn Mn46 1.0 0.79165 0.54168 0.50000 1.0000 + Mn Mn47 1.0 0.74998 0.58334 0.50000 1.0000 + Mn Mn48 1.0 0.70831 0.62501 0.50000 1.0000 + Mn Mn49 1.0 0.20831 0.20834 0.50000 1.0000 + Mn Mn50 1.0 0.16665 0.25001 0.50000 1.0000 + Mn Mn51 1.0 0.12498 0.29168 0.50000 1.0000 + Mn Mn52 1.0 0.08331 0.33334 0.50000 1.0000 + Mn Mn53 1.0 0.04165 0.37501 0.50000 1.0000 + Mn Mn54 1.0 0.99998 0.41668 0.50000 1.0000 + Mn Mn55 1.0 0.95831 0.45834 0.50000 1.0000 + Mn Mn56 1.0 0.91665 0.50001 0.50000 1.0000 + Mn Mn57 1.0 0.87498 0.54168 0.50000 1.0000 + Mn Mn58 1.0 0.83331 0.58334 0.50000 1.0000 + Mn Mn59 1.0 0.79165 0.62501 0.50000 1.0000 + Mn Mn60 1.0 0.74998 0.66668 0.50000 1.0000 + Mn Mn61 1.0 0.24998 0.25001 0.50000 1.0000 + Mn Mn62 1.0 0.20831 0.29168 0.50000 1.0000 + Mn Mn63 1.0 0.16665 0.33334 0.50000 1.0000 + Mn Mn64 1.0 0.12498 0.37501 0.50000 1.0000 + Mn Mn65 1.0 0.08331 0.41668 0.50000 1.0000 + Mn Mn66 1.0 0.04165 0.45834 0.50000 1.0000 + Mn Mn67 1.0 0.99998 0.50001 0.50000 1.0000 + Mn Mn68 1.0 0.95831 0.54168 0.50000 1.0000 + Mn Mn69 1.0 0.91665 0.58334 0.50000 1.0000 + Mn Mn70 1.0 0.87498 0.62501 0.50000 1.0000 + Mn Mn71 1.0 0.83331 0.66668 0.50000 1.0000 + Mn Mn72 1.0 0.79165 0.70834 0.50000 1.0000 + Mn Mn73 1.0 0.29165 0.29168 0.50000 1.0000 + Mn Mn74 1.0 0.24998 0.33334 0.50000 1.0000 + Mn Mn75 1.0 0.20831 0.37501 0.50000 1.0000 + Mn Mn76 1.0 0.16665 0.41668 0.50000 1.0000 + Mn Mn77 1.0 0.12498 0.45834 0.50000 1.0000 + Mn Mn78 1.0 0.08331 0.50001 0.50000 1.0000 + Mn Mn79 1.0 0.04165 0.54168 0.50000 1.0000 + Mn Mn80 1.0 0.99998 0.58334 0.50000 1.0000 + Mn Mn81 1.0 0.95831 0.62501 0.50000 1.0000 + Mn Mn82 1.0 0.91665 0.66668 0.50000 1.0000 + Mn Mn83 1.0 0.87498 0.70834 0.50000 1.0000 + Mn Mn84 1.0 0.83331 0.75001 0.50000 1.0000 + Mn Mn85 1.0 0.33331 0.33334 0.50000 1.0000 + Mn Mn86 1.0 0.29165 0.37501 0.50000 1.0000 + Mn Mn87 1.0 0.24998 0.41668 0.50000 1.0000 + Mn Mn88 1.0 0.20831 0.45834 0.50000 1.0000 + Mn Mn89 1.0 0.16665 0.50001 0.50000 1.0000 + Mn Mn90 1.0 0.12498 0.54168 0.50000 1.0000 + Mn Mn91 1.0 0.08331 0.58334 0.50000 1.0000 + Mn Mn92 1.0 0.04165 0.62501 0.50000 1.0000 + Mn Mn93 1.0 0.99998 0.66668 0.50000 1.0000 + Mn Mn94 1.0 0.95831 0.70834 0.50000 1.0000 + Mn Mn95 1.0 0.91665 0.75001 0.50000 1.0000 + Mn Mn96 1.0 0.87498 0.79168 0.50000 1.0000 + Mn Mn97 1.0 0.37498 0.37501 0.50000 1.0000 + Mn Mn98 1.0 0.33331 0.41668 0.50000 1.0000 + Mn Mn99 1.0 0.29165 0.45834 0.50000 1.0000 + Mn Mn100 1.0 0.24998 0.50001 0.50000 1.0000 + Mn Mn101 1.0 0.20831 0.54168 0.50000 1.0000 + Mn Mn102 1.0 0.16665 0.58334 0.50000 1.0000 + Mn Mn103 1.0 0.12498 0.62501 0.50000 1.0000 + Mn Mn104 1.0 0.08331 0.66668 0.50000 1.0000 + Mn Mn105 1.0 0.04165 0.70834 0.50000 1.0000 + Mn Mn106 1.0 0.99998 0.75001 0.50000 1.0000 + Mn Mn107 1.0 0.95831 0.79168 0.50000 1.0000 + Mn Mn108 1.0 0.91665 0.83334 0.50000 1.0000 + Mn Mn109 1.0 0.41665 0.41668 0.50000 1.0000 + Mn Mn110 1.0 0.37498 0.45834 0.50000 1.0000 + Mn Mn111 1.0 0.33331 0.50001 0.50000 1.0000 + Mn Mn112 1.0 0.29165 0.54168 0.50000 1.0000 + Mn Mn113 1.0 0.24998 0.58334 0.50000 1.0000 + Mn Mn114 1.0 0.20831 0.62501 0.50000 1.0000 + Mn Mn115 1.0 0.16665 0.66668 0.50000 1.0000 + Mn Mn116 1.0 0.12498 0.70834 0.50000 1.0000 + Mn Mn117 1.0 0.08331 0.75001 0.50000 1.0000 + Mn Mn118 1.0 0.04165 0.79168 0.50000 1.0000 + Mn Mn119 1.0 0.99998 0.83334 0.50000 1.0000 + Mn Mn120 1.0 0.95831 0.87501 0.50000 1.0000 + Mn Mn121 1.0 0.45831 0.45834 0.50000 1.0000 + Mn Mn122 1.0 0.41665 0.50001 0.50000 1.0000 + Mn Mn123 1.0 0.37498 0.54168 0.50000 1.0000 + Mn Mn124 1.0 0.33331 0.58334 0.50000 1.0000 + Mn Mn125 1.0 0.29165 0.62501 0.50000 1.0000 + Mn Mn126 1.0 0.24998 0.66668 0.50000 1.0000 + Mn Mn127 1.0 0.20831 0.70834 0.50000 1.0000 + Mn Mn128 1.0 0.16665 0.75001 0.50000 1.0000 + Mn Mn129 1.0 0.12498 0.79168 0.50000 1.0000 + Mn Mn130 1.0 0.08331 0.83334 0.50000 1.0000 + Mn Mn131 1.0 0.04165 0.87501 0.50000 1.0000 + Mn Mn132 1.0 0.99998 0.91668 0.50000 1.0000 + Mn Mn133 1.0 0.49998 0.50001 0.50000 1.0000 + Mn Mn134 1.0 0.45831 0.54168 0.50000 1.0000 + Mn Mn135 1.0 0.41665 0.58334 0.50000 1.0000 + Mn Mn136 1.0 0.37498 0.62501 0.50000 1.0000 + Mn Mn137 1.0 0.33331 0.66668 0.50000 1.0000 + Mn Mn138 1.0 0.29165 0.70834 0.50000 1.0000 + Mn Mn139 1.0 0.24998 0.75001 0.50000 1.0000 + Mn Mn140 1.0 0.20831 0.79168 0.50000 1.0000 + Mn Mn141 1.0 0.16665 0.83334 0.50000 1.0000 + Mn Mn142 1.0 0.12498 0.87501 0.50000 1.0000 + Mn Mn143 1.0 0.08331 0.91668 0.50000 1.0000 + Mn Mn144 1.0 0.04165 0.95834 0.50000 1.0000 + F F1 1.0 0.00625 0.06452 0.32794 1.0000 + F F2 1.0 0.96459 0.10619 0.32794 1.0000 + F F3 1.0 0.92292 0.14785 0.32794 1.0000 + F F4 1.0 0.88125 0.18952 0.32794 1.0000 + F F5 1.0 0.83959 0.23119 0.32794 1.0000 + F F6 1.0 0.79792 0.27285 0.32794 1.0000 + F F7 1.0 0.75625 0.31452 0.32794 1.0000 + F F8 1.0 0.71459 0.35619 0.32794 1.0000 + F F9 1.0 0.67292 0.39785 0.32794 1.0000 + F F10 1.0 0.63125 0.43952 0.32794 1.0000 + F F11 1.0 0.58959 0.48119 0.32794 1.0000 + F F12 1.0 0.54792 0.52285 0.32794 1.0000 + F F13 1.0 0.04792 0.10619 0.32794 1.0000 + F F14 1.0 0.00625 0.14785 0.32794 1.0000 + F F15 1.0 0.96459 0.18952 0.32794 1.0000 + F F16 1.0 0.92292 0.23119 0.32794 1.0000 + F F17 1.0 0.88125 0.27285 0.32794 1.0000 + F F18 1.0 0.83959 0.31452 0.32794 1.0000 + F F19 1.0 0.79792 0.35619 0.32794 1.0000 + F F20 1.0 0.75625 0.39785 0.32794 1.0000 + F F21 1.0 0.71459 0.43952 0.32794 1.0000 + F F22 1.0 0.67292 0.48119 0.32794 1.0000 + F F23 1.0 0.63125 0.52285 0.32794 1.0000 + F F24 1.0 0.58959 0.56452 0.32794 1.0000 + F F25 1.0 0.08959 0.14785 0.32794 1.0000 + F F26 1.0 0.04792 0.18952 0.32794 1.0000 + F F27 1.0 0.00625 0.23119 0.32794 1.0000 + F F28 1.0 0.96459 0.27285 0.32794 1.0000 + F F29 1.0 0.92292 0.31452 0.32794 1.0000 + F F30 1.0 0.88125 0.35619 0.32794 1.0000 + F F31 1.0 0.83959 0.39785 0.32794 1.0000 + F F32 1.0 0.79792 0.43952 0.32794 1.0000 + F F33 1.0 0.75625 0.48119 0.32794 1.0000 + F F34 1.0 0.71459 0.52285 0.32794 1.0000 + F F35 1.0 0.67292 0.56452 0.32794 1.0000 + F F36 1.0 0.63125 0.60619 0.32794 1.0000 + F F37 1.0 0.13125 0.18952 0.32794 1.0000 + F F38 1.0 0.08959 0.23119 0.32794 1.0000 + F F39 1.0 0.04792 0.27285 0.32794 1.0000 + F F40 1.0 0.00625 0.31452 0.32794 1.0000 + F F41 1.0 0.96459 0.35619 0.32794 1.0000 + F F42 1.0 0.92292 0.39785 0.32794 1.0000 + F F43 1.0 0.88125 0.43952 0.32794 1.0000 + F F44 1.0 0.83959 0.48119 0.32794 1.0000 + F F45 1.0 0.79792 0.52285 0.32794 1.0000 + F F46 1.0 0.75625 0.56452 0.32794 1.0000 + F F47 1.0 0.71459 0.60619 0.32794 1.0000 + F F48 1.0 0.67292 0.64785 0.32794 1.0000 + F F49 1.0 0.17292 0.23119 0.32794 1.0000 + F F50 1.0 0.13125 0.27285 0.32794 1.0000 + F F51 1.0 0.08959 0.31452 0.32794 1.0000 + F F52 1.0 0.04792 0.35619 0.32794 1.0000 + F F53 1.0 0.00625 0.39785 0.32794 1.0000 + F F54 1.0 0.96459 0.43952 0.32794 1.0000 + F F55 1.0 0.92292 0.48119 0.32794 1.0000 + F F56 1.0 0.88125 0.52285 0.32794 1.0000 + F F57 1.0 0.83959 0.56452 0.32794 1.0000 + F F58 1.0 0.79792 0.60619 0.32794 1.0000 + F F59 1.0 0.75625 0.64785 0.32794 1.0000 + F F60 1.0 0.71459 0.68952 0.32794 1.0000 + F F61 1.0 0.21459 0.27285 0.32794 1.0000 + F F62 1.0 0.17292 0.31452 0.32794 1.0000 + F F63 1.0 0.13125 0.35619 0.32794 1.0000 + F F64 1.0 0.08959 0.39785 0.32794 1.0000 + F F65 1.0 0.04792 0.43952 0.32794 1.0000 + F F66 1.0 0.00625 0.48119 0.32794 1.0000 + F F67 1.0 0.96459 0.52285 0.32794 1.0000 + F F68 1.0 0.92292 0.56452 0.32794 1.0000 + F F69 1.0 0.88125 0.60619 0.32794 1.0000 + F F70 1.0 0.83959 0.64785 0.32794 1.0000 + F F71 1.0 0.79792 0.68952 0.32794 1.0000 + F F72 1.0 0.75625 0.73119 0.32794 1.0000 + F F73 1.0 0.25625 0.31452 0.32794 1.0000 + F F74 1.0 0.21459 0.35619 0.32794 1.0000 + F F75 1.0 0.17292 0.39785 0.32794 1.0000 + F F76 1.0 0.13125 0.43952 0.32794 1.0000 + F F77 1.0 0.08959 0.48119 0.32794 1.0000 + F F78 1.0 0.04792 0.52285 0.32794 1.0000 + F F79 1.0 0.00625 0.56452 0.32794 1.0000 + F F80 1.0 0.96459 0.60619 0.32794 1.0000 + F F81 1.0 0.92292 0.64785 0.32794 1.0000 + F F82 1.0 0.88125 0.68952 0.32794 1.0000 + F F83 1.0 0.83959 0.73119 0.32794 1.0000 + F F84 1.0 0.79792 0.77285 0.32794 1.0000 + F F85 1.0 0.29792 0.35619 0.32794 1.0000 + F F86 1.0 0.25625 0.39785 0.32794 1.0000 + F F87 1.0 0.21459 0.43952 0.32794 1.0000 + F F88 1.0 0.17292 0.48119 0.32794 1.0000 + F F89 1.0 0.13125 0.52285 0.32794 1.0000 + F F90 1.0 0.08959 0.56452 0.32794 1.0000 + F F91 1.0 0.04792 0.60619 0.32794 1.0000 + F F92 1.0 0.00625 0.64785 0.32794 1.0000 + F F93 1.0 0.96459 0.68952 0.32794 1.0000 + F F94 1.0 0.92292 0.73119 0.32794 1.0000 + F F95 1.0 0.88125 0.77285 0.32794 1.0000 + F F96 1.0 0.83959 0.81452 0.32794 1.0000 + F F97 1.0 0.33959 0.39785 0.32794 1.0000 + F F98 1.0 0.29792 0.43952 0.32794 1.0000 + F F99 1.0 0.25625 0.48119 0.32794 1.0000 + F F100 1.0 0.21459 0.52285 0.32794 1.0000 + F F101 1.0 0.17292 0.56452 0.32794 1.0000 + F F102 1.0 0.13125 0.60619 0.32794 1.0000 + F F103 1.0 0.08959 0.64785 0.32794 1.0000 + F F104 1.0 0.04792 0.68952 0.32794 1.0000 + F F105 1.0 0.00625 0.73119 0.32794 1.0000 + F F106 1.0 0.96459 0.77285 0.32794 1.0000 + F F107 1.0 0.92292 0.81452 0.32794 1.0000 + F F108 1.0 0.88125 0.85619 0.32794 1.0000 + F F109 1.0 0.38125 0.43952 0.32794 1.0000 + F F110 1.0 0.33959 0.48119 0.32794 1.0000 + F F111 1.0 0.29792 0.52285 0.32794 1.0000 + F F112 1.0 0.25625 0.56452 0.32794 1.0000 + F F113 1.0 0.21459 0.60619 0.32794 1.0000 + F F114 1.0 0.17292 0.64785 0.32794 1.0000 + F F115 1.0 0.13125 0.68952 0.32794 1.0000 + F F116 1.0 0.08959 0.73119 0.32794 1.0000 + F F117 1.0 0.04792 0.77285 0.32794 1.0000 + F F118 1.0 0.00625 0.81452 0.32794 1.0000 + F F119 1.0 0.96459 0.85619 0.32794 1.0000 + F F120 1.0 0.92292 0.89785 0.32794 1.0000 + F F121 1.0 0.42292 0.48119 0.32794 1.0000 + F F122 1.0 0.38125 0.52285 0.32794 1.0000 + F F123 1.0 0.33959 0.56452 0.32794 1.0000 + F F124 1.0 0.29792 0.60619 0.32794 1.0000 + F F125 1.0 0.25625 0.64785 0.32794 1.0000 + F F126 1.0 0.21459 0.68952 0.32794 1.0000 + F F127 1.0 0.17292 0.73119 0.32794 1.0000 + F F128 1.0 0.13125 0.77285 0.32794 1.0000 + F F129 1.0 0.08959 0.81452 0.32794 1.0000 + F F130 1.0 0.04792 0.85619 0.32794 1.0000 + F F131 1.0 0.00625 0.89785 0.32794 1.0000 + F F132 1.0 0.96459 0.93952 0.32794 1.0000 + F F133 1.0 0.46459 0.52285 0.32794 1.0000 + F F134 1.0 0.42292 0.56452 0.32794 1.0000 + F F135 1.0 0.38125 0.60619 0.32794 1.0000 + F F136 1.0 0.33959 0.64785 0.32794 1.0000 + F F137 1.0 0.29792 0.68952 0.32794 1.0000 + F F138 1.0 0.25625 0.73119 0.32794 1.0000 + F F139 1.0 0.21459 0.77285 0.32794 1.0000 + F F140 1.0 0.17292 0.81452 0.32794 1.0000 + F F141 1.0 0.13125 0.85619 0.32794 1.0000 + F F142 1.0 0.08959 0.89785 0.32794 1.0000 + F F143 1.0 0.04792 0.93952 0.32794 1.0000 + F F144 1.0 0.00625 0.98119 0.32794 1.0000 + F F145 1.0 0.02911 0.04166 0.32797 1.0000 + F F146 1.0 0.98744 0.08333 0.32797 1.0000 + F F147 1.0 0.94578 0.12500 0.32797 1.0000 + F F148 1.0 0.90411 0.16666 0.32797 1.0000 + F F149 1.0 0.86244 0.20833 0.32797 1.0000 + F F150 1.0 0.82078 0.25000 0.32797 1.0000 + F F151 1.0 0.77911 0.29166 0.32797 1.0000 + F F152 1.0 0.73744 0.33333 0.32797 1.0000 + F F153 1.0 0.69578 0.37500 0.32797 1.0000 + F F154 1.0 0.65411 0.41666 0.32797 1.0000 + F F155 1.0 0.61244 0.45833 0.32797 1.0000 + F F156 1.0 0.57078 0.50000 0.32797 1.0000 + F F157 1.0 0.07078 0.08333 0.32797 1.0000 + F F158 1.0 0.02911 0.12500 0.32797 1.0000 + F F159 1.0 0.98744 0.16666 0.32797 1.0000 + F F160 1.0 0.94578 0.20833 0.32797 1.0000 + F F161 1.0 0.90411 0.25000 0.32797 1.0000 + F F162 1.0 0.86244 0.29166 0.32797 1.0000 + F F163 1.0 0.82078 0.33333 0.32797 1.0000 + F F164 1.0 0.77911 0.37500 0.32797 1.0000 + F F165 1.0 0.73744 0.41666 0.32797 1.0000 + F F166 1.0 0.69578 0.45833 0.32797 1.0000 + F F167 1.0 0.65411 0.50000 0.32797 1.0000 + F F168 1.0 0.61244 0.54166 0.32797 1.0000 + F F169 1.0 0.11244 0.12500 0.32797 1.0000 + F F170 1.0 0.07078 0.16666 0.32797 1.0000 + F F171 1.0 0.02911 0.20833 0.32797 1.0000 + F F172 1.0 0.98744 0.25000 0.32797 1.0000 + F F173 1.0 0.94578 0.29166 0.32797 1.0000 + F F174 1.0 0.90411 0.33333 0.32797 1.0000 + F F175 1.0 0.86244 0.37500 0.32797 1.0000 + F F176 1.0 0.82078 0.41666 0.32797 1.0000 + F F177 1.0 0.77911 0.45833 0.32797 1.0000 + F F178 1.0 0.73744 0.50000 0.32797 1.0000 + F F179 1.0 0.69578 0.54166 0.32797 1.0000 + F F180 1.0 0.65411 0.58333 0.32797 1.0000 + F F181 1.0 0.15411 0.16666 0.32797 1.0000 + 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0.50000 1.0000 + Mn Mn158 1.0 0.54165 0.62501 0.50000 1.0000 + Mn Mn159 1.0 0.49998 0.66668 0.50000 1.0000 + Mn Mn160 1.0 0.45831 0.70834 0.50000 1.0000 + Mn Mn161 1.0 0.41665 0.75001 0.50000 1.0000 + Mn Mn162 1.0 0.37498 0.79168 0.50000 1.0000 + Mn Mn163 1.0 0.33331 0.83334 0.50000 1.0000 + Mn Mn164 1.0 0.29165 0.87501 0.50000 1.0000 + Mn Mn165 1.0 0.24998 0.91668 0.50000 1.0000 + Mn Mn166 1.0 0.20831 0.95834 0.50000 1.0000 + Mn Mn167 1.0 0.16665 0.00001 0.50000 1.0000 + Mn Mn168 1.0 0.12498 0.04168 0.50000 1.0000 + Mn Mn169 1.0 0.62498 0.62501 0.50000 1.0000 + Mn Mn170 1.0 0.58331 0.66668 0.50000 1.0000 + Mn Mn171 1.0 0.54165 0.70834 0.50000 1.0000 + Mn Mn172 1.0 0.49998 0.75001 0.50000 1.0000 + Mn Mn173 1.0 0.45831 0.79168 0.50000 1.0000 + Mn Mn174 1.0 0.41665 0.83334 0.50000 1.0000 + Mn Mn175 1.0 0.37498 0.87501 0.50000 1.0000 + Mn Mn176 1.0 0.33331 0.91668 0.50000 1.0000 + Mn Mn177 1.0 0.29165 0.95834 0.50000 1.0000 + Mn Mn178 1.0 0.24998 0.00001 0.50000 1.0000 + Mn Mn179 1.0 0.20831 0.04168 0.50000 1.0000 + Mn Mn180 1.0 0.16665 0.08334 0.50000 1.0000 + Mn Mn181 1.0 0.66665 0.66668 0.50000 1.0000 + Mn Mn182 1.0 0.62498 0.70834 0.50000 1.0000 + Mn Mn183 1.0 0.58331 0.75001 0.50000 1.0000 + Mn Mn184 1.0 0.54165 0.79168 0.50000 1.0000 + Mn Mn185 1.0 0.49998 0.83334 0.50000 1.0000 + Mn Mn186 1.0 0.45831 0.87501 0.50000 1.0000 + Mn Mn187 1.0 0.41665 0.91668 0.50000 1.0000 + Mn Mn188 1.0 0.37498 0.95834 0.50000 1.0000 + Mn Mn189 1.0 0.33331 0.00001 0.50000 1.0000 + Mn Mn190 1.0 0.29165 0.04168 0.50000 1.0000 + Mn Mn191 1.0 0.24998 0.08334 0.50000 1.0000 + Mn Mn192 1.0 0.20831 0.12501 0.50000 1.0000 + Mn Mn193 1.0 0.70831 0.70834 0.50000 1.0000 + Mn Mn194 1.0 0.66665 0.75001 0.50000 1.0000 + Mn Mn195 1.0 0.62498 0.79168 0.50000 1.0000 + Mn Mn196 1.0 0.58331 0.83334 0.50000 1.0000 + Mn Mn197 1.0 0.54165 0.87501 0.50000 1.0000 + Mn Mn198 1.0 0.49998 0.91668 0.50000 1.0000 + Mn Mn199 1.0 0.45831 0.95834 0.50000 1.0000 + Mn Mn200 1.0 0.41665 0.00001 0.50000 1.0000 + Mn Mn201 1.0 0.37498 0.04168 0.50000 1.0000 + Mn Mn202 1.0 0.33331 0.08334 0.50000 1.0000 + Mn Mn203 1.0 0.29165 0.12501 0.50000 1.0000 + Mn Mn204 1.0 0.24998 0.16668 0.50000 1.0000 + Mn Mn205 1.0 0.74998 0.75001 0.50000 1.0000 + Mn Mn206 1.0 0.70831 0.79168 0.50000 1.0000 + Mn Mn207 1.0 0.66665 0.83334 0.50000 1.0000 + Mn Mn208 1.0 0.62498 0.87501 0.50000 1.0000 + Mn Mn209 1.0 0.58331 0.91668 0.50000 1.0000 + Mn Mn210 1.0 0.54165 0.95834 0.50000 1.0000 + Mn Mn211 1.0 0.49998 0.00001 0.50000 1.0000 + Mn Mn212 1.0 0.45831 0.04168 0.50000 1.0000 + Mn Mn213 1.0 0.41665 0.08334 0.50000 1.0000 + Mn Mn214 1.0 0.37498 0.12501 0.50000 1.0000 + Mn Mn215 1.0 0.33331 0.16668 0.50000 1.0000 + Mn Mn216 1.0 0.29165 0.20834 0.50000 1.0000 + Mn Mn217 1.0 0.79165 0.79168 0.50000 1.0000 + Mn Mn218 1.0 0.74998 0.83334 0.50000 1.0000 + Mn Mn219 1.0 0.70831 0.87501 0.50000 1.0000 + Mn Mn220 1.0 0.66665 0.91668 0.50000 1.0000 + Mn Mn221 1.0 0.62498 0.95834 0.50000 1.0000 + Mn Mn222 1.0 0.58331 0.00001 0.50000 1.0000 + Mn Mn223 1.0 0.54165 0.04168 0.50000 1.0000 + Mn Mn224 1.0 0.49998 0.08334 0.50000 1.0000 + Mn Mn225 1.0 0.45831 0.12501 0.50000 1.0000 + Mn Mn226 1.0 0.41665 0.16668 0.50000 1.0000 + Mn Mn227 1.0 0.37498 0.20834 0.50000 1.0000 + Mn Mn228 1.0 0.33331 0.25001 0.50000 1.0000 + Mn Mn229 1.0 0.83331 0.83334 0.50000 1.0000 + Mn Mn230 1.0 0.79165 0.87501 0.50000 1.0000 + Mn Mn231 1.0 0.74998 0.91668 0.50000 1.0000 + Mn Mn232 1.0 0.70831 0.95834 0.50000 1.0000 + Mn Mn233 1.0 0.66665 0.00001 0.50000 1.0000 + Mn Mn234 1.0 0.62498 0.04168 0.50000 1.0000 + Mn Mn235 1.0 0.58331 0.08334 0.50000 1.0000 + Mn Mn236 1.0 0.54165 0.12501 0.50000 1.0000 + Mn Mn237 1.0 0.49998 0.16668 0.50000 1.0000 + Mn Mn238 1.0 0.45831 0.20834 0.50000 1.0000 + Mn Mn239 1.0 0.41665 0.25001 0.50000 1.0000 + Mn Mn240 1.0 0.37498 0.29168 0.50000 1.0000 + Mn Mn241 1.0 0.87498 0.87501 0.50000 1.0000 + Mn Mn242 1.0 0.83331 0.91668 0.50000 1.0000 + Mn Mn243 1.0 0.79165 0.95834 0.50000 1.0000 + Mn Mn244 1.0 0.74998 0.00001 0.50000 1.0000 + Mn Mn245 1.0 0.70831 0.04168 0.50000 1.0000 + Mn Mn246 1.0 0.66665 0.08334 0.50000 1.0000 + Mn Mn247 1.0 0.62498 0.12501 0.50000 1.0000 + Mn Mn248 1.0 0.58331 0.16668 0.50000 1.0000 + Mn Mn249 1.0 0.54165 0.20834 0.50000 1.0000 + Mn Mn250 1.0 0.49998 0.25001 0.50000 1.0000 + Mn Mn251 1.0 0.45831 0.29168 0.50000 1.0000 + Mn Mn252 1.0 0.41665 0.33334 0.50000 1.0000 + Mn Mn253 1.0 0.91665 0.91668 0.50000 1.0000 + Mn Mn254 1.0 0.87498 0.95834 0.50000 1.0000 + Mn Mn255 1.0 0.83331 0.00001 0.50000 1.0000 + Mn Mn256 1.0 0.79165 0.04168 0.50000 1.0000 + Mn Mn257 1.0 0.74998 0.08334 0.50000 1.0000 + Mn Mn258 1.0 0.70831 0.12501 0.50000 1.0000 + Mn Mn259 1.0 0.66665 0.16668 0.50000 1.0000 + Mn Mn260 1.0 0.62498 0.20834 0.50000 1.0000 + Mn Mn261 1.0 0.58331 0.25001 0.50000 1.0000 + Mn Mn262 1.0 0.54165 0.29168 0.50000 1.0000 + Mn Mn263 1.0 0.49998 0.33334 0.50000 1.0000 + Mn Mn264 1.0 0.45831 0.37501 0.50000 1.0000 + Mn Mn265 1.0 0.95831 0.95834 0.50000 1.0000 + Mn Mn266 1.0 0.91665 0.00001 0.50000 1.0000 + Mn Mn267 1.0 0.87498 0.04168 0.50000 1.0000 + Mn Mn268 1.0 0.83331 0.08334 0.50000 1.0000 + Mn Mn269 1.0 0.79165 0.12501 0.50000 1.0000 + Mn Mn270 1.0 0.74998 0.16668 0.50000 1.0000 + Mn Mn271 1.0 0.70831 0.20834 0.50000 1.0000 + Mn Mn272 1.0 0.66665 0.25001 0.50000 1.0000 + Mn Mn273 1.0 0.62498 0.29168 0.50000 1.0000 + Mn Mn274 1.0 0.58331 0.33334 0.50000 1.0000 + Mn Mn275 1.0 0.54165 0.37501 0.50000 1.0000 + Mn Mn276 1.0 0.49998 0.41668 0.50000 1.0000 + Mn Mn277 1.0 0.99998 0.00001 0.50000 1.0000 + Mn Mn278 1.0 0.95831 0.04168 0.50000 1.0000 + Mn Mn279 1.0 0.91665 0.08334 0.50000 1.0000 + Mn Mn280 1.0 0.87498 0.12501 0.50000 1.0000 + Mn Mn281 1.0 0.83331 0.16668 0.50000 1.0000 + Mn Mn282 1.0 0.79165 0.20834 0.50000 1.0000 + Mn Mn283 1.0 0.74998 0.25001 0.50000 1.0000 + Mn Mn284 1.0 0.70831 0.29168 0.50000 1.0000 + Mn Mn285 1.0 0.66665 0.33334 0.50000 1.0000 + Mn Mn286 1.0 0.62498 0.37501 0.50000 1.0000 + Mn Mn287 1.0 0.58331 0.41668 0.50000 1.0000 + Mn Mn288 1.0 0.54165 0.45834 0.50000 1.0000 + F F865 1.0 0.50625 0.56452 0.32794 1.0000 + F F866 1.0 0.46459 0.60619 0.32794 1.0000 + F F867 1.0 0.42292 0.64785 0.32794 1.0000 + F F868 1.0 0.38125 0.68952 0.32794 1.0000 + F F869 1.0 0.33959 0.73119 0.32794 1.0000 + F F870 1.0 0.29792 0.77285 0.32794 1.0000 + F F871 1.0 0.25625 0.81452 0.32794 1.0000 + F F872 1.0 0.21459 0.85619 0.32794 1.0000 + F F873 1.0 0.17292 0.89785 0.32794 1.0000 + F F874 1.0 0.13125 0.93952 0.32794 1.0000 + F F875 1.0 0.08959 0.98119 0.32794 1.0000 + F F876 1.0 0.04792 0.02285 0.32794 1.0000 + F F877 1.0 0.54792 0.60619 0.32794 1.0000 + F F878 1.0 0.50625 0.64785 0.32794 1.0000 + F F879 1.0 0.46459 0.68952 0.32794 1.0000 + F F880 1.0 0.42292 0.73119 0.32794 1.0000 + F F881 1.0 0.38125 0.77285 0.32794 1.0000 + F F882 1.0 0.33959 0.81452 0.32794 1.0000 + F F883 1.0 0.29792 0.85619 0.32794 1.0000 + F F884 1.0 0.25625 0.89785 0.32794 1.0000 + F F885 1.0 0.21459 0.93952 0.32794 1.0000 + F F886 1.0 0.17292 0.98119 0.32794 1.0000 + F F887 1.0 0.13125 0.02285 0.32794 1.0000 + F F888 1.0 0.08959 0.06452 0.32794 1.0000 + F F889 1.0 0.58959 0.64785 0.32794 1.0000 + F F890 1.0 0.54792 0.68952 0.32794 1.0000 + F F891 1.0 0.50625 0.73119 0.32794 1.0000 + F F892 1.0 0.46459 0.77285 0.32794 1.0000 + F F893 1.0 0.42292 0.81452 0.32794 1.0000 + F F894 1.0 0.38125 0.85619 0.32794 1.0000 + F F895 1.0 0.33959 0.89785 0.32794 1.0000 + F F896 1.0 0.29792 0.93952 0.32794 1.0000 + F F897 1.0 0.25625 0.98119 0.32794 1.0000 + F F898 1.0 0.21459 0.02285 0.32794 1.0000 + F F899 1.0 0.17292 0.06452 0.32794 1.0000 + F F900 1.0 0.13125 0.10619 0.32794 1.0000 + F F901 1.0 0.63125 0.68952 0.32794 1.0000 + F F902 1.0 0.58959 0.73119 0.32794 1.0000 + F F903 1.0 0.54792 0.77285 0.32794 1.0000 + F F904 1.0 0.50625 0.81452 0.32794 1.0000 + F F905 1.0 0.46459 0.85619 0.32794 1.0000 + F F906 1.0 0.42292 0.89785 0.32794 1.0000 + F F907 1.0 0.38125 0.93952 0.32794 1.0000 + F F908 1.0 0.33959 0.98119 0.32794 1.0000 + F F909 1.0 0.29792 0.02285 0.32794 1.0000 + F F910 1.0 0.25625 0.06452 0.32794 1.0000 + F F911 1.0 0.21459 0.10619 0.32794 1.0000 + F F912 1.0 0.17292 0.14785 0.32794 1.0000 + F F913 1.0 0.67292 0.73119 0.32794 1.0000 + F F914 1.0 0.63125 0.77285 0.32794 1.0000 + F F915 1.0 0.58959 0.81452 0.32794 1.0000 + F F916 1.0 0.54792 0.85619 0.32794 1.0000 + F F917 1.0 0.50625 0.89785 0.32794 1.0000 + F F918 1.0 0.46459 0.93952 0.32794 1.0000 + F F919 1.0 0.42292 0.98119 0.32794 1.0000 + F F920 1.0 0.38125 0.02285 0.32794 1.0000 + F F921 1.0 0.33959 0.06452 0.32794 1.0000 + F F922 1.0 0.29792 0.10619 0.32794 1.0000 + F F923 1.0 0.25625 0.14785 0.32794 1.0000 + F F924 1.0 0.21459 0.18952 0.32794 1.0000 + F F925 1.0 0.71459 0.77285 0.32794 1.0000 + F F926 1.0 0.67292 0.81452 0.32794 1.0000 + F F927 1.0 0.63125 0.85619 0.32794 1.0000 + F F928 1.0 0.58959 0.89785 0.32794 1.0000 + F F929 1.0 0.54792 0.93952 0.32794 1.0000 + F F930 1.0 0.50625 0.98119 0.32794 1.0000 + F F931 1.0 0.46459 0.02285 0.32794 1.0000 + F F932 1.0 0.42292 0.06452 0.32794 1.0000 + F F933 1.0 0.38125 0.10619 0.32794 1.0000 + F F934 1.0 0.33959 0.14785 0.32794 1.0000 + F F935 1.0 0.29792 0.18952 0.32794 1.0000 + F F936 1.0 0.25625 0.23119 0.32794 1.0000 + F F937 1.0 0.75625 0.81452 0.32794 1.0000 + F F938 1.0 0.71459 0.85619 0.32794 1.0000 + F F939 1.0 0.67292 0.89785 0.32794 1.0000 + F F940 1.0 0.63125 0.93952 0.32794 1.0000 + F F941 1.0 0.58959 0.98119 0.32794 1.0000 + F F942 1.0 0.54792 0.02285 0.32794 1.0000 + F F943 1.0 0.50625 0.06452 0.32794 1.0000 + F F944 1.0 0.46459 0.10619 0.32794 1.0000 + F F945 1.0 0.42292 0.14785 0.32794 1.0000 + F F946 1.0 0.38125 0.18952 0.32794 1.0000 + F F947 1.0 0.33959 0.23119 0.32794 1.0000 + F F948 1.0 0.29792 0.27285 0.32794 1.0000 + F F949 1.0 0.79792 0.85619 0.32794 1.0000 + F F950 1.0 0.75625 0.89785 0.32794 1.0000 + F F951 1.0 0.71459 0.93952 0.32794 1.0000 + F F952 1.0 0.67292 0.98119 0.32794 1.0000 + F F953 1.0 0.63125 0.02285 0.32794 1.0000 + F F954 1.0 0.58959 0.06452 0.32794 1.0000 + F F955 1.0 0.54792 0.10619 0.32794 1.0000 + F F956 1.0 0.50625 0.14785 0.32794 1.0000 + F F957 1.0 0.46459 0.18952 0.32794 1.0000 + F F958 1.0 0.42292 0.23119 0.32794 1.0000 + F F959 1.0 0.38125 0.27285 0.32794 1.0000 + F F960 1.0 0.33959 0.31452 0.32794 1.0000 + F F961 1.0 0.83959 0.89785 0.32794 1.0000 + F F962 1.0 0.79792 0.93952 0.32794 1.0000 + F F963 1.0 0.75625 0.98119 0.32794 1.0000 + F F964 1.0 0.71459 0.02285 0.32794 1.0000 + F F965 1.0 0.67292 0.06452 0.32794 1.0000 + F F966 1.0 0.63125 0.10619 0.32794 1.0000 + F F967 1.0 0.58959 0.14785 0.32794 1.0000 + F F968 1.0 0.54792 0.18952 0.32794 1.0000 + F F969 1.0 0.50625 0.23119 0.32794 1.0000 + F F970 1.0 0.46459 0.27285 0.32794 1.0000 + F F971 1.0 0.42292 0.31452 0.32794 1.0000 + F F972 1.0 0.38125 0.35619 0.32794 1.0000 + F F973 1.0 0.88125 0.93952 0.32794 1.0000 + F F974 1.0 0.83959 0.98119 0.32794 1.0000 + F F975 1.0 0.79792 0.02285 0.32794 1.0000 + F F976 1.0 0.75625 0.06452 0.32794 1.0000 + F F977 1.0 0.71459 0.10619 0.32794 1.0000 + F F978 1.0 0.67292 0.14785 0.32794 1.0000 + F F979 1.0 0.63125 0.18952 0.32794 1.0000 + F F980 1.0 0.58959 0.23119 0.32794 1.0000 + F F981 1.0 0.54792 0.27285 0.32794 1.0000 + F F982 1.0 0.50625 0.31452 0.32794 1.0000 + F F983 1.0 0.46459 0.35619 0.32794 1.0000 + F F984 1.0 0.42292 0.39785 0.32794 1.0000 + F F985 1.0 0.92292 0.98119 0.32794 1.0000 + F F986 1.0 0.88125 0.02285 0.32794 1.0000 + F F987 1.0 0.83959 0.06452 0.32794 1.0000 + F F988 1.0 0.79792 0.10619 0.32794 1.0000 + F F989 1.0 0.75625 0.14785 0.32794 1.0000 + F F990 1.0 0.71459 0.18952 0.32794 1.0000 + F F991 1.0 0.67292 0.23119 0.32794 1.0000 + F F992 1.0 0.63125 0.27285 0.32794 1.0000 + F F993 1.0 0.58959 0.31452 0.32794 1.0000 + F F994 1.0 0.54792 0.35619 0.32794 1.0000 + F F995 1.0 0.50625 0.39785 0.32794 1.0000 + F F996 1.0 0.46459 0.43952 0.32794 1.0000 + F F997 1.0 0.96459 0.02285 0.32794 1.0000 + F F998 1.0 0.92292 0.06452 0.32794 1.0000 + F F999 1.0 0.88125 0.10619 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F1710 1.0 0.70204 0.14381 0.67201 1.0000 + F F1711 1.0 0.66038 0.18547 0.67201 1.0000 + F F1712 1.0 0.61871 0.22714 0.67201 1.0000 + F F1713 1.0 0.57704 0.26881 0.67201 1.0000 + F F1714 1.0 0.53538 0.31047 0.67201 1.0000 + F F1715 1.0 0.49371 0.35214 0.67201 1.0000 + F F1716 1.0 0.45204 0.39381 0.67201 1.0000 + F F1717 1.0 0.95204 0.97714 0.67201 1.0000 + F F1718 1.0 0.91038 0.01881 0.67201 1.0000 + F F1719 1.0 0.86871 0.06047 0.67201 1.0000 + F F1720 1.0 0.82704 0.10214 0.67201 1.0000 + F F1721 1.0 0.78538 0.14381 0.67201 1.0000 + F F1722 1.0 0.74371 0.18547 0.67201 1.0000 + F F1723 1.0 0.70204 0.22714 0.67201 1.0000 + F F1724 1.0 0.66038 0.26881 0.67201 1.0000 + F F1725 1.0 0.61871 0.31047 0.67201 1.0000 + F F1726 1.0 0.57704 0.35214 0.67201 1.0000 + F F1727 1.0 0.53538 0.39381 0.67201 1.0000 + F F1728 1.0 0.49371 0.43547 0.67201 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-5195_supercell_12x12x1.cif b/tier3/cif_file/orthogonal_2dm-5195_supercell_12x12x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..2072a4f0a7ecdde1a6c378a5eb7f940898044d1b --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-5195_supercell_12x12x1.cif @@ -0,0 +1,2185 @@ +data_image0 +_chemical_formula_structural Be288Te1008Cl864 +_chemical_formula_sum "Be288 Te1008 Cl864" +_cell_length_a 65.2349 +_cell_length_b 198.521 +_cell_length_c 6.79129 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Be Be1 1.0 0.00000 0.00663 0.50000 1.0000 + Be Be2 1.0 0.00000 0.08997 0.50000 1.0000 + Be Be3 1.0 0.00000 0.17330 0.50000 1.0000 + Be Be4 1.0 0.00000 0.25663 0.50000 1.0000 + Be Be5 1.0 0.00000 0.33997 0.50000 1.0000 + Be Be6 1.0 0.00000 0.42330 0.50000 1.0000 + Be Be7 1.0 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Te Te526 1.0 0.59715 0.78076 0.65950 1.0000 + Te Te527 1.0 0.59715 0.86409 0.65950 1.0000 + Te Te528 1.0 0.59715 0.94743 0.65950 1.0000 + Te Te529 1.0 0.68049 0.03076 0.65950 1.0000 + Te Te530 1.0 0.68049 0.11409 0.65950 1.0000 + Te Te531 1.0 0.68049 0.19743 0.65950 1.0000 + Te Te532 1.0 0.68049 0.28076 0.65950 1.0000 + Te Te533 1.0 0.68049 0.36409 0.65950 1.0000 + Te Te534 1.0 0.68049 0.44743 0.65950 1.0000 + Te Te535 1.0 0.68049 0.53076 0.65950 1.0000 + Te Te536 1.0 0.68049 0.61409 0.65950 1.0000 + Te Te537 1.0 0.68049 0.69743 0.65950 1.0000 + Te Te538 1.0 0.68049 0.78076 0.65950 1.0000 + Te Te539 1.0 0.68049 0.86409 0.65950 1.0000 + Te Te540 1.0 0.68049 0.94743 0.65950 1.0000 + Te Te541 1.0 0.76382 0.03076 0.65950 1.0000 + Te Te542 1.0 0.76382 0.11409 0.65950 1.0000 + Te Te543 1.0 0.76382 0.19743 0.65950 1.0000 + Te Te544 1.0 0.76382 0.28076 0.65950 1.0000 + Te Te545 1.0 0.76382 0.36409 0.65950 1.0000 + Te Te546 1.0 0.76382 0.44743 0.65950 1.0000 + Te Te547 1.0 0.76382 0.53076 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Te Te591 1.0 0.15285 0.19743 0.34050 1.0000 + Te Te592 1.0 0.15285 0.28076 0.34050 1.0000 + Te Te593 1.0 0.15285 0.36409 0.34050 1.0000 + Te Te594 1.0 0.15285 0.44743 0.34050 1.0000 + Te Te595 1.0 0.15285 0.53076 0.34050 1.0000 + Te Te596 1.0 0.15285 0.61409 0.34050 1.0000 + Te Te597 1.0 0.15285 0.69743 0.34050 1.0000 + Te Te598 1.0 0.15285 0.78076 0.34050 1.0000 + Te Te599 1.0 0.15285 0.86409 0.34050 1.0000 + Te Te600 1.0 0.15285 0.94743 0.34050 1.0000 + Te Te601 1.0 0.23618 0.03076 0.34050 1.0000 + Te Te602 1.0 0.23618 0.11409 0.34050 1.0000 + Te Te603 1.0 0.23618 0.19743 0.34050 1.0000 + Te Te604 1.0 0.23618 0.28076 0.34050 1.0000 + Te Te605 1.0 0.23618 0.36409 0.34050 1.0000 + Te Te606 1.0 0.23618 0.44743 0.34050 1.0000 + Te Te607 1.0 0.23618 0.53076 0.34050 1.0000 + Te Te608 1.0 0.23618 0.61409 0.34050 1.0000 + Te Te609 1.0 0.23618 0.69743 0.34050 1.0000 + Te Te610 1.0 0.23618 0.78076 0.34050 1.0000 + Te Te611 1.0 0.23618 0.86409 0.34050 1.0000 + Te Te612 1.0 0.23618 0.94743 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Te Te656 1.0 0.56951 0.61409 0.34050 1.0000 + Te Te657 1.0 0.56951 0.69743 0.34050 1.0000 + Te Te658 1.0 0.56951 0.78076 0.34050 1.0000 + Te Te659 1.0 0.56951 0.86409 0.34050 1.0000 + Te Te660 1.0 0.56951 0.94743 0.34050 1.0000 + Te Te661 1.0 0.65285 0.03076 0.34050 1.0000 + Te Te662 1.0 0.65285 0.11409 0.34050 1.0000 + Te Te663 1.0 0.65285 0.19743 0.34050 1.0000 + Te Te664 1.0 0.65285 0.28076 0.34050 1.0000 + Te Te665 1.0 0.65285 0.36409 0.34050 1.0000 + Te Te666 1.0 0.65285 0.44743 0.34050 1.0000 + Te Te667 1.0 0.65285 0.53076 0.34050 1.0000 + Te Te668 1.0 0.65285 0.61409 0.34050 1.0000 + Te Te669 1.0 0.65285 0.69743 0.34050 1.0000 + Te Te670 1.0 0.65285 0.78076 0.34050 1.0000 + Te Te671 1.0 0.65285 0.86409 0.34050 1.0000 + Te Te672 1.0 0.65285 0.94743 0.34050 1.0000 + Te Te673 1.0 0.73618 0.03076 0.34050 1.0000 + Te Te674 1.0 0.73618 0.11409 0.34050 1.0000 + Te Te675 1.0 0.73618 0.19743 0.34050 1.0000 + Te Te676 1.0 0.73618 0.28076 0.34050 1.0000 + Te Te677 1.0 0.73618 0.36409 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Te Te721 1.0 0.04167 0.06238 0.50000 1.0000 + Te Te722 1.0 0.04167 0.14571 0.50000 1.0000 + Te Te723 1.0 0.04167 0.22905 0.50000 1.0000 + Te Te724 1.0 0.04167 0.31238 0.50000 1.0000 + Te Te725 1.0 0.04167 0.39571 0.50000 1.0000 + Te Te726 1.0 0.04167 0.47905 0.50000 1.0000 + Te Te727 1.0 0.04167 0.56238 0.50000 1.0000 + Te Te728 1.0 0.04167 0.64571 0.50000 1.0000 + Te Te729 1.0 0.04167 0.72905 0.50000 1.0000 + Te Te730 1.0 0.04167 0.81238 0.50000 1.0000 + Te Te731 1.0 0.04167 0.89571 0.50000 1.0000 + Te Te732 1.0 0.04167 0.97905 0.50000 1.0000 + Te Te733 1.0 0.12500 0.06238 0.50000 1.0000 + Te Te734 1.0 0.12500 0.14571 0.50000 1.0000 + Te Te735 1.0 0.12500 0.22905 0.50000 1.0000 + Te Te736 1.0 0.12500 0.31238 0.50000 1.0000 + Te Te737 1.0 0.12500 0.39571 0.50000 1.0000 + Te Te738 1.0 0.12500 0.47905 0.50000 1.0000 + Te Te739 1.0 0.12500 0.56238 0.50000 1.0000 + Te Te740 1.0 0.12500 0.64571 0.50000 1.0000 + Te Te741 1.0 0.12500 0.72905 0.50000 1.0000 + Te Te742 1.0 0.12500 0.81238 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Te Te786 1.0 0.45833 0.47905 0.50000 1.0000 + Te Te787 1.0 0.45833 0.56238 0.50000 1.0000 + Te Te788 1.0 0.45833 0.64571 0.50000 1.0000 + Te Te789 1.0 0.45833 0.72905 0.50000 1.0000 + Te Te790 1.0 0.45833 0.81238 0.50000 1.0000 + Te Te791 1.0 0.45833 0.89571 0.50000 1.0000 + Te Te792 1.0 0.45833 0.97905 0.50000 1.0000 + Te Te793 1.0 0.54167 0.06238 0.50000 1.0000 + Te Te794 1.0 0.54167 0.14571 0.50000 1.0000 + Te Te795 1.0 0.54167 0.22905 0.50000 1.0000 + Te Te796 1.0 0.54167 0.31238 0.50000 1.0000 + Te Te797 1.0 0.54167 0.39571 0.50000 1.0000 + Te Te798 1.0 0.54167 0.47905 0.50000 1.0000 + Te Te799 1.0 0.54167 0.56238 0.50000 1.0000 + Te Te800 1.0 0.54167 0.64571 0.50000 1.0000 + Te Te801 1.0 0.54167 0.72905 0.50000 1.0000 + Te Te802 1.0 0.54167 0.81238 0.50000 1.0000 + Te Te803 1.0 0.54167 0.89571 0.50000 1.0000 + Te Te804 1.0 0.54167 0.97905 0.50000 1.0000 + Te Te805 1.0 0.62500 0.06238 0.50000 1.0000 + Te Te806 1.0 0.62500 0.14571 0.50000 1.0000 + Te Te807 1.0 0.62500 0.22905 0.50000 1.0000 + Te Te808 1.0 0.62500 0.31238 0.50000 1.0000 + Te Te809 1.0 0.62500 0.39571 0.50000 1.0000 + Te Te810 1.0 0.62500 0.47905 0.50000 1.0000 + Te Te811 1.0 0.62500 0.56238 0.50000 1.0000 + Te Te812 1.0 0.62500 0.64571 0.50000 1.0000 + Te Te813 1.0 0.62500 0.72905 0.50000 1.0000 + Te Te814 1.0 0.62500 0.81238 0.50000 1.0000 + Te Te815 1.0 0.62500 0.89571 0.50000 1.0000 + Te Te816 1.0 0.62500 0.97905 0.50000 1.0000 + Te Te817 1.0 0.70833 0.06238 0.50000 1.0000 + Te Te818 1.0 0.70833 0.14571 0.50000 1.0000 + Te Te819 1.0 0.70833 0.22905 0.50000 1.0000 + Te Te820 1.0 0.70833 0.31238 0.50000 1.0000 + Te Te821 1.0 0.70833 0.39571 0.50000 1.0000 + Te Te822 1.0 0.70833 0.47905 0.50000 1.0000 + Te Te823 1.0 0.70833 0.56238 0.50000 1.0000 + Te Te824 1.0 0.70833 0.64571 0.50000 1.0000 + Te Te825 1.0 0.70833 0.72905 0.50000 1.0000 + Te Te826 1.0 0.70833 0.81238 0.50000 1.0000 + Te Te827 1.0 0.70833 0.89571 0.50000 1.0000 + Te Te828 1.0 0.70833 0.97905 0.50000 1.0000 + Te Te829 1.0 0.79167 0.06238 0.50000 1.0000 + Te Te830 1.0 0.79167 0.14571 0.50000 1.0000 + Te Te831 1.0 0.79167 0.22905 0.50000 1.0000 + Te Te832 1.0 0.79167 0.31238 0.50000 1.0000 + Te Te833 1.0 0.79167 0.39571 0.50000 1.0000 + Te Te834 1.0 0.79167 0.47905 0.50000 1.0000 + Te Te835 1.0 0.79167 0.56238 0.50000 1.0000 + Te Te836 1.0 0.79167 0.64571 0.50000 1.0000 + Te Te837 1.0 0.79167 0.72905 0.50000 1.0000 + Te Te838 1.0 0.79167 0.81238 0.50000 1.0000 + Te Te839 1.0 0.79167 0.89571 0.50000 1.0000 + Te Te840 1.0 0.79167 0.97905 0.50000 1.0000 + Te Te841 1.0 0.87500 0.06238 0.50000 1.0000 + Te Te842 1.0 0.87500 0.14571 0.50000 1.0000 + Te Te843 1.0 0.87500 0.22905 0.50000 1.0000 + Te Te844 1.0 0.87500 0.31238 0.50000 1.0000 + Te Te845 1.0 0.87500 0.39571 0.50000 1.0000 + Te Te846 1.0 0.87500 0.47905 0.50000 1.0000 + Te Te847 1.0 0.87500 0.56238 0.50000 1.0000 + Te Te848 1.0 0.87500 0.64571 0.50000 1.0000 + Te Te849 1.0 0.87500 0.72905 0.50000 1.0000 + Te Te850 1.0 0.87500 0.81238 0.50000 1.0000 + Te Te851 1.0 0.87500 0.89571 0.50000 1.0000 + Te Te852 1.0 0.87500 0.97905 0.50000 1.0000 + Te Te853 1.0 0.95833 0.06238 0.50000 1.0000 + Te Te854 1.0 0.95833 0.14571 0.50000 1.0000 + Te Te855 1.0 0.95833 0.22905 0.50000 1.0000 + Te Te856 1.0 0.95833 0.31238 0.50000 1.0000 + Te Te857 1.0 0.95833 0.39571 0.50000 1.0000 + Te Te858 1.0 0.95833 0.47905 0.50000 1.0000 + Te Te859 1.0 0.95833 0.56238 0.50000 1.0000 + Te Te860 1.0 0.95833 0.64571 0.50000 1.0000 + Te Te861 1.0 0.95833 0.72905 0.50000 1.0000 + Te Te862 1.0 0.95833 0.81238 0.50000 1.0000 + Te Te863 1.0 0.95833 0.89571 0.50000 1.0000 + Te Te864 1.0 0.95833 0.97905 0.50000 1.0000 + Te Te865 1.0 0.04167 0.02095 0.50000 1.0000 + Te Te866 1.0 0.04167 0.10429 0.50000 1.0000 + Te Te867 1.0 0.04167 0.18762 0.50000 1.0000 + Te Te868 1.0 0.04167 0.27095 0.50000 1.0000 + Te Te869 1.0 0.04167 0.35429 0.50000 1.0000 + Te Te870 1.0 0.04167 0.43762 0.50000 1.0000 + Te Te871 1.0 0.04167 0.52095 0.50000 1.0000 + Te Te872 1.0 0.04167 0.60429 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Te Te916 1.0 0.37500 0.27095 0.50000 1.0000 + Te Te917 1.0 0.37500 0.35429 0.50000 1.0000 + Te Te918 1.0 0.37500 0.43762 0.50000 1.0000 + Te Te919 1.0 0.37500 0.52095 0.50000 1.0000 + Te Te920 1.0 0.37500 0.60429 0.50000 1.0000 + Te Te921 1.0 0.37500 0.68762 0.50000 1.0000 + Te Te922 1.0 0.37500 0.77095 0.50000 1.0000 + Te Te923 1.0 0.37500 0.85429 0.50000 1.0000 + Te Te924 1.0 0.37500 0.93762 0.50000 1.0000 + Te Te925 1.0 0.45833 0.02095 0.50000 1.0000 + Te Te926 1.0 0.45833 0.10429 0.50000 1.0000 + Te Te927 1.0 0.45833 0.18762 0.50000 1.0000 + Te Te928 1.0 0.45833 0.27095 0.50000 1.0000 + Te Te929 1.0 0.45833 0.35429 0.50000 1.0000 + Te Te930 1.0 0.45833 0.43762 0.50000 1.0000 + Te Te931 1.0 0.45833 0.52095 0.50000 1.0000 + Te Te932 1.0 0.45833 0.60429 0.50000 1.0000 + Te Te933 1.0 0.45833 0.68762 0.50000 1.0000 + Te Te934 1.0 0.45833 0.77095 0.50000 1.0000 + Te Te935 1.0 0.45833 0.85429 0.50000 1.0000 + Te Te936 1.0 0.45833 0.93762 0.50000 1.0000 + Te Te937 1.0 0.54167 0.02095 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1.0000 + F F512 1.0 0.96875 0.95873 0.31400 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-5275_supercell_12x12x1.cif b/tier3/cif_file/orthogonal_2dm-5275_supercell_12x12x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..44f4e9016690f4a89ce598265bded2c813d7d907 --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-5275_supercell_12x12x1.cif @@ -0,0 +1,3481 @@ +data_image0 +_chemical_formula_structural Mn144Co432O1152Mn144Co432O1152 +_chemical_formula_sum "Mn288 Co864 O2304" +_cell_length_a 121.86 +_cell_length_b 70.3562 +_cell_length_c 5.91107 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Mn Mn1 1.0 0.05556 0.00000 0.50000 1.0000 + Mn Mn2 1.0 0.09722 0.04167 0.50000 1.0000 + Mn Mn3 1.0 0.13889 0.08333 0.50000 1.0000 + Mn Mn4 1.0 0.18056 0.12500 0.50000 1.0000 + Mn Mn5 1.0 0.22222 0.16667 0.50000 1.0000 + Mn Mn6 1.0 0.26389 0.20833 0.50000 1.0000 + Mn Mn7 1.0 0.30556 0.25000 0.50000 1.0000 + Mn Mn8 1.0 0.34722 0.29167 0.50000 1.0000 + Mn Mn9 1.0 0.38889 0.33333 0.50000 1.0000 + Mn Mn10 1.0 0.43056 0.37500 0.50000 1.0000 + Mn Mn11 1.0 0.47222 0.41667 0.50000 1.0000 + Mn Mn12 1.0 0.51389 0.45833 0.50000 1.0000 + Mn Mn13 1.0 0.09722 0.95833 0.50000 1.0000 + Mn Mn14 1.0 0.13889 0.00000 0.50000 1.0000 + Mn Mn15 1.0 0.18056 0.04167 0.50000 1.0000 + Mn Mn16 1.0 0.22222 0.08333 0.50000 1.0000 + Mn Mn17 1.0 0.26389 0.12500 0.50000 1.0000 + Mn Mn18 1.0 0.30556 0.16667 0.50000 1.0000 + Mn Mn19 1.0 0.34722 0.20833 0.50000 1.0000 + Mn Mn20 1.0 0.38889 0.25000 0.50000 1.0000 + Mn Mn21 1.0 0.43056 0.29167 0.50000 1.0000 + Mn Mn22 1.0 0.47222 0.33333 0.50000 1.0000 + Mn Mn23 1.0 0.51389 0.37500 0.50000 1.0000 + Mn Mn24 1.0 0.55556 0.41667 0.50000 1.0000 + Mn Mn25 1.0 0.13889 0.91667 0.50000 1.0000 + Mn Mn26 1.0 0.18056 0.95833 0.50000 1.0000 + Mn Mn27 1.0 0.22222 0.00000 0.50000 1.0000 + Mn Mn28 1.0 0.26389 0.04167 0.50000 1.0000 + Mn Mn29 1.0 0.30556 0.08333 0.50000 1.0000 + Mn Mn30 1.0 0.34722 0.12500 0.50000 1.0000 + Mn Mn31 1.0 0.38889 0.16667 0.50000 1.0000 + Mn Mn32 1.0 0.43056 0.20833 0.50000 1.0000 + Mn Mn33 1.0 0.47222 0.25000 0.50000 1.0000 + Mn Mn34 1.0 0.51389 0.29167 0.50000 1.0000 + Mn Mn35 1.0 0.55556 0.33333 0.50000 1.0000 + Mn Mn36 1.0 0.59722 0.37500 0.50000 1.0000 + Mn Mn37 1.0 0.18056 0.87500 0.50000 1.0000 + Mn Mn38 1.0 0.22222 0.91667 0.50000 1.0000 + Mn Mn39 1.0 0.26389 0.95833 0.50000 1.0000 + Mn Mn40 1.0 0.30556 0.00000 0.50000 1.0000 + Mn Mn41 1.0 0.34722 0.04167 0.50000 1.0000 + Mn Mn42 1.0 0.38889 0.08333 0.50000 1.0000 + Mn Mn43 1.0 0.43056 0.12500 0.50000 1.0000 + Mn Mn44 1.0 0.47222 0.16667 0.50000 1.0000 + Mn Mn45 1.0 0.51389 0.20833 0.50000 1.0000 + Mn Mn46 1.0 0.55556 0.25000 0.50000 1.0000 + Mn Mn47 1.0 0.59722 0.29167 0.50000 1.0000 + Mn Mn48 1.0 0.63889 0.33333 0.50000 1.0000 + Mn Mn49 1.0 0.22222 0.83333 0.50000 1.0000 + Mn Mn50 1.0 0.26389 0.87500 0.50000 1.0000 + Mn Mn51 1.0 0.30556 0.91667 0.50000 1.0000 + Mn Mn52 1.0 0.34722 0.95833 0.50000 1.0000 + Mn Mn53 1.0 0.38889 1.00000 0.50000 1.0000 + Mn Mn54 1.0 0.43056 0.04167 0.50000 1.0000 + Mn Mn55 1.0 0.47222 0.08333 0.50000 1.0000 + Mn Mn56 1.0 0.51389 0.12500 0.50000 1.0000 + Mn Mn57 1.0 0.55556 0.16667 0.50000 1.0000 + Mn Mn58 1.0 0.59722 0.20833 0.50000 1.0000 + Mn Mn59 1.0 0.63889 0.25000 0.50000 1.0000 + Mn Mn60 1.0 0.68056 0.29167 0.50000 1.0000 + Mn Mn61 1.0 0.26389 0.79167 0.50000 1.0000 + Mn Mn62 1.0 0.30556 0.83333 0.50000 1.0000 + Mn Mn63 1.0 0.34722 0.87500 0.50000 1.0000 + Mn Mn64 1.0 0.38889 0.91667 0.50000 1.0000 + Mn Mn65 1.0 0.43056 0.95833 0.50000 1.0000 + Mn Mn66 1.0 0.47222 0.00000 0.50000 1.0000 + Mn Mn67 1.0 0.51389 0.04167 0.50000 1.0000 + Mn Mn68 1.0 0.55556 0.08333 0.50000 1.0000 + Mn Mn69 1.0 0.59722 0.12500 0.50000 1.0000 + Mn Mn70 1.0 0.63889 0.16667 0.50000 1.0000 + Mn Mn71 1.0 0.68056 0.20833 0.50000 1.0000 + Mn Mn72 1.0 0.72222 0.25000 0.50000 1.0000 + Mn Mn73 1.0 0.30556 0.75000 0.50000 1.0000 + Mn Mn74 1.0 0.34722 0.79167 0.50000 1.0000 + Mn Mn75 1.0 0.38889 0.83333 0.50000 1.0000 + Mn Mn76 1.0 0.43056 0.87500 0.50000 1.0000 + Mn Mn77 1.0 0.47222 0.91667 0.50000 1.0000 + Mn Mn78 1.0 0.51389 0.95833 0.50000 1.0000 + Mn Mn79 1.0 0.55556 0.00000 0.50000 1.0000 + Mn Mn80 1.0 0.59722 0.04167 0.50000 1.0000 + Mn Mn81 1.0 0.63889 0.08333 0.50000 1.0000 + Mn Mn82 1.0 0.68056 0.12500 0.50000 1.0000 + Mn Mn83 1.0 0.72222 0.16667 0.50000 1.0000 + Mn Mn84 1.0 0.76389 0.20833 0.50000 1.0000 + Mn Mn85 1.0 0.34722 0.70833 0.50000 1.0000 + Mn Mn86 1.0 0.38889 0.75000 0.50000 1.0000 + Mn Mn87 1.0 0.43056 0.79167 0.50000 1.0000 + Mn Mn88 1.0 0.47222 0.83333 0.50000 1.0000 + Mn Mn89 1.0 0.51389 0.87500 0.50000 1.0000 + Mn Mn90 1.0 0.55556 0.91667 0.50000 1.0000 + Mn Mn91 1.0 0.59722 0.95833 0.50000 1.0000 + Mn Mn92 1.0 0.63889 1.00000 0.50000 1.0000 + Mn Mn93 1.0 0.68056 0.04167 0.50000 1.0000 + Mn Mn94 1.0 0.72222 0.08333 0.50000 1.0000 + Mn Mn95 1.0 0.76389 0.12500 0.50000 1.0000 + Mn Mn96 1.0 0.80556 0.16667 0.50000 1.0000 + Mn Mn97 1.0 0.38889 0.66667 0.50000 1.0000 + Mn Mn98 1.0 0.43056 0.70833 0.50000 1.0000 + Mn Mn99 1.0 0.47222 0.75000 0.50000 1.0000 + Mn Mn100 1.0 0.51389 0.79167 0.50000 1.0000 + Mn Mn101 1.0 0.55556 0.83333 0.50000 1.0000 + Mn Mn102 1.0 0.59722 0.87500 0.50000 1.0000 + Mn Mn103 1.0 0.63889 0.91667 0.50000 1.0000 + Mn Mn104 1.0 0.68056 0.95833 0.50000 1.0000 + Mn Mn105 1.0 0.72222 0.00000 0.50000 1.0000 + Mn Mn106 1.0 0.76389 0.04167 0.50000 1.0000 + Mn Mn107 1.0 0.80556 0.08333 0.50000 1.0000 + Mn Mn108 1.0 0.84722 0.12500 0.50000 1.0000 + Mn Mn109 1.0 0.43056 0.62500 0.50000 1.0000 + Mn Mn110 1.0 0.47222 0.66667 0.50000 1.0000 + Mn Mn111 1.0 0.51389 0.70833 0.50000 1.0000 + Mn Mn112 1.0 0.55556 0.75000 0.50000 1.0000 + Mn Mn113 1.0 0.59722 0.79167 0.50000 1.0000 + Mn Mn114 1.0 0.63889 0.83333 0.50000 1.0000 + Mn Mn115 1.0 0.68056 0.87500 0.50000 1.0000 + Mn Mn116 1.0 0.72222 0.91667 0.50000 1.0000 + Mn Mn117 1.0 0.76389 0.95833 0.50000 1.0000 + Mn Mn118 1.0 0.80556 0.00000 0.50000 1.0000 + Mn Mn119 1.0 0.84722 0.04167 0.50000 1.0000 + Mn Mn120 1.0 0.88889 0.08333 0.50000 1.0000 + Mn Mn121 1.0 0.47222 0.58333 0.50000 1.0000 + Mn Mn122 1.0 0.51389 0.62500 0.50000 1.0000 + Mn Mn123 1.0 0.55556 0.66667 0.50000 1.0000 + Mn Mn124 1.0 0.59722 0.70833 0.50000 1.0000 + Mn Mn125 1.0 0.63889 0.75000 0.50000 1.0000 + Mn Mn126 1.0 0.68056 0.79167 0.50000 1.0000 + Mn Mn127 1.0 0.72222 0.83333 0.50000 1.0000 + Mn Mn128 1.0 0.76389 0.87500 0.50000 1.0000 + Mn Mn129 1.0 0.80556 0.91667 0.50000 1.0000 + Mn Mn130 1.0 0.84722 0.95833 0.50000 1.0000 + Mn Mn131 1.0 0.88889 0.00000 0.50000 1.0000 + Mn Mn132 1.0 0.93056 0.04167 0.50000 1.0000 + Mn Mn133 1.0 0.51389 0.54167 0.50000 1.0000 + Mn Mn134 1.0 0.55556 0.58333 0.50000 1.0000 + Mn Mn135 1.0 0.59722 0.62500 0.50000 1.0000 + Mn Mn136 1.0 0.63889 0.66667 0.50000 1.0000 + Mn Mn137 1.0 0.68056 0.70833 0.50000 1.0000 + Mn Mn138 1.0 0.72222 0.75000 0.50000 1.0000 + Mn Mn139 1.0 0.76389 0.79167 0.50000 1.0000 + Mn Mn140 1.0 0.80556 0.83333 0.50000 1.0000 + Mn Mn141 1.0 0.84722 0.87500 0.50000 1.0000 + Mn Mn142 1.0 0.88889 0.91667 0.50000 1.0000 + Mn Mn143 1.0 0.93056 0.95833 0.50000 1.0000 + Mn Mn144 1.0 0.97222 1.00000 0.50000 1.0000 + Co Co1 1.0 0.03472 0.97917 0.50000 1.0000 + Co Co2 1.0 0.07639 0.02083 0.50000 1.0000 + Co Co3 1.0 0.11806 0.06250 0.50000 1.0000 + Co Co4 1.0 0.15972 0.10417 0.50000 1.0000 + Co Co5 1.0 0.20139 0.14583 0.50000 1.0000 + Co Co6 1.0 0.24306 0.18750 0.50000 1.0000 + Co Co7 1.0 0.28472 0.22917 0.50000 1.0000 + Co Co8 1.0 0.32639 0.27083 0.50000 1.0000 + Co Co9 1.0 0.36806 0.31250 0.50000 1.0000 + Co Co10 1.0 0.40972 0.35417 0.50000 1.0000 + Co Co11 1.0 0.45139 0.39583 0.50000 1.0000 + Co Co12 1.0 0.49306 0.43750 0.50000 1.0000 + Co Co13 1.0 0.07639 0.93750 0.50000 1.0000 + Co Co14 1.0 0.11806 0.97917 0.50000 1.0000 + Co Co15 1.0 0.15972 0.02083 0.50000 1.0000 + Co Co16 1.0 0.20139 0.06250 0.50000 1.0000 + Co Co17 1.0 0.24306 0.10417 0.50000 1.0000 + Co Co18 1.0 0.28472 0.14583 0.50000 1.0000 + Co Co19 1.0 0.32639 0.18750 0.50000 1.0000 + Co Co20 1.0 0.36806 0.22917 0.50000 1.0000 + Co Co21 1.0 0.40972 0.27083 0.50000 1.0000 + Co Co22 1.0 0.45139 0.31250 0.50000 1.0000 + Co Co23 1.0 0.49306 0.35417 0.50000 1.0000 + Co Co24 1.0 0.53472 0.39583 0.50000 1.0000 + Co Co25 1.0 0.11806 0.89583 0.50000 1.0000 + Co Co26 1.0 0.15972 0.93750 0.50000 1.0000 + Co Co27 1.0 0.20139 0.97917 0.50000 1.0000 + Co Co28 1.0 0.24306 0.02083 0.50000 1.0000 + Co Co29 1.0 0.28472 0.06250 0.50000 1.0000 + Co Co30 1.0 0.32639 0.10417 0.50000 1.0000 + Co Co31 1.0 0.36806 0.14583 0.50000 1.0000 + Co Co32 1.0 0.40972 0.18750 0.50000 1.0000 + Co Co33 1.0 0.45139 0.22917 0.50000 1.0000 + Co Co34 1.0 0.49306 0.27083 0.50000 1.0000 + Co Co35 1.0 0.53472 0.31250 0.50000 1.0000 + Co Co36 1.0 0.57639 0.35417 0.50000 1.0000 + Co Co37 1.0 0.15972 0.85417 0.50000 1.0000 + Co Co38 1.0 0.20139 0.89583 0.50000 1.0000 + Co Co39 1.0 0.24306 0.93750 0.50000 1.0000 + Co Co40 1.0 0.28472 0.97917 0.50000 1.0000 + Co Co41 1.0 0.32639 0.02083 0.50000 1.0000 + Co Co42 1.0 0.36806 0.06250 0.50000 1.0000 + Co Co43 1.0 0.40972 0.10417 0.50000 1.0000 + Co Co44 1.0 0.45139 0.14583 0.50000 1.0000 + Co Co45 1.0 0.49306 0.18750 0.50000 1.0000 + Co Co46 1.0 0.53472 0.22917 0.50000 1.0000 + Co Co47 1.0 0.57639 0.27083 0.50000 1.0000 + Co Co48 1.0 0.61806 0.31250 0.50000 1.0000 + Co Co49 1.0 0.20139 0.81250 0.50000 1.0000 + Co Co50 1.0 0.24306 0.85417 0.50000 1.0000 + Co Co51 1.0 0.28472 0.89583 0.50000 1.0000 + Co Co52 1.0 0.32639 0.93750 0.50000 1.0000 + Co Co53 1.0 0.36806 0.97917 0.50000 1.0000 + Co Co54 1.0 0.40972 0.02083 0.50000 1.0000 + Co Co55 1.0 0.45139 0.06250 0.50000 1.0000 + Co Co56 1.0 0.49306 0.10417 0.50000 1.0000 + Co Co57 1.0 0.53472 0.14583 0.50000 1.0000 + Co Co58 1.0 0.57639 0.18750 0.50000 1.0000 + Co Co59 1.0 0.61806 0.22917 0.50000 1.0000 + Co Co60 1.0 0.65972 0.27083 0.50000 1.0000 + Co Co61 1.0 0.24306 0.77083 0.50000 1.0000 + Co Co62 1.0 0.28472 0.81250 0.50000 1.0000 + Co Co63 1.0 0.32639 0.85417 0.50000 1.0000 + Co Co64 1.0 0.36806 0.89583 0.50000 1.0000 + Co Co65 1.0 0.40972 0.93750 0.50000 1.0000 + Co Co66 1.0 0.45139 0.97917 0.50000 1.0000 + Co Co67 1.0 0.49306 0.02083 0.50000 1.0000 + Co Co68 1.0 0.53472 0.06250 0.50000 1.0000 + Co Co69 1.0 0.57639 0.10417 0.50000 1.0000 + Co Co70 1.0 0.61806 0.14583 0.50000 1.0000 + Co Co71 1.0 0.65972 0.18750 0.50000 1.0000 + Co Co72 1.0 0.70139 0.22917 0.50000 1.0000 + Co Co73 1.0 0.28472 0.72917 0.50000 1.0000 + Co Co74 1.0 0.32639 0.77083 0.50000 1.0000 + Co Co75 1.0 0.36806 0.81250 0.50000 1.0000 + Co Co76 1.0 0.40972 0.85417 0.50000 1.0000 + Co Co77 1.0 0.45139 0.89583 0.50000 1.0000 + Co Co78 1.0 0.49306 0.93750 0.50000 1.0000 + Co Co79 1.0 0.53472 0.97917 0.50000 1.0000 + Co Co80 1.0 0.57639 0.02083 0.50000 1.0000 + Co Co81 1.0 0.61806 0.06250 0.50000 1.0000 + Co Co82 1.0 0.65972 0.10417 0.50000 1.0000 + Co Co83 1.0 0.70139 0.14583 0.50000 1.0000 + Co Co84 1.0 0.74306 0.18750 0.50000 1.0000 + Co Co85 1.0 0.32639 0.68750 0.50000 1.0000 + Co Co86 1.0 0.36806 0.72917 0.50000 1.0000 + Co Co87 1.0 0.40972 0.77083 0.50000 1.0000 + Co Co88 1.0 0.45139 0.81250 0.50000 1.0000 + Co Co89 1.0 0.49306 0.85417 0.50000 1.0000 + Co Co90 1.0 0.53472 0.89583 0.50000 1.0000 + Co Co91 1.0 0.57639 0.93750 0.50000 1.0000 + Co Co92 1.0 0.61806 0.97917 0.50000 1.0000 + Co Co93 1.0 0.65972 0.02083 0.50000 1.0000 + Co Co94 1.0 0.70139 0.06250 0.50000 1.0000 + Co Co95 1.0 0.74306 0.10417 0.50000 1.0000 + Co Co96 1.0 0.78472 0.14583 0.50000 1.0000 + Co Co97 1.0 0.36806 0.64583 0.50000 1.0000 + Co Co98 1.0 0.40972 0.68750 0.50000 1.0000 + Co Co99 1.0 0.45139 0.72917 0.50000 1.0000 + Co Co100 1.0 0.49306 0.77083 0.50000 1.0000 + Co Co101 1.0 0.53472 0.81250 0.50000 1.0000 + Co Co102 1.0 0.57639 0.85417 0.50000 1.0000 + Co Co103 1.0 0.61806 0.89583 0.50000 1.0000 + Co Co104 1.0 0.65972 0.93750 0.50000 1.0000 + Co Co105 1.0 0.70139 0.97917 0.50000 1.0000 + Co Co106 1.0 0.74306 0.02083 0.50000 1.0000 + Co Co107 1.0 0.78472 0.06250 0.50000 1.0000 + Co Co108 1.0 0.82639 0.10417 0.50000 1.0000 + Co Co109 1.0 0.40972 0.60417 0.50000 1.0000 + Co Co110 1.0 0.45139 0.64583 0.50000 1.0000 + Co Co111 1.0 0.49306 0.68750 0.50000 1.0000 + Co Co112 1.0 0.53472 0.72917 0.50000 1.0000 + Co Co113 1.0 0.57639 0.77083 0.50000 1.0000 + Co Co114 1.0 0.61806 0.81250 0.50000 1.0000 + Co Co115 1.0 0.65972 0.85417 0.50000 1.0000 + Co Co116 1.0 0.70139 0.89583 0.50000 1.0000 + Co Co117 1.0 0.74306 0.93750 0.50000 1.0000 + Co Co118 1.0 0.78472 0.97917 0.50000 1.0000 + Co Co119 1.0 0.82639 0.02083 0.50000 1.0000 + Co Co120 1.0 0.86806 0.06250 0.50000 1.0000 + Co Co121 1.0 0.45139 0.56250 0.50000 1.0000 + Co Co122 1.0 0.49306 0.60417 0.50000 1.0000 + Co Co123 1.0 0.53472 0.64583 0.50000 1.0000 + Co Co124 1.0 0.57639 0.68750 0.50000 1.0000 + Co Co125 1.0 0.61806 0.72917 0.50000 1.0000 + Co Co126 1.0 0.65972 0.77083 0.50000 1.0000 + Co Co127 1.0 0.70139 0.81250 0.50000 1.0000 + Co Co128 1.0 0.74306 0.85417 0.50000 1.0000 + Co Co129 1.0 0.78472 0.89583 0.50000 1.0000 + Co Co130 1.0 0.82639 0.93750 0.50000 1.0000 + Co Co131 1.0 0.86806 0.97917 0.50000 1.0000 + Co Co132 1.0 0.90972 0.02083 0.50000 1.0000 + Co Co133 1.0 0.49306 0.52083 0.50000 1.0000 + Co Co134 1.0 0.53472 0.56250 0.50000 1.0000 + Co Co135 1.0 0.57639 0.60417 0.50000 1.0000 + Co Co136 1.0 0.61806 0.64583 0.50000 1.0000 + Co Co137 1.0 0.65972 0.68750 0.50000 1.0000 + Co Co138 1.0 0.70139 0.72917 0.50000 1.0000 + Co Co139 1.0 0.74306 0.77083 0.50000 1.0000 + Co Co140 1.0 0.78472 0.81250 0.50000 1.0000 + Co Co141 1.0 0.82639 0.85417 0.50000 1.0000 + Co Co142 1.0 0.86806 0.89583 0.50000 1.0000 + Co Co143 1.0 0.90972 0.93750 0.50000 1.0000 + Co Co144 1.0 0.95139 0.97917 0.50000 1.0000 + Co Co145 1.0 0.01389 0.00000 0.50000 1.0000 + Co Co146 1.0 0.05556 0.04167 0.50000 1.0000 + Co Co147 1.0 0.09722 0.08333 0.50000 1.0000 + Co Co148 1.0 0.13889 0.12500 0.50000 1.0000 + Co Co149 1.0 0.18056 0.16667 0.50000 1.0000 + Co Co150 1.0 0.22222 0.20833 0.50000 1.0000 + Co Co151 1.0 0.26389 0.25000 0.50000 1.0000 + Co Co152 1.0 0.30556 0.29167 0.50000 1.0000 + Co Co153 1.0 0.34722 0.33333 0.50000 1.0000 + Co Co154 1.0 0.38889 0.37500 0.50000 1.0000 + Co Co155 1.0 0.43056 0.41667 0.50000 1.0000 + Co Co156 1.0 0.47222 0.45833 0.50000 1.0000 + Co Co157 1.0 0.05556 0.95833 0.50000 1.0000 + Co Co158 1.0 0.09722 0.00000 0.50000 1.0000 + Co Co159 1.0 0.13889 0.04167 0.50000 1.0000 + Co Co160 1.0 0.18056 0.08333 0.50000 1.0000 + Co Co161 1.0 0.22222 0.12500 0.50000 1.0000 + Co Co162 1.0 0.26389 0.16667 0.50000 1.0000 + Co Co163 1.0 0.30556 0.20833 0.50000 1.0000 + Co Co164 1.0 0.34722 0.25000 0.50000 1.0000 + Co Co165 1.0 0.38889 0.29167 0.50000 1.0000 + Co Co166 1.0 0.43056 0.33333 0.50000 1.0000 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0.50000 1.0000 + Co Co189 1.0 0.47222 0.20833 0.50000 1.0000 + Co Co190 1.0 0.51389 0.25000 0.50000 1.0000 + Co Co191 1.0 0.55556 0.29167 0.50000 1.0000 + Co Co192 1.0 0.59722 0.33333 0.50000 1.0000 + Co Co193 1.0 0.18056 0.83333 0.50000 1.0000 + Co Co194 1.0 0.22222 0.87500 0.50000 1.0000 + Co Co195 1.0 0.26389 0.91667 0.50000 1.0000 + Co Co196 1.0 0.30556 0.95833 0.50000 1.0000 + Co Co197 1.0 0.34722 0.00000 0.50000 1.0000 + Co Co198 1.0 0.38889 0.04167 0.50000 1.0000 + Co Co199 1.0 0.43056 0.08333 0.50000 1.0000 + Co Co200 1.0 0.47222 0.12500 0.50000 1.0000 + Co Co201 1.0 0.51389 0.16667 0.50000 1.0000 + Co Co202 1.0 0.55556 0.20833 0.50000 1.0000 + Co Co203 1.0 0.59722 0.25000 0.50000 1.0000 + Co Co204 1.0 0.63889 0.29167 0.50000 1.0000 + Co Co205 1.0 0.22222 0.79167 0.50000 1.0000 + Co Co206 1.0 0.26389 0.83333 0.50000 1.0000 + Co Co207 1.0 0.30556 0.87500 0.50000 1.0000 + Co Co208 1.0 0.34722 0.91667 0.50000 1.0000 + Co Co209 1.0 0.38889 0.95833 0.50000 1.0000 + Co Co210 1.0 0.43056 0.00000 0.50000 1.0000 + Co Co211 1.0 0.47222 0.04167 0.50000 1.0000 + Co Co212 1.0 0.51389 0.08333 0.50000 1.0000 + Co Co213 1.0 0.55556 0.12500 0.50000 1.0000 + Co Co214 1.0 0.59722 0.16667 0.50000 1.0000 + Co Co215 1.0 0.63889 0.20833 0.50000 1.0000 + Co Co216 1.0 0.68056 0.25000 0.50000 1.0000 + Co Co217 1.0 0.26389 0.75000 0.50000 1.0000 + Co Co218 1.0 0.30556 0.79167 0.50000 1.0000 + Co Co219 1.0 0.34722 0.83333 0.50000 1.0000 + Co Co220 1.0 0.38889 0.87500 0.50000 1.0000 + Co Co221 1.0 0.43056 0.91667 0.50000 1.0000 + Co Co222 1.0 0.47222 0.95833 0.50000 1.0000 + Co Co223 1.0 0.51389 1.00000 0.50000 1.0000 + Co Co224 1.0 0.55556 0.04167 0.50000 1.0000 + Co Co225 1.0 0.59722 0.08333 0.50000 1.0000 + Co Co226 1.0 0.63889 0.12500 0.50000 1.0000 + Co Co227 1.0 0.68056 0.16667 0.50000 1.0000 + Co Co228 1.0 0.72222 0.20833 0.50000 1.0000 + Co Co229 1.0 0.30556 0.70833 0.50000 1.0000 + Co Co230 1.0 0.34722 0.75000 0.50000 1.0000 + Co Co231 1.0 0.38889 0.79167 0.50000 1.0000 + 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1.0000 + O O1128 1.0 0.89577 0.10397 0.66165 1.0000 + O O1129 1.0 0.47910 0.60397 0.66165 1.0000 + O O1130 1.0 0.52077 0.64564 0.66165 1.0000 + O O1131 1.0 0.56243 0.68730 0.66165 1.0000 + O O1132 1.0 0.60410 0.72897 0.66165 1.0000 + O O1133 1.0 0.64577 0.77064 0.66165 1.0000 + O O1134 1.0 0.68743 0.81230 0.66165 1.0000 + O O1135 1.0 0.72910 0.85397 0.66165 1.0000 + O O1136 1.0 0.77077 0.89564 0.66165 1.0000 + O O1137 1.0 0.81243 0.93730 0.66165 1.0000 + O O1138 1.0 0.85410 0.97897 0.66165 1.0000 + O O1139 1.0 0.89577 0.02064 0.66165 1.0000 + O O1140 1.0 0.93743 0.06230 0.66165 1.0000 + O O1141 1.0 0.52077 0.56230 0.66165 1.0000 + O O1142 1.0 0.56243 0.60397 0.66165 1.0000 + O O1143 1.0 0.60410 0.64564 0.66165 1.0000 + O O1144 1.0 0.64577 0.68730 0.66165 1.0000 + O O1145 1.0 0.68743 0.72897 0.66165 1.0000 + O O1146 1.0 0.72910 0.77064 0.66165 1.0000 + O O1147 1.0 0.77077 0.81230 0.66165 1.0000 + O O1148 1.0 0.81243 0.85397 0.66165 1.0000 + O O1149 1.0 0.85410 0.89564 0.66165 1.0000 + O O1150 1.0 0.89577 0.93730 0.66165 1.0000 + O O1151 1.0 0.93743 0.97897 0.66165 1.0000 + O O1152 1.0 0.97910 0.02064 0.66165 1.0000 + Mn Mn145 1.0 0.55556 0.50000 0.50000 1.0000 + Mn Mn146 1.0 0.59722 0.54167 0.50000 1.0000 + Mn Mn147 1.0 0.63889 0.58333 0.50000 1.0000 + Mn Mn148 1.0 0.68056 0.62500 0.50000 1.0000 + Mn Mn149 1.0 0.72222 0.66667 0.50000 1.0000 + Mn Mn150 1.0 0.76389 0.70833 0.50000 1.0000 + Mn Mn151 1.0 0.80556 0.75000 0.50000 1.0000 + Mn Mn152 1.0 0.84722 0.79167 0.50000 1.0000 + Mn Mn153 1.0 0.88889 0.83333 0.50000 1.0000 + Mn Mn154 1.0 0.93056 0.87500 0.50000 1.0000 + Mn Mn155 1.0 0.97222 0.91667 0.50000 1.0000 + Mn Mn156 1.0 0.01389 0.95833 0.50000 1.0000 + Mn Mn157 1.0 0.59722 0.45833 0.50000 1.0000 + Mn Mn158 1.0 0.63889 0.50000 0.50000 1.0000 + Mn Mn159 1.0 0.68056 0.54167 0.50000 1.0000 + Mn Mn160 1.0 0.72222 0.58333 0.50000 1.0000 + Mn Mn161 1.0 0.76389 0.62500 0.50000 1.0000 + Mn Mn162 1.0 0.80556 0.66667 0.50000 1.0000 + Mn Mn163 1.0 0.84722 0.70833 0.50000 1.0000 + Mn Mn164 1.0 0.88889 0.75000 0.50000 1.0000 + Mn Mn165 1.0 0.93056 0.79167 0.50000 1.0000 + Mn Mn166 1.0 0.97222 0.83333 0.50000 1.0000 + Mn Mn167 1.0 0.01389 0.87500 0.50000 1.0000 + Mn Mn168 1.0 0.05556 0.91667 0.50000 1.0000 + Mn Mn169 1.0 0.63889 0.41667 0.50000 1.0000 + Mn Mn170 1.0 0.68056 0.45833 0.50000 1.0000 + Mn Mn171 1.0 0.72222 0.50000 0.50000 1.0000 + Mn Mn172 1.0 0.76389 0.54167 0.50000 1.0000 + Mn Mn173 1.0 0.80556 0.58333 0.50000 1.0000 + Mn Mn174 1.0 0.84722 0.62500 0.50000 1.0000 + Mn Mn175 1.0 0.88889 0.66667 0.50000 1.0000 + Mn Mn176 1.0 0.93056 0.70833 0.50000 1.0000 + Mn Mn177 1.0 0.97222 0.75000 0.50000 1.0000 + Mn Mn178 1.0 0.01389 0.79167 0.50000 1.0000 + Mn Mn179 1.0 0.05556 0.83333 0.50000 1.0000 + Mn Mn180 1.0 0.09722 0.87500 0.50000 1.0000 + Mn Mn181 1.0 0.68056 0.37500 0.50000 1.0000 + Mn Mn182 1.0 0.72222 0.41667 0.50000 1.0000 + Mn Mn183 1.0 0.76389 0.45833 0.50000 1.0000 + Mn Mn184 1.0 0.80556 0.50000 0.50000 1.0000 + Mn Mn185 1.0 0.84722 0.54167 0.50000 1.0000 + Mn Mn186 1.0 0.88889 0.58333 0.50000 1.0000 + Mn Mn187 1.0 0.93056 0.62500 0.50000 1.0000 + Mn Mn188 1.0 0.97222 0.66667 0.50000 1.0000 + Mn Mn189 1.0 0.01389 0.70833 0.50000 1.0000 + Mn Mn190 1.0 0.05556 0.75000 0.50000 1.0000 + Mn Mn191 1.0 0.09722 0.79167 0.50000 1.0000 + Mn Mn192 1.0 0.13889 0.83333 0.50000 1.0000 + Mn Mn193 1.0 0.72222 0.33333 0.50000 1.0000 + Mn Mn194 1.0 0.76389 0.37500 0.50000 1.0000 + Mn Mn195 1.0 0.80556 0.41667 0.50000 1.0000 + Mn Mn196 1.0 0.84722 0.45833 0.50000 1.0000 + Mn Mn197 1.0 0.88889 0.50000 0.50000 1.0000 + Mn Mn198 1.0 0.93056 0.54167 0.50000 1.0000 + Mn Mn199 1.0 0.97222 0.58333 0.50000 1.0000 + Mn Mn200 1.0 0.01389 0.62500 0.50000 1.0000 + Mn Mn201 1.0 0.05556 0.66667 0.50000 1.0000 + Mn Mn202 1.0 0.09722 0.70833 0.50000 1.0000 + Mn Mn203 1.0 0.13889 0.75000 0.50000 1.0000 + Mn Mn204 1.0 0.18056 0.79167 0.50000 1.0000 + Mn Mn205 1.0 0.76389 0.29167 0.50000 1.0000 + Mn Mn206 1.0 0.80556 0.33333 0.50000 1.0000 + Mn Mn207 1.0 0.84722 0.37500 0.50000 1.0000 + Mn Mn208 1.0 0.88889 0.41667 0.50000 1.0000 + Mn Mn209 1.0 0.93056 0.45833 0.50000 1.0000 + Mn Mn210 1.0 0.97222 0.50000 0.50000 1.0000 + Mn Mn211 1.0 0.01389 0.54167 0.50000 1.0000 + Mn Mn212 1.0 0.05556 0.58333 0.50000 1.0000 + Mn Mn213 1.0 0.09722 0.62500 0.50000 1.0000 + Mn Mn214 1.0 0.13889 0.66667 0.50000 1.0000 + Mn Mn215 1.0 0.18056 0.70833 0.50000 1.0000 + Mn Mn216 1.0 0.22222 0.75000 0.50000 1.0000 + Mn Mn217 1.0 0.80556 0.25000 0.50000 1.0000 + Mn Mn218 1.0 0.84722 0.29167 0.50000 1.0000 + Mn Mn219 1.0 0.88889 0.33333 0.50000 1.0000 + Mn Mn220 1.0 0.93056 0.37500 0.50000 1.0000 + Mn Mn221 1.0 0.97222 0.41667 0.50000 1.0000 + Mn Mn222 1.0 0.01389 0.45833 0.50000 1.0000 + Mn Mn223 1.0 0.05556 0.50000 0.50000 1.0000 + Mn Mn224 1.0 0.09722 0.54167 0.50000 1.0000 + Mn Mn225 1.0 0.13889 0.58333 0.50000 1.0000 + Mn Mn226 1.0 0.18056 0.62500 0.50000 1.0000 + Mn Mn227 1.0 0.22222 0.66667 0.50000 1.0000 + Mn Mn228 1.0 0.26389 0.70833 0.50000 1.0000 + Mn Mn229 1.0 0.84722 0.20833 0.50000 1.0000 + Mn Mn230 1.0 0.88889 0.25000 0.50000 1.0000 + Mn Mn231 1.0 0.93056 0.29167 0.50000 1.0000 + Mn Mn232 1.0 0.97222 0.33333 0.50000 1.0000 + Mn Mn233 1.0 0.01389 0.37500 0.50000 1.0000 + Mn Mn234 1.0 0.05556 0.41667 0.50000 1.0000 + Mn Mn235 1.0 0.09722 0.45833 0.50000 1.0000 + Mn Mn236 1.0 0.13889 0.50000 0.50000 1.0000 + Mn Mn237 1.0 0.18056 0.54167 0.50000 1.0000 + Mn Mn238 1.0 0.22222 0.58333 0.50000 1.0000 + Mn Mn239 1.0 0.26389 0.62500 0.50000 1.0000 + Mn Mn240 1.0 0.30556 0.66667 0.50000 1.0000 + Mn Mn241 1.0 0.88889 0.16667 0.50000 1.0000 + Mn Mn242 1.0 0.93056 0.20833 0.50000 1.0000 + Mn Mn243 1.0 0.97222 0.25000 0.50000 1.0000 + Mn Mn244 1.0 0.01389 0.29167 0.50000 1.0000 + Mn Mn245 1.0 0.05556 0.33333 0.50000 1.0000 + Mn Mn246 1.0 0.09722 0.37500 0.50000 1.0000 + Mn Mn247 1.0 0.13889 0.41667 0.50000 1.0000 + Mn Mn248 1.0 0.18056 0.45833 0.50000 1.0000 + Mn Mn249 1.0 0.22222 0.50000 0.50000 1.0000 + Mn Mn250 1.0 0.26389 0.54167 0.50000 1.0000 + Mn Mn251 1.0 0.30556 0.58333 0.50000 1.0000 + Mn Mn252 1.0 0.34722 0.62500 0.50000 1.0000 + Mn Mn253 1.0 0.93056 0.12500 0.50000 1.0000 + Mn Mn254 1.0 0.97222 0.16667 0.50000 1.0000 + Mn Mn255 1.0 0.01389 0.20833 0.50000 1.0000 + Mn Mn256 1.0 0.05556 0.25000 0.50000 1.0000 + Mn Mn257 1.0 0.09722 0.29167 0.50000 1.0000 + Mn Mn258 1.0 0.13889 0.33333 0.50000 1.0000 + Mn Mn259 1.0 0.18056 0.37500 0.50000 1.0000 + Mn Mn260 1.0 0.22222 0.41667 0.50000 1.0000 + Mn Mn261 1.0 0.26389 0.45833 0.50000 1.0000 + Mn Mn262 1.0 0.30556 0.50000 0.50000 1.0000 + Mn Mn263 1.0 0.34722 0.54167 0.50000 1.0000 + Mn Mn264 1.0 0.38889 0.58333 0.50000 1.0000 + Mn Mn265 1.0 0.97222 0.08333 0.50000 1.0000 + Mn Mn266 1.0 0.01389 0.12500 0.50000 1.0000 + Mn Mn267 1.0 0.05556 0.16667 0.50000 1.0000 + Mn Mn268 1.0 0.09722 0.20833 0.50000 1.0000 + Mn Mn269 1.0 0.13889 0.25000 0.50000 1.0000 + Mn Mn270 1.0 0.18056 0.29167 0.50000 1.0000 + Mn Mn271 1.0 0.22222 0.33333 0.50000 1.0000 + Mn Mn272 1.0 0.26389 0.37500 0.50000 1.0000 + Mn Mn273 1.0 0.30556 0.41667 0.50000 1.0000 + Mn Mn274 1.0 0.34722 0.45833 0.50000 1.0000 + Mn Mn275 1.0 0.38889 0.50000 0.50000 1.0000 + Mn Mn276 1.0 0.43056 0.54167 0.50000 1.0000 + Mn Mn277 1.0 0.01389 0.04167 0.50000 1.0000 + Mn Mn278 1.0 0.05556 0.08333 0.50000 1.0000 + Mn Mn279 1.0 0.09722 0.12500 0.50000 1.0000 + Mn Mn280 1.0 0.13889 0.16667 0.50000 1.0000 + Mn Mn281 1.0 0.18056 0.20833 0.50000 1.0000 + Mn Mn282 1.0 0.22222 0.25000 0.50000 1.0000 + Mn Mn283 1.0 0.26389 0.29167 0.50000 1.0000 + Mn Mn284 1.0 0.30556 0.33333 0.50000 1.0000 + Mn Mn285 1.0 0.34722 0.37500 0.50000 1.0000 + Mn Mn286 1.0 0.38889 0.41667 0.50000 1.0000 + Mn Mn287 1.0 0.43056 0.45833 0.50000 1.0000 + Mn Mn288 1.0 0.47222 0.50000 0.50000 1.0000 + Co Co433 1.0 0.53472 0.47917 0.50000 1.0000 + Co Co434 1.0 0.57639 0.52083 0.50000 1.0000 + Co Co435 1.0 0.61806 0.56250 0.50000 1.0000 + Co Co436 1.0 0.65972 0.60417 0.50000 1.0000 + Co Co437 1.0 0.70139 0.64583 0.50000 1.0000 + Co Co438 1.0 0.74306 0.68750 0.50000 1.0000 + Co Co439 1.0 0.78472 0.72917 0.50000 1.0000 + Co Co440 1.0 0.82639 0.77083 0.50000 1.0000 + Co Co441 1.0 0.86806 0.81250 0.50000 1.0000 + Co Co442 1.0 0.90972 0.85417 0.50000 1.0000 + Co Co443 1.0 0.95139 0.89583 0.50000 1.0000 + Co Co444 1.0 0.99306 0.93750 0.50000 1.0000 + Co Co445 1.0 0.57639 0.43750 0.50000 1.0000 + Co Co446 1.0 0.61806 0.47917 0.50000 1.0000 + Co Co447 1.0 0.65972 0.52083 0.50000 1.0000 + Co Co448 1.0 0.70139 0.56250 0.50000 1.0000 + Co Co449 1.0 0.74306 0.60417 0.50000 1.0000 + Co Co450 1.0 0.78472 0.64583 0.50000 1.0000 + Co Co451 1.0 0.82639 0.68750 0.50000 1.0000 + Co Co452 1.0 0.86806 0.72917 0.50000 1.0000 + Co Co453 1.0 0.90972 0.77083 0.50000 1.0000 + Co Co454 1.0 0.95139 0.81250 0.50000 1.0000 + Co Co455 1.0 0.99306 0.85417 0.50000 1.0000 + Co Co456 1.0 0.03472 0.89583 0.50000 1.0000 + Co Co457 1.0 0.61806 0.39583 0.50000 1.0000 + Co Co458 1.0 0.65972 0.43750 0.50000 1.0000 + Co Co459 1.0 0.70139 0.47917 0.50000 1.0000 + Co Co460 1.0 0.74306 0.52083 0.50000 1.0000 + Co Co461 1.0 0.78472 0.56250 0.50000 1.0000 + Co Co462 1.0 0.82639 0.60417 0.50000 1.0000 + Co Co463 1.0 0.86806 0.64583 0.50000 1.0000 + Co Co464 1.0 0.90972 0.68750 0.50000 1.0000 + Co Co465 1.0 0.95139 0.72917 0.50000 1.0000 + Co Co466 1.0 0.99306 0.77083 0.50000 1.0000 + Co Co467 1.0 0.03472 0.81250 0.50000 1.0000 + Co Co468 1.0 0.07639 0.85417 0.50000 1.0000 + Co Co469 1.0 0.65972 0.35417 0.50000 1.0000 + Co Co470 1.0 0.70139 0.39583 0.50000 1.0000 + Co Co471 1.0 0.74306 0.43750 0.50000 1.0000 + Co Co472 1.0 0.78472 0.47917 0.50000 1.0000 + Co Co473 1.0 0.82639 0.52083 0.50000 1.0000 + Co Co474 1.0 0.86806 0.56250 0.50000 1.0000 + Co Co475 1.0 0.90972 0.60417 0.50000 1.0000 + Co Co476 1.0 0.95139 0.64583 0.50000 1.0000 + Co Co477 1.0 0.99306 0.68750 0.50000 1.0000 + Co Co478 1.0 0.03472 0.72917 0.50000 1.0000 + Co Co479 1.0 0.07639 0.77083 0.50000 1.0000 + Co Co480 1.0 0.11806 0.81250 0.50000 1.0000 + Co Co481 1.0 0.70139 0.31250 0.50000 1.0000 + Co Co482 1.0 0.74306 0.35417 0.50000 1.0000 + Co Co483 1.0 0.78472 0.39583 0.50000 1.0000 + Co Co484 1.0 0.82639 0.43750 0.50000 1.0000 + Co Co485 1.0 0.86806 0.47917 0.50000 1.0000 + Co Co486 1.0 0.90972 0.52083 0.50000 1.0000 + Co Co487 1.0 0.95139 0.56250 0.50000 1.0000 + Co Co488 1.0 0.99306 0.60417 0.50000 1.0000 + Co Co489 1.0 0.03472 0.64583 0.50000 1.0000 + Co Co490 1.0 0.07639 0.68750 0.50000 1.0000 + Co Co491 1.0 0.11806 0.72917 0.50000 1.0000 + Co Co492 1.0 0.15972 0.77083 0.50000 1.0000 + Co Co493 1.0 0.74306 0.27083 0.50000 1.0000 + Co Co494 1.0 0.78472 0.31250 0.50000 1.0000 + Co Co495 1.0 0.82639 0.35417 0.50000 1.0000 + Co Co496 1.0 0.86806 0.39583 0.50000 1.0000 + Co Co497 1.0 0.90972 0.43750 0.50000 1.0000 + Co Co498 1.0 0.95139 0.47917 0.50000 1.0000 + Co Co499 1.0 0.99306 0.52083 0.50000 1.0000 + Co Co500 1.0 0.03472 0.56250 0.50000 1.0000 + Co Co501 1.0 0.07639 0.60417 0.50000 1.0000 + Co Co502 1.0 0.11806 0.64583 0.50000 1.0000 + Co Co503 1.0 0.15972 0.68750 0.50000 1.0000 + Co Co504 1.0 0.20139 0.72917 0.50000 1.0000 + Co Co505 1.0 0.78472 0.22917 0.50000 1.0000 + Co Co506 1.0 0.82639 0.27083 0.50000 1.0000 + Co Co507 1.0 0.86806 0.31250 0.50000 1.0000 + Co Co508 1.0 0.90972 0.35417 0.50000 1.0000 + Co Co509 1.0 0.95139 0.39583 0.50000 1.0000 + Co Co510 1.0 0.99306 0.43750 0.50000 1.0000 + Co Co511 1.0 0.03472 0.47917 0.50000 1.0000 + Co Co512 1.0 0.07639 0.52083 0.50000 1.0000 + Co Co513 1.0 0.11806 0.56250 0.50000 1.0000 + Co Co514 1.0 0.15972 0.60417 0.50000 1.0000 + Co Co515 1.0 0.20139 0.64583 0.50000 1.0000 + Co Co516 1.0 0.24306 0.68750 0.50000 1.0000 + Co Co517 1.0 0.82639 0.18750 0.50000 1.0000 + Co Co518 1.0 0.86806 0.22917 0.50000 1.0000 + Co Co519 1.0 0.90972 0.27083 0.50000 1.0000 + Co Co520 1.0 0.95139 0.31250 0.50000 1.0000 + Co Co521 1.0 0.99306 0.35417 0.50000 1.0000 + Co Co522 1.0 0.03472 0.39583 0.50000 1.0000 + Co Co523 1.0 0.07639 0.43750 0.50000 1.0000 + Co Co524 1.0 0.11806 0.47917 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O1646 1.0 0.43024 0.15658 0.29940 1.0000 + O O1647 1.0 0.43024 0.23991 0.29940 1.0000 + O O1648 1.0 0.43024 0.32324 0.29940 1.0000 + O O1649 1.0 0.43024 0.40658 0.29940 1.0000 + O O1650 1.0 0.43024 0.48991 0.29940 1.0000 + O O1651 1.0 0.43024 0.57324 0.29940 1.0000 + O O1652 1.0 0.43024 0.65658 0.29940 1.0000 + O O1653 1.0 0.43024 0.73991 0.29940 1.0000 + O O1654 1.0 0.43024 0.82324 0.29940 1.0000 + O O1655 1.0 0.43024 0.90658 0.29940 1.0000 + O O1656 1.0 0.43024 0.98991 0.29940 1.0000 + O O1657 1.0 0.51358 0.07324 0.29940 1.0000 + O O1658 1.0 0.51358 0.15658 0.29940 1.0000 + O O1659 1.0 0.51358 0.23991 0.29940 1.0000 + O O1660 1.0 0.51358 0.32324 0.29940 1.0000 + O O1661 1.0 0.51358 0.40658 0.29940 1.0000 + O O1662 1.0 0.51358 0.48991 0.29940 1.0000 + O O1663 1.0 0.51358 0.57324 0.29940 1.0000 + O O1664 1.0 0.51358 0.65658 0.29940 1.0000 + O O1665 1.0 0.51358 0.73991 0.29940 1.0000 + O O1666 1.0 0.51358 0.82324 0.29940 1.0000 + O O1667 1.0 0.51358 0.90658 0.29940 1.0000 + O O1668 1.0 0.51358 0.98991 0.29940 1.0000 + O O1669 1.0 0.59691 0.07324 0.29940 1.0000 + O O1670 1.0 0.59691 0.15658 0.29940 1.0000 + O O1671 1.0 0.59691 0.23991 0.29940 1.0000 + O O1672 1.0 0.59691 0.32324 0.29940 1.0000 + O O1673 1.0 0.59691 0.40658 0.29940 1.0000 + O O1674 1.0 0.59691 0.48991 0.29940 1.0000 + O O1675 1.0 0.59691 0.57324 0.29940 1.0000 + O O1676 1.0 0.59691 0.65658 0.29940 1.0000 + O O1677 1.0 0.59691 0.73991 0.29940 1.0000 + O O1678 1.0 0.59691 0.82324 0.29940 1.0000 + O O1679 1.0 0.59691 0.90658 0.29940 1.0000 + O O1680 1.0 0.59691 0.98991 0.29940 1.0000 + O O1681 1.0 0.68024 0.07324 0.29940 1.0000 + O O1682 1.0 0.68024 0.15658 0.29940 1.0000 + O O1683 1.0 0.68024 0.23991 0.29940 1.0000 + O O1684 1.0 0.68024 0.32324 0.29940 1.0000 + O O1685 1.0 0.68024 0.40658 0.29940 1.0000 + O O1686 1.0 0.68024 0.48991 0.29940 1.0000 + O O1687 1.0 0.68024 0.57324 0.29940 1.0000 + O O1688 1.0 0.68024 0.65658 0.29940 1.0000 + O O1689 1.0 0.68024 0.73991 0.29940 1.0000 + O O1690 1.0 0.68024 0.82324 0.29940 1.0000 + O O1691 1.0 0.68024 0.90658 0.29940 1.0000 + O O1692 1.0 0.68024 0.98991 0.29940 1.0000 + O O1693 1.0 0.76358 0.07324 0.29940 1.0000 + O O1694 1.0 0.76358 0.15658 0.29940 1.0000 + O O1695 1.0 0.76358 0.23991 0.29940 1.0000 + O O1696 1.0 0.76358 0.32324 0.29940 1.0000 + O O1697 1.0 0.76358 0.40658 0.29940 1.0000 + O O1698 1.0 0.76358 0.48991 0.29940 1.0000 + O O1699 1.0 0.76358 0.57324 0.29940 1.0000 + O O1700 1.0 0.76358 0.65658 0.29940 1.0000 + O O1701 1.0 0.76358 0.73991 0.29940 1.0000 + O O1702 1.0 0.76358 0.82324 0.29940 1.0000 + O O1703 1.0 0.76358 0.90658 0.29940 1.0000 + O O1704 1.0 0.76358 0.98991 0.29940 1.0000 + O O1705 1.0 0.84691 0.07324 0.29940 1.0000 + O O1706 1.0 0.84691 0.15658 0.29940 1.0000 + O O1707 1.0 0.84691 0.23991 0.29940 1.0000 + O O1708 1.0 0.84691 0.32324 0.29940 1.0000 + O O1709 1.0 0.84691 0.40658 0.29940 1.0000 + O O1710 1.0 0.84691 0.48991 0.29940 1.0000 + O O1711 1.0 0.84691 0.57324 0.29940 1.0000 + O O1712 1.0 0.84691 0.65658 0.29940 1.0000 + O O1713 1.0 0.84691 0.73991 0.29940 1.0000 + O O1714 1.0 0.84691 0.82324 0.29940 1.0000 + O O1715 1.0 0.84691 0.90658 0.29940 1.0000 + O O1716 1.0 0.84691 0.98991 0.29940 1.0000 + O O1717 1.0 0.93024 0.07324 0.29940 1.0000 + O O1718 1.0 0.93024 0.15658 0.29940 1.0000 + O O1719 1.0 0.93024 0.23991 0.29940 1.0000 + O O1720 1.0 0.93024 0.32324 0.29940 1.0000 + O O1721 1.0 0.93024 0.40658 0.29940 1.0000 + O O1722 1.0 0.93024 0.48991 0.29940 1.0000 + O O1723 1.0 0.93024 0.57324 0.29940 1.0000 + O O1724 1.0 0.93024 0.65658 0.29940 1.0000 + O O1725 1.0 0.93024 0.73991 0.29940 1.0000 + O O1726 1.0 0.93024 0.82324 0.29940 1.0000 + O O1727 1.0 0.93024 0.90658 0.29940 1.0000 + O O1728 1.0 0.93024 0.98991 0.29940 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-5338_supercell_12x12x1.cif b/tier3/cif_file/orthogonal_2dm-5338_supercell_12x12x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..0e65b2640a9eaedbc6677e5d63dd57f55b82e5ba --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-5338_supercell_12x12x1.cif @@ -0,0 +1,1897 @@ +data_image0 +_chemical_formula_structural Zn288Fe432O1152 +_chemical_formula_sum "Zn288 Fe432 O1152" +_cell_length_a 60.6912 +_cell_length_b 72.5167 +_cell_length_c 6.90786 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Zn Zn1 1.0 0.02148 0.00000 0.71047 1.0000 + Zn Zn2 1.0 0.02148 0.08333 0.71047 1.0000 + Zn Zn3 1.0 0.02148 0.16667 0.71047 1.0000 + Zn Zn4 1.0 0.02148 0.25000 0.71047 1.0000 + Zn Zn5 1.0 0.02148 0.33333 0.71047 1.0000 + Zn Zn6 1.0 0.02148 0.41667 0.71047 1.0000 + Zn Zn7 1.0 0.02148 0.50000 0.71047 1.0000 + Zn Zn8 1.0 0.02148 0.58333 0.71047 1.0000 + Zn Zn9 1.0 0.02148 0.66667 0.71047 1.0000 + Zn Zn10 1.0 0.02148 0.75000 0.71047 1.0000 + Zn Zn11 1.0 0.02148 0.83333 0.71047 1.0000 + Zn Zn12 1.0 0.02148 0.91667 0.71047 1.0000 + Zn Zn13 1.0 0.10481 0.00000 0.71047 1.0000 + Zn Zn14 1.0 0.10481 0.08333 0.71047 1.0000 + Zn Zn15 1.0 0.10481 0.16667 0.71047 1.0000 + Zn Zn16 1.0 0.10481 0.25000 0.71047 1.0000 + Zn Zn17 1.0 0.10481 0.33333 0.71047 1.0000 + Zn Zn18 1.0 0.10481 0.41667 0.71047 1.0000 + Zn Zn19 1.0 0.10481 0.50000 0.71047 1.0000 + Zn Zn20 1.0 0.10481 0.58333 0.71047 1.0000 + Zn Zn21 1.0 0.10481 0.66667 0.71047 1.0000 + Zn Zn22 1.0 0.10481 0.75000 0.71047 1.0000 + Zn Zn23 1.0 0.10481 0.83333 0.71047 1.0000 + Zn Zn24 1.0 0.10481 0.91667 0.71047 1.0000 + Zn Zn25 1.0 0.18815 0.00000 0.71047 1.0000 + Zn Zn26 1.0 0.18815 0.08333 0.71047 1.0000 + Zn Zn27 1.0 0.18815 0.16667 0.71047 1.0000 + Zn Zn28 1.0 0.18815 0.25000 0.71047 1.0000 + Zn Zn29 1.0 0.18815 0.33333 0.71047 1.0000 + Zn Zn30 1.0 0.18815 0.41667 0.71047 1.0000 + Zn Zn31 1.0 0.18815 0.50000 0.71047 1.0000 + Zn Zn32 1.0 0.18815 0.58333 0.71047 1.0000 + Zn Zn33 1.0 0.18815 0.66667 0.71047 1.0000 + Zn Zn34 1.0 0.18815 0.75000 0.71047 1.0000 + Zn Zn35 1.0 0.18815 0.83333 0.71047 1.0000 + Zn Zn36 1.0 0.18815 0.91667 0.71047 1.0000 + Zn Zn37 1.0 0.27148 0.00000 0.71047 1.0000 + Zn Zn38 1.0 0.27148 0.08333 0.71047 1.0000 + Zn Zn39 1.0 0.27148 0.16667 0.71047 1.0000 + Zn Zn40 1.0 0.27148 0.25000 0.71047 1.0000 + Zn Zn41 1.0 0.27148 0.33333 0.71047 1.0000 + Zn Zn42 1.0 0.27148 0.41667 0.71047 1.0000 + Zn Zn43 1.0 0.27148 0.50000 0.71047 1.0000 + Zn Zn44 1.0 0.27148 0.58333 0.71047 1.0000 + Zn Zn45 1.0 0.27148 0.66667 0.71047 1.0000 + Zn Zn46 1.0 0.27148 0.75000 0.71047 1.0000 + Zn Zn47 1.0 0.27148 0.83333 0.71047 1.0000 + Zn Zn48 1.0 0.27148 0.91667 0.71047 1.0000 + Zn Zn49 1.0 0.35481 0.00000 0.71047 1.0000 + Zn Zn50 1.0 0.35481 0.08333 0.71047 1.0000 + Zn Zn51 1.0 0.35481 0.16667 0.71047 1.0000 + Zn Zn52 1.0 0.35481 0.25000 0.71047 1.0000 + Zn Zn53 1.0 0.35481 0.33333 0.71047 1.0000 + Zn Zn54 1.0 0.35481 0.41667 0.71047 1.0000 + Zn Zn55 1.0 0.35481 0.50000 0.71047 1.0000 + Zn Zn56 1.0 0.35481 0.58333 0.71047 1.0000 + Zn Zn57 1.0 0.35481 0.66667 0.71047 1.0000 + Zn Zn58 1.0 0.35481 0.75000 0.71047 1.0000 + Zn Zn59 1.0 0.35481 0.83333 0.71047 1.0000 + Zn Zn60 1.0 0.35481 0.91667 0.71047 1.0000 + Zn Zn61 1.0 0.43815 0.00000 0.71047 1.0000 + Zn Zn62 1.0 0.43815 0.08333 0.71047 1.0000 + Zn Zn63 1.0 0.43815 0.16667 0.71047 1.0000 + Zn Zn64 1.0 0.43815 0.25000 0.71047 1.0000 + Zn Zn65 1.0 0.43815 0.33333 0.71047 1.0000 + Zn Zn66 1.0 0.43815 0.41667 0.71047 1.0000 + Zn Zn67 1.0 0.43815 0.50000 0.71047 1.0000 + Zn Zn68 1.0 0.43815 0.58333 0.71047 1.0000 + Zn Zn69 1.0 0.43815 0.66667 0.71047 1.0000 + Zn Zn70 1.0 0.43815 0.75000 0.71047 1.0000 + Zn Zn71 1.0 0.43815 0.83333 0.71047 1.0000 + Zn Zn72 1.0 0.43815 0.91667 0.71047 1.0000 + Zn Zn73 1.0 0.52148 0.00000 0.71047 1.0000 + Zn Zn74 1.0 0.52148 0.08333 0.71047 1.0000 + Zn Zn75 1.0 0.52148 0.16667 0.71047 1.0000 + Zn Zn76 1.0 0.52148 0.25000 0.71047 1.0000 + Zn Zn77 1.0 0.52148 0.33333 0.71047 1.0000 + Zn Zn78 1.0 0.52148 0.41667 0.71047 1.0000 + Zn Zn79 1.0 0.52148 0.50000 0.71047 1.0000 + Zn Zn80 1.0 0.52148 0.58333 0.71047 1.0000 + Zn Zn81 1.0 0.52148 0.66667 0.71047 1.0000 + Zn Zn82 1.0 0.52148 0.75000 0.71047 1.0000 + Zn Zn83 1.0 0.52148 0.83333 0.71047 1.0000 + Zn Zn84 1.0 0.52148 0.91667 0.71047 1.0000 + Zn Zn85 1.0 0.60481 0.00000 0.71047 1.0000 + Zn Zn86 1.0 0.60481 0.08333 0.71047 1.0000 + Zn Zn87 1.0 0.60481 0.16667 0.71047 1.0000 + Zn Zn88 1.0 0.60481 0.25000 0.71047 1.0000 + Zn Zn89 1.0 0.60481 0.33333 0.71047 1.0000 + Zn Zn90 1.0 0.60481 0.41667 0.71047 1.0000 + Zn Zn91 1.0 0.60481 0.50000 0.71047 1.0000 + Zn Zn92 1.0 0.60481 0.58333 0.71047 1.0000 + Zn Zn93 1.0 0.60481 0.66667 0.71047 1.0000 + Zn Zn94 1.0 0.60481 0.75000 0.71047 1.0000 + Zn Zn95 1.0 0.60481 0.83333 0.71047 1.0000 + Zn Zn96 1.0 0.60481 0.91667 0.71047 1.0000 + Zn Zn97 1.0 0.68815 0.00000 0.71047 1.0000 + Zn Zn98 1.0 0.68815 0.08333 0.71047 1.0000 + Zn Zn99 1.0 0.68815 0.16667 0.71047 1.0000 + Zn Zn100 1.0 0.68815 0.25000 0.71047 1.0000 + Zn Zn101 1.0 0.68815 0.33333 0.71047 1.0000 + Zn Zn102 1.0 0.68815 0.41667 0.71047 1.0000 + Zn Zn103 1.0 0.68815 0.50000 0.71047 1.0000 + Zn Zn104 1.0 0.68815 0.58333 0.71047 1.0000 + Zn Zn105 1.0 0.68815 0.66667 0.71047 1.0000 + Zn Zn106 1.0 0.68815 0.75000 0.71047 1.0000 + Zn Zn107 1.0 0.68815 0.83333 0.71047 1.0000 + Zn Zn108 1.0 0.68815 0.91667 0.71047 1.0000 + Zn Zn109 1.0 0.77148 0.00000 0.71047 1.0000 + Zn Zn110 1.0 0.77148 0.08333 0.71047 1.0000 + Zn Zn111 1.0 0.77148 0.16667 0.71047 1.0000 + Zn Zn112 1.0 0.77148 0.25000 0.71047 1.0000 + Zn Zn113 1.0 0.77148 0.33333 0.71047 1.0000 + Zn Zn114 1.0 0.77148 0.41667 0.71047 1.0000 + Zn Zn115 1.0 0.77148 0.50000 0.71047 1.0000 + Zn Zn116 1.0 0.77148 0.58333 0.71047 1.0000 + Zn Zn117 1.0 0.77148 0.66667 0.71047 1.0000 + Zn Zn118 1.0 0.77148 0.75000 0.71047 1.0000 + Zn Zn119 1.0 0.77148 0.83333 0.71047 1.0000 + Zn Zn120 1.0 0.77148 0.91667 0.71047 1.0000 + Zn Zn121 1.0 0.85481 0.00000 0.71047 1.0000 + Zn Zn122 1.0 0.85481 0.08333 0.71047 1.0000 + Zn Zn123 1.0 0.85481 0.16667 0.71047 1.0000 + Zn Zn124 1.0 0.85481 0.25000 0.71047 1.0000 + Zn Zn125 1.0 0.85481 0.33333 0.71047 1.0000 + Zn Zn126 1.0 0.85481 0.41667 0.71047 1.0000 + Zn Zn127 1.0 0.85481 0.50000 0.71047 1.0000 + Zn Zn128 1.0 0.85481 0.58333 0.71047 1.0000 + Zn Zn129 1.0 0.85481 0.66667 0.71047 1.0000 + Zn Zn130 1.0 0.85481 0.75000 0.71047 1.0000 + Zn Zn131 1.0 0.85481 0.83333 0.71047 1.0000 + Zn Zn132 1.0 0.85481 0.91667 0.71047 1.0000 + Zn Zn133 1.0 0.93815 0.00000 0.71047 1.0000 + Zn Zn134 1.0 0.93815 0.08333 0.71047 1.0000 + Zn Zn135 1.0 0.93815 0.16667 0.71047 1.0000 + Zn Zn136 1.0 0.93815 0.25000 0.71047 1.0000 + Zn Zn137 1.0 0.93815 0.33333 0.71047 1.0000 + Zn Zn138 1.0 0.93815 0.41667 0.71047 1.0000 + Zn Zn139 1.0 0.93815 0.50000 0.71047 1.0000 + Zn Zn140 1.0 0.93815 0.58333 0.71047 1.0000 + Zn Zn141 1.0 0.93815 0.66667 0.71047 1.0000 + Zn Zn142 1.0 0.93815 0.75000 0.71047 1.0000 + Zn Zn143 1.0 0.93815 0.83333 0.71047 1.0000 + Zn Zn144 1.0 0.93815 0.91667 0.71047 1.0000 + Zn Zn145 1.0 0.02250 0.00000 0.28953 1.0000 + Zn Zn146 1.0 0.02250 0.08333 0.28953 1.0000 + Zn Zn147 1.0 0.02250 0.16667 0.28953 1.0000 + Zn Zn148 1.0 0.02250 0.25000 0.28953 1.0000 + Zn Zn149 1.0 0.02250 0.33333 0.28953 1.0000 + Zn Zn150 1.0 0.02250 0.41667 0.28953 1.0000 + Zn Zn151 1.0 0.02250 0.50000 0.28953 1.0000 + Zn Zn152 1.0 0.02250 0.58333 0.28953 1.0000 + Zn Zn153 1.0 0.02250 0.66667 0.28953 1.0000 + Zn Zn154 1.0 0.02250 0.75000 0.28953 1.0000 + Zn Zn155 1.0 0.02250 0.83333 0.28953 1.0000 + Zn Zn156 1.0 0.02250 0.91667 0.28953 1.0000 + Zn Zn157 1.0 0.10584 0.00000 0.28953 1.0000 + Zn Zn158 1.0 0.10584 0.08333 0.28953 1.0000 + Zn Zn159 1.0 0.10584 0.16667 0.28953 1.0000 + Zn Zn160 1.0 0.10584 0.25000 0.28953 1.0000 + Zn Zn161 1.0 0.10584 0.33333 0.28953 1.0000 + Zn Zn162 1.0 0.10584 0.41667 0.28953 1.0000 + Zn Zn163 1.0 0.10584 0.50000 0.28953 1.0000 + Zn Zn164 1.0 0.10584 0.58333 0.28953 1.0000 + Zn Zn165 1.0 0.10584 0.66667 0.28953 1.0000 + Zn Zn166 1.0 0.10584 0.75000 0.28953 1.0000 + Zn Zn167 1.0 0.10584 0.83333 0.28953 1.0000 + Zn Zn168 1.0 0.10584 0.91667 0.28953 1.0000 + Zn Zn169 1.0 0.18917 0.00000 0.28953 1.0000 + Zn Zn170 1.0 0.18917 0.08333 0.28953 1.0000 + Zn Zn171 1.0 0.18917 0.16667 0.28953 1.0000 + Zn Zn172 1.0 0.18917 0.25000 0.28953 1.0000 + Zn Zn173 1.0 0.18917 0.33333 0.28953 1.0000 + Zn Zn174 1.0 0.18917 0.41667 0.28953 1.0000 + Zn Zn175 1.0 0.18917 0.50000 0.28953 1.0000 + Zn Zn176 1.0 0.18917 0.58333 0.28953 1.0000 + Zn Zn177 1.0 0.18917 0.66667 0.28953 1.0000 + Zn Zn178 1.0 0.18917 0.75000 0.28953 1.0000 + Zn Zn179 1.0 0.18917 0.83333 0.28953 1.0000 + Zn Zn180 1.0 0.18917 0.91667 0.28953 1.0000 + Zn Zn181 1.0 0.27250 0.00000 0.28953 1.0000 + Zn Zn182 1.0 0.27250 0.08333 0.28953 1.0000 + Zn Zn183 1.0 0.27250 0.16667 0.28953 1.0000 + Zn Zn184 1.0 0.27250 0.25000 0.28953 1.0000 + Zn Zn185 1.0 0.27250 0.33333 0.28953 1.0000 + Zn Zn186 1.0 0.27250 0.41667 0.28953 1.0000 + Zn Zn187 1.0 0.27250 0.50000 0.28953 1.0000 + Zn Zn188 1.0 0.27250 0.58333 0.28953 1.0000 + Zn Zn189 1.0 0.27250 0.66667 0.28953 1.0000 + Zn Zn190 1.0 0.27250 0.75000 0.28953 1.0000 + Zn Zn191 1.0 0.27250 0.83333 0.28953 1.0000 + Zn Zn192 1.0 0.27250 0.91667 0.28953 1.0000 + Zn Zn193 1.0 0.35584 0.00000 0.28953 1.0000 + Zn Zn194 1.0 0.35584 0.08333 0.28953 1.0000 + Zn Zn195 1.0 0.35584 0.16667 0.28953 1.0000 + Zn Zn196 1.0 0.35584 0.25000 0.28953 1.0000 + Zn Zn197 1.0 0.35584 0.33333 0.28953 1.0000 + Zn Zn198 1.0 0.35584 0.41667 0.28953 1.0000 + Zn Zn199 1.0 0.35584 0.50000 0.28953 1.0000 + Zn Zn200 1.0 0.35584 0.58333 0.28953 1.0000 + Zn Zn201 1.0 0.35584 0.66667 0.28953 1.0000 + Zn Zn202 1.0 0.35584 0.75000 0.28953 1.0000 + Zn Zn203 1.0 0.35584 0.83333 0.28953 1.0000 + Zn Zn204 1.0 0.35584 0.91667 0.28953 1.0000 + Zn Zn205 1.0 0.43917 0.00000 0.28953 1.0000 + Zn Zn206 1.0 0.43917 0.08333 0.28953 1.0000 + Zn Zn207 1.0 0.43917 0.16667 0.28953 1.0000 + Zn Zn208 1.0 0.43917 0.25000 0.28953 1.0000 + Zn Zn209 1.0 0.43917 0.33333 0.28953 1.0000 + Zn Zn210 1.0 0.43917 0.41667 0.28953 1.0000 + Zn Zn211 1.0 0.43917 0.50000 0.28953 1.0000 + Zn Zn212 1.0 0.43917 0.58333 0.28953 1.0000 + Zn Zn213 1.0 0.43917 0.66667 0.28953 1.0000 + Zn Zn214 1.0 0.43917 0.75000 0.28953 1.0000 + Zn Zn215 1.0 0.43917 0.83333 0.28953 1.0000 + Zn Zn216 1.0 0.43917 0.91667 0.28953 1.0000 + Zn Zn217 1.0 0.52250 0.00000 0.28953 1.0000 + Zn Zn218 1.0 0.52250 0.08333 0.28953 1.0000 + Zn Zn219 1.0 0.52250 0.16667 0.28953 1.0000 + Zn Zn220 1.0 0.52250 0.25000 0.28953 1.0000 + Zn Zn221 1.0 0.52250 0.33333 0.28953 1.0000 + Zn Zn222 1.0 0.52250 0.41667 0.28953 1.0000 + Zn Zn223 1.0 0.52250 0.50000 0.28953 1.0000 + Zn Zn224 1.0 0.52250 0.58333 0.28953 1.0000 + Zn Zn225 1.0 0.52250 0.66667 0.28953 1.0000 + Zn Zn226 1.0 0.52250 0.75000 0.28953 1.0000 + Zn Zn227 1.0 0.52250 0.83333 0.28953 1.0000 + Zn Zn228 1.0 0.52250 0.91667 0.28953 1.0000 + Zn Zn229 1.0 0.60584 0.00000 0.28953 1.0000 + Zn Zn230 1.0 0.60584 0.08333 0.28953 1.0000 + Zn Zn231 1.0 0.60584 0.16667 0.28953 1.0000 + Zn Zn232 1.0 0.60584 0.25000 0.28953 1.0000 + Zn Zn233 1.0 0.60584 0.33333 0.28953 1.0000 + Zn Zn234 1.0 0.60584 0.41667 0.28953 1.0000 + Zn Zn235 1.0 0.60584 0.50000 0.28953 1.0000 + Zn Zn236 1.0 0.60584 0.58333 0.28953 1.0000 + Zn Zn237 1.0 0.60584 0.66667 0.28953 1.0000 + Zn Zn238 1.0 0.60584 0.75000 0.28953 1.0000 + Zn Zn239 1.0 0.60584 0.83333 0.28953 1.0000 + Zn Zn240 1.0 0.60584 0.91667 0.28953 1.0000 + Zn Zn241 1.0 0.68917 0.00000 0.28953 1.0000 + Zn Zn242 1.0 0.68917 0.08333 0.28953 1.0000 + Zn Zn243 1.0 0.68917 0.16667 0.28953 1.0000 + Zn Zn244 1.0 0.68917 0.25000 0.28953 1.0000 + Zn Zn245 1.0 0.68917 0.33333 0.28953 1.0000 + Zn Zn246 1.0 0.68917 0.41667 0.28953 1.0000 + Zn Zn247 1.0 0.68917 0.50000 0.28953 1.0000 + Zn Zn248 1.0 0.68917 0.58333 0.28953 1.0000 + Zn Zn249 1.0 0.68917 0.66667 0.28953 1.0000 + Zn Zn250 1.0 0.68917 0.75000 0.28953 1.0000 + Zn Zn251 1.0 0.68917 0.83333 0.28953 1.0000 + Zn Zn252 1.0 0.68917 0.91667 0.28953 1.0000 + Zn Zn253 1.0 0.77250 0.00000 0.28953 1.0000 + Zn Zn254 1.0 0.77250 0.08333 0.28953 1.0000 + Zn Zn255 1.0 0.77250 0.16667 0.28953 1.0000 + Zn Zn256 1.0 0.77250 0.25000 0.28953 1.0000 + Zn Zn257 1.0 0.77250 0.33333 0.28953 1.0000 + Zn Zn258 1.0 0.77250 0.41667 0.28953 1.0000 + Zn Zn259 1.0 0.77250 0.50000 0.28953 1.0000 + Zn Zn260 1.0 0.77250 0.58333 0.28953 1.0000 + Zn Zn261 1.0 0.77250 0.66667 0.28953 1.0000 + Zn Zn262 1.0 0.77250 0.75000 0.28953 1.0000 + Zn Zn263 1.0 0.77250 0.83333 0.28953 1.0000 + Zn Zn264 1.0 0.77250 0.91667 0.28953 1.0000 + Zn Zn265 1.0 0.85584 0.00000 0.28953 1.0000 + Zn Zn266 1.0 0.85584 0.08333 0.28953 1.0000 + Zn Zn267 1.0 0.85584 0.16667 0.28953 1.0000 + Zn Zn268 1.0 0.85584 0.25000 0.28953 1.0000 + Zn Zn269 1.0 0.85584 0.33333 0.28953 1.0000 + Zn Zn270 1.0 0.85584 0.41667 0.28953 1.0000 + Zn Zn271 1.0 0.85584 0.50000 0.28953 1.0000 + Zn Zn272 1.0 0.85584 0.58333 0.28953 1.0000 + Zn Zn273 1.0 0.85584 0.66667 0.28953 1.0000 + Zn Zn274 1.0 0.85584 0.75000 0.28953 1.0000 + Zn Zn275 1.0 0.85584 0.83333 0.28953 1.0000 + Zn Zn276 1.0 0.85584 0.91667 0.28953 1.0000 + Zn Zn277 1.0 0.93917 0.00000 0.28953 1.0000 + Zn Zn278 1.0 0.93917 0.08333 0.28953 1.0000 + Zn Zn279 1.0 0.93917 0.16667 0.28953 1.0000 + Zn Zn280 1.0 0.93917 0.25000 0.28953 1.0000 + Zn Zn281 1.0 0.93917 0.33333 0.28953 1.0000 + Zn Zn282 1.0 0.93917 0.41667 0.28953 1.0000 + Zn Zn283 1.0 0.93917 0.50000 0.28953 1.0000 + Zn Zn284 1.0 0.93917 0.58333 0.28953 1.0000 + Zn Zn285 1.0 0.93917 0.66667 0.28953 1.0000 + Zn Zn286 1.0 0.93917 0.75000 0.28953 1.0000 + Zn Zn287 1.0 0.93917 0.83333 0.28953 1.0000 + Zn Zn288 1.0 0.93917 0.91667 0.28953 1.0000 + Fe Fe1 1.0 0.02199 0.04167 0.50000 1.0000 + Fe Fe2 1.0 0.02199 0.12500 0.50000 1.0000 + Fe Fe3 1.0 0.02199 0.20833 0.50000 1.0000 + Fe Fe4 1.0 0.02199 0.29167 0.50000 1.0000 + Fe Fe5 1.0 0.02199 0.37500 0.50000 1.0000 + Fe Fe6 1.0 0.02199 0.45833 0.50000 1.0000 + Fe Fe7 1.0 0.02199 0.54167 0.50000 1.0000 + Fe Fe8 1.0 0.02199 0.62500 0.50000 1.0000 + Fe Fe9 1.0 0.02199 0.70833 0.50000 1.0000 + Fe Fe10 1.0 0.02199 0.79167 0.50000 1.0000 + Fe Fe11 1.0 0.02199 0.87500 0.50000 1.0000 + Fe Fe12 1.0 0.02199 0.95833 0.50000 1.0000 + Fe Fe13 1.0 0.10532 0.04167 0.50000 1.0000 + Fe Fe14 1.0 0.10532 0.12500 0.50000 1.0000 + Fe Fe15 1.0 0.10532 0.20833 0.50000 1.0000 + Fe Fe16 1.0 0.10532 0.29167 0.50000 1.0000 + Fe Fe17 1.0 0.10532 0.37500 0.50000 1.0000 + Fe Fe18 1.0 0.10532 0.45833 0.50000 1.0000 + Fe Fe19 1.0 0.10532 0.54167 0.50000 1.0000 + Fe Fe20 1.0 0.10532 0.62500 0.50000 1.0000 + Fe Fe21 1.0 0.10532 0.70833 0.50000 1.0000 + Fe Fe22 1.0 0.10532 0.79167 0.50000 1.0000 + Fe Fe23 1.0 0.10532 0.87500 0.50000 1.0000 + Fe Fe24 1.0 0.10532 0.95833 0.50000 1.0000 + Fe Fe25 1.0 0.18866 0.04167 0.50000 1.0000 + Fe Fe26 1.0 0.18866 0.12500 0.50000 1.0000 + Fe Fe27 1.0 0.18866 0.20833 0.50000 1.0000 + Fe Fe28 1.0 0.18866 0.29167 0.50000 1.0000 + Fe Fe29 1.0 0.18866 0.37500 0.50000 1.0000 + Fe Fe30 1.0 0.18866 0.45833 0.50000 1.0000 + Fe Fe31 1.0 0.18866 0.54167 0.50000 1.0000 + Fe Fe32 1.0 0.18866 0.62500 0.50000 1.0000 + Fe Fe33 1.0 0.18866 0.70833 0.50000 1.0000 + Fe Fe34 1.0 0.18866 0.79167 0.50000 1.0000 + Fe Fe35 1.0 0.18866 0.87500 0.50000 1.0000 + Fe Fe36 1.0 0.18866 0.95833 0.50000 1.0000 + Fe Fe37 1.0 0.27199 0.04167 0.50000 1.0000 + Fe Fe38 1.0 0.27199 0.12500 0.50000 1.0000 + Fe Fe39 1.0 0.27199 0.20833 0.50000 1.0000 + Fe Fe40 1.0 0.27199 0.29167 0.50000 1.0000 + Fe Fe41 1.0 0.27199 0.37500 0.50000 1.0000 + Fe Fe42 1.0 0.27199 0.45833 0.50000 1.0000 + Fe Fe43 1.0 0.27199 0.54167 0.50000 1.0000 + Fe Fe44 1.0 0.27199 0.62500 0.50000 1.0000 + Fe Fe45 1.0 0.27199 0.70833 0.50000 1.0000 + Fe Fe46 1.0 0.27199 0.79167 0.50000 1.0000 + Fe Fe47 1.0 0.27199 0.87500 0.50000 1.0000 + Fe Fe48 1.0 0.27199 0.95833 0.50000 1.0000 + Fe Fe49 1.0 0.35532 0.04167 0.50000 1.0000 + Fe Fe50 1.0 0.35532 0.12500 0.50000 1.0000 + Fe Fe51 1.0 0.35532 0.20833 0.50000 1.0000 + Fe Fe52 1.0 0.35532 0.29167 0.50000 1.0000 + Fe Fe53 1.0 0.35532 0.37500 0.50000 1.0000 + Fe Fe54 1.0 0.35532 0.45833 0.50000 1.0000 + Fe Fe55 1.0 0.35532 0.54167 0.50000 1.0000 + Fe Fe56 1.0 0.35532 0.62500 0.50000 1.0000 + Fe Fe57 1.0 0.35532 0.70833 0.50000 1.0000 + Fe Fe58 1.0 0.35532 0.79167 0.50000 1.0000 + Fe Fe59 1.0 0.35532 0.87500 0.50000 1.0000 + Fe Fe60 1.0 0.35532 0.95833 0.50000 1.0000 + Fe Fe61 1.0 0.43866 0.04167 0.50000 1.0000 + Fe Fe62 1.0 0.43866 0.12500 0.50000 1.0000 + Fe Fe63 1.0 0.43866 0.20833 0.50000 1.0000 + Fe Fe64 1.0 0.43866 0.29167 0.50000 1.0000 + Fe Fe65 1.0 0.43866 0.37500 0.50000 1.0000 + Fe Fe66 1.0 0.43866 0.45833 0.50000 1.0000 + Fe Fe67 1.0 0.43866 0.54167 0.50000 1.0000 + Fe Fe68 1.0 0.43866 0.62500 0.50000 1.0000 + Fe Fe69 1.0 0.43866 0.70833 0.50000 1.0000 + Fe Fe70 1.0 0.43866 0.79167 0.50000 1.0000 + Fe Fe71 1.0 0.43866 0.87500 0.50000 1.0000 + Fe Fe72 1.0 0.43866 0.95833 0.50000 1.0000 + Fe Fe73 1.0 0.52199 0.04167 0.50000 1.0000 + Fe Fe74 1.0 0.52199 0.12500 0.50000 1.0000 + Fe Fe75 1.0 0.52199 0.20833 0.50000 1.0000 + Fe Fe76 1.0 0.52199 0.29167 0.50000 1.0000 + Fe Fe77 1.0 0.52199 0.37500 0.50000 1.0000 + Fe Fe78 1.0 0.52199 0.45833 0.50000 1.0000 + Fe Fe79 1.0 0.52199 0.54167 0.50000 1.0000 + Fe Fe80 1.0 0.52199 0.62500 0.50000 1.0000 + Fe Fe81 1.0 0.52199 0.70833 0.50000 1.0000 + Fe Fe82 1.0 0.52199 0.79167 0.50000 1.0000 + Fe Fe83 1.0 0.52199 0.87500 0.50000 1.0000 + Fe Fe84 1.0 0.52199 0.95833 0.50000 1.0000 + Fe Fe85 1.0 0.60532 0.04167 0.50000 1.0000 + Fe Fe86 1.0 0.60532 0.12500 0.50000 1.0000 + Fe Fe87 1.0 0.60532 0.20833 0.50000 1.0000 + Fe Fe88 1.0 0.60532 0.29167 0.50000 1.0000 + Fe Fe89 1.0 0.60532 0.37500 0.50000 1.0000 + Fe Fe90 1.0 0.60532 0.45833 0.50000 1.0000 + Fe Fe91 1.0 0.60532 0.54167 0.50000 1.0000 + Fe Fe92 1.0 0.60532 0.62500 0.50000 1.0000 + Fe Fe93 1.0 0.60532 0.70833 0.50000 1.0000 + Fe Fe94 1.0 0.60532 0.79167 0.50000 1.0000 + Fe Fe95 1.0 0.60532 0.87500 0.50000 1.0000 + Fe Fe96 1.0 0.60532 0.95833 0.50000 1.0000 + Fe Fe97 1.0 0.68866 0.04167 0.50000 1.0000 + Fe Fe98 1.0 0.68866 0.12500 0.50000 1.0000 + Fe Fe99 1.0 0.68866 0.20833 0.50000 1.0000 + Fe Fe100 1.0 0.68866 0.29167 0.50000 1.0000 + Fe Fe101 1.0 0.68866 0.37500 0.50000 1.0000 + Fe Fe102 1.0 0.68866 0.45833 0.50000 1.0000 + Fe Fe103 1.0 0.68866 0.54167 0.50000 1.0000 + Fe Fe104 1.0 0.68866 0.62500 0.50000 1.0000 + Fe Fe105 1.0 0.68866 0.70833 0.50000 1.0000 + Fe Fe106 1.0 0.68866 0.79167 0.50000 1.0000 + Fe Fe107 1.0 0.68866 0.87500 0.50000 1.0000 + Fe Fe108 1.0 0.68866 0.95833 0.50000 1.0000 + Fe Fe109 1.0 0.77199 0.04167 0.50000 1.0000 + Fe Fe110 1.0 0.77199 0.12500 0.50000 1.0000 + Fe Fe111 1.0 0.77199 0.20833 0.50000 1.0000 + Fe Fe112 1.0 0.77199 0.29167 0.50000 1.0000 + Fe Fe113 1.0 0.77199 0.37500 0.50000 1.0000 + Fe Fe114 1.0 0.77199 0.45833 0.50000 1.0000 + Fe Fe115 1.0 0.77199 0.54167 0.50000 1.0000 + Fe Fe116 1.0 0.77199 0.62500 0.50000 1.0000 + Fe Fe117 1.0 0.77199 0.70833 0.50000 1.0000 + Fe Fe118 1.0 0.77199 0.79167 0.50000 1.0000 + Fe Fe119 1.0 0.77199 0.87500 0.50000 1.0000 + Fe Fe120 1.0 0.77199 0.95833 0.50000 1.0000 + Fe Fe121 1.0 0.85532 0.04167 0.50000 1.0000 + Fe Fe122 1.0 0.85532 0.12500 0.50000 1.0000 + Fe Fe123 1.0 0.85532 0.20833 0.50000 1.0000 + Fe Fe124 1.0 0.85532 0.29167 0.50000 1.0000 + Fe Fe125 1.0 0.85532 0.37500 0.50000 1.0000 + Fe Fe126 1.0 0.85532 0.45833 0.50000 1.0000 + Fe Fe127 1.0 0.85532 0.54167 0.50000 1.0000 + Fe Fe128 1.0 0.85532 0.62500 0.50000 1.0000 + Fe Fe129 1.0 0.85532 0.70833 0.50000 1.0000 + Fe Fe130 1.0 0.85532 0.79167 0.50000 1.0000 + Fe Fe131 1.0 0.85532 0.87500 0.50000 1.0000 + Fe Fe132 1.0 0.85532 0.95833 0.50000 1.0000 + Fe Fe133 1.0 0.93866 0.04167 0.50000 1.0000 + Fe Fe134 1.0 0.93866 0.12500 0.50000 1.0000 + Fe Fe135 1.0 0.93866 0.20833 0.50000 1.0000 + Fe Fe136 1.0 0.93866 0.29167 0.50000 1.0000 + Fe Fe137 1.0 0.93866 0.37500 0.50000 1.0000 + Fe Fe138 1.0 0.93866 0.45833 0.50000 1.0000 + Fe Fe139 1.0 0.93866 0.54167 0.50000 1.0000 + Fe Fe140 1.0 0.93866 0.62500 0.50000 1.0000 + Fe Fe141 1.0 0.93866 0.70833 0.50000 1.0000 + Fe Fe142 1.0 0.93866 0.79167 0.50000 1.0000 + Fe Fe143 1.0 0.93866 0.87500 0.50000 1.0000 + Fe Fe144 1.0 0.93866 0.95833 0.50000 1.0000 + Fe Fe145 1.0 0.06366 0.02042 0.50000 1.0000 + Fe Fe146 1.0 0.06366 0.10376 0.50000 1.0000 + Fe Fe147 1.0 0.06366 0.18709 0.50000 1.0000 + Fe Fe148 1.0 0.06366 0.27042 0.50000 1.0000 + Fe Fe149 1.0 0.06366 0.35376 0.50000 1.0000 + Fe Fe150 1.0 0.06366 0.43709 0.50000 1.0000 + Fe Fe151 1.0 0.06366 0.52042 0.50000 1.0000 + Fe Fe152 1.0 0.06366 0.60376 0.50000 1.0000 + Fe Fe153 1.0 0.06366 0.68709 0.50000 1.0000 + Fe Fe154 1.0 0.06366 0.77042 0.50000 1.0000 + Fe Fe155 1.0 0.06366 0.85376 0.50000 1.0000 + Fe Fe156 1.0 0.06366 0.93709 0.50000 1.0000 + Fe Fe157 1.0 0.14699 0.02042 0.50000 1.0000 + Fe Fe158 1.0 0.14699 0.10376 0.50000 1.0000 + Fe Fe159 1.0 0.14699 0.18709 0.50000 1.0000 + Fe Fe160 1.0 0.14699 0.27042 0.50000 1.0000 + Fe Fe161 1.0 0.14699 0.35376 0.50000 1.0000 + Fe Fe162 1.0 0.14699 0.43709 0.50000 1.0000 + Fe Fe163 1.0 0.14699 0.52042 0.50000 1.0000 + Fe Fe164 1.0 0.14699 0.60376 0.50000 1.0000 + Fe Fe165 1.0 0.14699 0.68709 0.50000 1.0000 + Fe Fe166 1.0 0.14699 0.77042 0.50000 1.0000 + Fe Fe167 1.0 0.14699 0.85376 0.50000 1.0000 + Fe Fe168 1.0 0.14699 0.93709 0.50000 1.0000 + Fe Fe169 1.0 0.23032 0.02042 0.50000 1.0000 + Fe Fe170 1.0 0.23032 0.10376 0.50000 1.0000 + Fe Fe171 1.0 0.23032 0.18709 0.50000 1.0000 + Fe Fe172 1.0 0.23032 0.27042 0.50000 1.0000 + Fe Fe173 1.0 0.23032 0.35376 0.50000 1.0000 + Fe Fe174 1.0 0.23032 0.43709 0.50000 1.0000 + Fe Fe175 1.0 0.23032 0.52042 0.50000 1.0000 + Fe Fe176 1.0 0.23032 0.60376 0.50000 1.0000 + Fe Fe177 1.0 0.23032 0.68709 0.50000 1.0000 + Fe Fe178 1.0 0.23032 0.77042 0.50000 1.0000 + Fe Fe179 1.0 0.23032 0.85376 0.50000 1.0000 + Fe Fe180 1.0 0.23032 0.93709 0.50000 1.0000 + Fe Fe181 1.0 0.31366 0.02042 0.50000 1.0000 + Fe Fe182 1.0 0.31366 0.10376 0.50000 1.0000 + Fe Fe183 1.0 0.31366 0.18709 0.50000 1.0000 + Fe Fe184 1.0 0.31366 0.27042 0.50000 1.0000 + Fe Fe185 1.0 0.31366 0.35376 0.50000 1.0000 + Fe Fe186 1.0 0.31366 0.43709 0.50000 1.0000 + Fe Fe187 1.0 0.31366 0.52042 0.50000 1.0000 + Fe Fe188 1.0 0.31366 0.60376 0.50000 1.0000 + Fe Fe189 1.0 0.31366 0.68709 0.50000 1.0000 + Fe Fe190 1.0 0.31366 0.77042 0.50000 1.0000 + Fe Fe191 1.0 0.31366 0.85376 0.50000 1.0000 + Fe Fe192 1.0 0.31366 0.93709 0.50000 1.0000 + Fe Fe193 1.0 0.39699 0.02042 0.50000 1.0000 + Fe Fe194 1.0 0.39699 0.10376 0.50000 1.0000 + Fe Fe195 1.0 0.39699 0.18709 0.50000 1.0000 + Fe Fe196 1.0 0.39699 0.27042 0.50000 1.0000 + Fe Fe197 1.0 0.39699 0.35376 0.50000 1.0000 + Fe Fe198 1.0 0.39699 0.43709 0.50000 1.0000 + Fe Fe199 1.0 0.39699 0.52042 0.50000 1.0000 + Fe Fe200 1.0 0.39699 0.60376 0.50000 1.0000 + Fe Fe201 1.0 0.39699 0.68709 0.50000 1.0000 + Fe Fe202 1.0 0.39699 0.77042 0.50000 1.0000 + Fe Fe203 1.0 0.39699 0.85376 0.50000 1.0000 + Fe Fe204 1.0 0.39699 0.93709 0.50000 1.0000 + Fe Fe205 1.0 0.48032 0.02042 0.50000 1.0000 + Fe Fe206 1.0 0.48032 0.10376 0.50000 1.0000 + Fe Fe207 1.0 0.48032 0.18709 0.50000 1.0000 + Fe Fe208 1.0 0.48032 0.27042 0.50000 1.0000 + Fe Fe209 1.0 0.48032 0.35376 0.50000 1.0000 + Fe Fe210 1.0 0.48032 0.43709 0.50000 1.0000 + Fe Fe211 1.0 0.48032 0.52042 0.50000 1.0000 + Fe Fe212 1.0 0.48032 0.60376 0.50000 1.0000 + Fe Fe213 1.0 0.48032 0.68709 0.50000 1.0000 + Fe Fe214 1.0 0.48032 0.77042 0.50000 1.0000 + Fe Fe215 1.0 0.48032 0.85376 0.50000 1.0000 + Fe Fe216 1.0 0.48032 0.93709 0.50000 1.0000 + Fe Fe217 1.0 0.56366 0.02042 0.50000 1.0000 + Fe Fe218 1.0 0.56366 0.10376 0.50000 1.0000 + Fe Fe219 1.0 0.56366 0.18709 0.50000 1.0000 + Fe Fe220 1.0 0.56366 0.27042 0.50000 1.0000 + Fe Fe221 1.0 0.56366 0.35376 0.50000 1.0000 + Fe Fe222 1.0 0.56366 0.43709 0.50000 1.0000 + Fe Fe223 1.0 0.56366 0.52042 0.50000 1.0000 + Fe Fe224 1.0 0.56366 0.60376 0.50000 1.0000 + Fe Fe225 1.0 0.56366 0.68709 0.50000 1.0000 + Fe Fe226 1.0 0.56366 0.77042 0.50000 1.0000 + Fe Fe227 1.0 0.56366 0.85376 0.50000 1.0000 + Fe Fe228 1.0 0.56366 0.93709 0.50000 1.0000 + Fe Fe229 1.0 0.64699 0.02042 0.50000 1.0000 + Fe Fe230 1.0 0.64699 0.10376 0.50000 1.0000 + Fe Fe231 1.0 0.64699 0.18709 0.50000 1.0000 + Fe Fe232 1.0 0.64699 0.27042 0.50000 1.0000 + Fe Fe233 1.0 0.64699 0.35376 0.50000 1.0000 + Fe Fe234 1.0 0.64699 0.43709 0.50000 1.0000 + Fe Fe235 1.0 0.64699 0.52042 0.50000 1.0000 + Fe Fe236 1.0 0.64699 0.60376 0.50000 1.0000 + Fe Fe237 1.0 0.64699 0.68709 0.50000 1.0000 + Fe Fe238 1.0 0.64699 0.77042 0.50000 1.0000 + Fe Fe239 1.0 0.64699 0.85376 0.50000 1.0000 + Fe Fe240 1.0 0.64699 0.93709 0.50000 1.0000 + Fe Fe241 1.0 0.73032 0.02042 0.50000 1.0000 + Fe Fe242 1.0 0.73032 0.10376 0.50000 1.0000 + Fe Fe243 1.0 0.73032 0.18709 0.50000 1.0000 + Fe Fe244 1.0 0.73032 0.27042 0.50000 1.0000 + Fe Fe245 1.0 0.73032 0.35376 0.50000 1.0000 + Fe Fe246 1.0 0.73032 0.43709 0.50000 1.0000 + Fe Fe247 1.0 0.73032 0.52042 0.50000 1.0000 + Fe Fe248 1.0 0.73032 0.60376 0.50000 1.0000 + Fe Fe249 1.0 0.73032 0.68709 0.50000 1.0000 + Fe Fe250 1.0 0.73032 0.77042 0.50000 1.0000 + Fe Fe251 1.0 0.73032 0.85376 0.50000 1.0000 + Fe Fe252 1.0 0.73032 0.93709 0.50000 1.0000 + Fe Fe253 1.0 0.81366 0.02042 0.50000 1.0000 + Fe Fe254 1.0 0.81366 0.10376 0.50000 1.0000 + Fe Fe255 1.0 0.81366 0.18709 0.50000 1.0000 + Fe Fe256 1.0 0.81366 0.27042 0.50000 1.0000 + Fe Fe257 1.0 0.81366 0.35376 0.50000 1.0000 + Fe Fe258 1.0 0.81366 0.43709 0.50000 1.0000 + Fe Fe259 1.0 0.81366 0.52042 0.50000 1.0000 + Fe Fe260 1.0 0.81366 0.60376 0.50000 1.0000 + Fe Fe261 1.0 0.81366 0.68709 0.50000 1.0000 + Fe Fe262 1.0 0.81366 0.77042 0.50000 1.0000 + Fe Fe263 1.0 0.81366 0.85376 0.50000 1.0000 + Fe Fe264 1.0 0.81366 0.93709 0.50000 1.0000 + Fe Fe265 1.0 0.89699 0.02042 0.50000 1.0000 + Fe Fe266 1.0 0.89699 0.10376 0.50000 1.0000 + Fe Fe267 1.0 0.89699 0.18709 0.50000 1.0000 + Fe Fe268 1.0 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Fe Fe290 1.0 0.06366 0.14624 0.50000 1.0000 + Fe Fe291 1.0 0.06366 0.22958 0.50000 1.0000 + Fe Fe292 1.0 0.06366 0.31291 0.50000 1.0000 + Fe Fe293 1.0 0.06366 0.39624 0.50000 1.0000 + Fe Fe294 1.0 0.06366 0.47958 0.50000 1.0000 + Fe Fe295 1.0 0.06366 0.56291 0.50000 1.0000 + Fe Fe296 1.0 0.06366 0.64624 0.50000 1.0000 + Fe Fe297 1.0 0.06366 0.72958 0.50000 1.0000 + Fe Fe298 1.0 0.06366 0.81291 0.50000 1.0000 + Fe Fe299 1.0 0.06366 0.89624 0.50000 1.0000 + Fe Fe300 1.0 0.06366 0.97958 0.50000 1.0000 + Fe Fe301 1.0 0.14699 0.06291 0.50000 1.0000 + Fe Fe302 1.0 0.14699 0.14624 0.50000 1.0000 + Fe Fe303 1.0 0.14699 0.22958 0.50000 1.0000 + Fe Fe304 1.0 0.14699 0.31291 0.50000 1.0000 + Fe Fe305 1.0 0.14699 0.39624 0.50000 1.0000 + Fe Fe306 1.0 0.14699 0.47958 0.50000 1.0000 + Fe Fe307 1.0 0.14699 0.56291 0.50000 1.0000 + Fe Fe308 1.0 0.14699 0.64624 0.50000 1.0000 + Fe Fe309 1.0 0.14699 0.72958 0.50000 1.0000 + Fe Fe310 1.0 0.14699 0.81291 0.50000 1.0000 + Fe Fe311 1.0 0.14699 0.89624 0.50000 1.0000 + Fe Fe312 1.0 0.14699 0.97958 0.50000 1.0000 + Fe Fe313 1.0 0.23032 0.06291 0.50000 1.0000 + Fe Fe314 1.0 0.23032 0.14624 0.50000 1.0000 + Fe Fe315 1.0 0.23032 0.22958 0.50000 1.0000 + Fe Fe316 1.0 0.23032 0.31291 0.50000 1.0000 + Fe Fe317 1.0 0.23032 0.39624 0.50000 1.0000 + Fe Fe318 1.0 0.23032 0.47958 0.50000 1.0000 + Fe Fe319 1.0 0.23032 0.56291 0.50000 1.0000 + Fe Fe320 1.0 0.23032 0.64624 0.50000 1.0000 + Fe Fe321 1.0 0.23032 0.72958 0.50000 1.0000 + Fe Fe322 1.0 0.23032 0.81291 0.50000 1.0000 + Fe Fe323 1.0 0.23032 0.89624 0.50000 1.0000 + Fe Fe324 1.0 0.23032 0.97958 0.50000 1.0000 + Fe Fe325 1.0 0.31366 0.06291 0.50000 1.0000 + Fe Fe326 1.0 0.31366 0.14624 0.50000 1.0000 + Fe Fe327 1.0 0.31366 0.22958 0.50000 1.0000 + Fe Fe328 1.0 0.31366 0.31291 0.50000 1.0000 + Fe Fe329 1.0 0.31366 0.39624 0.50000 1.0000 + Fe Fe330 1.0 0.31366 0.47958 0.50000 1.0000 + Fe Fe331 1.0 0.31366 0.56291 0.50000 1.0000 + Fe Fe332 1.0 0.31366 0.64624 0.50000 1.0000 + Fe Fe333 1.0 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Fe Fe355 1.0 0.48032 0.56291 0.50000 1.0000 + Fe Fe356 1.0 0.48032 0.64624 0.50000 1.0000 + Fe Fe357 1.0 0.48032 0.72958 0.50000 1.0000 + Fe Fe358 1.0 0.48032 0.81291 0.50000 1.0000 + Fe Fe359 1.0 0.48032 0.89624 0.50000 1.0000 + Fe Fe360 1.0 0.48032 0.97958 0.50000 1.0000 + Fe Fe361 1.0 0.56366 0.06291 0.50000 1.0000 + Fe Fe362 1.0 0.56366 0.14624 0.50000 1.0000 + Fe Fe363 1.0 0.56366 0.22958 0.50000 1.0000 + Fe Fe364 1.0 0.56366 0.31291 0.50000 1.0000 + Fe Fe365 1.0 0.56366 0.39624 0.50000 1.0000 + Fe Fe366 1.0 0.56366 0.47958 0.50000 1.0000 + Fe Fe367 1.0 0.56366 0.56291 0.50000 1.0000 + Fe Fe368 1.0 0.56366 0.64624 0.50000 1.0000 + Fe Fe369 1.0 0.56366 0.72958 0.50000 1.0000 + Fe Fe370 1.0 0.56366 0.81291 0.50000 1.0000 + Fe Fe371 1.0 0.56366 0.89624 0.50000 1.0000 + Fe Fe372 1.0 0.56366 0.97958 0.50000 1.0000 + Fe Fe373 1.0 0.64699 0.06291 0.50000 1.0000 + Fe Fe374 1.0 0.64699 0.14624 0.50000 1.0000 + Fe Fe375 1.0 0.64699 0.22958 0.50000 1.0000 + Fe Fe376 1.0 0.64699 0.31291 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Fe Fe420 1.0 0.89699 0.97958 0.50000 1.0000 + Fe Fe421 1.0 0.98032 0.06291 0.50000 1.0000 + Fe Fe422 1.0 0.98032 0.14624 0.50000 1.0000 + Fe Fe423 1.0 0.98032 0.22958 0.50000 1.0000 + Fe Fe424 1.0 0.98032 0.31291 0.50000 1.0000 + Fe Fe425 1.0 0.98032 0.39624 0.50000 1.0000 + Fe Fe426 1.0 0.98032 0.47958 0.50000 1.0000 + Fe Fe427 1.0 0.98032 0.56291 0.50000 1.0000 + Fe Fe428 1.0 0.98032 0.64624 0.50000 1.0000 + Fe Fe429 1.0 0.98032 0.72958 0.50000 1.0000 + Fe Fe430 1.0 0.98032 0.81291 0.50000 1.0000 + Fe Fe431 1.0 0.98032 0.89624 0.50000 1.0000 + Fe Fe432 1.0 0.98032 0.97958 0.50000 1.0000 + O O1 1.0 0.07520 0.00000 0.34198 1.0000 + O O2 1.0 0.07520 0.08333 0.34198 1.0000 + O O3 1.0 0.07520 0.16667 0.34198 1.0000 + O O4 1.0 0.07520 0.25000 0.34198 1.0000 + O O5 1.0 0.07520 0.33333 0.34198 1.0000 + O O6 1.0 0.07520 0.41667 0.34198 1.0000 + O O7 1.0 0.07520 0.50000 0.34198 1.0000 + O O8 1.0 0.07520 0.58333 0.34198 1.0000 + O O9 1.0 0.07520 0.66667 0.34198 1.0000 + O O10 1.0 0.07520 0.75000 0.34198 1.0000 + O O11 1.0 0.07520 0.83333 0.34198 1.0000 + O O12 1.0 0.07520 0.91667 0.34198 1.0000 + O O13 1.0 0.15854 0.00000 0.34198 1.0000 + O O14 1.0 0.15854 0.08333 0.34198 1.0000 + O O15 1.0 0.15854 0.16667 0.34198 1.0000 + O O16 1.0 0.15854 0.25000 0.34198 1.0000 + O O17 1.0 0.15854 0.33333 0.34198 1.0000 + O O18 1.0 0.15854 0.41667 0.34198 1.0000 + O O19 1.0 0.15854 0.50000 0.34198 1.0000 + O O20 1.0 0.15854 0.58333 0.34198 1.0000 + O O21 1.0 0.15854 0.66667 0.34198 1.0000 + O O22 1.0 0.15854 0.75000 0.34198 1.0000 + O O23 1.0 0.15854 0.83333 0.34198 1.0000 + O O24 1.0 0.15854 0.91667 0.34198 1.0000 + O O25 1.0 0.24187 0.00000 0.34198 1.0000 + O O26 1.0 0.24187 0.08333 0.34198 1.0000 + O O27 1.0 0.24187 0.16667 0.34198 1.0000 + O O28 1.0 0.24187 0.25000 0.34198 1.0000 + O O29 1.0 0.24187 0.33333 0.34198 1.0000 + O O30 1.0 0.24187 0.41667 0.34198 1.0000 + O O31 1.0 0.24187 0.50000 0.34198 1.0000 + O O32 1.0 0.24187 0.58333 0.34198 1.0000 + O O33 1.0 0.24187 0.66667 0.34198 1.0000 + O O34 1.0 0.24187 0.75000 0.34198 1.0000 + O O35 1.0 0.24187 0.83333 0.34198 1.0000 + O O36 1.0 0.24187 0.91667 0.34198 1.0000 + O O37 1.0 0.32520 0.00000 0.34198 1.0000 + O O38 1.0 0.32520 0.08333 0.34198 1.0000 + O O39 1.0 0.32520 0.16667 0.34198 1.0000 + O O40 1.0 0.32520 0.25000 0.34198 1.0000 + O O41 1.0 0.32520 0.33333 0.34198 1.0000 + O O42 1.0 0.32520 0.41667 0.34198 1.0000 + O O43 1.0 0.32520 0.50000 0.34198 1.0000 + O O44 1.0 0.32520 0.58333 0.34198 1.0000 + O O45 1.0 0.32520 0.66667 0.34198 1.0000 + O O46 1.0 0.32520 0.75000 0.34198 1.0000 + O O47 1.0 0.32520 0.83333 0.34198 1.0000 + O O48 1.0 0.32520 0.91667 0.34198 1.0000 + O O49 1.0 0.40854 0.00000 0.34198 1.0000 + O O50 1.0 0.40854 0.08333 0.34198 1.0000 + O O51 1.0 0.40854 0.16667 0.34198 1.0000 + O O52 1.0 0.40854 0.25000 0.34198 1.0000 + O O53 1.0 0.40854 0.33333 0.34198 1.0000 + O O54 1.0 0.40854 0.41667 0.34198 1.0000 + O O55 1.0 0.40854 0.50000 0.34198 1.0000 + O O56 1.0 0.40854 0.58333 0.34198 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O1054 1.0 0.28736 0.77248 0.34422 1.0000 + O O1055 1.0 0.28736 0.85582 0.34422 1.0000 + O O1056 1.0 0.28736 0.93915 0.34422 1.0000 + O O1057 1.0 0.37069 0.02248 0.34422 1.0000 + O O1058 1.0 0.37069 0.10582 0.34422 1.0000 + O O1059 1.0 0.37069 0.18915 0.34422 1.0000 + O O1060 1.0 0.37069 0.27248 0.34422 1.0000 + O O1061 1.0 0.37069 0.35582 0.34422 1.0000 + O O1062 1.0 0.37069 0.43915 0.34422 1.0000 + O O1063 1.0 0.37069 0.52248 0.34422 1.0000 + O O1064 1.0 0.37069 0.60582 0.34422 1.0000 + O O1065 1.0 0.37069 0.68915 0.34422 1.0000 + O O1066 1.0 0.37069 0.77248 0.34422 1.0000 + O O1067 1.0 0.37069 0.85582 0.34422 1.0000 + O O1068 1.0 0.37069 0.93915 0.34422 1.0000 + O O1069 1.0 0.45402 0.02248 0.34422 1.0000 + O O1070 1.0 0.45402 0.10582 0.34422 1.0000 + O O1071 1.0 0.45402 0.18915 0.34422 1.0000 + O O1072 1.0 0.45402 0.27248 0.34422 1.0000 + O O1073 1.0 0.45402 0.35582 0.34422 1.0000 + O O1074 1.0 0.45402 0.43915 0.34422 1.0000 + O O1075 1.0 0.45402 0.52248 0.34422 1.0000 + O O1076 1.0 0.45402 0.60582 0.34422 1.0000 + O O1077 1.0 0.45402 0.68915 0.34422 1.0000 + O O1078 1.0 0.45402 0.77248 0.34422 1.0000 + O O1079 1.0 0.45402 0.85582 0.34422 1.0000 + O O1080 1.0 0.45402 0.93915 0.34422 1.0000 + O O1081 1.0 0.53736 0.02248 0.34422 1.0000 + O O1082 1.0 0.53736 0.10582 0.34422 1.0000 + O O1083 1.0 0.53736 0.18915 0.34422 1.0000 + O O1084 1.0 0.53736 0.27248 0.34422 1.0000 + O O1085 1.0 0.53736 0.35582 0.34422 1.0000 + O O1086 1.0 0.53736 0.43915 0.34422 1.0000 + O O1087 1.0 0.53736 0.52248 0.34422 1.0000 + O O1088 1.0 0.53736 0.60582 0.34422 1.0000 + O O1089 1.0 0.53736 0.68915 0.34422 1.0000 + O O1090 1.0 0.53736 0.77248 0.34422 1.0000 + O O1091 1.0 0.53736 0.85582 0.34422 1.0000 + O O1092 1.0 0.53736 0.93915 0.34422 1.0000 + O O1093 1.0 0.62069 0.02248 0.34422 1.0000 + O O1094 1.0 0.62069 0.10582 0.34422 1.0000 + O O1095 1.0 0.62069 0.18915 0.34422 1.0000 + O O1096 1.0 0.62069 0.27248 0.34422 1.0000 + O O1097 1.0 0.62069 0.35582 0.34422 1.0000 + O O1098 1.0 0.62069 0.43915 0.34422 1.0000 + O O1099 1.0 0.62069 0.52248 0.34422 1.0000 + O O1100 1.0 0.62069 0.60582 0.34422 1.0000 + O O1101 1.0 0.62069 0.68915 0.34422 1.0000 + O O1102 1.0 0.62069 0.77248 0.34422 1.0000 + O O1103 1.0 0.62069 0.85582 0.34422 1.0000 + O O1104 1.0 0.62069 0.93915 0.34422 1.0000 + O O1105 1.0 0.70402 0.02248 0.34422 1.0000 + O O1106 1.0 0.70402 0.10582 0.34422 1.0000 + O O1107 1.0 0.70402 0.18915 0.34422 1.0000 + O O1108 1.0 0.70402 0.27248 0.34422 1.0000 + O O1109 1.0 0.70402 0.35582 0.34422 1.0000 + O O1110 1.0 0.70402 0.43915 0.34422 1.0000 + O O1111 1.0 0.70402 0.52248 0.34422 1.0000 + O O1112 1.0 0.70402 0.60582 0.34422 1.0000 + O O1113 1.0 0.70402 0.68915 0.34422 1.0000 + O O1114 1.0 0.70402 0.77248 0.34422 1.0000 + O O1115 1.0 0.70402 0.85582 0.34422 1.0000 + O O1116 1.0 0.70402 0.93915 0.34422 1.0000 + O O1117 1.0 0.78736 0.02248 0.34422 1.0000 + O O1118 1.0 0.78736 0.10582 0.34422 1.0000 + O O1119 1.0 0.78736 0.18915 0.34422 1.0000 + O O1120 1.0 0.78736 0.27248 0.34422 1.0000 + O O1121 1.0 0.78736 0.35582 0.34422 1.0000 + O O1122 1.0 0.78736 0.43915 0.34422 1.0000 + O O1123 1.0 0.78736 0.52248 0.34422 1.0000 + O O1124 1.0 0.78736 0.60582 0.34422 1.0000 + O O1125 1.0 0.78736 0.68915 0.34422 1.0000 + O O1126 1.0 0.78736 0.77248 0.34422 1.0000 + O O1127 1.0 0.78736 0.85582 0.34422 1.0000 + O O1128 1.0 0.78736 0.93915 0.34422 1.0000 + O O1129 1.0 0.87069 0.02248 0.34422 1.0000 + O O1130 1.0 0.87069 0.10582 0.34422 1.0000 + O O1131 1.0 0.87069 0.18915 0.34422 1.0000 + O O1132 1.0 0.87069 0.27248 0.34422 1.0000 + O O1133 1.0 0.87069 0.35582 0.34422 1.0000 + O O1134 1.0 0.87069 0.43915 0.34422 1.0000 + O O1135 1.0 0.87069 0.52248 0.34422 1.0000 + O O1136 1.0 0.87069 0.60582 0.34422 1.0000 + O O1137 1.0 0.87069 0.68915 0.34422 1.0000 + O O1138 1.0 0.87069 0.77248 0.34422 1.0000 + O O1139 1.0 0.87069 0.85582 0.34422 1.0000 + O O1140 1.0 0.87069 0.93915 0.34422 1.0000 + O O1141 1.0 0.95402 0.02248 0.34422 1.0000 + O O1142 1.0 0.95402 0.10582 0.34422 1.0000 + O O1143 1.0 0.95402 0.18915 0.34422 1.0000 + O O1144 1.0 0.95402 0.27248 0.34422 1.0000 + O O1145 1.0 0.95402 0.35582 0.34422 1.0000 + O O1146 1.0 0.95402 0.43915 0.34422 1.0000 + O O1147 1.0 0.95402 0.52248 0.34422 1.0000 + O O1148 1.0 0.95402 0.60582 0.34422 1.0000 + O O1149 1.0 0.95402 0.68915 0.34422 1.0000 + O O1150 1.0 0.95402 0.77248 0.34422 1.0000 + O O1151 1.0 0.95402 0.85582 0.34422 1.0000 + O O1152 1.0 0.95402 0.93915 0.34422 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-5365_supercell_12x12x1.cif b/tier3/cif_file/orthogonal_2dm-5365_supercell_12x12x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..ff9edda415ab16d6744c6b5ccf3b8bc8b98337ed --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-5365_supercell_12x12x1.cif @@ -0,0 +1,1033 @@ +data_image0 +_chemical_formula_structural Mn144Cu288Cl576 +_chemical_formula_sum "Mn144 Cu288 Cl576" +_cell_length_a 44.3889 +_cell_length_b 94.3394 +_cell_length_c 6.96325 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Mn Mn1 1.0 0.00000 0.00000 0.50328 1.0000 + Mn Mn2 1.0 0.00000 0.08333 0.50328 1.0000 + Mn Mn3 1.0 0.00000 0.16667 0.50328 1.0000 + Mn Mn4 1.0 0.00000 0.25000 0.50328 1.0000 + Mn Mn5 1.0 0.00000 0.33333 0.50328 1.0000 + Mn Mn6 1.0 0.00000 0.41667 0.50328 1.0000 + Mn Mn7 1.0 0.00000 0.50000 0.50328 1.0000 + Mn Mn8 1.0 0.00000 0.58333 0.50328 1.0000 + Mn Mn9 1.0 0.00000 0.66667 0.50328 1.0000 + Mn Mn10 1.0 0.00000 0.75000 0.50328 1.0000 + Mn Mn11 1.0 0.00000 0.83333 0.50328 1.0000 + Mn Mn12 1.0 0.00000 0.91667 0.50328 1.0000 + Mn Mn13 1.0 0.08333 0.00000 0.50328 1.0000 + Mn Mn14 1.0 0.08333 0.08333 0.50328 1.0000 + Mn Mn15 1.0 0.08333 0.16667 0.50328 1.0000 + Mn Mn16 1.0 0.08333 0.25000 0.50328 1.0000 + Mn Mn17 1.0 0.08333 0.33333 0.50328 1.0000 + Mn Mn18 1.0 0.08333 0.41667 0.50328 1.0000 + Mn Mn19 1.0 0.08333 0.50000 0.50328 1.0000 + Mn Mn20 1.0 0.08333 0.58333 0.50328 1.0000 + Mn Mn21 1.0 0.08333 0.66667 0.50328 1.0000 + Mn Mn22 1.0 0.08333 0.75000 0.50328 1.0000 + Mn Mn23 1.0 0.08333 0.83333 0.50328 1.0000 + Mn Mn24 1.0 0.08333 0.91667 0.50328 1.0000 + Mn Mn25 1.0 0.16667 0.00000 0.50328 1.0000 + Mn Mn26 1.0 0.16667 0.08333 0.50328 1.0000 + Mn Mn27 1.0 0.16667 0.16667 0.50328 1.0000 + Mn Mn28 1.0 0.16667 0.25000 0.50328 1.0000 + Mn Mn29 1.0 0.16667 0.33333 0.50328 1.0000 + Mn Mn30 1.0 0.16667 0.41667 0.50328 1.0000 + Mn Mn31 1.0 0.16667 0.50000 0.50328 1.0000 + Mn Mn32 1.0 0.16667 0.58333 0.50328 1.0000 + Mn Mn33 1.0 0.16667 0.66667 0.50328 1.0000 + Mn Mn34 1.0 0.16667 0.75000 0.50328 1.0000 + Mn Mn35 1.0 0.16667 0.83333 0.50328 1.0000 + Mn Mn36 1.0 0.16667 0.91667 0.50328 1.0000 + Mn Mn37 1.0 0.25000 0.00000 0.50328 1.0000 + Mn Mn38 1.0 0.25000 0.08333 0.50328 1.0000 + Mn Mn39 1.0 0.25000 0.16667 0.50328 1.0000 + Mn Mn40 1.0 0.25000 0.25000 0.50328 1.0000 + Mn Mn41 1.0 0.25000 0.33333 0.50328 1.0000 + Mn Mn42 1.0 0.25000 0.41667 0.50328 1.0000 + Mn Mn43 1.0 0.25000 0.50000 0.50328 1.0000 + Mn Mn44 1.0 0.25000 0.58333 0.50328 1.0000 + Mn Mn45 1.0 0.25000 0.66667 0.50328 1.0000 + Mn Mn46 1.0 0.25000 0.75000 0.50328 1.0000 + Mn Mn47 1.0 0.25000 0.83333 0.50328 1.0000 + Mn Mn48 1.0 0.25000 0.91667 0.50328 1.0000 + Mn Mn49 1.0 0.33333 0.00000 0.50328 1.0000 + Mn Mn50 1.0 0.33333 0.08333 0.50328 1.0000 + Mn Mn51 1.0 0.33333 0.16667 0.50328 1.0000 + Mn Mn52 1.0 0.33333 0.25000 0.50328 1.0000 + Mn Mn53 1.0 0.33333 0.33333 0.50328 1.0000 + Mn Mn54 1.0 0.33333 0.41667 0.50328 1.0000 + Mn Mn55 1.0 0.33333 0.50000 0.50328 1.0000 + Mn Mn56 1.0 0.33333 0.58333 0.50328 1.0000 + Mn Mn57 1.0 0.33333 0.66667 0.50328 1.0000 + Mn Mn58 1.0 0.33333 0.75000 0.50328 1.0000 + Mn Mn59 1.0 0.33333 0.83333 0.50328 1.0000 + Mn Mn60 1.0 0.33333 0.91667 0.50328 1.0000 + Mn Mn61 1.0 0.41667 0.00000 0.50328 1.0000 + Mn Mn62 1.0 0.41667 0.08333 0.50328 1.0000 + Mn Mn63 1.0 0.41667 0.16667 0.50328 1.0000 + Mn Mn64 1.0 0.41667 0.25000 0.50328 1.0000 + Mn Mn65 1.0 0.41667 0.33333 0.50328 1.0000 + Mn Mn66 1.0 0.41667 0.41667 0.50328 1.0000 + Mn Mn67 1.0 0.41667 0.50000 0.50328 1.0000 + Mn Mn68 1.0 0.41667 0.58333 0.50328 1.0000 + Mn Mn69 1.0 0.41667 0.66667 0.50328 1.0000 + Mn Mn70 1.0 0.41667 0.75000 0.50328 1.0000 + Mn Mn71 1.0 0.41667 0.83333 0.50328 1.0000 + Mn Mn72 1.0 0.41667 0.91667 0.50328 1.0000 + Mn Mn73 1.0 0.50000 0.00000 0.50328 1.0000 + Mn Mn74 1.0 0.50000 0.08333 0.50328 1.0000 + Mn Mn75 1.0 0.50000 0.16667 0.50328 1.0000 + Mn Mn76 1.0 0.50000 0.25000 0.50328 1.0000 + Mn Mn77 1.0 0.50000 0.33333 0.50328 1.0000 + Mn Mn78 1.0 0.50000 0.41667 0.50328 1.0000 + Mn Mn79 1.0 0.50000 0.50000 0.50328 1.0000 + Mn Mn80 1.0 0.50000 0.58333 0.50328 1.0000 + Mn Mn81 1.0 0.50000 0.66667 0.50328 1.0000 + Mn Mn82 1.0 0.50000 0.75000 0.50328 1.0000 + Mn Mn83 1.0 0.50000 0.83333 0.50328 1.0000 + Mn Mn84 1.0 0.50000 0.91667 0.50328 1.0000 + Mn Mn85 1.0 0.58333 0.00000 0.50328 1.0000 + Mn Mn86 1.0 0.58333 0.08333 0.50328 1.0000 + Mn Mn87 1.0 0.58333 0.16667 0.50328 1.0000 + Mn Mn88 1.0 0.58333 0.25000 0.50328 1.0000 + Mn Mn89 1.0 0.58333 0.33333 0.50328 1.0000 + Mn Mn90 1.0 0.58333 0.41667 0.50328 1.0000 + Mn Mn91 1.0 0.58333 0.50000 0.50328 1.0000 + Mn Mn92 1.0 0.58333 0.58333 0.50328 1.0000 + Mn Mn93 1.0 0.58333 0.66667 0.50328 1.0000 + Mn Mn94 1.0 0.58333 0.75000 0.50328 1.0000 + Mn Mn95 1.0 0.58333 0.83333 0.50328 1.0000 + Mn Mn96 1.0 0.58333 0.91667 0.50328 1.0000 + Mn Mn97 1.0 0.66667 0.00000 0.50328 1.0000 + Mn Mn98 1.0 0.66667 0.08333 0.50328 1.0000 + Mn Mn99 1.0 0.66667 0.16667 0.50328 1.0000 + Mn Mn100 1.0 0.66667 0.25000 0.50328 1.0000 + Mn Mn101 1.0 0.66667 0.33333 0.50328 1.0000 + Mn Mn102 1.0 0.66667 0.41667 0.50328 1.0000 + Mn Mn103 1.0 0.66667 0.50000 0.50328 1.0000 + Mn Mn104 1.0 0.66667 0.58333 0.50328 1.0000 + Mn Mn105 1.0 0.66667 0.66667 0.50328 1.0000 + Mn Mn106 1.0 0.66667 0.75000 0.50328 1.0000 + Mn Mn107 1.0 0.66667 0.83333 0.50328 1.0000 + Mn Mn108 1.0 0.66667 0.91667 0.50328 1.0000 + Mn Mn109 1.0 0.75000 0.00000 0.50328 1.0000 + Mn Mn110 1.0 0.75000 0.08333 0.50328 1.0000 + Mn Mn111 1.0 0.75000 0.16667 0.50328 1.0000 + Mn Mn112 1.0 0.75000 0.25000 0.50328 1.0000 + Mn Mn113 1.0 0.75000 0.33333 0.50328 1.0000 + Mn Mn114 1.0 0.75000 0.41667 0.50328 1.0000 + Mn Mn115 1.0 0.75000 0.50000 0.50328 1.0000 + Mn Mn116 1.0 0.75000 0.58333 0.50328 1.0000 + Mn Mn117 1.0 0.75000 0.66667 0.50328 1.0000 + Mn Mn118 1.0 0.75000 0.75000 0.50328 1.0000 + Mn Mn119 1.0 0.75000 0.83333 0.50328 1.0000 + Mn Mn120 1.0 0.75000 0.91667 0.50328 1.0000 + Mn Mn121 1.0 0.83333 0.00000 0.50328 1.0000 + Mn Mn122 1.0 0.83333 0.08333 0.50328 1.0000 + Mn Mn123 1.0 0.83333 0.16667 0.50328 1.0000 + Mn Mn124 1.0 0.83333 0.25000 0.50328 1.0000 + Mn Mn125 1.0 0.83333 0.33333 0.50328 1.0000 + Mn Mn126 1.0 0.83333 0.41667 0.50328 1.0000 + Mn Mn127 1.0 0.83333 0.50000 0.50328 1.0000 + Mn Mn128 1.0 0.83333 0.58333 0.50328 1.0000 + Mn Mn129 1.0 0.83333 0.66667 0.50328 1.0000 + Mn Mn130 1.0 0.83333 0.75000 0.50328 1.0000 + Mn Mn131 1.0 0.83333 0.83333 0.50328 1.0000 + Mn Mn132 1.0 0.83333 0.91667 0.50328 1.0000 + Mn Mn133 1.0 0.91667 0.00000 0.50328 1.0000 + Mn Mn134 1.0 0.91667 0.08333 0.50328 1.0000 + Mn Mn135 1.0 0.91667 0.16667 0.50328 1.0000 + Mn Mn136 1.0 0.91667 0.25000 0.50328 1.0000 + Mn Mn137 1.0 0.91667 0.33333 0.50328 1.0000 + Mn Mn138 1.0 0.91667 0.41667 0.50328 1.0000 + Mn Mn139 1.0 0.91667 0.50000 0.50328 1.0000 + Mn Mn140 1.0 0.91667 0.58333 0.50328 1.0000 + Mn Mn141 1.0 0.91667 0.66667 0.50328 1.0000 + Mn Mn142 1.0 0.91667 0.75000 0.50328 1.0000 + Mn Mn143 1.0 0.91667 0.83333 0.50328 1.0000 + Mn Mn144 1.0 0.91667 0.91667 0.50328 1.0000 + Cu Cu1 1.0 0.04167 0.02788 0.54028 1.0000 + Cu Cu2 1.0 0.04167 0.11121 0.54028 1.0000 + Cu Cu3 1.0 0.04167 0.19454 0.54028 1.0000 + Cu Cu4 1.0 0.04167 0.27788 0.54028 1.0000 + Cu Cu5 1.0 0.04167 0.36121 0.54028 1.0000 + Cu Cu6 1.0 0.04167 0.44454 0.54028 1.0000 + Cu Cu7 1.0 0.04167 0.52788 0.54028 1.0000 + Cu Cu8 1.0 0.04167 0.61121 0.54028 1.0000 + Cu Cu9 1.0 0.04167 0.69454 0.54028 1.0000 + Cu Cu10 1.0 0.04167 0.77788 0.54028 1.0000 + Cu Cu11 1.0 0.04167 0.86121 0.54028 1.0000 + Cu Cu12 1.0 0.04167 0.94454 0.54028 1.0000 + Cu Cu13 1.0 0.12500 0.02788 0.54028 1.0000 + Cu Cu14 1.0 0.12500 0.11121 0.54028 1.0000 + Cu Cu15 1.0 0.12500 0.19454 0.54028 1.0000 + Cu Cu16 1.0 0.12500 0.27788 0.54028 1.0000 + Cu Cu17 1.0 0.12500 0.36121 0.54028 1.0000 + Cu Cu18 1.0 0.12500 0.44454 0.54028 1.0000 + Cu Cu19 1.0 0.12500 0.52788 0.54028 1.0000 + Cu Cu20 1.0 0.12500 0.61121 0.54028 1.0000 + Cu Cu21 1.0 0.12500 0.69454 0.54028 1.0000 + Cu Cu22 1.0 0.12500 0.77788 0.54028 1.0000 + Cu Cu23 1.0 0.12500 0.86121 0.54028 1.0000 + Cu Cu24 1.0 0.12500 0.94454 0.54028 1.0000 + Cu Cu25 1.0 0.20833 0.02788 0.54028 1.0000 + Cu Cu26 1.0 0.20833 0.11121 0.54028 1.0000 + Cu Cu27 1.0 0.20833 0.19454 0.54028 1.0000 + Cu Cu28 1.0 0.20833 0.27788 0.54028 1.0000 + Cu Cu29 1.0 0.20833 0.36121 0.54028 1.0000 + Cu Cu30 1.0 0.20833 0.44454 0.54028 1.0000 + Cu Cu31 1.0 0.20833 0.52788 0.54028 1.0000 + Cu Cu32 1.0 0.20833 0.61121 0.54028 1.0000 + Cu Cu33 1.0 0.20833 0.69454 0.54028 1.0000 + Cu Cu34 1.0 0.20833 0.77788 0.54028 1.0000 + Cu Cu35 1.0 0.20833 0.86121 0.54028 1.0000 + Cu Cu36 1.0 0.20833 0.94454 0.54028 1.0000 + Cu Cu37 1.0 0.29167 0.02788 0.54028 1.0000 + Cu Cu38 1.0 0.29167 0.11121 0.54028 1.0000 + Cu Cu39 1.0 0.29167 0.19454 0.54028 1.0000 + Cu Cu40 1.0 0.29167 0.27788 0.54028 1.0000 + Cu Cu41 1.0 0.29167 0.36121 0.54028 1.0000 + Cu Cu42 1.0 0.29167 0.44454 0.54028 1.0000 + Cu Cu43 1.0 0.29167 0.52788 0.54028 1.0000 + Cu Cu44 1.0 0.29167 0.61121 0.54028 1.0000 + Cu Cu45 1.0 0.29167 0.69454 0.54028 1.0000 + Cu Cu46 1.0 0.29167 0.77788 0.54028 1.0000 + Cu Cu47 1.0 0.29167 0.86121 0.54028 1.0000 + Cu Cu48 1.0 0.29167 0.94454 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Ca104 1.0 0.37500 0.46875 0.40018 1.0000 + Ca Ca105 1.0 0.37500 0.53125 0.40018 1.0000 + Ca Ca106 1.0 0.37500 0.59375 0.40018 1.0000 + Ca Ca107 1.0 0.37500 0.65625 0.40018 1.0000 + Ca Ca108 1.0 0.37500 0.71875 0.40018 1.0000 + Ca Ca109 1.0 0.37500 0.78125 0.40018 1.0000 + Ca Ca110 1.0 0.37500 0.84375 0.40018 1.0000 + Ca Ca111 1.0 0.37500 0.90625 0.40018 1.0000 + Ca Ca112 1.0 0.37500 0.96875 0.40018 1.0000 + Ca Ca113 1.0 0.43750 0.03125 0.40018 1.0000 + Ca Ca114 1.0 0.43750 0.09375 0.40018 1.0000 + Ca Ca115 1.0 0.43750 0.15625 0.40018 1.0000 + Ca Ca116 1.0 0.43750 0.21875 0.40018 1.0000 + Ca Ca117 1.0 0.43750 0.28125 0.40018 1.0000 + Ca Ca118 1.0 0.43750 0.34375 0.40018 1.0000 + Ca Ca119 1.0 0.43750 0.40625 0.40018 1.0000 + Ca Ca120 1.0 0.43750 0.46875 0.40018 1.0000 + Ca Ca121 1.0 0.43750 0.53125 0.40018 1.0000 + Ca Ca122 1.0 0.43750 0.59375 0.40018 1.0000 + Ca Ca123 1.0 0.43750 0.65625 0.40018 1.0000 + Ca Ca124 1.0 0.43750 0.71875 0.40018 1.0000 + Ca Ca125 1.0 0.43750 0.78125 0.40018 1.0000 + Ca Ca126 1.0 0.43750 0.84375 0.40018 1.0000 + Ca Ca127 1.0 0.43750 0.90625 0.40018 1.0000 + Ca Ca128 1.0 0.43750 0.96875 0.40018 1.0000 + Ca Ca129 1.0 0.50000 0.03125 0.40018 1.0000 + Ca Ca130 1.0 0.50000 0.09375 0.40018 1.0000 + Ca Ca131 1.0 0.50000 0.15625 0.40018 1.0000 + Ca Ca132 1.0 0.50000 0.21875 0.40018 1.0000 + Ca Ca133 1.0 0.50000 0.28125 0.40018 1.0000 + Ca Ca134 1.0 0.50000 0.34375 0.40018 1.0000 + Ca Ca135 1.0 0.50000 0.40625 0.40018 1.0000 + Ca Ca136 1.0 0.50000 0.46875 0.40018 1.0000 + Ca Ca137 1.0 0.50000 0.53125 0.40018 1.0000 + Ca Ca138 1.0 0.50000 0.59375 0.40018 1.0000 + Ca Ca139 1.0 0.50000 0.65625 0.40018 1.0000 + Ca Ca140 1.0 0.50000 0.71875 0.40018 1.0000 + Ca Ca141 1.0 0.50000 0.78125 0.40018 1.0000 + Ca Ca142 1.0 0.50000 0.84375 0.40018 1.0000 + Ca Ca143 1.0 0.50000 0.90625 0.40018 1.0000 + Ca Ca144 1.0 0.50000 0.96875 0.40018 1.0000 + Ca Ca145 1.0 0.56250 0.03125 0.40018 1.0000 + Ca Ca146 1.0 0.56250 0.09375 0.40018 1.0000 + Ca Ca147 1.0 0.56250 0.15625 0.40018 1.0000 + Ca Ca148 1.0 0.56250 0.21875 0.40018 1.0000 + Ca Ca149 1.0 0.56250 0.28125 0.40018 1.0000 + Ca Ca150 1.0 0.56250 0.34375 0.40018 1.0000 + Ca Ca151 1.0 0.56250 0.40625 0.40018 1.0000 + Ca Ca152 1.0 0.56250 0.46875 0.40018 1.0000 + Ca Ca153 1.0 0.56250 0.53125 0.40018 1.0000 + Ca Ca154 1.0 0.56250 0.59375 0.40018 1.0000 + Ca Ca155 1.0 0.56250 0.65625 0.40018 1.0000 + Ca Ca156 1.0 0.56250 0.71875 0.40018 1.0000 + Ca Ca157 1.0 0.56250 0.78125 0.40018 1.0000 + Ca Ca158 1.0 0.56250 0.84375 0.40018 1.0000 + Ca Ca159 1.0 0.56250 0.90625 0.40018 1.0000 + Ca Ca160 1.0 0.56250 0.96875 0.40018 1.0000 + Ca Ca161 1.0 0.62500 0.03125 0.40018 1.0000 + Ca Ca162 1.0 0.62500 0.09375 0.40018 1.0000 + Ca Ca163 1.0 0.62500 0.15625 0.40018 1.0000 + Ca Ca164 1.0 0.62500 0.21875 0.40018 1.0000 + Ca Ca165 1.0 0.62500 0.28125 0.40018 1.0000 + Ca Ca166 1.0 0.62500 0.34375 0.40018 1.0000 + Ca Ca167 1.0 0.62500 0.40625 0.40018 1.0000 + Ca Ca168 1.0 0.62500 0.46875 0.40018 1.0000 + Ca Ca169 1.0 0.62500 0.53125 0.40018 1.0000 + Ca Ca170 1.0 0.62500 0.59375 0.40018 1.0000 + Ca Ca171 1.0 0.62500 0.65625 0.40018 1.0000 + Ca Ca172 1.0 0.62500 0.71875 0.40018 1.0000 + Ca Ca173 1.0 0.62500 0.78125 0.40018 1.0000 + Ca Ca174 1.0 0.62500 0.84375 0.40018 1.0000 + Ca Ca175 1.0 0.62500 0.90625 0.40018 1.0000 + Ca Ca176 1.0 0.62500 0.96875 0.40018 1.0000 + Ca Ca177 1.0 0.68750 0.03125 0.40018 1.0000 + Ca Ca178 1.0 0.68750 0.09375 0.40018 1.0000 + Ca Ca179 1.0 0.68750 0.15625 0.40018 1.0000 + Ca Ca180 1.0 0.68750 0.21875 0.40018 1.0000 + Ca Ca181 1.0 0.68750 0.28125 0.40018 1.0000 + Ca Ca182 1.0 0.68750 0.34375 0.40018 1.0000 + Ca Ca183 1.0 0.68750 0.40625 0.40018 1.0000 + Ca Ca184 1.0 0.68750 0.46875 0.40018 1.0000 + Ca Ca185 1.0 0.68750 0.53125 0.40018 1.0000 + Ca Ca186 1.0 0.68750 0.59375 0.40018 1.0000 + Ca Ca187 1.0 0.68750 0.65625 0.40018 1.0000 + Ca Ca188 1.0 0.68750 0.71875 0.40018 1.0000 + Ca Ca189 1.0 0.68750 0.78125 0.40018 1.0000 + Ca Ca190 1.0 0.68750 0.84375 0.40018 1.0000 + Ca Ca191 1.0 0.68750 0.90625 0.40018 1.0000 + Ca Ca192 1.0 0.68750 0.96875 0.40018 1.0000 + Ca Ca193 1.0 0.75000 0.03125 0.40018 1.0000 + Ca Ca194 1.0 0.75000 0.09375 0.40018 1.0000 + Ca Ca195 1.0 0.75000 0.15625 0.40018 1.0000 + Ca Ca196 1.0 0.75000 0.21875 0.40018 1.0000 + Ca Ca197 1.0 0.75000 0.28125 0.40018 1.0000 + Ca Ca198 1.0 0.75000 0.34375 0.40018 1.0000 + Ca Ca199 1.0 0.75000 0.40625 0.40018 1.0000 + Ca Ca200 1.0 0.75000 0.46875 0.40018 1.0000 + Ca Ca201 1.0 0.75000 0.53125 0.40018 1.0000 + Ca Ca202 1.0 0.75000 0.59375 0.40018 1.0000 + Ca Ca203 1.0 0.75000 0.65625 0.40018 1.0000 + Ca Ca204 1.0 0.75000 0.71875 0.40018 1.0000 + Ca Ca205 1.0 0.75000 0.78125 0.40018 1.0000 + Ca Ca206 1.0 0.75000 0.84375 0.40018 1.0000 + Ca Ca207 1.0 0.75000 0.90625 0.40018 1.0000 + Ca Ca208 1.0 0.75000 0.96875 0.40018 1.0000 + Ca Ca209 1.0 0.81250 0.03125 0.40018 1.0000 + Ca Ca210 1.0 0.81250 0.09375 0.40018 1.0000 + Ca Ca211 1.0 0.81250 0.15625 0.40018 1.0000 + Ca Ca212 1.0 0.81250 0.21875 0.40018 1.0000 + Ca Ca213 1.0 0.81250 0.28125 0.40018 1.0000 + Ca Ca214 1.0 0.81250 0.34375 0.40018 1.0000 + Ca Ca215 1.0 0.81250 0.40625 0.40018 1.0000 + Ca Ca216 1.0 0.81250 0.46875 0.40018 1.0000 + Ca Ca217 1.0 0.81250 0.53125 0.40018 1.0000 + Ca Ca218 1.0 0.81250 0.59375 0.40018 1.0000 + Ca Ca219 1.0 0.81250 0.65625 0.40018 1.0000 + Ca Ca220 1.0 0.81250 0.71875 0.40018 1.0000 + Ca Ca221 1.0 0.81250 0.78125 0.40018 1.0000 + Ca Ca222 1.0 0.81250 0.84375 0.40018 1.0000 + Ca Ca223 1.0 0.81250 0.90625 0.40018 1.0000 + Ca Ca224 1.0 0.81250 0.96875 0.40018 1.0000 + Ca Ca225 1.0 0.87500 0.03125 0.40018 1.0000 + Ca Ca226 1.0 0.87500 0.09375 0.40018 1.0000 + Ca Ca227 1.0 0.87500 0.15625 0.40018 1.0000 + Ca Ca228 1.0 0.87500 0.21875 0.40018 1.0000 + Ca Ca229 1.0 0.87500 0.28125 0.40018 1.0000 + Ca Ca230 1.0 0.87500 0.34375 0.40018 1.0000 + Ca Ca231 1.0 0.87500 0.40625 0.40018 1.0000 + Ca Ca232 1.0 0.87500 0.46875 0.40018 1.0000 + Ca Ca233 1.0 0.87500 0.53125 0.40018 1.0000 + Ca Ca234 1.0 0.87500 0.59375 0.40018 1.0000 + Ca Ca235 1.0 0.87500 0.65625 0.40018 1.0000 + Ca Ca236 1.0 0.87500 0.71875 0.40018 1.0000 + Ca Ca237 1.0 0.87500 0.78125 0.40018 1.0000 + Ca Ca238 1.0 0.87500 0.84375 0.40018 1.0000 + Ca Ca239 1.0 0.87500 0.90625 0.40018 1.0000 + Ca Ca240 1.0 0.87500 0.96875 0.40018 1.0000 + Ca Ca241 1.0 0.93750 0.03125 0.40018 1.0000 + Ca Ca242 1.0 0.93750 0.09375 0.40018 1.0000 + Ca Ca243 1.0 0.93750 0.15625 0.40018 1.0000 + Ca Ca244 1.0 0.93750 0.21875 0.40018 1.0000 + Ca Ca245 1.0 0.93750 0.28125 0.40018 1.0000 + Ca Ca246 1.0 0.93750 0.34375 0.40018 1.0000 + Ca Ca247 1.0 0.93750 0.40625 0.40018 1.0000 + Ca Ca248 1.0 0.93750 0.46875 0.40018 1.0000 + Ca Ca249 1.0 0.93750 0.53125 0.40018 1.0000 + Ca Ca250 1.0 0.93750 0.59375 0.40018 1.0000 + Ca Ca251 1.0 0.93750 0.65625 0.40018 1.0000 + Ca Ca252 1.0 0.93750 0.71875 0.40018 1.0000 + Ca Ca253 1.0 0.93750 0.78125 0.40018 1.0000 + Ca Ca254 1.0 0.93750 0.84375 0.40018 1.0000 + Ca Ca255 1.0 0.93750 0.90625 0.40018 1.0000 + Ca Ca256 1.0 0.93750 0.96875 0.40018 1.0000 + Sn Sn1 1.0 0.03125 0.00000 0.58711 1.0000 + Sn Sn2 1.0 0.03125 0.06250 0.58711 1.0000 + Sn Sn3 1.0 0.03125 0.12500 0.58711 1.0000 + Sn Sn4 1.0 0.03125 0.18750 0.58711 1.0000 + Sn Sn5 1.0 0.03125 0.25000 0.58711 1.0000 + Sn Sn6 1.0 0.03125 0.31250 0.58711 1.0000 + Sn Sn7 1.0 0.03125 0.37500 0.58711 1.0000 + Sn Sn8 1.0 0.03125 0.43750 0.58711 1.0000 + Sn Sn9 1.0 0.03125 0.50000 0.58711 1.0000 + Sn Sn10 1.0 0.03125 0.56250 0.58711 1.0000 + Sn Sn11 1.0 0.03125 0.62500 0.58711 1.0000 + Sn Sn12 1.0 0.03125 0.68750 0.58711 1.0000 + Sn Sn13 1.0 0.03125 0.75000 0.58711 1.0000 + Sn Sn14 1.0 0.03125 0.81250 0.58711 1.0000 + Sn Sn15 1.0 0.03125 0.87500 0.58711 1.0000 + Sn Sn16 1.0 0.03125 0.93750 0.58711 1.0000 + Sn Sn17 1.0 0.09375 0.00000 0.58711 1.0000 + Sn Sn18 1.0 0.09375 0.06250 0.58711 1.0000 + Sn Sn19 1.0 0.09375 0.12500 0.58711 1.0000 + Sn Sn20 1.0 0.09375 0.18750 0.58711 1.0000 + Sn Sn21 1.0 0.09375 0.25000 0.58711 1.0000 + Sn Sn22 1.0 0.09375 0.31250 0.58711 1.0000 + Sn Sn23 1.0 0.09375 0.37500 0.58711 1.0000 + Sn Sn24 1.0 0.09375 0.43750 0.58711 1.0000 + Sn Sn25 1.0 0.09375 0.50000 0.58711 1.0000 + Sn Sn26 1.0 0.09375 0.56250 0.58711 1.0000 + Sn Sn27 1.0 0.09375 0.62500 0.58711 1.0000 + Sn Sn28 1.0 0.09375 0.68750 0.58711 1.0000 + Sn Sn29 1.0 0.09375 0.75000 0.58711 1.0000 + Sn Sn30 1.0 0.09375 0.81250 0.58711 1.0000 + Sn Sn31 1.0 0.09375 0.87500 0.58711 1.0000 + Sn Sn32 1.0 0.09375 0.93750 0.58711 1.0000 + Sn Sn33 1.0 0.15625 0.00000 0.58711 1.0000 + Sn Sn34 1.0 0.15625 0.06250 0.58711 1.0000 + Sn Sn35 1.0 0.15625 0.12500 0.58711 1.0000 + Sn Sn36 1.0 0.15625 0.18750 0.58711 1.0000 + Sn Sn37 1.0 0.15625 0.25000 0.58711 1.0000 + Sn Sn38 1.0 0.15625 0.31250 0.58711 1.0000 + Sn Sn39 1.0 0.15625 0.37500 0.58711 1.0000 + Sn Sn40 1.0 0.15625 0.43750 0.58711 1.0000 + Sn Sn41 1.0 0.15625 0.50000 0.58711 1.0000 + Sn Sn42 1.0 0.15625 0.56250 0.58711 1.0000 + Sn Sn43 1.0 0.15625 0.62500 0.58711 1.0000 + Sn Sn44 1.0 0.15625 0.68750 0.58711 1.0000 + Sn Sn45 1.0 0.15625 0.75000 0.58711 1.0000 + Sn Sn46 1.0 0.15625 0.81250 0.58711 1.0000 + Sn Sn47 1.0 0.15625 0.87500 0.58711 1.0000 + Sn Sn48 1.0 0.15625 0.93750 0.58711 1.0000 + Sn Sn49 1.0 0.21875 0.00000 0.58711 1.0000 + Sn Sn50 1.0 0.21875 0.06250 0.58711 1.0000 + Sn Sn51 1.0 0.21875 0.12500 0.58711 1.0000 + Sn Sn52 1.0 0.21875 0.18750 0.58711 1.0000 + Sn Sn53 1.0 0.21875 0.25000 0.58711 1.0000 + Sn Sn54 1.0 0.21875 0.31250 0.58711 1.0000 + Sn Sn55 1.0 0.21875 0.37500 0.58711 1.0000 + Sn Sn56 1.0 0.21875 0.43750 0.58711 1.0000 + Sn Sn57 1.0 0.21875 0.50000 0.58711 1.0000 + Sn Sn58 1.0 0.21875 0.56250 0.58711 1.0000 + Sn Sn59 1.0 0.21875 0.62500 0.58711 1.0000 + Sn Sn60 1.0 0.21875 0.68750 0.58711 1.0000 + Sn Sn61 1.0 0.21875 0.75000 0.58711 1.0000 + Sn Sn62 1.0 0.21875 0.81250 0.58711 1.0000 + Sn Sn63 1.0 0.21875 0.87500 0.58711 1.0000 + Sn Sn64 1.0 0.21875 0.93750 0.58711 1.0000 + Sn Sn65 1.0 0.28125 0.00000 0.58711 1.0000 + Sn Sn66 1.0 0.28125 0.06250 0.58711 1.0000 + Sn Sn67 1.0 0.28125 0.12500 0.58711 1.0000 + Sn Sn68 1.0 0.28125 0.18750 0.58711 1.0000 + Sn Sn69 1.0 0.28125 0.25000 0.58711 1.0000 + Sn Sn70 1.0 0.28125 0.31250 0.58711 1.0000 + Sn Sn71 1.0 0.28125 0.37500 0.58711 1.0000 + Sn Sn72 1.0 0.28125 0.43750 0.58711 1.0000 + Sn Sn73 1.0 0.28125 0.50000 0.58711 1.0000 + Sn Sn74 1.0 0.28125 0.56250 0.58711 1.0000 + Sn Sn75 1.0 0.28125 0.62500 0.58711 1.0000 + Sn Sn76 1.0 0.28125 0.68750 0.58711 1.0000 + Sn Sn77 1.0 0.28125 0.75000 0.58711 1.0000 + Sn Sn78 1.0 0.28125 0.81250 0.58711 1.0000 + Sn Sn79 1.0 0.28125 0.87500 0.58711 1.0000 + Sn Sn80 1.0 0.28125 0.93750 0.58711 1.0000 + Sn Sn81 1.0 0.34375 0.00000 0.58711 1.0000 + Sn Sn82 1.0 0.34375 0.06250 0.58711 1.0000 + Sn Sn83 1.0 0.34375 0.12500 0.58711 1.0000 + Sn Sn84 1.0 0.34375 0.18750 0.58711 1.0000 + Sn Sn85 1.0 0.34375 0.25000 0.58711 1.0000 + Sn Sn86 1.0 0.34375 0.31250 0.58711 1.0000 + Sn Sn87 1.0 0.34375 0.37500 0.58711 1.0000 + Sn Sn88 1.0 0.34375 0.43750 0.58711 1.0000 + Sn Sn89 1.0 0.34375 0.50000 0.58711 1.0000 + Sn Sn90 1.0 0.34375 0.56250 0.58711 1.0000 + Sn Sn91 1.0 0.34375 0.62500 0.58711 1.0000 + Sn Sn92 1.0 0.34375 0.68750 0.58711 1.0000 + Sn Sn93 1.0 0.34375 0.75000 0.58711 1.0000 + Sn Sn94 1.0 0.34375 0.81250 0.58711 1.0000 + Sn Sn95 1.0 0.34375 0.87500 0.58711 1.0000 + Sn Sn96 1.0 0.34375 0.93750 0.58711 1.0000 + Sn Sn97 1.0 0.40625 0.00000 0.58711 1.0000 + Sn Sn98 1.0 0.40625 0.06250 0.58711 1.0000 + Sn Sn99 1.0 0.40625 0.12500 0.58711 1.0000 + Sn Sn100 1.0 0.40625 0.18750 0.58711 1.0000 + Sn Sn101 1.0 0.40625 0.25000 0.58711 1.0000 + Sn Sn102 1.0 0.40625 0.31250 0.58711 1.0000 + Sn Sn103 1.0 0.40625 0.37500 0.58711 1.0000 + Sn Sn104 1.0 0.40625 0.43750 0.58711 1.0000 + Sn Sn105 1.0 0.40625 0.50000 0.58711 1.0000 + Sn Sn106 1.0 0.40625 0.56250 0.58711 1.0000 + Sn Sn107 1.0 0.40625 0.62500 0.58711 1.0000 + Sn Sn108 1.0 0.40625 0.68750 0.58711 1.0000 + Sn Sn109 1.0 0.40625 0.75000 0.58711 1.0000 + Sn Sn110 1.0 0.40625 0.81250 0.58711 1.0000 + Sn Sn111 1.0 0.40625 0.87500 0.58711 1.0000 + Sn Sn112 1.0 0.40625 0.93750 0.58711 1.0000 + Sn Sn113 1.0 0.46875 0.00000 0.58711 1.0000 + Sn Sn114 1.0 0.46875 0.06250 0.58711 1.0000 + Sn Sn115 1.0 0.46875 0.12500 0.58711 1.0000 + Sn Sn116 1.0 0.46875 0.18750 0.58711 1.0000 + Sn Sn117 1.0 0.46875 0.25000 0.58711 1.0000 + Sn Sn118 1.0 0.46875 0.31250 0.58711 1.0000 + Sn Sn119 1.0 0.46875 0.37500 0.58711 1.0000 + Sn Sn120 1.0 0.46875 0.43750 0.58711 1.0000 + Sn Sn121 1.0 0.46875 0.50000 0.58711 1.0000 + Sn Sn122 1.0 0.46875 0.56250 0.58711 1.0000 + Sn Sn123 1.0 0.46875 0.62500 0.58711 1.0000 + Sn Sn124 1.0 0.46875 0.68750 0.58711 1.0000 + Sn Sn125 1.0 0.46875 0.75000 0.58711 1.0000 + Sn Sn126 1.0 0.46875 0.81250 0.58711 1.0000 + Sn Sn127 1.0 0.46875 0.87500 0.58711 1.0000 + Sn Sn128 1.0 0.46875 0.93750 0.58711 1.0000 + Sn Sn129 1.0 0.53125 0.00000 0.58711 1.0000 + Sn Sn130 1.0 0.53125 0.06250 0.58711 1.0000 + Sn Sn131 1.0 0.53125 0.12500 0.58711 1.0000 + Sn Sn132 1.0 0.53125 0.18750 0.58711 1.0000 + Sn Sn133 1.0 0.53125 0.25000 0.58711 1.0000 + Sn Sn134 1.0 0.53125 0.31250 0.58711 1.0000 + Sn Sn135 1.0 0.53125 0.37500 0.58711 1.0000 + Sn Sn136 1.0 0.53125 0.43750 0.58711 1.0000 + Sn Sn137 1.0 0.53125 0.50000 0.58711 1.0000 + Sn Sn138 1.0 0.53125 0.56250 0.58711 1.0000 + Sn Sn139 1.0 0.53125 0.62500 0.58711 1.0000 + Sn Sn140 1.0 0.53125 0.68750 0.58711 1.0000 + Sn Sn141 1.0 0.53125 0.75000 0.58711 1.0000 + Sn Sn142 1.0 0.53125 0.81250 0.58711 1.0000 + Sn Sn143 1.0 0.53125 0.87500 0.58711 1.0000 + Sn Sn144 1.0 0.53125 0.93750 0.58711 1.0000 + Sn Sn145 1.0 0.59375 0.00000 0.58711 1.0000 + Sn Sn146 1.0 0.59375 0.06250 0.58711 1.0000 + Sn Sn147 1.0 0.59375 0.12500 0.58711 1.0000 + Sn Sn148 1.0 0.59375 0.18750 0.58711 1.0000 + Sn Sn149 1.0 0.59375 0.25000 0.58711 1.0000 + Sn Sn150 1.0 0.59375 0.31250 0.58711 1.0000 + Sn Sn151 1.0 0.59375 0.37500 0.58711 1.0000 + Sn Sn152 1.0 0.59375 0.43750 0.58711 1.0000 + Sn Sn153 1.0 0.59375 0.50000 0.58711 1.0000 + Sn Sn154 1.0 0.59375 0.56250 0.58711 1.0000 + Sn Sn155 1.0 0.59375 0.62500 0.58711 1.0000 + Sn Sn156 1.0 0.59375 0.68750 0.58711 1.0000 + Sn Sn157 1.0 0.59375 0.75000 0.58711 1.0000 + Sn Sn158 1.0 0.59375 0.81250 0.58711 1.0000 + Sn Sn159 1.0 0.59375 0.87500 0.58711 1.0000 + Sn Sn160 1.0 0.59375 0.93750 0.58711 1.0000 + Sn Sn161 1.0 0.65625 0.00000 0.58711 1.0000 + Sn Sn162 1.0 0.65625 0.06250 0.58711 1.0000 + Sn Sn163 1.0 0.65625 0.12500 0.58711 1.0000 + Sn Sn164 1.0 0.65625 0.18750 0.58711 1.0000 + Sn Sn165 1.0 0.65625 0.25000 0.58711 1.0000 + Sn Sn166 1.0 0.65625 0.31250 0.58711 1.0000 + Sn Sn167 1.0 0.65625 0.37500 0.58711 1.0000 + Sn Sn168 1.0 0.65625 0.43750 0.58711 1.0000 + Sn Sn169 1.0 0.65625 0.50000 0.58711 1.0000 + Sn Sn170 1.0 0.65625 0.56250 0.58711 1.0000 + Sn Sn171 1.0 0.65625 0.62500 0.58711 1.0000 + Sn Sn172 1.0 0.65625 0.68750 0.58711 1.0000 + Sn Sn173 1.0 0.65625 0.75000 0.58711 1.0000 + Sn Sn174 1.0 0.65625 0.81250 0.58711 1.0000 + Sn Sn175 1.0 0.65625 0.87500 0.58711 1.0000 + Sn Sn176 1.0 0.65625 0.93750 0.58711 1.0000 + Sn Sn177 1.0 0.71875 0.00000 0.58711 1.0000 + Sn Sn178 1.0 0.71875 0.06250 0.58711 1.0000 + Sn Sn179 1.0 0.71875 0.12500 0.58711 1.0000 + Sn Sn180 1.0 0.71875 0.18750 0.58711 1.0000 + Sn Sn181 1.0 0.71875 0.25000 0.58711 1.0000 + Sn Sn182 1.0 0.71875 0.31250 0.58711 1.0000 + Sn Sn183 1.0 0.71875 0.37500 0.58711 1.0000 + Sn Sn184 1.0 0.71875 0.43750 0.58711 1.0000 + Sn Sn185 1.0 0.71875 0.50000 0.58711 1.0000 + Sn Sn186 1.0 0.71875 0.56250 0.58711 1.0000 + Sn Sn187 1.0 0.71875 0.62500 0.58711 1.0000 + Sn Sn188 1.0 0.71875 0.68750 0.58711 1.0000 + Sn Sn189 1.0 0.71875 0.75000 0.58711 1.0000 + Sn Sn190 1.0 0.71875 0.81250 0.58711 1.0000 + Sn Sn191 1.0 0.71875 0.87500 0.58711 1.0000 + Sn Sn192 1.0 0.71875 0.93750 0.58711 1.0000 + Sn Sn193 1.0 0.78125 0.00000 0.58711 1.0000 + Sn Sn194 1.0 0.78125 0.06250 0.58711 1.0000 + Sn Sn195 1.0 0.78125 0.12500 0.58711 1.0000 + Sn Sn196 1.0 0.78125 0.18750 0.58711 1.0000 + Sn Sn197 1.0 0.78125 0.25000 0.58711 1.0000 + Sn Sn198 1.0 0.78125 0.31250 0.58711 1.0000 + Sn Sn199 1.0 0.78125 0.37500 0.58711 1.0000 + Sn Sn200 1.0 0.78125 0.43750 0.58711 1.0000 + Sn Sn201 1.0 0.78125 0.50000 0.58711 1.0000 + Sn Sn202 1.0 0.78125 0.56250 0.58711 1.0000 + Sn Sn203 1.0 0.78125 0.62500 0.58711 1.0000 + Sn Sn204 1.0 0.78125 0.68750 0.58711 1.0000 + Sn Sn205 1.0 0.78125 0.75000 0.58711 1.0000 + Sn Sn206 1.0 0.78125 0.81250 0.58711 1.0000 + Sn Sn207 1.0 0.78125 0.87500 0.58711 1.0000 + Sn Sn208 1.0 0.78125 0.93750 0.58711 1.0000 + Sn Sn209 1.0 0.84375 0.00000 0.58711 1.0000 + Sn Sn210 1.0 0.84375 0.06250 0.58711 1.0000 + Sn Sn211 1.0 0.84375 0.12500 0.58711 1.0000 + Sn Sn212 1.0 0.84375 0.18750 0.58711 1.0000 + Sn Sn213 1.0 0.84375 0.25000 0.58711 1.0000 + Sn Sn214 1.0 0.84375 0.31250 0.58711 1.0000 + Sn Sn215 1.0 0.84375 0.37500 0.58711 1.0000 + Sn Sn216 1.0 0.84375 0.43750 0.58711 1.0000 + Sn Sn217 1.0 0.84375 0.50000 0.58711 1.0000 + Sn Sn218 1.0 0.84375 0.56250 0.58711 1.0000 + Sn Sn219 1.0 0.84375 0.62500 0.58711 1.0000 + Sn Sn220 1.0 0.84375 0.68750 0.58711 1.0000 + Sn Sn221 1.0 0.84375 0.75000 0.58711 1.0000 + Sn Sn222 1.0 0.84375 0.81250 0.58711 1.0000 + Sn Sn223 1.0 0.84375 0.87500 0.58711 1.0000 + Sn Sn224 1.0 0.84375 0.93750 0.58711 1.0000 + Sn Sn225 1.0 0.90625 0.00000 0.58711 1.0000 + Sn Sn226 1.0 0.90625 0.06250 0.58711 1.0000 + Sn Sn227 1.0 0.90625 0.12500 0.58711 1.0000 + Sn Sn228 1.0 0.90625 0.18750 0.58711 1.0000 + Sn Sn229 1.0 0.90625 0.25000 0.58711 1.0000 + Sn Sn230 1.0 0.90625 0.31250 0.58711 1.0000 + Sn Sn231 1.0 0.90625 0.37500 0.58711 1.0000 + Sn Sn232 1.0 0.90625 0.43750 0.58711 1.0000 + Sn Sn233 1.0 0.90625 0.50000 0.58711 1.0000 + Sn Sn234 1.0 0.90625 0.56250 0.58711 1.0000 + Sn Sn235 1.0 0.90625 0.62500 0.58711 1.0000 + Sn Sn236 1.0 0.90625 0.68750 0.58711 1.0000 + Sn Sn237 1.0 0.90625 0.75000 0.58711 1.0000 + Sn Sn238 1.0 0.90625 0.81250 0.58711 1.0000 + Sn Sn239 1.0 0.90625 0.87500 0.58711 1.0000 + Sn Sn240 1.0 0.90625 0.93750 0.58711 1.0000 + Sn Sn241 1.0 0.96875 0.00000 0.58711 1.0000 + Sn Sn242 1.0 0.96875 0.06250 0.58711 1.0000 + Sn Sn243 1.0 0.96875 0.12500 0.58711 1.0000 + Sn Sn244 1.0 0.96875 0.18750 0.58711 1.0000 + Sn Sn245 1.0 0.96875 0.25000 0.58711 1.0000 + Sn Sn246 1.0 0.96875 0.31250 0.58711 1.0000 + Sn Sn247 1.0 0.96875 0.37500 0.58711 1.0000 + Sn Sn248 1.0 0.96875 0.43750 0.58711 1.0000 + Sn Sn249 1.0 0.96875 0.50000 0.58711 1.0000 + Sn Sn250 1.0 0.96875 0.56250 0.58711 1.0000 + Sn Sn251 1.0 0.96875 0.62500 0.58711 1.0000 + Sn Sn252 1.0 0.96875 0.68750 0.58711 1.0000 + Sn Sn253 1.0 0.96875 0.75000 0.58711 1.0000 + Sn Sn254 1.0 0.96875 0.81250 0.58711 1.0000 + Sn Sn255 1.0 0.96875 0.87500 0.58711 1.0000 + Sn Sn256 1.0 0.96875 0.93750 0.58711 1.0000 + S S1 1.0 0.03125 0.03125 0.68307 1.0000 + S S2 1.0 0.03125 0.09375 0.68307 1.0000 + S S3 1.0 0.03125 0.15625 0.68307 1.0000 + S S4 1.0 0.03125 0.21875 0.68307 1.0000 + S S5 1.0 0.03125 0.28125 0.68307 1.0000 + S S6 1.0 0.03125 0.34375 0.68307 1.0000 + S S7 1.0 0.03125 0.40625 0.68307 1.0000 + S S8 1.0 0.03125 0.46875 0.68307 1.0000 + S S9 1.0 0.03125 0.53125 0.68307 1.0000 + S S10 1.0 0.03125 0.59375 0.68307 1.0000 + S S11 1.0 0.03125 0.65625 0.68307 1.0000 + S S12 1.0 0.03125 0.71875 0.68307 1.0000 + S S13 1.0 0.03125 0.78125 0.68307 1.0000 + S S14 1.0 0.03125 0.84375 0.68307 1.0000 + S S15 1.0 0.03125 0.90625 0.68307 1.0000 + S S16 1.0 0.03125 0.96875 0.68307 1.0000 + S S17 1.0 0.09375 0.03125 0.68307 1.0000 + S S18 1.0 0.09375 0.09375 0.68307 1.0000 + S S19 1.0 0.09375 0.15625 0.68307 1.0000 + S S20 1.0 0.09375 0.21875 0.68307 1.0000 + S S21 1.0 0.09375 0.28125 0.68307 1.0000 + S S22 1.0 0.09375 0.34375 0.68307 1.0000 + S S23 1.0 0.09375 0.40625 0.68307 1.0000 + S S24 1.0 0.09375 0.46875 0.68307 1.0000 + S S25 1.0 0.09375 0.53125 0.68307 1.0000 + S S26 1.0 0.09375 0.59375 0.68307 1.0000 + S S27 1.0 0.09375 0.65625 0.68307 1.0000 + S S28 1.0 0.09375 0.71875 0.68307 1.0000 + S S29 1.0 0.09375 0.78125 0.68307 1.0000 + S S30 1.0 0.09375 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0.35174 1.0000 + Cd Cd15 1.0 0.54688 0.45312 0.35174 1.0000 + Cd Cd16 1.0 0.51562 0.48438 0.35174 1.0000 + Cd Cd17 1.0 0.01562 0.04687 0.35174 1.0000 + Cd Cd18 1.0 0.98437 0.07813 0.35174 1.0000 + Cd Cd19 1.0 0.95312 0.10937 0.35174 1.0000 + Cd Cd20 1.0 0.92187 0.14062 0.35174 1.0000 + Cd Cd21 1.0 0.89062 0.17187 0.35174 1.0000 + Cd Cd22 1.0 0.85937 0.20312 0.35174 1.0000 + Cd Cd23 1.0 0.82812 0.23438 0.35174 1.0000 + Cd Cd24 1.0 0.79687 0.26562 0.35174 1.0000 + Cd Cd25 1.0 0.76562 0.29687 0.35174 1.0000 + Cd Cd26 1.0 0.73437 0.32812 0.35174 1.0000 + Cd Cd27 1.0 0.70312 0.35937 0.35174 1.0000 + Cd Cd28 1.0 0.67187 0.39063 0.35174 1.0000 + Cd Cd29 1.0 0.64062 0.42188 0.35174 1.0000 + Cd Cd30 1.0 0.60937 0.45312 0.35174 1.0000 + Cd Cd31 1.0 0.57812 0.48438 0.35174 1.0000 + Cd Cd32 1.0 0.54688 0.51562 0.35174 1.0000 + Cd Cd33 1.0 0.04687 0.07812 0.35174 1.0000 + Cd Cd34 1.0 0.01562 0.10938 0.35174 1.0000 + Cd Cd35 1.0 0.98437 0.14063 0.35174 1.0000 + Cd Cd36 1.0 0.95312 0.17187 0.35174 1.0000 + Cd Cd37 1.0 0.92187 0.20312 0.35174 1.0000 + Cd Cd38 1.0 0.89062 0.23437 0.35174 1.0000 + Cd Cd39 1.0 0.85937 0.26562 0.35174 1.0000 + Cd Cd40 1.0 0.82812 0.29687 0.35174 1.0000 + Cd Cd41 1.0 0.79687 0.32812 0.35174 1.0000 + Cd Cd42 1.0 0.76562 0.35938 0.35174 1.0000 + Cd Cd43 1.0 0.73437 0.39063 0.35174 1.0000 + Cd Cd44 1.0 0.70312 0.42188 0.35174 1.0000 + Cd Cd45 1.0 0.67187 0.45312 0.35174 1.0000 + Cd Cd46 1.0 0.64062 0.48437 0.35174 1.0000 + Cd Cd47 1.0 0.60937 0.51562 0.35174 1.0000 + Cd Cd48 1.0 0.57812 0.54688 0.35174 1.0000 + Cd Cd49 1.0 0.07812 0.10937 0.35174 1.0000 + Cd Cd50 1.0 0.04687 0.14062 0.35174 1.0000 + Cd Cd51 1.0 0.01562 0.17187 0.35174 1.0000 + Cd Cd52 1.0 0.98437 0.20312 0.35174 1.0000 + Cd Cd53 1.0 0.95312 0.23438 0.35174 1.0000 + Cd Cd54 1.0 0.92187 0.26562 0.35174 1.0000 + Cd Cd55 1.0 0.89062 0.29687 0.35174 1.0000 + Cd Cd56 1.0 0.85937 0.32812 0.35174 1.0000 + Cd Cd57 1.0 0.82812 0.35937 0.35174 1.0000 + Cd Cd58 1.0 0.79687 0.39062 0.35174 1.0000 + Cd Cd59 1.0 0.76562 0.42187 0.35174 1.0000 + Cd Cd60 1.0 0.73437 0.45312 0.35174 1.0000 + Cd Cd61 1.0 0.70312 0.48438 0.35174 1.0000 + Cd Cd62 1.0 0.67187 0.51562 0.35174 1.0000 + Cd Cd63 1.0 0.64062 0.54688 0.35174 1.0000 + Cd Cd64 1.0 0.60937 0.57812 0.35174 1.0000 + Cd Cd65 1.0 0.10937 0.14062 0.35174 1.0000 + Cd Cd66 1.0 0.07812 0.17187 0.35174 1.0000 + Cd Cd67 1.0 0.04688 0.20312 0.35174 1.0000 + Cd Cd68 1.0 0.01563 0.23438 0.35174 1.0000 + Cd Cd69 1.0 0.98437 0.26562 0.35174 1.0000 + Cd Cd70 1.0 0.95312 0.29688 0.35174 1.0000 + Cd Cd71 1.0 0.92187 0.32812 0.35174 1.0000 + Cd Cd72 1.0 0.89062 0.35937 0.35174 1.0000 + Cd Cd73 1.0 0.85937 0.39062 0.35174 1.0000 + Cd Cd74 1.0 0.82812 0.42187 0.35174 1.0000 + Cd Cd75 1.0 0.79687 0.45312 0.35174 1.0000 + Cd Cd76 1.0 0.76562 0.48438 0.35174 1.0000 + Cd Cd77 1.0 0.73437 0.51563 0.35174 1.0000 + Cd Cd78 1.0 0.70312 0.54688 0.35174 1.0000 + Cd Cd79 1.0 0.67187 0.57812 0.35174 1.0000 + Cd Cd80 1.0 0.64062 0.60937 0.35174 1.0000 + Cd Cd81 1.0 0.14062 0.17188 0.35174 1.0000 + Cd Cd82 1.0 0.10938 0.20313 0.35174 1.0000 + Cd Cd83 1.0 0.07813 0.23438 0.35174 1.0000 + Cd Cd84 1.0 0.04688 0.26562 0.35174 1.0000 + Cd Cd85 1.0 0.01563 0.29688 0.35174 1.0000 + Cd Cd86 1.0 0.98437 0.32812 0.35174 1.0000 + Cd Cd87 1.0 0.95312 0.35938 0.35174 1.0000 + Cd Cd88 1.0 0.92187 0.39062 0.35174 1.0000 + Cd Cd89 1.0 0.89062 0.42188 0.35174 1.0000 + Cd Cd90 1.0 0.85937 0.45312 0.35174 1.0000 + Cd Cd91 1.0 0.82812 0.48437 0.35174 1.0000 + Cd Cd92 1.0 0.79687 0.51562 0.35174 1.0000 + Cd Cd93 1.0 0.76562 0.54688 0.35174 1.0000 + Cd Cd94 1.0 0.73437 0.57812 0.35174 1.0000 + Cd Cd95 1.0 0.70312 0.60937 0.35174 1.0000 + Cd Cd96 1.0 0.67187 0.64062 0.35174 1.0000 + Cd Cd97 1.0 0.17187 0.20312 0.35174 1.0000 + Cd Cd98 1.0 0.14062 0.23437 0.35174 1.0000 + Cd Cd99 1.0 0.10937 0.26562 0.35174 1.0000 + Cd Cd100 1.0 0.07812 0.29687 0.35174 1.0000 + Cd Cd101 1.0 0.04687 0.32812 0.35174 1.0000 + Cd Cd102 1.0 0.01562 0.35937 0.35174 1.0000 + Cd Cd103 1.0 0.98437 0.39062 0.35174 1.0000 + Cd Cd104 1.0 0.95312 0.42188 0.35174 1.0000 + Cd Cd105 1.0 0.92187 0.45312 0.35174 1.0000 + Cd Cd106 1.0 0.89062 0.48437 0.35174 1.0000 + Cd Cd107 1.0 0.85937 0.51562 0.35174 1.0000 + Cd Cd108 1.0 0.82812 0.54688 0.35174 1.0000 + Cd Cd109 1.0 0.79687 0.57812 0.35174 1.0000 + Cd Cd110 1.0 0.76562 0.60937 0.35174 1.0000 + Cd Cd111 1.0 0.73437 0.64062 0.35174 1.0000 + Cd Cd112 1.0 0.70312 0.67187 0.35174 1.0000 + Cd Cd113 1.0 0.20312 0.23438 0.35174 1.0000 + Cd Cd114 1.0 0.17187 0.26562 0.35174 1.0000 + Cd Cd115 1.0 0.14062 0.29687 0.35174 1.0000 + Cd Cd116 1.0 0.10937 0.32812 0.35174 1.0000 + Cd Cd117 1.0 0.07812 0.35938 0.35174 1.0000 + Cd Cd118 1.0 0.04687 0.39062 0.35174 1.0000 + Cd Cd119 1.0 0.01562 0.42188 0.35174 1.0000 + Cd Cd120 1.0 0.98437 0.45312 0.35174 1.0000 + Cd Cd121 1.0 0.95312 0.48437 0.35174 1.0000 + Cd Cd122 1.0 0.92187 0.51562 0.35174 1.0000 + Cd Cd123 1.0 0.89062 0.54688 0.35174 1.0000 + Cd Cd124 1.0 0.85937 0.57812 0.35174 1.0000 + Cd Cd125 1.0 0.82812 0.60937 0.35174 1.0000 + Cd Cd126 1.0 0.79687 0.64062 0.35174 1.0000 + Cd Cd127 1.0 0.76562 0.67187 0.35174 1.0000 + Cd Cd128 1.0 0.73437 0.70312 0.35174 1.0000 + Cd Cd129 1.0 0.23437 0.26562 0.35174 1.0000 + Cd Cd130 1.0 0.20312 0.29687 0.35174 1.0000 + Cd Cd131 1.0 0.17187 0.32812 0.35174 1.0000 + Cd Cd132 1.0 0.14062 0.35938 0.35174 1.0000 + Cd Cd133 1.0 0.10937 0.39062 0.35174 1.0000 + Cd Cd134 1.0 0.07812 0.42188 0.35174 1.0000 + Cd Cd135 1.0 0.04687 0.45312 0.35174 1.0000 + Cd Cd136 1.0 0.01562 0.48438 0.35174 1.0000 + Cd Cd137 1.0 0.98437 0.51562 0.35174 1.0000 + Cd Cd138 1.0 0.95312 0.54688 0.35174 1.0000 + Cd Cd139 1.0 0.92187 0.57812 0.35174 1.0000 + Cd Cd140 1.0 0.89062 0.60937 0.35174 1.0000 + Cd Cd141 1.0 0.85937 0.64062 0.35174 1.0000 + Cd Cd142 1.0 0.82812 0.67187 0.35174 1.0000 + Cd Cd143 1.0 0.79687 0.70313 0.35174 1.0000 + Cd Cd144 1.0 0.76562 0.73438 0.35174 1.0000 + Cd Cd145 1.0 0.26562 0.29688 0.35174 1.0000 + Cd Cd146 1.0 0.23438 0.32812 0.35174 1.0000 + Cd Cd147 1.0 0.20312 0.35938 0.35174 1.0000 + Cd Cd148 1.0 0.17187 0.39063 0.35174 1.0000 + Cd Cd149 1.0 0.14062 0.42188 0.35174 1.0000 + Cd Cd150 1.0 0.10938 0.45312 0.35174 1.0000 + Cd Cd151 1.0 0.07812 0.48438 0.35174 1.0000 + Cd Cd152 1.0 0.04688 0.51562 0.35174 1.0000 + Cd Cd153 1.0 0.01563 0.54688 0.35174 1.0000 + Cd Cd154 1.0 0.98437 0.57812 0.35174 1.0000 + Cd Cd155 1.0 0.95312 0.60937 0.35174 1.0000 + Cd Cd156 1.0 0.92187 0.64062 0.35174 1.0000 + Cd Cd157 1.0 0.89062 0.67187 0.35174 1.0000 + Cd Cd158 1.0 0.85937 0.70312 0.35174 1.0000 + Cd Cd159 1.0 0.82812 0.73438 0.35174 1.0000 + Cd Cd160 1.0 0.79687 0.76562 0.35174 1.0000 + Cd Cd161 1.0 0.29687 0.32812 0.35174 1.0000 + Cd Cd162 1.0 0.26562 0.35938 0.35174 1.0000 + Cd Cd163 1.0 0.23438 0.39062 0.35174 1.0000 + Cd Cd164 1.0 0.20312 0.42188 0.35174 1.0000 + Cd Cd165 1.0 0.17188 0.45312 0.35174 1.0000 + Cd Cd166 1.0 0.14063 0.48437 0.35174 1.0000 + Cd Cd167 1.0 0.10938 0.51563 0.35174 1.0000 + Cd Cd168 1.0 0.07813 0.54688 0.35174 1.0000 + Cd Cd169 1.0 0.04688 0.57813 0.35174 1.0000 + Cd Cd170 1.0 0.01563 0.60937 0.35174 1.0000 + Cd Cd171 1.0 0.98437 0.64062 0.35174 1.0000 + Cd Cd172 1.0 0.95312 0.67188 0.35174 1.0000 + Cd Cd173 1.0 0.92187 0.70313 0.35174 1.0000 + Cd Cd174 1.0 0.89062 0.73438 0.35174 1.0000 + Cd Cd175 1.0 0.85937 0.76562 0.35174 1.0000 + Cd Cd176 1.0 0.82812 0.79687 0.35174 1.0000 + Cd Cd177 1.0 0.32812 0.35938 0.35174 1.0000 + Cd Cd178 1.0 0.29687 0.39062 0.35174 1.0000 + Cd Cd179 1.0 0.26562 0.42188 0.35174 1.0000 + Cd Cd180 1.0 0.23437 0.45312 0.35174 1.0000 + Cd Cd181 1.0 0.20312 0.48437 0.35174 1.0000 + Cd Cd182 1.0 0.17187 0.51562 0.35174 1.0000 + Cd Cd183 1.0 0.14062 0.54688 0.35174 1.0000 + Cd Cd184 1.0 0.10938 0.57812 0.35174 1.0000 + Cd Cd185 1.0 0.07813 0.60937 0.35174 1.0000 + Cd Cd186 1.0 0.04687 0.64062 0.35174 1.0000 + Cd Cd187 1.0 0.01562 0.67188 0.35174 1.0000 + Cd Cd188 1.0 0.98437 0.70312 0.35174 1.0000 + Cd Cd189 1.0 0.95312 0.73438 0.35174 1.0000 + Cd Cd190 1.0 0.92187 0.76562 0.35174 1.0000 + Cd Cd191 1.0 0.89062 0.79687 0.35174 1.0000 + Cd Cd192 1.0 0.85937 0.82813 0.35174 1.0000 + Cd Cd193 1.0 0.35937 0.39062 0.35174 1.0000 + Cd Cd194 1.0 0.32812 0.42188 0.35174 1.0000 + Cd Cd195 1.0 0.29687 0.45312 0.35174 1.0000 + Cd Cd196 1.0 0.26562 0.48437 0.35174 1.0000 + Cd Cd197 1.0 0.23437 0.51562 0.35174 1.0000 + Cd Cd198 1.0 0.20312 0.54688 0.35174 1.0000 + Cd Cd199 1.0 0.17187 0.57812 0.35174 1.0000 + Cd Cd200 1.0 0.14062 0.60937 0.35174 1.0000 + Cd Cd201 1.0 0.10937 0.64062 0.35174 1.0000 + Cd Cd202 1.0 0.07812 0.67188 0.35174 1.0000 + Cd Cd203 1.0 0.04688 0.70312 0.35174 1.0000 + Cd Cd204 1.0 0.01562 0.73438 0.35174 1.0000 + Cd Cd205 1.0 0.98437 0.76562 0.35174 1.0000 + Cd Cd206 1.0 0.95312 0.79687 0.35174 1.0000 + Cd Cd207 1.0 0.92187 0.82813 0.35174 1.0000 + Cd Cd208 1.0 0.89062 0.85937 0.35174 1.0000 + Cd Cd209 1.0 0.39062 0.42188 0.35174 1.0000 + Cd Cd210 1.0 0.35938 0.45312 0.35174 1.0000 + Cd Cd211 1.0 0.32813 0.48438 0.35174 1.0000 + Cd Cd212 1.0 0.29687 0.51562 0.35174 1.0000 + Cd Cd213 1.0 0.26562 0.54688 0.35174 1.0000 + Cd Cd214 1.0 0.23438 0.57813 0.35174 1.0000 + Cd Cd215 1.0 0.20312 0.60938 0.35174 1.0000 + Cd Cd216 1.0 0.17188 0.64062 0.35174 1.0000 + Cd Cd217 1.0 0.14062 0.67188 0.35174 1.0000 + Cd Cd218 1.0 0.10938 0.70313 0.35174 1.0000 + Cd Cd219 1.0 0.07813 0.73438 0.35174 1.0000 + Cd Cd220 1.0 0.04688 0.76562 0.35174 1.0000 + Cd Cd221 1.0 0.01563 0.79687 0.35174 1.0000 + Cd Cd222 1.0 0.98437 0.82813 0.35174 1.0000 + Cd Cd223 1.0 0.95312 0.85938 0.35174 1.0000 + Cd Cd224 1.0 0.92187 0.89063 0.35174 1.0000 + Cd Cd225 1.0 0.42187 0.45312 0.35174 1.0000 + Cd Cd226 1.0 0.39062 0.48437 0.35174 1.0000 + Cd Cd227 1.0 0.35937 0.51562 0.35174 1.0000 + Cd Cd228 1.0 0.32812 0.54688 0.35174 1.0000 + Cd Cd229 1.0 0.29687 0.57812 0.35174 1.0000 + Cd Cd230 1.0 0.26562 0.60937 0.35174 1.0000 + Cd Cd231 1.0 0.23438 0.64063 0.35174 1.0000 + Cd Cd232 1.0 0.20312 0.67188 0.35174 1.0000 + Cd Cd233 1.0 0.17187 0.70312 0.35174 1.0000 + Cd Cd234 1.0 0.14062 0.73438 0.35174 1.0000 + Cd Cd235 1.0 0.10937 0.76562 0.35174 1.0000 + Cd Cd236 1.0 0.07813 0.79687 0.35174 1.0000 + Cd Cd237 1.0 0.04688 0.82813 0.35174 1.0000 + Cd Cd238 1.0 0.01562 0.85938 0.35174 1.0000 + Cd Cd239 1.0 0.98437 0.89063 0.35174 1.0000 + Cd Cd240 1.0 0.95312 0.92187 0.35174 1.0000 + Cd Cd241 1.0 0.45312 0.48437 0.35174 1.0000 + Cd Cd242 1.0 0.42187 0.51562 0.35174 1.0000 + Cd Cd243 1.0 0.39062 0.54688 0.35174 1.0000 + Cd Cd244 1.0 0.35938 0.57812 0.35174 1.0000 + Cd Cd245 1.0 0.32813 0.60937 0.35174 1.0000 + Cd Cd246 1.0 0.29687 0.64062 0.35174 1.0000 + Cd Cd247 1.0 0.26562 0.67188 0.35174 1.0000 + Cd Cd248 1.0 0.23438 0.70313 0.35174 1.0000 + Cd Cd249 1.0 0.20312 0.73438 0.35174 1.0000 + Cd Cd250 1.0 0.17187 0.76562 0.35174 1.0000 + Cd Cd251 1.0 0.14063 0.79687 0.35174 1.0000 + Cd Cd252 1.0 0.10938 0.82813 0.35174 1.0000 + Cd Cd253 1.0 0.07813 0.85937 0.35174 1.0000 + Cd Cd254 1.0 0.04688 0.89063 0.35174 1.0000 + Cd Cd255 1.0 0.01563 0.92188 0.35174 1.0000 + Cd Cd256 1.0 0.98437 0.95312 0.35174 1.0000 + Cd Cd257 1.0 0.00000 0.03125 0.64826 1.0000 + Cd Cd258 1.0 0.96875 0.06250 0.64826 1.0000 + Cd Cd259 1.0 0.93750 0.09375 0.64826 1.0000 + Cd Cd260 1.0 0.90625 0.12500 0.64826 1.0000 + Cd Cd261 1.0 0.87500 0.15625 0.64826 1.0000 + Cd Cd262 1.0 0.84375 0.18750 0.64826 1.0000 + Cd Cd263 1.0 0.81250 0.21875 0.64826 1.0000 + Cd Cd264 1.0 0.78125 0.25000 0.64826 1.0000 + Cd Cd265 1.0 0.75000 0.28125 0.64826 1.0000 + Cd Cd266 1.0 0.71875 0.31250 0.64826 1.0000 + Cd Cd267 1.0 0.68750 0.34375 0.64826 1.0000 + Cd Cd268 1.0 0.65625 0.37500 0.64826 1.0000 + Cd Cd269 1.0 0.62500 0.40625 0.64826 1.0000 + Cd Cd270 1.0 0.59375 0.43750 0.64826 1.0000 + Cd Cd271 1.0 0.56250 0.46875 0.64826 1.0000 + Cd Cd272 1.0 0.53125 0.50000 0.64826 1.0000 + Cd Cd273 1.0 0.03125 0.06250 0.64826 1.0000 + Cd Cd274 1.0 0.00000 0.09375 0.64826 1.0000 + Cd Cd275 1.0 0.96875 0.12500 0.64826 1.0000 + Cd Cd276 1.0 0.93750 0.15625 0.64826 1.0000 + Cd Cd277 1.0 0.90625 0.18750 0.64826 1.0000 + Cd Cd278 1.0 0.87500 0.21875 0.64826 1.0000 + Cd Cd279 1.0 0.84375 0.25000 0.64826 1.0000 + Cd Cd280 1.0 0.81250 0.28125 0.64826 1.0000 + Cd Cd281 1.0 0.78125 0.31250 0.64826 1.0000 + Cd Cd282 1.0 0.75000 0.34375 0.64826 1.0000 + Cd Cd283 1.0 0.71875 0.37500 0.64826 1.0000 + Cd Cd284 1.0 0.68750 0.40625 0.64826 1.0000 + Cd Cd285 1.0 0.65625 0.43750 0.64826 1.0000 + Cd Cd286 1.0 0.62500 0.46875 0.64826 1.0000 + Cd Cd287 1.0 0.59375 0.50000 0.64826 1.0000 + Cd Cd288 1.0 0.56250 0.53125 0.64826 1.0000 + Cd Cd289 1.0 0.06250 0.09375 0.64826 1.0000 + Cd Cd290 1.0 0.03125 0.12500 0.64826 1.0000 + Cd Cd291 1.0 0.00000 0.15625 0.64826 1.0000 + Cd Cd292 1.0 0.96875 0.18750 0.64826 1.0000 + Cd Cd293 1.0 0.93750 0.21875 0.64826 1.0000 + Cd Cd294 1.0 0.90625 0.25000 0.64826 1.0000 + Cd Cd295 1.0 0.87500 0.28125 0.64826 1.0000 + Cd Cd296 1.0 0.84375 0.31250 0.64826 1.0000 + Cd Cd297 1.0 0.81250 0.34375 0.64826 1.0000 + Cd Cd298 1.0 0.78125 0.37500 0.64826 1.0000 + Cd Cd299 1.0 0.75000 0.40625 0.64826 1.0000 + Cd Cd300 1.0 0.71875 0.43750 0.64826 1.0000 + Cd Cd301 1.0 0.68750 0.46875 0.64826 1.0000 + Cd Cd302 1.0 0.65625 0.50000 0.64826 1.0000 + Cd Cd303 1.0 0.62500 0.53125 0.64826 1.0000 + Cd Cd304 1.0 0.59375 0.56250 0.64826 1.0000 + Cd Cd305 1.0 0.09375 0.12500 0.64826 1.0000 + Cd Cd306 1.0 0.06250 0.15625 0.64826 1.0000 + Cd Cd307 1.0 0.03125 0.18750 0.64826 1.0000 + Cd Cd308 1.0 0.00000 0.21875 0.64826 1.0000 + Cd Cd309 1.0 0.96875 0.25000 0.64826 1.0000 + Cd Cd310 1.0 0.93750 0.28125 0.64826 1.0000 + Cd Cd311 1.0 0.90625 0.31250 0.64826 1.0000 + Cd Cd312 1.0 0.87500 0.34375 0.64826 1.0000 + Cd Cd313 1.0 0.84375 0.37500 0.64826 1.0000 + Cd Cd314 1.0 0.81250 0.40625 0.64826 1.0000 + Cd Cd315 1.0 0.78125 0.43750 0.64826 1.0000 + Cd Cd316 1.0 0.75000 0.46875 0.64826 1.0000 + Cd Cd317 1.0 0.71875 0.50000 0.64826 1.0000 + Cd Cd318 1.0 0.68750 0.53125 0.64826 1.0000 + Cd Cd319 1.0 0.65625 0.56250 0.64826 1.0000 + Cd Cd320 1.0 0.62500 0.59375 0.64826 1.0000 + Cd Cd321 1.0 0.12500 0.15625 0.64826 1.0000 + Cd Cd322 1.0 0.09375 0.18750 0.64826 1.0000 + Cd Cd323 1.0 0.06250 0.21875 0.64826 1.0000 + Cd Cd324 1.0 0.03125 0.25000 0.64826 1.0000 + Cd Cd325 1.0 0.00000 0.28125 0.64826 1.0000 + Cd Cd326 1.0 0.96875 0.31250 0.64826 1.0000 + Cd Cd327 1.0 0.93750 0.34375 0.64826 1.0000 + Cd Cd328 1.0 0.90625 0.37500 0.64826 1.0000 + Cd Cd329 1.0 0.87500 0.40625 0.64826 1.0000 + Cd Cd330 1.0 0.84375 0.43750 0.64826 1.0000 + Cd Cd331 1.0 0.81250 0.46875 0.64826 1.0000 + Cd Cd332 1.0 0.78125 0.50000 0.64826 1.0000 + Cd Cd333 1.0 0.75000 0.53125 0.64826 1.0000 + Cd Cd334 1.0 0.71875 0.56250 0.64826 1.0000 + Cd Cd335 1.0 0.68750 0.59375 0.64826 1.0000 + Cd Cd336 1.0 0.65625 0.62500 0.64826 1.0000 + Cd Cd337 1.0 0.15625 0.18750 0.64826 1.0000 + Cd Cd338 1.0 0.12500 0.21875 0.64826 1.0000 + Cd Cd339 1.0 0.09375 0.25000 0.64826 1.0000 + Cd Cd340 1.0 0.06250 0.28125 0.64826 1.0000 + Cd Cd341 1.0 0.03125 0.31250 0.64826 1.0000 + Cd Cd342 1.0 0.00000 0.34375 0.64826 1.0000 + Cd Cd343 1.0 0.96875 0.37500 0.64826 1.0000 + Cd Cd344 1.0 0.93750 0.40625 0.64826 1.0000 + Cd Cd345 1.0 0.90625 0.43750 0.64826 1.0000 + Cd Cd346 1.0 0.87500 0.46875 0.64826 1.0000 + Cd Cd347 1.0 0.84375 0.50000 0.64826 1.0000 + Cd Cd348 1.0 0.81250 0.53125 0.64826 1.0000 + Cd Cd349 1.0 0.78125 0.56250 0.64826 1.0000 + Cd Cd350 1.0 0.75000 0.59375 0.64826 1.0000 + Cd Cd351 1.0 0.71875 0.62500 0.64826 1.0000 + Cd Cd352 1.0 0.68750 0.65625 0.64826 1.0000 + Cd Cd353 1.0 0.18750 0.21875 0.64826 1.0000 + Cd Cd354 1.0 0.15625 0.25000 0.64826 1.0000 + Cd Cd355 1.0 0.12500 0.28125 0.64826 1.0000 + Cd Cd356 1.0 0.09375 0.31250 0.64826 1.0000 + Cd Cd357 1.0 0.06250 0.34375 0.64826 1.0000 + Cd Cd358 1.0 0.03125 0.37500 0.64826 1.0000 + Cd Cd359 1.0 0.00000 0.40625 0.64826 1.0000 + Cd Cd360 1.0 0.96875 0.43750 0.64826 1.0000 + Cd Cd361 1.0 0.93750 0.46875 0.64826 1.0000 + Cd Cd362 1.0 0.90625 0.50000 0.64826 1.0000 + Cd Cd363 1.0 0.87500 0.53125 0.64826 1.0000 + Cd Cd364 1.0 0.84375 0.56250 0.64826 1.0000 + Cd Cd365 1.0 0.81250 0.59375 0.64826 1.0000 + Cd Cd366 1.0 0.78125 0.62500 0.64826 1.0000 + Cd Cd367 1.0 0.75000 0.65625 0.64826 1.0000 + Cd Cd368 1.0 0.71875 0.68750 0.64826 1.0000 + Cd Cd369 1.0 0.21875 0.25000 0.64826 1.0000 + Cd Cd370 1.0 0.18750 0.28125 0.64826 1.0000 + Cd Cd371 1.0 0.15625 0.31250 0.64826 1.0000 + Cd Cd372 1.0 0.12500 0.34375 0.64826 1.0000 + Cd Cd373 1.0 0.09375 0.37500 0.64826 1.0000 + Cd Cd374 1.0 0.06250 0.40625 0.64826 1.0000 + Cd Cd375 1.0 0.03125 0.43750 0.64826 1.0000 + Cd Cd376 1.0 0.00000 0.46875 0.64826 1.0000 + Cd Cd377 1.0 0.96875 0.50000 0.64826 1.0000 + Cd Cd378 1.0 0.93750 0.53125 0.64826 1.0000 + Cd Cd379 1.0 0.90625 0.56250 0.64826 1.0000 + Cd Cd380 1.0 0.87500 0.59375 0.64826 1.0000 + Cd Cd381 1.0 0.84375 0.62500 0.64826 1.0000 + Cd Cd382 1.0 0.81250 0.65625 0.64826 1.0000 + Cd Cd383 1.0 0.78125 0.68750 0.64826 1.0000 + Cd Cd384 1.0 0.75000 0.71875 0.64826 1.0000 + Cd Cd385 1.0 0.25000 0.28125 0.64826 1.0000 + Cd Cd386 1.0 0.21875 0.31250 0.64826 1.0000 + Cd Cd387 1.0 0.18750 0.34375 0.64826 1.0000 + Cd Cd388 1.0 0.15625 0.37500 0.64826 1.0000 + Cd Cd389 1.0 0.12500 0.40625 0.64826 1.0000 + Cd Cd390 1.0 0.09375 0.43750 0.64826 1.0000 + Cd Cd391 1.0 0.06250 0.46875 0.64826 1.0000 + Cd Cd392 1.0 0.03125 0.50000 0.64826 1.0000 + Cd Cd393 1.0 0.00000 0.53125 0.64826 1.0000 + Cd Cd394 1.0 0.96875 0.56250 0.64826 1.0000 + Cd Cd395 1.0 0.93750 0.59375 0.64826 1.0000 + Cd Cd396 1.0 0.90625 0.62500 0.64826 1.0000 + Cd Cd397 1.0 0.87500 0.65625 0.64826 1.0000 + Cd Cd398 1.0 0.84375 0.68750 0.64826 1.0000 + Cd Cd399 1.0 0.81250 0.71875 0.64826 1.0000 + Cd Cd400 1.0 0.78125 0.75000 0.64826 1.0000 + Cd Cd401 1.0 0.28125 0.31250 0.64826 1.0000 + Cd Cd402 1.0 0.25000 0.34375 0.64826 1.0000 + Cd Cd403 1.0 0.21875 0.37500 0.64826 1.0000 + Cd Cd404 1.0 0.18750 0.40625 0.64826 1.0000 + Cd Cd405 1.0 0.15625 0.43750 0.64826 1.0000 + Cd Cd406 1.0 0.12500 0.46875 0.64826 1.0000 + Cd Cd407 1.0 0.09375 0.50000 0.64826 1.0000 + Cd Cd408 1.0 0.06250 0.53125 0.64826 1.0000 + Cd Cd409 1.0 0.03125 0.56250 0.64826 1.0000 + Cd Cd410 1.0 0.00000 0.59375 0.64826 1.0000 + Cd Cd411 1.0 0.96875 0.62500 0.64826 1.0000 + Cd Cd412 1.0 0.93750 0.65625 0.64826 1.0000 + Cd Cd413 1.0 0.90625 0.68750 0.64826 1.0000 + Cd Cd414 1.0 0.87500 0.71875 0.64826 1.0000 + Cd Cd415 1.0 0.84375 0.75000 0.64826 1.0000 + Cd Cd416 1.0 0.81250 0.78125 0.64826 1.0000 + Cd Cd417 1.0 0.31250 0.34375 0.64826 1.0000 + Cd Cd418 1.0 0.28125 0.37500 0.64826 1.0000 + Cd Cd419 1.0 0.25000 0.40625 0.64826 1.0000 + Cd Cd420 1.0 0.21875 0.43750 0.64826 1.0000 + Cd Cd421 1.0 0.18750 0.46875 0.64826 1.0000 + Cd Cd422 1.0 0.15625 0.50000 0.64826 1.0000 + Cd Cd423 1.0 0.12500 0.53125 0.64826 1.0000 + Cd Cd424 1.0 0.09375 0.56250 0.64826 1.0000 + Cd Cd425 1.0 0.06250 0.59375 0.64826 1.0000 + Cd Cd426 1.0 0.03125 0.62500 0.64826 1.0000 + Cd Cd427 1.0 0.00000 0.65625 0.64826 1.0000 + Cd Cd428 1.0 0.96875 0.68750 0.64826 1.0000 + Cd Cd429 1.0 0.93750 0.71875 0.64826 1.0000 + Cd Cd430 1.0 0.90625 0.75000 0.64826 1.0000 + Cd Cd431 1.0 0.87500 0.78125 0.64826 1.0000 + Cd Cd432 1.0 0.84375 0.81250 0.64826 1.0000 + Cd Cd433 1.0 0.34375 0.37500 0.64826 1.0000 + Cd Cd434 1.0 0.31250 0.40625 0.64826 1.0000 + Cd Cd435 1.0 0.28125 0.43750 0.64826 1.0000 + Cd Cd436 1.0 0.25000 0.46875 0.64826 1.0000 + Cd Cd437 1.0 0.21875 0.50000 0.64826 1.0000 + Cd Cd438 1.0 0.18750 0.53125 0.64826 1.0000 + Cd Cd439 1.0 0.15625 0.56250 0.64826 1.0000 + Cd Cd440 1.0 0.12500 0.59375 0.64826 1.0000 + Cd Cd441 1.0 0.09375 0.62500 0.64826 1.0000 + Cd Cd442 1.0 0.06250 0.65625 0.64826 1.0000 + Cd Cd443 1.0 0.03125 0.68750 0.64826 1.0000 + Cd Cd444 1.0 0.00000 0.71875 0.64826 1.0000 + Cd Cd445 1.0 0.96875 0.75000 0.64826 1.0000 + Cd Cd446 1.0 0.93750 0.78125 0.64826 1.0000 + Cd Cd447 1.0 0.90625 0.81250 0.64826 1.0000 + Cd Cd448 1.0 0.87500 0.84375 0.64826 1.0000 + Cd Cd449 1.0 0.37500 0.40625 0.64826 1.0000 + Cd Cd450 1.0 0.34375 0.43750 0.64826 1.0000 + Cd Cd451 1.0 0.31250 0.46875 0.64826 1.0000 + Cd Cd452 1.0 0.28125 0.50000 0.64826 1.0000 + Cd Cd453 1.0 0.25000 0.53125 0.64826 1.0000 + Cd Cd454 1.0 0.21875 0.56250 0.64826 1.0000 + Cd Cd455 1.0 0.18750 0.59375 0.64826 1.0000 + Cd Cd456 1.0 0.15625 0.62500 0.64826 1.0000 + Cd Cd457 1.0 0.12500 0.65625 0.64826 1.0000 + Cd Cd458 1.0 0.09375 0.68750 0.64826 1.0000 + Cd Cd459 1.0 0.06250 0.71875 0.64826 1.0000 + Cd Cd460 1.0 0.03125 0.75000 0.64826 1.0000 + Cd Cd461 1.0 0.00000 0.78125 0.64826 1.0000 + Cd Cd462 1.0 0.96875 0.81250 0.64826 1.0000 + Cd Cd463 1.0 0.93750 0.84375 0.64826 1.0000 + Cd Cd464 1.0 0.90625 0.87500 0.64826 1.0000 + Cd Cd465 1.0 0.40625 0.43750 0.64826 1.0000 + Cd Cd466 1.0 0.37500 0.46875 0.64826 1.0000 + Cd Cd467 1.0 0.34375 0.50000 0.64826 1.0000 + Cd Cd468 1.0 0.31250 0.53125 0.64826 1.0000 + Cd Cd469 1.0 0.28125 0.56250 0.64826 1.0000 + Cd Cd470 1.0 0.25000 0.59375 0.64826 1.0000 + Cd Cd471 1.0 0.21875 0.62500 0.64826 1.0000 + Cd Cd472 1.0 0.18750 0.65625 0.64826 1.0000 + Cd Cd473 1.0 0.15625 0.68750 0.64826 1.0000 + Cd Cd474 1.0 0.12500 0.71875 0.64826 1.0000 + Cd Cd475 1.0 0.09375 0.75000 0.64826 1.0000 + Cd Cd476 1.0 0.06250 0.78125 0.64826 1.0000 + Cd Cd477 1.0 0.03125 0.81250 0.64826 1.0000 + Cd Cd478 1.0 0.00000 0.84375 0.64826 1.0000 + Cd Cd479 1.0 0.96875 0.87500 0.64826 1.0000 + Cd Cd480 1.0 0.93750 0.90625 0.64826 1.0000 + Cd Cd481 1.0 0.43750 0.46875 0.64826 1.0000 + Cd Cd482 1.0 0.40625 0.50000 0.64826 1.0000 + Cd Cd483 1.0 0.37500 0.53125 0.64826 1.0000 + Cd Cd484 1.0 0.34375 0.56250 0.64826 1.0000 + Cd Cd485 1.0 0.31250 0.59375 0.64826 1.0000 + Cd Cd486 1.0 0.28125 0.62500 0.64826 1.0000 + Cd Cd487 1.0 0.25000 0.65625 0.64826 1.0000 + Cd Cd488 1.0 0.21875 0.68750 0.64826 1.0000 + Cd Cd489 1.0 0.18750 0.71875 0.64826 1.0000 + Cd Cd490 1.0 0.15625 0.75000 0.64826 1.0000 + Cd Cd491 1.0 0.12500 0.78125 0.64826 1.0000 + Cd Cd492 1.0 0.09375 0.81250 0.64826 1.0000 + Cd Cd493 1.0 0.06250 0.84375 0.64826 1.0000 + Cd Cd494 1.0 0.03125 0.87500 0.64826 1.0000 + Cd Cd495 1.0 0.00000 0.90625 0.64826 1.0000 + Cd Cd496 1.0 0.96875 0.93750 0.64826 1.0000 + Cd Cd497 1.0 0.46875 0.50000 0.64826 1.0000 + Cd Cd498 1.0 0.43750 0.53125 0.64826 1.0000 + Cd Cd499 1.0 0.40625 0.56250 0.64826 1.0000 + Cd Cd500 1.0 0.37500 0.59375 0.64826 1.0000 + Cd Cd501 1.0 0.34375 0.62500 0.64826 1.0000 + Cd Cd502 1.0 0.31250 0.65625 0.64826 1.0000 + Cd Cd503 1.0 0.28125 0.68750 0.64826 1.0000 + Cd Cd504 1.0 0.25000 0.71875 0.64826 1.0000 + Cd Cd505 1.0 0.21875 0.75000 0.64826 1.0000 + Cd Cd506 1.0 0.18750 0.78125 0.64826 1.0000 + Cd Cd507 1.0 0.15625 0.81250 0.64826 1.0000 + Cd Cd508 1.0 0.12500 0.84375 0.64826 1.0000 + Cd Cd509 1.0 0.09375 0.87500 0.64826 1.0000 + Cd Cd510 1.0 0.06250 0.90625 0.64826 1.0000 + Cd Cd511 1.0 0.03125 0.93750 0.64826 1.0000 + Cd Cd512 1.0 0.00000 0.96875 0.64826 1.0000 + Si Si1 1.0 0.00000 0.00000 0.50000 1.0000 + Si Si2 1.0 0.96875 0.03125 0.50000 1.0000 + Si Si3 1.0 0.93750 0.06250 0.50000 1.0000 + Si Si4 1.0 0.90625 0.09375 0.50000 1.0000 + Si Si5 1.0 0.87500 0.12500 0.50000 1.0000 + Si Si6 1.0 0.84375 0.15625 0.50000 1.0000 + Si Si7 1.0 0.81250 0.18750 0.50000 1.0000 + Si Si8 1.0 0.78125 0.21875 0.50000 1.0000 + Si Si9 1.0 0.75000 0.25000 0.50000 1.0000 + Si Si10 1.0 0.71875 0.28125 0.50000 1.0000 + Si Si11 1.0 0.68750 0.31250 0.50000 1.0000 + Si Si12 1.0 0.65625 0.34375 0.50000 1.0000 + Si Si13 1.0 0.62500 0.37500 0.50000 1.0000 + Si Si14 1.0 0.59375 0.40625 0.50000 1.0000 + Si Si15 1.0 0.56250 0.43750 0.50000 1.0000 + Si Si16 1.0 0.53125 0.46875 0.50000 1.0000 + Si Si17 1.0 0.03125 0.03125 0.50000 1.0000 + Si Si18 1.0 0.00000 0.06250 0.50000 1.0000 + Si Si19 1.0 0.96875 0.09375 0.50000 1.0000 + Si Si20 1.0 0.93750 0.12500 0.50000 1.0000 + Si Si21 1.0 0.90625 0.15625 0.50000 1.0000 + Si Si22 1.0 0.87500 0.18750 0.50000 1.0000 + Si Si23 1.0 0.84375 0.21875 0.50000 1.0000 + Si Si24 1.0 0.81250 0.25000 0.50000 1.0000 + Si Si25 1.0 0.78125 0.28125 0.50000 1.0000 + Si Si26 1.0 0.75000 0.31250 0.50000 1.0000 + Si Si27 1.0 0.71875 0.34375 0.50000 1.0000 + Si Si28 1.0 0.68750 0.37500 0.50000 1.0000 + Si Si29 1.0 0.65625 0.40625 0.50000 1.0000 + Si Si30 1.0 0.62500 0.43750 0.50000 1.0000 + Si Si31 1.0 0.59375 0.46875 0.50000 1.0000 + Si Si32 1.0 0.56250 0.50000 0.50000 1.0000 + Si Si33 1.0 0.06250 0.06250 0.50000 1.0000 + Si Si34 1.0 0.03125 0.09375 0.50000 1.0000 + Si Si35 1.0 0.00000 0.12500 0.50000 1.0000 + Si Si36 1.0 0.96875 0.15625 0.50000 1.0000 + Si Si37 1.0 0.93750 0.18750 0.50000 1.0000 + Si Si38 1.0 0.90625 0.21875 0.50000 1.0000 + Si Si39 1.0 0.87500 0.25000 0.50000 1.0000 + Si Si40 1.0 0.84375 0.28125 0.50000 1.0000 + Si Si41 1.0 0.81250 0.31250 0.50000 1.0000 + Si Si42 1.0 0.78125 0.34375 0.50000 1.0000 + Si Si43 1.0 0.75000 0.37500 0.50000 1.0000 + Si Si44 1.0 0.71875 0.40625 0.50000 1.0000 + Si Si45 1.0 0.68750 0.43750 0.50000 1.0000 + Si Si46 1.0 0.65625 0.46875 0.50000 1.0000 + Si Si47 1.0 0.62500 0.50000 0.50000 1.0000 + Si Si48 1.0 0.59375 0.53125 0.50000 1.0000 + Si Si49 1.0 0.09375 0.09375 0.50000 1.0000 + Si Si50 1.0 0.06250 0.12500 0.50000 1.0000 + Si Si51 1.0 0.03125 0.15625 0.50000 1.0000 + Si Si52 1.0 0.00000 0.18750 0.50000 1.0000 + Si Si53 1.0 0.96875 0.21875 0.50000 1.0000 + Si Si54 1.0 0.93750 0.25000 0.50000 1.0000 + Si Si55 1.0 0.90625 0.28125 0.50000 1.0000 + Si Si56 1.0 0.87500 0.31250 0.50000 1.0000 + Si Si57 1.0 0.84375 0.34375 0.50000 1.0000 + Si Si58 1.0 0.81250 0.37500 0.50000 1.0000 + Si Si59 1.0 0.78125 0.40625 0.50000 1.0000 + Si Si60 1.0 0.75000 0.43750 0.50000 1.0000 + Si Si61 1.0 0.71875 0.46875 0.50000 1.0000 + Si Si62 1.0 0.68750 0.50000 0.50000 1.0000 + Si Si63 1.0 0.65625 0.53125 0.50000 1.0000 + Si Si64 1.0 0.62500 0.56250 0.50000 1.0000 + Si Si65 1.0 0.12500 0.12500 0.50000 1.0000 + Si Si66 1.0 0.09375 0.15625 0.50000 1.0000 + Si Si67 1.0 0.06250 0.18750 0.50000 1.0000 + Si Si68 1.0 0.03125 0.21875 0.50000 1.0000 + Si Si69 1.0 0.00000 0.25000 0.50000 1.0000 + Si Si70 1.0 0.96875 0.28125 0.50000 1.0000 + Si Si71 1.0 0.93750 0.31250 0.50000 1.0000 + Si Si72 1.0 0.90625 0.34375 0.50000 1.0000 + Si Si73 1.0 0.87500 0.37500 0.50000 1.0000 + Si Si74 1.0 0.84375 0.40625 0.50000 1.0000 + Si Si75 1.0 0.81250 0.43750 0.50000 1.0000 + Si Si76 1.0 0.78125 0.46875 0.50000 1.0000 + Si Si77 1.0 0.75000 0.50000 0.50000 1.0000 + Si Si78 1.0 0.71875 0.53125 0.50000 1.0000 + Si Si79 1.0 0.68750 0.56250 0.50000 1.0000 + Si Si80 1.0 0.65625 0.59375 0.50000 1.0000 + Si Si81 1.0 0.15625 0.15625 0.50000 1.0000 + Si Si82 1.0 0.12500 0.18750 0.50000 1.0000 + Si Si83 1.0 0.09375 0.21875 0.50000 1.0000 + Si Si84 1.0 0.06250 0.25000 0.50000 1.0000 + Si Si85 1.0 0.03125 0.28125 0.50000 1.0000 + Si Si86 1.0 0.00000 0.31250 0.50000 1.0000 + Si Si87 1.0 0.96875 0.34375 0.50000 1.0000 + Si Si88 1.0 0.93750 0.37500 0.50000 1.0000 + Si Si89 1.0 0.90625 0.40625 0.50000 1.0000 + Si Si90 1.0 0.87500 0.43750 0.50000 1.0000 + Si Si91 1.0 0.84375 0.46875 0.50000 1.0000 + Si Si92 1.0 0.81250 0.50000 0.50000 1.0000 + Si Si93 1.0 0.78125 0.53125 0.50000 1.0000 + Si Si94 1.0 0.75000 0.56250 0.50000 1.0000 + Si Si95 1.0 0.71875 0.59375 0.50000 1.0000 + Si Si96 1.0 0.68750 0.62500 0.50000 1.0000 + Si Si97 1.0 0.18750 0.18750 0.50000 1.0000 + Si Si98 1.0 0.15625 0.21875 0.50000 1.0000 + Si Si99 1.0 0.12500 0.25000 0.50000 1.0000 + Si Si100 1.0 0.09375 0.28125 0.50000 1.0000 + Si Si101 1.0 0.06250 0.31250 0.50000 1.0000 + Si Si102 1.0 0.03125 0.34375 0.50000 1.0000 + Si Si103 1.0 0.00000 0.37500 0.50000 1.0000 + Si Si104 1.0 0.96875 0.40625 0.50000 1.0000 + Si Si105 1.0 0.93750 0.43750 0.50000 1.0000 + Si Si106 1.0 0.90625 0.46875 0.50000 1.0000 + Si Si107 1.0 0.87500 0.50000 0.50000 1.0000 + Si Si108 1.0 0.84375 0.53125 0.50000 1.0000 + Si Si109 1.0 0.81250 0.56250 0.50000 1.0000 + Si Si110 1.0 0.78125 0.59375 0.50000 1.0000 + Si Si111 1.0 0.75000 0.62500 0.50000 1.0000 + Si Si112 1.0 0.71875 0.65625 0.50000 1.0000 + Si Si113 1.0 0.21875 0.21875 0.50000 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0.09579 0.23109 0.66738 1.0000 + O O852 1.0 0.06454 0.26234 0.66738 1.0000 + O O853 1.0 0.03329 0.29359 0.66738 1.0000 + O O854 1.0 0.00204 0.32484 0.66738 1.0000 + O O855 1.0 0.97079 0.35609 0.66738 1.0000 + O O856 1.0 0.93954 0.38734 0.66738 1.0000 + O O857 1.0 0.90829 0.41859 0.66738 1.0000 + O O858 1.0 0.87704 0.44984 0.66738 1.0000 + O O859 1.0 0.84579 0.48109 0.66738 1.0000 + O O860 1.0 0.81454 0.51234 0.66738 1.0000 + O O861 1.0 0.78329 0.54359 0.66738 1.0000 + O O862 1.0 0.75204 0.57484 0.66738 1.0000 + O O863 1.0 0.72079 0.60609 0.66738 1.0000 + O O864 1.0 0.68954 0.63734 0.66738 1.0000 + O O865 1.0 0.18954 0.19984 0.66738 1.0000 + O O866 1.0 0.15829 0.23109 0.66738 1.0000 + O O867 1.0 0.12704 0.26234 0.66738 1.0000 + O O868 1.0 0.09579 0.29359 0.66738 1.0000 + O O869 1.0 0.06454 0.32484 0.66738 1.0000 + O O870 1.0 0.03329 0.35609 0.66738 1.0000 + O O871 1.0 0.00204 0.38734 0.66738 1.0000 + O O872 1.0 0.97079 0.41859 0.66738 1.0000 + O O873 1.0 0.93954 0.44984 0.66738 1.0000 + O O874 1.0 0.90829 0.48109 0.66738 1.0000 + O O875 1.0 0.87704 0.51234 0.66738 1.0000 + O O876 1.0 0.84579 0.54359 0.66738 1.0000 + O O877 1.0 0.81454 0.57484 0.66738 1.0000 + O O878 1.0 0.78329 0.60609 0.66738 1.0000 + O O879 1.0 0.75204 0.63734 0.66738 1.0000 + O O880 1.0 0.72079 0.66859 0.66738 1.0000 + O O881 1.0 0.22079 0.23109 0.66738 1.0000 + O O882 1.0 0.18954 0.26234 0.66738 1.0000 + O O883 1.0 0.15829 0.29359 0.66738 1.0000 + O O884 1.0 0.12704 0.32484 0.66738 1.0000 + O O885 1.0 0.09579 0.35609 0.66738 1.0000 + O O886 1.0 0.06454 0.38734 0.66738 1.0000 + O O887 1.0 0.03329 0.41859 0.66738 1.0000 + O O888 1.0 0.00204 0.44984 0.66738 1.0000 + O O889 1.0 0.97079 0.48109 0.66738 1.0000 + O O890 1.0 0.93954 0.51234 0.66738 1.0000 + O O891 1.0 0.90829 0.54359 0.66738 1.0000 + O O892 1.0 0.87704 0.57484 0.66738 1.0000 + O O893 1.0 0.84579 0.60609 0.66738 1.0000 + O O894 1.0 0.81454 0.63734 0.66738 1.0000 + O O895 1.0 0.78329 0.66859 0.66738 1.0000 + O O896 1.0 0.75204 0.69984 0.66738 1.0000 + O O897 1.0 0.25204 0.26234 0.66738 1.0000 + O O898 1.0 0.22079 0.29359 0.66738 1.0000 + O O899 1.0 0.18954 0.32484 0.66738 1.0000 + O O900 1.0 0.15829 0.35609 0.66738 1.0000 + O O901 1.0 0.12704 0.38734 0.66738 1.0000 + O O902 1.0 0.09579 0.41859 0.66738 1.0000 + O O903 1.0 0.06454 0.44984 0.66738 1.0000 + O O904 1.0 0.03329 0.48109 0.66738 1.0000 + O O905 1.0 0.00204 0.51234 0.66738 1.0000 + O O906 1.0 0.97079 0.54359 0.66738 1.0000 + O O907 1.0 0.93954 0.57484 0.66738 1.0000 + O O908 1.0 0.90829 0.60609 0.66738 1.0000 + O O909 1.0 0.87704 0.63734 0.66738 1.0000 + O O910 1.0 0.84579 0.66859 0.66738 1.0000 + O O911 1.0 0.81454 0.69984 0.66738 1.0000 + O O912 1.0 0.78329 0.73109 0.66738 1.0000 + O O913 1.0 0.28329 0.29359 0.66738 1.0000 + O O914 1.0 0.25204 0.32484 0.66738 1.0000 + O O915 1.0 0.22079 0.35609 0.66738 1.0000 + O O916 1.0 0.18954 0.38734 0.66738 1.0000 + O O917 1.0 0.15829 0.41859 0.66738 1.0000 + O O918 1.0 0.12704 0.44984 0.66738 1.0000 + O O919 1.0 0.09579 0.48109 0.66738 1.0000 + O O920 1.0 0.06454 0.51234 0.66738 1.0000 + O O921 1.0 0.03329 0.54359 0.66738 1.0000 + O O922 1.0 0.00204 0.57484 0.66738 1.0000 + O O923 1.0 0.97079 0.60609 0.66738 1.0000 + O O924 1.0 0.93954 0.63734 0.66738 1.0000 + O O925 1.0 0.90829 0.66859 0.66738 1.0000 + O O926 1.0 0.87704 0.69984 0.66738 1.0000 + O O927 1.0 0.84579 0.73109 0.66738 1.0000 + O O928 1.0 0.81454 0.76234 0.66738 1.0000 + O O929 1.0 0.31454 0.32484 0.66738 1.0000 + O O930 1.0 0.28329 0.35609 0.66738 1.0000 + O O931 1.0 0.25204 0.38734 0.66738 1.0000 + O O932 1.0 0.22079 0.41859 0.66738 1.0000 + O O933 1.0 0.18954 0.44984 0.66738 1.0000 + O O934 1.0 0.15829 0.48109 0.66738 1.0000 + O O935 1.0 0.12704 0.51234 0.66738 1.0000 + O O936 1.0 0.09579 0.54359 0.66738 1.0000 + O O937 1.0 0.06454 0.57484 0.66738 1.0000 + O O938 1.0 0.03329 0.60609 0.66738 1.0000 + O O939 1.0 0.00204 0.63734 0.66738 1.0000 + O O940 1.0 0.97079 0.66859 0.66738 1.0000 + O O941 1.0 0.93954 0.69984 0.66738 1.0000 + O O942 1.0 0.90829 0.73109 0.66738 1.0000 + O O943 1.0 0.87704 0.76234 0.66738 1.0000 + O O944 1.0 0.84579 0.79359 0.66738 1.0000 + O O945 1.0 0.34579 0.35609 0.66738 1.0000 + O O946 1.0 0.31454 0.38734 0.66738 1.0000 + O O947 1.0 0.28329 0.41859 0.66738 1.0000 + O O948 1.0 0.25204 0.44984 0.66738 1.0000 + O O949 1.0 0.22079 0.48109 0.66738 1.0000 + O O950 1.0 0.18954 0.51234 0.66738 1.0000 + O O951 1.0 0.15829 0.54359 0.66738 1.0000 + O O952 1.0 0.12704 0.57484 0.66738 1.0000 + O O953 1.0 0.09579 0.60609 0.66738 1.0000 + O O954 1.0 0.06454 0.63734 0.66738 1.0000 + O O955 1.0 0.03329 0.66859 0.66738 1.0000 + O O956 1.0 0.00204 0.69984 0.66738 1.0000 + O O957 1.0 0.97079 0.73109 0.66738 1.0000 + O O958 1.0 0.93954 0.76234 0.66738 1.0000 + O O959 1.0 0.90829 0.79359 0.66738 1.0000 + O O960 1.0 0.87704 0.82484 0.66738 1.0000 + O O961 1.0 0.37704 0.38734 0.66738 1.0000 + O O962 1.0 0.34579 0.41859 0.66738 1.0000 + O O963 1.0 0.31454 0.44984 0.66738 1.0000 + O O964 1.0 0.28329 0.48109 0.66738 1.0000 + O O965 1.0 0.25204 0.51234 0.66738 1.0000 + O O966 1.0 0.22079 0.54359 0.66738 1.0000 + O O967 1.0 0.18954 0.57484 0.66738 1.0000 + O O968 1.0 0.15829 0.60609 0.66738 1.0000 + O O969 1.0 0.12704 0.63734 0.66738 1.0000 + O O970 1.0 0.09579 0.66859 0.66738 1.0000 + O O971 1.0 0.06454 0.69984 0.66738 1.0000 + O O972 1.0 0.03329 0.73109 0.66738 1.0000 + O O973 1.0 0.00204 0.76234 0.66738 1.0000 + O O974 1.0 0.97079 0.79359 0.66738 1.0000 + O O975 1.0 0.93954 0.82484 0.66738 1.0000 + O O976 1.0 0.90829 0.85609 0.66738 1.0000 + O O977 1.0 0.40829 0.41859 0.66738 1.0000 + O O978 1.0 0.37704 0.44984 0.66738 1.0000 + O O979 1.0 0.34579 0.48109 0.66738 1.0000 + O O980 1.0 0.31454 0.51234 0.66738 1.0000 + O O981 1.0 0.28329 0.54359 0.66738 1.0000 + O O982 1.0 0.25204 0.57484 0.66738 1.0000 + O O983 1.0 0.22079 0.60609 0.66738 1.0000 + O O984 1.0 0.18954 0.63734 0.66738 1.0000 + O O985 1.0 0.15829 0.66859 0.66738 1.0000 + O O986 1.0 0.12704 0.69984 0.66738 1.0000 + O O987 1.0 0.09579 0.73109 0.66738 1.0000 + O O988 1.0 0.06454 0.76234 0.66738 1.0000 + O O989 1.0 0.03329 0.79359 0.66738 1.0000 + O O990 1.0 0.00204 0.82484 0.66738 1.0000 + O O991 1.0 0.97079 0.85609 0.66738 1.0000 + O O992 1.0 0.93954 0.88734 0.66738 1.0000 + O O993 1.0 0.43954 0.44984 0.66738 1.0000 + O O994 1.0 0.40829 0.48109 0.66738 1.0000 + O O995 1.0 0.37704 0.51234 0.66738 1.0000 + O O996 1.0 0.34579 0.54359 0.66738 1.0000 + O O997 1.0 0.31454 0.57484 0.66738 1.0000 + O O998 1.0 0.28329 0.60609 0.66738 1.0000 + O O999 1.0 0.25204 0.63734 0.66738 1.0000 + O O1000 1.0 0.22079 0.66859 0.66738 1.0000 + O O1001 1.0 0.18954 0.69984 0.66738 1.0000 + O O1002 1.0 0.15829 0.73109 0.66738 1.0000 + O O1003 1.0 0.12704 0.76234 0.66738 1.0000 + O O1004 1.0 0.09579 0.79359 0.66738 1.0000 + O O1005 1.0 0.06454 0.82484 0.66738 1.0000 + O O1006 1.0 0.03329 0.85609 0.66738 1.0000 + O O1007 1.0 0.00204 0.88734 0.66738 1.0000 + O O1008 1.0 0.97079 0.91859 0.66738 1.0000 + O O1009 1.0 0.47079 0.48109 0.66738 1.0000 + O O1010 1.0 0.43954 0.51234 0.66738 1.0000 + O O1011 1.0 0.40829 0.54359 0.66738 1.0000 + O O1012 1.0 0.37704 0.57484 0.66738 1.0000 + O O1013 1.0 0.34579 0.60609 0.66738 1.0000 + O O1014 1.0 0.31454 0.63734 0.66738 1.0000 + O O1015 1.0 0.28329 0.66859 0.66738 1.0000 + O O1016 1.0 0.25204 0.69984 0.66738 1.0000 + O O1017 1.0 0.22079 0.73109 0.66738 1.0000 + O O1018 1.0 0.18954 0.76234 0.66738 1.0000 + O O1019 1.0 0.15829 0.79359 0.66738 1.0000 + O O1020 1.0 0.12704 0.82484 0.66738 1.0000 + O O1021 1.0 0.09579 0.85609 0.66738 1.0000 + O O1022 1.0 0.06454 0.88734 0.66738 1.0000 + O O1023 1.0 0.03329 0.91859 0.66738 1.0000 + O O1024 1.0 0.00204 0.94984 0.66738 1.0000 + Cd Cd513 1.0 0.48437 0.51562 0.35174 1.0000 + Cd Cd514 1.0 0.45312 0.54688 0.35174 1.0000 + Cd Cd515 1.0 0.42188 0.57812 0.35174 1.0000 + Cd Cd516 1.0 0.39062 0.60937 0.35174 1.0000 + Cd Cd517 1.0 0.35937 0.64062 0.35174 1.0000 + Cd Cd518 1.0 0.32812 0.67188 0.35174 1.0000 + Cd Cd519 1.0 0.29687 0.70313 0.35174 1.0000 + Cd Cd520 1.0 0.26562 0.73438 0.35174 1.0000 + Cd Cd521 1.0 0.23437 0.76562 0.35174 1.0000 + Cd Cd522 1.0 0.20312 0.79687 0.35174 1.0000 + Cd Cd523 1.0 0.17187 0.82813 0.35174 1.0000 + Cd Cd524 1.0 0.14062 0.85938 0.35174 1.0000 + Cd Cd525 1.0 0.10938 0.89063 0.35174 1.0000 + Cd Cd526 1.0 0.07812 0.92188 0.35174 1.0000 + Cd Cd527 1.0 0.04688 0.95312 0.35174 1.0000 + Cd Cd528 1.0 0.01563 0.98438 0.35174 1.0000 + Cd Cd529 1.0 0.51562 0.54688 0.35174 1.0000 + Cd Cd530 1.0 0.48437 0.57812 0.35174 1.0000 + Cd Cd531 1.0 0.45312 0.60937 0.35174 1.0000 + Cd Cd532 1.0 0.42187 0.64062 0.35174 1.0000 + Cd Cd533 1.0 0.39062 0.67188 0.35174 1.0000 + Cd Cd534 1.0 0.35938 0.70313 0.35174 1.0000 + Cd Cd535 1.0 0.32812 0.73438 0.35174 1.0000 + Cd Cd536 1.0 0.29687 0.76562 0.35174 1.0000 + Cd Cd537 1.0 0.26562 0.79687 0.35174 1.0000 + Cd Cd538 1.0 0.23438 0.82813 0.35174 1.0000 + Cd Cd539 1.0 0.20312 0.85938 0.35174 1.0000 + Cd Cd540 1.0 0.17187 0.89063 0.35174 1.0000 + Cd Cd541 1.0 0.14062 0.92187 0.35174 1.0000 + Cd Cd542 1.0 0.10937 0.95312 0.35174 1.0000 + Cd Cd543 1.0 0.07812 0.98438 0.35174 1.0000 + Cd Cd544 1.0 0.04687 0.01563 0.35174 1.0000 + Cd Cd545 1.0 0.54688 0.57812 0.35174 1.0000 + Cd Cd546 1.0 0.51562 0.60938 0.35174 1.0000 + Cd Cd547 1.0 0.48437 0.64062 0.35174 1.0000 + Cd Cd548 1.0 0.45312 0.67188 0.35174 1.0000 + Cd Cd549 1.0 0.42187 0.70312 0.35174 1.0000 + Cd Cd550 1.0 0.39062 0.73438 0.35174 1.0000 + Cd Cd551 1.0 0.35937 0.76562 0.35174 1.0000 + Cd Cd552 1.0 0.32813 0.79687 0.35174 1.0000 + Cd Cd553 1.0 0.29687 0.82813 0.35174 1.0000 + Cd Cd554 1.0 0.26562 0.85938 0.35174 1.0000 + Cd Cd555 1.0 0.23437 0.89063 0.35174 1.0000 + Cd Cd556 1.0 0.20312 0.92187 0.35174 1.0000 + Cd Cd557 1.0 0.17187 0.95312 0.35174 1.0000 + Cd Cd558 1.0 0.14062 0.98438 0.35174 1.0000 + Cd Cd559 1.0 0.10937 0.01563 0.35174 1.0000 + Cd Cd560 1.0 0.07813 0.04688 0.35174 1.0000 + Cd Cd561 1.0 0.57812 0.60938 0.35174 1.0000 + Cd Cd562 1.0 0.54687 0.64062 0.35174 1.0000 + Cd Cd563 1.0 0.51562 0.67188 0.35174 1.0000 + Cd Cd564 1.0 0.48437 0.70312 0.35174 1.0000 + Cd Cd565 1.0 0.45312 0.73438 0.35174 1.0000 + Cd Cd566 1.0 0.42187 0.76562 0.35174 1.0000 + Cd Cd567 1.0 0.39062 0.79687 0.35174 1.0000 + Cd Cd568 1.0 0.35938 0.82813 0.35174 1.0000 + Cd Cd569 1.0 0.32812 0.85937 0.35174 1.0000 + Cd Cd570 1.0 0.29687 0.89063 0.35174 1.0000 + Cd Cd571 1.0 0.26562 0.92187 0.35174 1.0000 + Cd Cd572 1.0 0.23438 0.95312 0.35174 1.0000 + Cd Cd573 1.0 0.20312 0.98438 0.35174 1.0000 + Cd Cd574 1.0 0.17187 0.01563 0.35174 1.0000 + Cd Cd575 1.0 0.14062 0.04687 0.35174 1.0000 + Cd Cd576 1.0 0.10937 0.07813 0.35174 1.0000 + Cd Cd577 1.0 0.60937 0.64062 0.35174 1.0000 + Cd Cd578 1.0 0.57812 0.67188 0.35174 1.0000 + Cd Cd579 1.0 0.54688 0.70312 0.35174 1.0000 + Cd Cd580 1.0 0.51562 0.73438 0.35174 1.0000 + Cd Cd581 1.0 0.48437 0.76562 0.35174 1.0000 + Cd Cd582 1.0 0.45312 0.79687 0.35174 1.0000 + Cd Cd583 1.0 0.42187 0.82813 0.35174 1.0000 + Cd Cd584 1.0 0.39062 0.85938 0.35174 1.0000 + Cd Cd585 1.0 0.35937 0.89063 0.35174 1.0000 + Cd Cd586 1.0 0.32812 0.92187 0.35174 1.0000 + Cd Cd587 1.0 0.29687 0.95312 0.35174 1.0000 + Cd Cd588 1.0 0.26562 0.98437 0.35174 1.0000 + Cd Cd589 1.0 0.23437 0.01563 0.35174 1.0000 + Cd Cd590 1.0 0.20312 0.04687 0.35174 1.0000 + Cd Cd591 1.0 0.17187 0.07813 0.35174 1.0000 + Cd Cd592 1.0 0.14062 0.10938 0.35174 1.0000 + Cd Cd593 1.0 0.64062 0.67188 0.35174 1.0000 + Cd Cd594 1.0 0.60937 0.70312 0.35174 1.0000 + Cd Cd595 1.0 0.57812 0.73438 0.35174 1.0000 + Cd Cd596 1.0 0.54688 0.76562 0.35174 1.0000 + Cd Cd597 1.0 0.51562 0.79687 0.35174 1.0000 + Cd Cd598 1.0 0.48437 0.82813 0.35174 1.0000 + Cd Cd599 1.0 0.45312 0.85938 0.35174 1.0000 + Cd Cd600 1.0 0.42187 0.89063 0.35174 1.0000 + Cd Cd601 1.0 0.39062 0.92188 0.35174 1.0000 + Cd Cd602 1.0 0.35938 0.95312 0.35174 1.0000 + Cd Cd603 1.0 0.32813 0.98438 0.35174 1.0000 + Cd Cd604 1.0 0.29687 0.01563 0.35174 1.0000 + Cd Cd605 1.0 0.26562 0.04688 0.35174 1.0000 + Cd Cd606 1.0 0.23437 0.07813 0.35174 1.0000 + Cd Cd607 1.0 0.20312 0.10938 0.35174 1.0000 + Cd Cd608 1.0 0.17187 0.14063 0.35174 1.0000 + Cd Cd609 1.0 0.67187 0.70312 0.35174 1.0000 + Cd Cd610 1.0 0.64062 0.73438 0.35174 1.0000 + Cd Cd611 1.0 0.60937 0.76562 0.35174 1.0000 + Cd Cd612 1.0 0.57812 0.79688 0.35174 1.0000 + Cd Cd613 1.0 0.54687 0.82813 0.35174 1.0000 + Cd Cd614 1.0 0.51562 0.85937 0.35174 1.0000 + Cd Cd615 1.0 0.48437 0.89063 0.35174 1.0000 + Cd Cd616 1.0 0.45312 0.92187 0.35174 1.0000 + Cd Cd617 1.0 0.42187 0.95312 0.35174 1.0000 + Cd Cd618 1.0 0.39062 0.98438 0.35174 1.0000 + Cd Cd619 1.0 0.35937 0.01563 0.35174 1.0000 + Cd Cd620 1.0 0.32813 0.04687 0.35174 1.0000 + Cd Cd621 1.0 0.29687 0.07813 0.35174 1.0000 + Cd Cd622 1.0 0.26562 0.10938 0.35174 1.0000 + Cd Cd623 1.0 0.23437 0.14063 0.35174 1.0000 + Cd Cd624 1.0 0.20312 0.17187 0.35174 1.0000 + Cd Cd625 1.0 0.70312 0.73438 0.35174 1.0000 + Cd Cd626 1.0 0.67187 0.76562 0.35174 1.0000 + Cd Cd627 1.0 0.64062 0.79687 0.35174 1.0000 + Cd Cd628 1.0 0.60937 0.82813 0.35174 1.0000 + Cd Cd629 1.0 0.57812 0.85937 0.35174 1.0000 + Cd Cd630 1.0 0.54688 0.89062 0.35174 1.0000 + Cd Cd631 1.0 0.51562 0.92188 0.35174 1.0000 + Cd Cd632 1.0 0.48437 0.95312 0.35174 1.0000 + Cd Cd633 1.0 0.45312 0.98438 0.35174 1.0000 + Cd Cd634 1.0 0.42187 0.01563 0.35174 1.0000 + Cd Cd635 1.0 0.39062 0.04687 0.35174 1.0000 + Cd Cd636 1.0 0.35937 0.07812 0.35174 1.0000 + Cd Cd637 1.0 0.32812 0.10938 0.35174 1.0000 + Cd Cd638 1.0 0.29687 0.14063 0.35174 1.0000 + Cd Cd639 1.0 0.26562 0.17187 0.35174 1.0000 + Cd Cd640 1.0 0.23438 0.20312 0.35174 1.0000 + Cd Cd641 1.0 0.73437 0.76562 0.35174 1.0000 + Cd Cd642 1.0 0.70312 0.79687 0.35174 1.0000 + Cd Cd643 1.0 0.67187 0.82813 0.35174 1.0000 + Cd Cd644 1.0 0.64062 0.85938 0.35174 1.0000 + Cd Cd645 1.0 0.60937 0.89062 0.35174 1.0000 + Cd Cd646 1.0 0.57812 0.92187 0.35174 1.0000 + Cd Cd647 1.0 0.54687 0.95312 0.35174 1.0000 + Cd Cd648 1.0 0.51562 0.98438 0.35174 1.0000 + Cd Cd649 1.0 0.48437 0.01563 0.35174 1.0000 + Cd Cd650 1.0 0.45312 0.04687 0.35174 1.0000 + Cd Cd651 1.0 0.42187 0.07812 0.35174 1.0000 + Cd Cd652 1.0 0.39062 0.10938 0.35174 1.0000 + Cd Cd653 1.0 0.35938 0.14063 0.35174 1.0000 + Cd Cd654 1.0 0.32813 0.17187 0.35174 1.0000 + Cd Cd655 1.0 0.29687 0.20312 0.35174 1.0000 + Cd Cd656 1.0 0.26562 0.23438 0.35174 1.0000 + Cd Cd657 1.0 0.76562 0.79687 0.35174 1.0000 + Cd Cd658 1.0 0.73437 0.82813 0.35174 1.0000 + Cd Cd659 1.0 0.70312 0.85938 0.35174 1.0000 + Cd Cd660 1.0 0.67187 0.89063 0.35174 1.0000 + Cd Cd661 1.0 0.64062 0.92187 0.35174 1.0000 + Cd Cd662 1.0 0.60937 0.95312 0.35174 1.0000 + Cd Cd663 1.0 0.57812 0.98438 0.35174 1.0000 + Cd Cd664 1.0 0.54687 0.01563 0.35174 1.0000 + Cd Cd665 1.0 0.51562 0.04687 0.35174 1.0000 + Cd Cd666 1.0 0.48437 0.07813 0.35174 1.0000 + Cd Cd667 1.0 0.45312 0.10938 0.35174 1.0000 + Cd Cd668 1.0 0.42187 0.14062 0.35174 1.0000 + Cd Cd669 1.0 0.39062 0.17187 0.35174 1.0000 + Cd Cd670 1.0 0.35938 0.20313 0.35174 1.0000 + Cd Cd671 1.0 0.32812 0.23438 0.35174 1.0000 + Cd Cd672 1.0 0.29687 0.26562 0.35174 1.0000 + Cd Cd673 1.0 0.79687 0.82813 0.35174 1.0000 + Cd Cd674 1.0 0.76562 0.85938 0.35174 1.0000 + Cd Cd675 1.0 0.73437 0.89063 0.35174 1.0000 + Cd Cd676 1.0 0.70312 0.92188 0.35174 1.0000 + Cd Cd677 1.0 0.67187 0.95312 0.35174 1.0000 + Cd Cd678 1.0 0.64062 0.98438 0.35174 1.0000 + Cd Cd679 1.0 0.60937 0.01563 0.35174 1.0000 + Cd Cd680 1.0 0.57812 0.04688 0.35174 1.0000 + Cd Cd681 1.0 0.54688 0.07813 0.35174 1.0000 + Cd Cd682 1.0 0.51562 0.10938 0.35174 1.0000 + Cd Cd683 1.0 0.48437 0.14062 0.35174 1.0000 + Cd Cd684 1.0 0.45312 0.17188 0.35174 1.0000 + Cd Cd685 1.0 0.42187 0.20312 0.35174 1.0000 + Cd Cd686 1.0 0.39062 0.23438 0.35174 1.0000 + Cd Cd687 1.0 0.35938 0.26563 0.35174 1.0000 + Cd Cd688 1.0 0.32812 0.29688 0.35174 1.0000 + Cd Cd689 1.0 0.82812 0.85937 0.35174 1.0000 + Cd Cd690 1.0 0.79687 0.89063 0.35174 1.0000 + Cd Cd691 1.0 0.76562 0.92187 0.35174 1.0000 + Cd Cd692 1.0 0.73437 0.95312 0.35174 1.0000 + Cd Cd693 1.0 0.70312 0.98437 0.35174 1.0000 + Cd Cd694 1.0 0.67187 0.01563 0.35174 1.0000 + Cd Cd695 1.0 0.64062 0.04688 0.35174 1.0000 + Cd Cd696 1.0 0.60937 0.07812 0.35174 1.0000 + Cd Cd697 1.0 0.57812 0.10938 0.35174 1.0000 + Cd Cd698 1.0 0.54687 0.14062 0.35174 1.0000 + Cd Cd699 1.0 0.51562 0.17187 0.35174 1.0000 + Cd Cd700 1.0 0.48437 0.20313 0.35174 1.0000 + Cd Cd701 1.0 0.45312 0.23437 0.35174 1.0000 + Cd Cd702 1.0 0.42187 0.26562 0.35174 1.0000 + Cd Cd703 1.0 0.39062 0.29688 0.35174 1.0000 + Cd Cd704 1.0 0.35937 0.32813 0.35174 1.0000 + Cd Cd705 1.0 0.85937 0.89062 0.35174 1.0000 + Cd Cd706 1.0 0.82812 0.92187 0.35174 1.0000 + Cd Cd707 1.0 0.79687 0.95312 0.35174 1.0000 + Cd Cd708 1.0 0.76562 0.98438 0.35174 1.0000 + Cd Cd709 1.0 0.73437 0.01562 0.35174 1.0000 + Cd Cd710 1.0 0.70312 0.04687 0.35174 1.0000 + Cd Cd711 1.0 0.67187 0.07813 0.35174 1.0000 + Cd Cd712 1.0 0.64062 0.10937 0.35174 1.0000 + Cd Cd713 1.0 0.60937 0.14062 0.35174 1.0000 + Cd Cd714 1.0 0.57812 0.17187 0.35174 1.0000 + Cd Cd715 1.0 0.54688 0.20312 0.35174 1.0000 + Cd Cd716 1.0 0.51562 0.23438 0.35174 1.0000 + Cd Cd717 1.0 0.48437 0.26562 0.35174 1.0000 + Cd Cd718 1.0 0.45312 0.29688 0.35174 1.0000 + Cd Cd719 1.0 0.42187 0.32812 0.35174 1.0000 + Cd Cd720 1.0 0.39062 0.35938 0.35174 1.0000 + Cd Cd721 1.0 0.89062 0.92187 0.35174 1.0000 + Cd Cd722 1.0 0.85937 0.95312 0.35174 1.0000 + Cd Cd723 1.0 0.82812 0.98438 0.35174 1.0000 + Cd Cd724 1.0 0.79687 0.01563 0.35174 1.0000 + Cd Cd725 1.0 0.76562 0.04688 0.35174 1.0000 + Cd Cd726 1.0 0.73437 0.07813 0.35174 1.0000 + Cd Cd727 1.0 0.70312 0.10938 0.35174 1.0000 + Cd Cd728 1.0 0.67187 0.14063 0.35174 1.0000 + Cd Cd729 1.0 0.64062 0.17187 0.35174 1.0000 + Cd Cd730 1.0 0.60937 0.20313 0.35174 1.0000 + Cd Cd731 1.0 0.57812 0.23438 0.35174 1.0000 + Cd Cd732 1.0 0.54688 0.26562 0.35174 1.0000 + Cd Cd733 1.0 0.51562 0.29688 0.35174 1.0000 + Cd Cd734 1.0 0.48437 0.32813 0.35174 1.0000 + Cd Cd735 1.0 0.45312 0.35938 0.35174 1.0000 + Cd Cd736 1.0 0.42188 0.39063 0.35174 1.0000 + Cd Cd737 1.0 0.92187 0.95312 0.35174 1.0000 + Cd Cd738 1.0 0.89062 0.98437 0.35174 1.0000 + Cd Cd739 1.0 0.85937 0.01563 0.35174 1.0000 + Cd Cd740 1.0 0.82812 0.04687 0.35174 1.0000 + Cd Cd741 1.0 0.79687 0.07813 0.35174 1.0000 + Cd Cd742 1.0 0.76562 0.10938 0.35174 1.0000 + Cd Cd743 1.0 0.73437 0.14063 0.35174 1.0000 + Cd Cd744 1.0 0.70312 0.17187 0.35174 1.0000 + Cd Cd745 1.0 0.67187 0.20312 0.35174 1.0000 + Cd Cd746 1.0 0.64062 0.23437 0.35174 1.0000 + Cd Cd747 1.0 0.60937 0.26562 0.35174 1.0000 + Cd Cd748 1.0 0.57812 0.29688 0.35174 1.0000 + Cd Cd749 1.0 0.54688 0.32813 0.35174 1.0000 + Cd Cd750 1.0 0.51562 0.35938 0.35174 1.0000 + Cd Cd751 1.0 0.48437 0.39062 0.35174 1.0000 + Cd Cd752 1.0 0.45312 0.42187 0.35174 1.0000 + Cd Cd753 1.0 0.95312 0.98438 0.35174 1.0000 + Cd Cd754 1.0 0.92187 0.01562 0.35174 1.0000 + Cd Cd755 1.0 0.89062 0.04687 0.35174 1.0000 + Cd Cd756 1.0 0.85937 0.07812 0.35174 1.0000 + Cd Cd757 1.0 0.82812 0.10938 0.35174 1.0000 + Cd Cd758 1.0 0.79687 0.14062 0.35174 1.0000 + Cd Cd759 1.0 0.76562 0.17188 0.35174 1.0000 + Cd Cd760 1.0 0.73437 0.20313 0.35174 1.0000 + Cd Cd761 1.0 0.70312 0.23437 0.35174 1.0000 + Cd Cd762 1.0 0.67187 0.26562 0.35174 1.0000 + Cd Cd763 1.0 0.64062 0.29688 0.35174 1.0000 + Cd Cd764 1.0 0.60937 0.32813 0.35174 1.0000 + Cd Cd765 1.0 0.57812 0.35938 0.35174 1.0000 + Cd Cd766 1.0 0.54688 0.39062 0.35174 1.0000 + Cd Cd767 1.0 0.51562 0.42188 0.35174 1.0000 + Cd Cd768 1.0 0.48438 0.45313 0.35174 1.0000 + Cd Cd769 1.0 0.50000 0.53125 0.64826 1.0000 + Cd Cd770 1.0 0.46875 0.56250 0.64826 1.0000 + Cd Cd771 1.0 0.43750 0.59375 0.64826 1.0000 + Cd Cd772 1.0 0.40625 0.62500 0.64826 1.0000 + Cd Cd773 1.0 0.37500 0.65625 0.64826 1.0000 + Cd Cd774 1.0 0.34375 0.68750 0.64826 1.0000 + Cd Cd775 1.0 0.31250 0.71875 0.64826 1.0000 + Cd Cd776 1.0 0.28125 0.75000 0.64826 1.0000 + Cd Cd777 1.0 0.25000 0.78125 0.64826 1.0000 + Cd Cd778 1.0 0.21875 0.81250 0.64826 1.0000 + Cd Cd779 1.0 0.18750 0.84375 0.64826 1.0000 + Cd Cd780 1.0 0.15625 0.87500 0.64826 1.0000 + Cd Cd781 1.0 0.12500 0.90625 0.64826 1.0000 + Cd Cd782 1.0 0.09375 0.93750 0.64826 1.0000 + Cd Cd783 1.0 0.06250 0.96875 0.64826 1.0000 + Cd Cd784 1.0 0.03125 1.00000 0.64826 1.0000 + Cd Cd785 1.0 0.53125 0.56250 0.64826 1.0000 + Cd Cd786 1.0 0.50000 0.59375 0.64826 1.0000 + Cd Cd787 1.0 0.46875 0.62500 0.64826 1.0000 + Cd Cd788 1.0 0.43750 0.65625 0.64826 1.0000 + Cd Cd789 1.0 0.40625 0.68750 0.64826 1.0000 + Cd Cd790 1.0 0.37500 0.71875 0.64826 1.0000 + Cd Cd791 1.0 0.34375 0.75000 0.64826 1.0000 + Cd Cd792 1.0 0.31250 0.78125 0.64826 1.0000 + Cd Cd793 1.0 0.28125 0.81250 0.64826 1.0000 + Cd Cd794 1.0 0.25000 0.84375 0.64826 1.0000 + Cd Cd795 1.0 0.21875 0.87500 0.64826 1.0000 + Cd Cd796 1.0 0.18750 0.90625 0.64826 1.0000 + Cd Cd797 1.0 0.15625 0.93750 0.64826 1.0000 + Cd Cd798 1.0 0.12500 0.96875 0.64826 1.0000 + Cd Cd799 1.0 0.09375 1.00000 0.64826 1.0000 + Cd Cd800 1.0 0.06250 0.03125 0.64826 1.0000 + Cd Cd801 1.0 0.56250 0.59375 0.64826 1.0000 + Cd Cd802 1.0 0.53125 0.62500 0.64826 1.0000 + Cd Cd803 1.0 0.50000 0.65625 0.64826 1.0000 + Cd Cd804 1.0 0.46875 0.68750 0.64826 1.0000 + Cd Cd805 1.0 0.43750 0.71875 0.64826 1.0000 + Cd Cd806 1.0 0.40625 0.75000 0.64826 1.0000 + Cd Cd807 1.0 0.37500 0.78125 0.64826 1.0000 + Cd Cd808 1.0 0.34375 0.81250 0.64826 1.0000 + Cd Cd809 1.0 0.31250 0.84375 0.64826 1.0000 + Cd Cd810 1.0 0.28125 0.87500 0.64826 1.0000 + Cd Cd811 1.0 0.25000 0.90625 0.64826 1.0000 + Cd Cd812 1.0 0.21875 0.93750 0.64826 1.0000 + Cd Cd813 1.0 0.18750 0.96875 0.64826 1.0000 + Cd Cd814 1.0 0.15625 1.00000 0.64826 1.0000 + Cd Cd815 1.0 0.12500 0.03125 0.64826 1.0000 + Cd Cd816 1.0 0.09375 0.06250 0.64826 1.0000 + Cd Cd817 1.0 0.59375 0.62500 0.64826 1.0000 + Cd Cd818 1.0 0.56250 0.65625 0.64826 1.0000 + Cd Cd819 1.0 0.53125 0.68750 0.64826 1.0000 + Cd Cd820 1.0 0.50000 0.71875 0.64826 1.0000 + Cd Cd821 1.0 0.46875 0.75000 0.64826 1.0000 + Cd Cd822 1.0 0.43750 0.78125 0.64826 1.0000 + Cd Cd823 1.0 0.40625 0.81250 0.64826 1.0000 + Cd Cd824 1.0 0.37500 0.84375 0.64826 1.0000 + Cd Cd825 1.0 0.34375 0.87500 0.64826 1.0000 + Cd Cd826 1.0 0.31250 0.90625 0.64826 1.0000 + Cd Cd827 1.0 0.28125 0.93750 0.64826 1.0000 + Cd Cd828 1.0 0.25000 0.96875 0.64826 1.0000 + Cd Cd829 1.0 0.21875 1.00000 0.64826 1.0000 + Cd Cd830 1.0 0.18750 0.03125 0.64826 1.0000 + Cd Cd831 1.0 0.15625 0.06250 0.64826 1.0000 + Cd Cd832 1.0 0.12500 0.09375 0.64826 1.0000 + Cd Cd833 1.0 0.62500 0.65625 0.64826 1.0000 + Cd Cd834 1.0 0.59375 0.68750 0.64826 1.0000 + Cd Cd835 1.0 0.56250 0.71875 0.64826 1.0000 + Cd Cd836 1.0 0.53125 0.75000 0.64826 1.0000 + Cd Cd837 1.0 0.50000 0.78125 0.64826 1.0000 + Cd Cd838 1.0 0.46875 0.81250 0.64826 1.0000 + Cd Cd839 1.0 0.43750 0.84375 0.64826 1.0000 + Cd Cd840 1.0 0.40625 0.87500 0.64826 1.0000 + Cd Cd841 1.0 0.37500 0.90625 0.64826 1.0000 + Cd Cd842 1.0 0.34375 0.93750 0.64826 1.0000 + Cd Cd843 1.0 0.31250 0.96875 0.64826 1.0000 + Cd Cd844 1.0 0.28125 1.00000 0.64826 1.0000 + Cd Cd845 1.0 0.25000 0.03125 0.64826 1.0000 + Cd Cd846 1.0 0.21875 0.06250 0.64826 1.0000 + Cd Cd847 1.0 0.18750 0.09375 0.64826 1.0000 + Cd Cd848 1.0 0.15625 0.12500 0.64826 1.0000 + Cd Cd849 1.0 0.65625 0.68750 0.64826 1.0000 + Cd Cd850 1.0 0.62500 0.71875 0.64826 1.0000 + Cd Cd851 1.0 0.59375 0.75000 0.64826 1.0000 + Cd Cd852 1.0 0.56250 0.78125 0.64826 1.0000 + Cd Cd853 1.0 0.53125 0.81250 0.64826 1.0000 + Cd Cd854 1.0 0.50000 0.84375 0.64826 1.0000 + Cd Cd855 1.0 0.46875 0.87500 0.64826 1.0000 + Cd Cd856 1.0 0.43750 0.90625 0.64826 1.0000 + Cd Cd857 1.0 0.40625 0.93750 0.64826 1.0000 + Cd Cd858 1.0 0.37500 0.96875 0.64826 1.0000 + Cd Cd859 1.0 0.34375 1.00000 0.64826 1.0000 + Cd Cd860 1.0 0.31250 0.03125 0.64826 1.0000 + Cd Cd861 1.0 0.28125 0.06250 0.64826 1.0000 + Cd Cd862 1.0 0.25000 0.09375 0.64826 1.0000 + Cd Cd863 1.0 0.21875 0.12500 0.64826 1.0000 + Cd Cd864 1.0 0.18750 0.15625 0.64826 1.0000 + Cd Cd865 1.0 0.68750 0.71875 0.64826 1.0000 + Cd Cd866 1.0 0.65625 0.75000 0.64826 1.0000 + Cd Cd867 1.0 0.62500 0.78125 0.64826 1.0000 + Cd Cd868 1.0 0.59375 0.81250 0.64826 1.0000 + Cd Cd869 1.0 0.56250 0.84375 0.64826 1.0000 + Cd Cd870 1.0 0.53125 0.87500 0.64826 1.0000 + Cd Cd871 1.0 0.50000 0.90625 0.64826 1.0000 + Cd Cd872 1.0 0.46875 0.93750 0.64826 1.0000 + Cd Cd873 1.0 0.43750 0.96875 0.64826 1.0000 + Cd Cd874 1.0 0.40625 1.00000 0.64826 1.0000 + Cd Cd875 1.0 0.37500 0.03125 0.64826 1.0000 + Cd Cd876 1.0 0.34375 0.06250 0.64826 1.0000 + Cd Cd877 1.0 0.31250 0.09375 0.64826 1.0000 + Cd Cd878 1.0 0.28125 0.12500 0.64826 1.0000 + Cd Cd879 1.0 0.25000 0.15625 0.64826 1.0000 + Cd Cd880 1.0 0.21875 0.18750 0.64826 1.0000 + Cd Cd881 1.0 0.71875 0.75000 0.64826 1.0000 + Cd Cd882 1.0 0.68750 0.78125 0.64826 1.0000 + Cd Cd883 1.0 0.65625 0.81250 0.64826 1.0000 + Cd Cd884 1.0 0.62500 0.84375 0.64826 1.0000 + Cd Cd885 1.0 0.59375 0.87500 0.64826 1.0000 + Cd Cd886 1.0 0.56250 0.90625 0.64826 1.0000 + Cd Cd887 1.0 0.53125 0.93750 0.64826 1.0000 + Cd Cd888 1.0 0.50000 0.96875 0.64826 1.0000 + Cd Cd889 1.0 0.46875 1.00000 0.64826 1.0000 + Cd Cd890 1.0 0.43750 0.03125 0.64826 1.0000 + Cd Cd891 1.0 0.40625 0.06250 0.64826 1.0000 + Cd Cd892 1.0 0.37500 0.09375 0.64826 1.0000 + Cd Cd893 1.0 0.34375 0.12500 0.64826 1.0000 + Cd Cd894 1.0 0.31250 0.15625 0.64826 1.0000 + Cd Cd895 1.0 0.28125 0.18750 0.64826 1.0000 + Cd Cd896 1.0 0.25000 0.21875 0.64826 1.0000 + Cd Cd897 1.0 0.75000 0.78125 0.64826 1.0000 + Cd Cd898 1.0 0.71875 0.81250 0.64826 1.0000 + Cd Cd899 1.0 0.68750 0.84375 0.64826 1.0000 + Cd Cd900 1.0 0.65625 0.87500 0.64826 1.0000 + Cd Cd901 1.0 0.62500 0.90625 0.64826 1.0000 + Cd Cd902 1.0 0.59375 0.93750 0.64826 1.0000 + Cd Cd903 1.0 0.56250 0.96875 0.64826 1.0000 + Cd Cd904 1.0 0.53125 1.00000 0.64826 1.0000 + Cd Cd905 1.0 0.50000 0.03125 0.64826 1.0000 + Cd Cd906 1.0 0.46875 0.06250 0.64826 1.0000 + Cd Cd907 1.0 0.43750 0.09375 0.64826 1.0000 + Cd Cd908 1.0 0.40625 0.12500 0.64826 1.0000 + Cd Cd909 1.0 0.37500 0.15625 0.64826 1.0000 + Cd Cd910 1.0 0.34375 0.18750 0.64826 1.0000 + Cd Cd911 1.0 0.31250 0.21875 0.64826 1.0000 + Cd Cd912 1.0 0.28125 0.25000 0.64826 1.0000 + Cd Cd913 1.0 0.78125 0.81250 0.64826 1.0000 + Cd Cd914 1.0 0.75000 0.84375 0.64826 1.0000 + Cd Cd915 1.0 0.71875 0.87500 0.64826 1.0000 + Cd Cd916 1.0 0.68750 0.90625 0.64826 1.0000 + Cd Cd917 1.0 0.65625 0.93750 0.64826 1.0000 + Cd Cd918 1.0 0.62500 0.96875 0.64826 1.0000 + Cd Cd919 1.0 0.59375 1.00000 0.64826 1.0000 + Cd Cd920 1.0 0.56250 0.03125 0.64826 1.0000 + Cd Cd921 1.0 0.53125 0.06250 0.64826 1.0000 + Cd Cd922 1.0 0.50000 0.09375 0.64826 1.0000 + Cd Cd923 1.0 0.46875 0.12500 0.64826 1.0000 + Cd Cd924 1.0 0.43750 0.15625 0.64826 1.0000 + Cd Cd925 1.0 0.40625 0.18750 0.64826 1.0000 + Cd Cd926 1.0 0.37500 0.21875 0.64826 1.0000 + Cd Cd927 1.0 0.34375 0.25000 0.64826 1.0000 + Cd Cd928 1.0 0.31250 0.28125 0.64826 1.0000 + Cd Cd929 1.0 0.81250 0.84375 0.64826 1.0000 + Cd Cd930 1.0 0.78125 0.87500 0.64826 1.0000 + Cd Cd931 1.0 0.75000 0.90625 0.64826 1.0000 + Cd Cd932 1.0 0.71875 0.93750 0.64826 1.0000 + Cd Cd933 1.0 0.68750 0.96875 0.64826 1.0000 + Cd Cd934 1.0 0.65625 1.00000 0.64826 1.0000 + Cd Cd935 1.0 0.62500 0.03125 0.64826 1.0000 + Cd Cd936 1.0 0.59375 0.06250 0.64826 1.0000 + Cd Cd937 1.0 0.56250 0.09375 0.64826 1.0000 + Cd Cd938 1.0 0.53125 0.12500 0.64826 1.0000 + Cd Cd939 1.0 0.50000 0.15625 0.64826 1.0000 + Cd Cd940 1.0 0.46875 0.18750 0.64826 1.0000 + Cd Cd941 1.0 0.43750 0.21875 0.64826 1.0000 + Cd Cd942 1.0 0.40625 0.25000 0.64826 1.0000 + Cd Cd943 1.0 0.37500 0.28125 0.64826 1.0000 + Cd Cd944 1.0 0.34375 0.31250 0.64826 1.0000 + Cd Cd945 1.0 0.84375 0.87500 0.64826 1.0000 + Cd Cd946 1.0 0.81250 0.90625 0.64826 1.0000 + Cd Cd947 1.0 0.78125 0.93750 0.64826 1.0000 + Cd Cd948 1.0 0.75000 0.96875 0.64826 1.0000 + Cd Cd949 1.0 0.71875 1.00000 0.64826 1.0000 + Cd Cd950 1.0 0.68750 0.03125 0.64826 1.0000 + Cd Cd951 1.0 0.65625 0.06250 0.64826 1.0000 + Cd Cd952 1.0 0.62500 0.09375 0.64826 1.0000 + Cd Cd953 1.0 0.59375 0.12500 0.64826 1.0000 + Cd Cd954 1.0 0.56250 0.15625 0.64826 1.0000 + Cd Cd955 1.0 0.53125 0.18750 0.64826 1.0000 + Cd Cd956 1.0 0.50000 0.21875 0.64826 1.0000 + Cd Cd957 1.0 0.46875 0.25000 0.64826 1.0000 + Cd Cd958 1.0 0.43750 0.28125 0.64826 1.0000 + Cd Cd959 1.0 0.40625 0.31250 0.64826 1.0000 + Cd Cd960 1.0 0.37500 0.34375 0.64826 1.0000 + Cd Cd961 1.0 0.87500 0.90625 0.64826 1.0000 + Cd Cd962 1.0 0.84375 0.93750 0.64826 1.0000 + Cd Cd963 1.0 0.81250 0.96875 0.64826 1.0000 + Cd Cd964 1.0 0.78125 1.00000 0.64826 1.0000 + Cd Cd965 1.0 0.75000 0.03125 0.64826 1.0000 + Cd Cd966 1.0 0.71875 0.06250 0.64826 1.0000 + Cd Cd967 1.0 0.68750 0.09375 0.64826 1.0000 + Cd Cd968 1.0 0.65625 0.12500 0.64826 1.0000 + Cd Cd969 1.0 0.62500 0.15625 0.64826 1.0000 + Cd Cd970 1.0 0.59375 0.18750 0.64826 1.0000 + Cd Cd971 1.0 0.56250 0.21875 0.64826 1.0000 + Cd Cd972 1.0 0.53125 0.25000 0.64826 1.0000 + Cd Cd973 1.0 0.50000 0.28125 0.64826 1.0000 + Cd Cd974 1.0 0.46875 0.31250 0.64826 1.0000 + Cd Cd975 1.0 0.43750 0.34375 0.64826 1.0000 + Cd Cd976 1.0 0.40625 0.37500 0.64826 1.0000 + Cd Cd977 1.0 0.90625 0.93750 0.64826 1.0000 + Cd Cd978 1.0 0.87500 0.96875 0.64826 1.0000 + Cd Cd979 1.0 0.84375 1.00000 0.64826 1.0000 + Cd Cd980 1.0 0.81250 0.03125 0.64826 1.0000 + Cd Cd981 1.0 0.78125 0.06250 0.64826 1.0000 + Cd Cd982 1.0 0.75000 0.09375 0.64826 1.0000 + Cd Cd983 1.0 0.71875 0.12500 0.64826 1.0000 + Cd Cd984 1.0 0.68750 0.15625 0.64826 1.0000 + Cd Cd985 1.0 0.65625 0.18750 0.64826 1.0000 + Cd Cd986 1.0 0.62500 0.21875 0.64826 1.0000 + Cd Cd987 1.0 0.59375 0.25000 0.64826 1.0000 + Cd Cd988 1.0 0.56250 0.28125 0.64826 1.0000 + Cd Cd989 1.0 0.53125 0.31250 0.64826 1.0000 + Cd Cd990 1.0 0.50000 0.34375 0.64826 1.0000 + Cd Cd991 1.0 0.46875 0.37500 0.64826 1.0000 + Cd Cd992 1.0 0.43750 0.40625 0.64826 1.0000 + Cd Cd993 1.0 0.93750 0.96875 0.64826 1.0000 + Cd Cd994 1.0 0.90625 1.00000 0.64826 1.0000 + Cd Cd995 1.0 0.87500 0.03125 0.64826 1.0000 + Cd Cd996 1.0 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Si Si488 1.0 0.71875 0.15625 0.50000 1.0000 + Si Si489 1.0 0.68750 0.18750 0.50000 1.0000 + Si Si490 1.0 0.65625 0.21875 0.50000 1.0000 + Si Si491 1.0 0.62500 0.25000 0.50000 1.0000 + Si Si492 1.0 0.59375 0.28125 0.50000 1.0000 + Si Si493 1.0 0.56250 0.31250 0.50000 1.0000 + Si Si494 1.0 0.53125 0.34375 0.50000 1.0000 + Si Si495 1.0 0.50000 0.37500 0.50000 1.0000 + Si Si496 1.0 0.46875 0.40625 0.50000 1.0000 + Si Si497 1.0 0.96875 0.96875 0.50000 1.0000 + Si Si498 1.0 0.93750 1.00000 0.50000 1.0000 + Si Si499 1.0 0.90625 0.03125 0.50000 1.0000 + Si Si500 1.0 0.87500 0.06250 0.50000 1.0000 + Si Si501 1.0 0.84375 0.09375 0.50000 1.0000 + Si Si502 1.0 0.81250 0.12500 0.50000 1.0000 + Si Si503 1.0 0.78125 0.15625 0.50000 1.0000 + Si Si504 1.0 0.75000 0.18750 0.50000 1.0000 + Si Si505 1.0 0.71875 0.21875 0.50000 1.0000 + Si Si506 1.0 0.68750 0.25000 0.50000 1.0000 + Si Si507 1.0 0.65625 0.28125 0.50000 1.0000 + Si Si508 1.0 0.62500 0.31250 0.50000 1.0000 + Si Si509 1.0 0.59375 0.34375 0.50000 1.0000 + Si Si510 1.0 0.56250 0.37500 0.50000 1.0000 + Si Si511 1.0 0.53125 0.40625 0.50000 1.0000 + Si Si512 1.0 0.50000 0.43750 0.50000 1.0000 + O O1025 1.0 0.49796 0.55016 0.66738 1.0000 + O O1026 1.0 0.46671 0.58141 0.66738 1.0000 + O O1027 1.0 0.43546 0.61266 0.66738 1.0000 + O O1028 1.0 0.40421 0.64391 0.66738 1.0000 + O O1029 1.0 0.37296 0.67516 0.66738 1.0000 + O O1030 1.0 0.34171 0.70641 0.66738 1.0000 + O O1031 1.0 0.31046 0.73766 0.66738 1.0000 + O O1032 1.0 0.27921 0.76891 0.66738 1.0000 + O O1033 1.0 0.24796 0.80016 0.66738 1.0000 + O O1034 1.0 0.21671 0.83141 0.66738 1.0000 + O O1035 1.0 0.18546 0.86266 0.66738 1.0000 + O O1036 1.0 0.15421 0.89391 0.66738 1.0000 + O O1037 1.0 0.12296 0.92516 0.66738 1.0000 + O O1038 1.0 0.09171 0.95641 0.66738 1.0000 + O O1039 1.0 0.06046 0.98766 0.66738 1.0000 + O O1040 1.0 0.02921 0.01891 0.66738 1.0000 + O O1041 1.0 0.52921 0.58141 0.66738 1.0000 + O O1042 1.0 0.49796 0.61266 0.66738 1.0000 + O O1043 1.0 0.46671 0.64391 0.66738 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O1066 1.0 0.27921 0.89391 0.66738 1.0000 + O O1067 1.0 0.24796 0.92516 0.66738 1.0000 + O O1068 1.0 0.21671 0.95641 0.66738 1.0000 + O O1069 1.0 0.18546 0.98766 0.66738 1.0000 + O O1070 1.0 0.15421 0.01891 0.66738 1.0000 + O O1071 1.0 0.12296 0.05016 0.66738 1.0000 + O O1072 1.0 0.09171 0.08141 0.66738 1.0000 + O O1073 1.0 0.59171 0.64391 0.66738 1.0000 + O O1074 1.0 0.56046 0.67516 0.66738 1.0000 + O O1075 1.0 0.52921 0.70641 0.66738 1.0000 + O O1076 1.0 0.49796 0.73766 0.66738 1.0000 + O O1077 1.0 0.46671 0.76891 0.66738 1.0000 + O O1078 1.0 0.43546 0.80016 0.66738 1.0000 + O O1079 1.0 0.40421 0.83141 0.66738 1.0000 + O O1080 1.0 0.37296 0.86266 0.66738 1.0000 + O O1081 1.0 0.34171 0.89391 0.66738 1.0000 + O O1082 1.0 0.31046 0.92516 0.66738 1.0000 + O O1083 1.0 0.27921 0.95641 0.66738 1.0000 + O O1084 1.0 0.24796 0.98766 0.66738 1.0000 + O O1085 1.0 0.21671 0.01891 0.66738 1.0000 + O O1086 1.0 0.18546 0.05016 0.66738 1.0000 + O O1087 1.0 0.15421 0.08141 0.66738 1.0000 + O O1088 1.0 0.12296 0.11266 0.66738 1.0000 + O O1089 1.0 0.62296 0.67516 0.66738 1.0000 + O O1090 1.0 0.59171 0.70641 0.66738 1.0000 + O O1091 1.0 0.56046 0.73766 0.66738 1.0000 + O O1092 1.0 0.52921 0.76891 0.66738 1.0000 + O O1093 1.0 0.49796 0.80016 0.66738 1.0000 + O O1094 1.0 0.46671 0.83141 0.66738 1.0000 + O O1095 1.0 0.43546 0.86266 0.66738 1.0000 + O O1096 1.0 0.40421 0.89391 0.66738 1.0000 + O O1097 1.0 0.37296 0.92516 0.66738 1.0000 + O O1098 1.0 0.34171 0.95641 0.66738 1.0000 + O O1099 1.0 0.31046 0.98766 0.66738 1.0000 + O O1100 1.0 0.27921 0.01891 0.66738 1.0000 + O O1101 1.0 0.24796 0.05016 0.66738 1.0000 + O O1102 1.0 0.21671 0.08141 0.66738 1.0000 + O O1103 1.0 0.18546 0.11266 0.66738 1.0000 + O O1104 1.0 0.15421 0.14391 0.66738 1.0000 + O O1105 1.0 0.65421 0.70641 0.66738 1.0000 + O O1106 1.0 0.62296 0.73766 0.66738 1.0000 + O O1107 1.0 0.59171 0.76891 0.66738 1.0000 + O O1108 1.0 0.56046 0.80016 0.66738 1.0000 + O O1109 1.0 0.52921 0.83141 0.66738 1.0000 + O O1110 1.0 0.49796 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O1177 1.0 0.52921 0.08141 0.66738 1.0000 + O O1178 1.0 0.49796 0.11266 0.66738 1.0000 + O O1179 1.0 0.46671 0.14391 0.66738 1.0000 + O O1180 1.0 0.43546 0.17516 0.66738 1.0000 + O O1181 1.0 0.40421 0.20641 0.66738 1.0000 + O O1182 1.0 0.37296 0.23766 0.66738 1.0000 + O O1183 1.0 0.34171 0.26891 0.66738 1.0000 + O O1184 1.0 0.31046 0.30016 0.66738 1.0000 + O O1185 1.0 0.81046 0.86266 0.66738 1.0000 + O O1186 1.0 0.77921 0.89391 0.66738 1.0000 + O O1187 1.0 0.74796 0.92516 0.66738 1.0000 + O O1188 1.0 0.71671 0.95641 0.66738 1.0000 + O O1189 1.0 0.68546 0.98766 0.66738 1.0000 + O O1190 1.0 0.65421 0.01891 0.66738 1.0000 + O O1191 1.0 0.62296 0.05016 0.66738 1.0000 + O O1192 1.0 0.59171 0.08141 0.66738 1.0000 + O O1193 1.0 0.56046 0.11266 0.66738 1.0000 + O O1194 1.0 0.52921 0.14391 0.66738 1.0000 + O O1195 1.0 0.49796 0.17516 0.66738 1.0000 + O O1196 1.0 0.46671 0.20641 0.66738 1.0000 + O O1197 1.0 0.43546 0.23766 0.66738 1.0000 + O O1198 1.0 0.40421 0.26891 0.66738 1.0000 + O O1199 1.0 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O1843 1.0 0.53329 0.66859 0.66738 1.0000 + O O1844 1.0 0.50204 0.69984 0.66738 1.0000 + O O1845 1.0 0.47079 0.73109 0.66738 1.0000 + O O1846 1.0 0.43954 0.76234 0.66738 1.0000 + O O1847 1.0 0.40829 0.79359 0.66738 1.0000 + O O1848 1.0 0.37704 0.82484 0.66738 1.0000 + O O1849 1.0 0.34579 0.85609 0.66738 1.0000 + O O1850 1.0 0.31454 0.88734 0.66738 1.0000 + O O1851 1.0 0.28329 0.91859 0.66738 1.0000 + O O1852 1.0 0.25204 0.94984 0.66738 1.0000 + O O1853 1.0 0.22079 0.98109 0.66738 1.0000 + O O1854 1.0 0.18954 0.01234 0.66738 1.0000 + O O1855 1.0 0.15829 0.04359 0.66738 1.0000 + O O1856 1.0 0.12704 0.07484 0.66738 1.0000 + O O1857 1.0 0.62704 0.63734 0.66738 1.0000 + O O1858 1.0 0.59579 0.66859 0.66738 1.0000 + O O1859 1.0 0.56454 0.69984 0.66738 1.0000 + O O1860 1.0 0.53329 0.73109 0.66738 1.0000 + O O1861 1.0 0.50204 0.76234 0.66738 1.0000 + O O1862 1.0 0.47079 0.79359 0.66738 1.0000 + O O1863 1.0 0.43954 0.82484 0.66738 1.0000 + O O1864 1.0 0.40829 0.85609 0.66738 1.0000 + O O1865 1.0 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0.10609 0.66738 1.0000 + O O1888 1.0 0.18954 0.13734 0.66738 1.0000 + O O1889 1.0 0.68954 0.69984 0.66738 1.0000 + O O1890 1.0 0.65829 0.73109 0.66738 1.0000 + O O1891 1.0 0.62704 0.76234 0.66738 1.0000 + O O1892 1.0 0.59579 0.79359 0.66738 1.0000 + O O1893 1.0 0.56454 0.82484 0.66738 1.0000 + O O1894 1.0 0.53329 0.85609 0.66738 1.0000 + O O1895 1.0 0.50204 0.88734 0.66738 1.0000 + O O1896 1.0 0.47079 0.91859 0.66738 1.0000 + O O1897 1.0 0.43954 0.94984 0.66738 1.0000 + O O1898 1.0 0.40829 0.98109 0.66738 1.0000 + O O1899 1.0 0.37704 0.01234 0.66738 1.0000 + O O1900 1.0 0.34579 0.04359 0.66738 1.0000 + O O1901 1.0 0.31454 0.07484 0.66738 1.0000 + O O1902 1.0 0.28329 0.10609 0.66738 1.0000 + O O1903 1.0 0.25204 0.13734 0.66738 1.0000 + O O1904 1.0 0.22079 0.16859 0.66738 1.0000 + O O1905 1.0 0.72079 0.73109 0.66738 1.0000 + O O1906 1.0 0.68954 0.76234 0.66738 1.0000 + O O1907 1.0 0.65829 0.79359 0.66738 1.0000 + O O1908 1.0 0.62704 0.82484 0.66738 1.0000 + O O1909 1.0 0.59579 0.85609 0.66738 1.0000 + O O1910 1.0 0.56454 0.88734 0.66738 1.0000 + O O1911 1.0 0.53329 0.91859 0.66738 1.0000 + O O1912 1.0 0.50204 0.94984 0.66738 1.0000 + O O1913 1.0 0.47079 0.98109 0.66738 1.0000 + O O1914 1.0 0.43954 0.01234 0.66738 1.0000 + O O1915 1.0 0.40829 0.04359 0.66738 1.0000 + O O1916 1.0 0.37704 0.07484 0.66738 1.0000 + O O1917 1.0 0.34579 0.10609 0.66738 1.0000 + O O1918 1.0 0.31454 0.13734 0.66738 1.0000 + O O1919 1.0 0.28329 0.16859 0.66738 1.0000 + O O1920 1.0 0.25204 0.19984 0.66738 1.0000 + O O1921 1.0 0.75204 0.76234 0.66738 1.0000 + O O1922 1.0 0.72079 0.79359 0.66738 1.0000 + O O1923 1.0 0.68954 0.82484 0.66738 1.0000 + O O1924 1.0 0.65829 0.85609 0.66738 1.0000 + O O1925 1.0 0.62704 0.88734 0.66738 1.0000 + O O1926 1.0 0.59579 0.91859 0.66738 1.0000 + O O1927 1.0 0.56454 0.94984 0.66738 1.0000 + O O1928 1.0 0.53329 0.98109 0.66738 1.0000 + O O1929 1.0 0.50204 0.01234 0.66738 1.0000 + O O1930 1.0 0.47079 0.04359 0.66738 1.0000 + O O1931 1.0 0.43954 0.07484 0.66738 1.0000 + O O1932 1.0 0.40829 0.10609 0.66738 1.0000 + O O1933 1.0 0.37704 0.13734 0.66738 1.0000 + O O1934 1.0 0.34579 0.16859 0.66738 1.0000 + O O1935 1.0 0.31454 0.19984 0.66738 1.0000 + O O1936 1.0 0.28329 0.23109 0.66738 1.0000 + O O1937 1.0 0.78329 0.79359 0.66738 1.0000 + O O1938 1.0 0.75204 0.82484 0.66738 1.0000 + O O1939 1.0 0.72079 0.85609 0.66738 1.0000 + O O1940 1.0 0.68954 0.88734 0.66738 1.0000 + O O1941 1.0 0.65829 0.91859 0.66738 1.0000 + O O1942 1.0 0.62704 0.94984 0.66738 1.0000 + O O1943 1.0 0.59579 0.98109 0.66738 1.0000 + O O1944 1.0 0.56454 0.01234 0.66738 1.0000 + O O1945 1.0 0.53329 0.04359 0.66738 1.0000 + O O1946 1.0 0.50204 0.07484 0.66738 1.0000 + O O1947 1.0 0.47079 0.10609 0.66738 1.0000 + O O1948 1.0 0.43954 0.13734 0.66738 1.0000 + O O1949 1.0 0.40829 0.16859 0.66738 1.0000 + O O1950 1.0 0.37704 0.19984 0.66738 1.0000 + O O1951 1.0 0.34579 0.23109 0.66738 1.0000 + O O1952 1.0 0.31454 0.26234 0.66738 1.0000 + O O1953 1.0 0.81454 0.82484 0.66738 1.0000 + O O1954 1.0 0.78329 0.85609 0.66738 1.0000 + O O1955 1.0 0.75204 0.88734 0.66738 1.0000 + O O1956 1.0 0.72079 0.91859 0.66738 1.0000 + O O1957 1.0 0.68954 0.94984 0.66738 1.0000 + O O1958 1.0 0.65829 0.98109 0.66738 1.0000 + O O1959 1.0 0.62704 0.01234 0.66738 1.0000 + O O1960 1.0 0.59579 0.04359 0.66738 1.0000 + O O1961 1.0 0.56454 0.07484 0.66738 1.0000 + O O1962 1.0 0.53329 0.10609 0.66738 1.0000 + O O1963 1.0 0.50204 0.13734 0.66738 1.0000 + O O1964 1.0 0.47079 0.16859 0.66738 1.0000 + O O1965 1.0 0.43954 0.19984 0.66738 1.0000 + O O1966 1.0 0.40829 0.23109 0.66738 1.0000 + O O1967 1.0 0.37704 0.26234 0.66738 1.0000 + O O1968 1.0 0.34579 0.29359 0.66738 1.0000 + O O1969 1.0 0.84579 0.85609 0.66738 1.0000 + O O1970 1.0 0.81454 0.88734 0.66738 1.0000 + O O1971 1.0 0.78329 0.91859 0.66738 1.0000 + O O1972 1.0 0.75204 0.94984 0.66738 1.0000 + O O1973 1.0 0.72079 0.98109 0.66738 1.0000 + O O1974 1.0 0.68954 0.01234 0.66738 1.0000 + O O1975 1.0 0.65829 0.04359 0.66738 1.0000 + O O1976 1.0 0.62704 0.07484 0.66738 1.0000 + O O1977 1.0 0.59579 0.10609 0.66738 1.0000 + O O1978 1.0 0.56454 0.13734 0.66738 1.0000 + O O1979 1.0 0.53329 0.16859 0.66738 1.0000 + O O1980 1.0 0.50204 0.19984 0.66738 1.0000 + O O1981 1.0 0.47079 0.23109 0.66738 1.0000 + O O1982 1.0 0.43954 0.26234 0.66738 1.0000 + O O1983 1.0 0.40829 0.29359 0.66738 1.0000 + O O1984 1.0 0.37704 0.32484 0.66738 1.0000 + O O1985 1.0 0.87704 0.88734 0.66738 1.0000 + O O1986 1.0 0.84579 0.91859 0.66738 1.0000 + O O1987 1.0 0.81454 0.94984 0.66738 1.0000 + O O1988 1.0 0.78329 0.98109 0.66738 1.0000 + O O1989 1.0 0.75204 0.01234 0.66738 1.0000 + O O1990 1.0 0.72079 0.04359 0.66738 1.0000 + O O1991 1.0 0.68954 0.07484 0.66738 1.0000 + O O1992 1.0 0.65829 0.10609 0.66738 1.0000 + O O1993 1.0 0.62704 0.13734 0.66738 1.0000 + O O1994 1.0 0.59579 0.16859 0.66738 1.0000 + O O1995 1.0 0.56454 0.19984 0.66738 1.0000 + O O1996 1.0 0.53329 0.23109 0.66738 1.0000 + O O1997 1.0 0.50204 0.26234 0.66738 1.0000 + O O1998 1.0 0.47079 0.29359 0.66738 1.0000 + O O1999 1.0 0.43954 0.32484 0.66738 1.0000 + O O2000 1.0 0.40829 0.35609 0.66738 1.0000 + O O2001 1.0 0.90829 0.91859 0.66738 1.0000 + O O2002 1.0 0.87704 0.94984 0.66738 1.0000 + O O2003 1.0 0.84579 0.98109 0.66738 1.0000 + O O2004 1.0 0.81454 0.01234 0.66738 1.0000 + O O2005 1.0 0.78329 0.04359 0.66738 1.0000 + O O2006 1.0 0.75204 0.07484 0.66738 1.0000 + O O2007 1.0 0.72079 0.10609 0.66738 1.0000 + O O2008 1.0 0.68954 0.13734 0.66738 1.0000 + O O2009 1.0 0.65829 0.16859 0.66738 1.0000 + O O2010 1.0 0.62704 0.19984 0.66738 1.0000 + O O2011 1.0 0.59579 0.23109 0.66738 1.0000 + O O2012 1.0 0.56454 0.26234 0.66738 1.0000 + O O2013 1.0 0.53329 0.29359 0.66738 1.0000 + O O2014 1.0 0.50204 0.32484 0.66738 1.0000 + O O2015 1.0 0.47079 0.35609 0.66738 1.0000 + O O2016 1.0 0.43954 0.38734 0.66738 1.0000 + O O2017 1.0 0.93954 0.94984 0.66738 1.0000 + O O2018 1.0 0.90829 0.98109 0.66738 1.0000 + O O2019 1.0 0.87704 0.01234 0.66738 1.0000 + O O2020 1.0 0.84579 0.04359 0.66738 1.0000 + O O2021 1.0 0.81454 0.07484 0.66738 1.0000 + O O2022 1.0 0.78329 0.10609 0.66738 1.0000 + O O2023 1.0 0.75204 0.13734 0.66738 1.0000 + O O2024 1.0 0.72079 0.16859 0.66738 1.0000 + O O2025 1.0 0.68954 0.19984 0.66738 1.0000 + O O2026 1.0 0.65829 0.23109 0.66738 1.0000 + O O2027 1.0 0.62704 0.26234 0.66738 1.0000 + O O2028 1.0 0.59579 0.29359 0.66738 1.0000 + O O2029 1.0 0.56454 0.32484 0.66738 1.0000 + O O2030 1.0 0.53329 0.35609 0.66738 1.0000 + O O2031 1.0 0.50204 0.38734 0.66738 1.0000 + O O2032 1.0 0.47079 0.41859 0.66738 1.0000 + O O2033 1.0 0.97079 0.98109 0.66738 1.0000 + O O2034 1.0 0.93954 0.01234 0.66738 1.0000 + O O2035 1.0 0.90829 0.04359 0.66738 1.0000 + O O2036 1.0 0.87704 0.07484 0.66738 1.0000 + O O2037 1.0 0.84579 0.10609 0.66738 1.0000 + O O2038 1.0 0.81454 0.13734 0.66738 1.0000 + O O2039 1.0 0.78329 0.16859 0.66738 1.0000 + O O2040 1.0 0.75204 0.19984 0.66738 1.0000 + O O2041 1.0 0.72079 0.23109 0.66738 1.0000 + O O2042 1.0 0.68954 0.26234 0.66738 1.0000 + O O2043 1.0 0.65829 0.29359 0.66738 1.0000 + O O2044 1.0 0.62704 0.32484 0.66738 1.0000 + O O2045 1.0 0.59579 0.35609 0.66738 1.0000 + O O2046 1.0 0.56454 0.38734 0.66738 1.0000 + O O2047 1.0 0.53329 0.41859 0.66738 1.0000 + O O2048 1.0 0.50204 0.44984 0.66738 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-5465_supercell_16x16x1.cif b/tier3/cif_file/orthogonal_2dm-5465_supercell_16x16x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..f768e75cec32da5ae6ef0002f932abe294481705 --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-5465_supercell_16x16x1.cif @@ -0,0 +1,2585 @@ +data_image0 +_chemical_formula_structural Sn256C256Cl768Sn256C256Cl768 +_chemical_formula_sum "Sn512 C512 Cl1536" +_cell_length_a 173.397 +_cell_length_b 100.111 +_cell_length_c 4.99285 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Sn Sn1 1.0 0.02083 0.00000 0.40057 1.0000 + Sn Sn2 1.0 0.05208 0.03125 0.40057 1.0000 + Sn Sn3 1.0 0.08333 0.06250 0.40057 1.0000 + Sn Sn4 1.0 0.11458 0.09375 0.40057 1.0000 + Sn Sn5 1.0 0.14583 0.12500 0.40057 1.0000 + Sn Sn6 1.0 0.17708 0.15625 0.40057 1.0000 + Sn Sn7 1.0 0.20833 0.18750 0.40057 1.0000 + Sn Sn8 1.0 0.23958 0.21875 0.40057 1.0000 + Sn Sn9 1.0 0.27083 0.25000 0.40057 1.0000 + Sn Sn10 1.0 0.30208 0.28125 0.40057 1.0000 + Sn Sn11 1.0 0.33333 0.31250 0.40057 1.0000 + Sn Sn12 1.0 0.36458 0.34375 0.40057 1.0000 + Sn Sn13 1.0 0.39583 0.37500 0.40057 1.0000 + Sn Sn14 1.0 0.42708 0.40625 0.40057 1.0000 + Sn Sn15 1.0 0.45833 0.43750 0.40057 1.0000 + Sn Sn16 1.0 0.48958 0.46875 0.40057 1.0000 + Sn Sn17 1.0 0.05208 0.96875 0.40057 1.0000 + Sn Sn18 1.0 0.08333 0.00000 0.40057 1.0000 + Sn Sn19 1.0 0.11458 0.03125 0.40057 1.0000 + Sn Sn20 1.0 0.14583 0.06250 0.40057 1.0000 + Sn Sn21 1.0 0.17708 0.09375 0.40057 1.0000 + Sn Sn22 1.0 0.20833 0.12500 0.40057 1.0000 + Sn Sn23 1.0 0.23958 0.15625 0.40057 1.0000 + Sn Sn24 1.0 0.27083 0.18750 0.40057 1.0000 + Sn Sn25 1.0 0.30208 0.21875 0.40057 1.0000 + Sn Sn26 1.0 0.33333 0.25000 0.40057 1.0000 + Sn Sn27 1.0 0.36458 0.28125 0.40057 1.0000 + Sn Sn28 1.0 0.39583 0.31250 0.40057 1.0000 + Sn Sn29 1.0 0.42708 0.34375 0.40057 1.0000 + Sn Sn30 1.0 0.45833 0.37500 0.40057 1.0000 + Sn Sn31 1.0 0.48958 0.40625 0.40057 1.0000 + Sn Sn32 1.0 0.52083 0.43750 0.40057 1.0000 + Sn Sn33 1.0 0.08333 0.93750 0.40057 1.0000 + Sn Sn34 1.0 0.11458 0.96875 0.40057 1.0000 + Sn Sn35 1.0 0.14583 0.00000 0.40057 1.0000 + Sn Sn36 1.0 0.17708 0.03125 0.40057 1.0000 + Sn Sn37 1.0 0.20833 0.06250 0.40057 1.0000 + Sn Sn38 1.0 0.23958 0.09375 0.40057 1.0000 + Sn Sn39 1.0 0.27083 0.12500 0.40057 1.0000 + Sn Sn40 1.0 0.30208 0.15625 0.40057 1.0000 + Sn Sn41 1.0 0.33333 0.18750 0.40057 1.0000 + Sn Sn42 1.0 0.36458 0.21875 0.40057 1.0000 + Sn Sn43 1.0 0.39583 0.25000 0.40057 1.0000 + Sn Sn44 1.0 0.42708 0.28125 0.40057 1.0000 + Sn Sn45 1.0 0.45833 0.31250 0.40057 1.0000 + Sn Sn46 1.0 0.48958 0.34375 0.40057 1.0000 + Sn Sn47 1.0 0.52083 0.37500 0.40057 1.0000 + Sn Sn48 1.0 0.55208 0.40625 0.40057 1.0000 + Sn Sn49 1.0 0.11458 0.90625 0.40057 1.0000 + Sn Sn50 1.0 0.14583 0.93750 0.40057 1.0000 + Sn Sn51 1.0 0.17708 0.96875 0.40057 1.0000 + Sn Sn52 1.0 0.20833 0.00000 0.40057 1.0000 + Sn Sn53 1.0 0.23958 0.03125 0.40057 1.0000 + Sn Sn54 1.0 0.27083 0.06250 0.40057 1.0000 + Sn Sn55 1.0 0.30208 0.09375 0.40057 1.0000 + Sn Sn56 1.0 0.33333 0.12500 0.40057 1.0000 + Sn Sn57 1.0 0.36458 0.15625 0.40057 1.0000 + Sn Sn58 1.0 0.39583 0.18750 0.40057 1.0000 + Sn Sn59 1.0 0.42708 0.21875 0.40057 1.0000 + Sn Sn60 1.0 0.45833 0.25000 0.40057 1.0000 + Sn Sn61 1.0 0.48958 0.28125 0.40057 1.0000 + Sn Sn62 1.0 0.52083 0.31250 0.40057 1.0000 + Sn Sn63 1.0 0.55208 0.34375 0.40057 1.0000 + Sn Sn64 1.0 0.58333 0.37500 0.40057 1.0000 + Sn Sn65 1.0 0.14583 0.87500 0.40057 1.0000 + Sn Sn66 1.0 0.17708 0.90625 0.40057 1.0000 + Sn Sn67 1.0 0.20833 0.93750 0.40057 1.0000 + Sn Sn68 1.0 0.23958 0.96875 0.40057 1.0000 + Sn Sn69 1.0 0.27083 0.00000 0.40057 1.0000 + Sn Sn70 1.0 0.30208 0.03125 0.40057 1.0000 + Sn Sn71 1.0 0.33333 0.06250 0.40057 1.0000 + Sn Sn72 1.0 0.36458 0.09375 0.40057 1.0000 + Sn Sn73 1.0 0.39583 0.12500 0.40057 1.0000 + Sn Sn74 1.0 0.42708 0.15625 0.40057 1.0000 + Sn Sn75 1.0 0.45833 0.18750 0.40057 1.0000 + Sn Sn76 1.0 0.48958 0.21875 0.40057 1.0000 + Sn Sn77 1.0 0.52083 0.25000 0.40057 1.0000 + Sn Sn78 1.0 0.55208 0.28125 0.40057 1.0000 + Sn Sn79 1.0 0.58333 0.31250 0.40057 1.0000 + Sn Sn80 1.0 0.61458 0.34375 0.40057 1.0000 + Sn Sn81 1.0 0.17708 0.84375 0.40057 1.0000 + Sn Sn82 1.0 0.20833 0.87500 0.40057 1.0000 + Sn Sn83 1.0 0.23958 0.90625 0.40057 1.0000 + Sn Sn84 1.0 0.27083 0.93750 0.40057 1.0000 + Sn Sn85 1.0 0.30208 0.96875 0.40057 1.0000 + Sn Sn86 1.0 0.33333 0.00000 0.40057 1.0000 + Sn Sn87 1.0 0.36458 0.03125 0.40057 1.0000 + Sn Sn88 1.0 0.39583 0.06250 0.40057 1.0000 + Sn Sn89 1.0 0.42708 0.09375 0.40057 1.0000 + Sn Sn90 1.0 0.45833 0.12500 0.40057 1.0000 + Sn Sn91 1.0 0.48958 0.15625 0.40057 1.0000 + Sn Sn92 1.0 0.52083 0.18750 0.40057 1.0000 + Sn Sn93 1.0 0.55208 0.21875 0.40057 1.0000 + Sn Sn94 1.0 0.58333 0.25000 0.40057 1.0000 + Sn Sn95 1.0 0.61458 0.28125 0.40057 1.0000 + Sn Sn96 1.0 0.64583 0.31250 0.40057 1.0000 + Sn Sn97 1.0 0.20833 0.81250 0.40057 1.0000 + Sn Sn98 1.0 0.23958 0.84375 0.40057 1.0000 + Sn Sn99 1.0 0.27083 0.87500 0.40057 1.0000 + Sn Sn100 1.0 0.30208 0.90625 0.40057 1.0000 + Sn Sn101 1.0 0.33333 0.93750 0.40057 1.0000 + Sn Sn102 1.0 0.36458 0.96875 0.40057 1.0000 + Sn Sn103 1.0 0.39583 0.00000 0.40057 1.0000 + Sn Sn104 1.0 0.42708 0.03125 0.40057 1.0000 + Sn Sn105 1.0 0.45833 0.06250 0.40057 1.0000 + Sn Sn106 1.0 0.48958 0.09375 0.40057 1.0000 + Sn Sn107 1.0 0.52083 0.12500 0.40057 1.0000 + Sn Sn108 1.0 0.55208 0.15625 0.40057 1.0000 + Sn Sn109 1.0 0.58333 0.18750 0.40057 1.0000 + Sn Sn110 1.0 0.61458 0.21875 0.40057 1.0000 + Sn Sn111 1.0 0.64583 0.25000 0.40057 1.0000 + Sn Sn112 1.0 0.67708 0.28125 0.40057 1.0000 + Sn Sn113 1.0 0.23958 0.78125 0.40057 1.0000 + Sn Sn114 1.0 0.27083 0.81250 0.40057 1.0000 + Sn Sn115 1.0 0.30208 0.84375 0.40057 1.0000 + Sn Sn116 1.0 0.33333 0.87500 0.40057 1.0000 + Sn Sn117 1.0 0.36458 0.90625 0.40057 1.0000 + Sn Sn118 1.0 0.39583 0.93750 0.40057 1.0000 + Sn Sn119 1.0 0.42708 0.96875 0.40057 1.0000 + Sn Sn120 1.0 0.45833 0.00000 0.40057 1.0000 + Sn Sn121 1.0 0.48958 0.03125 0.40057 1.0000 + Sn Sn122 1.0 0.52083 0.06250 0.40057 1.0000 + Sn Sn123 1.0 0.55208 0.09375 0.40057 1.0000 + Sn Sn124 1.0 0.58333 0.12500 0.40057 1.0000 + Sn Sn125 1.0 0.61458 0.15625 0.40057 1.0000 + Sn Sn126 1.0 0.64583 0.18750 0.40057 1.0000 + Sn Sn127 1.0 0.67708 0.21875 0.40057 1.0000 + Sn Sn128 1.0 0.70833 0.25000 0.40057 1.0000 + Sn Sn129 1.0 0.27083 0.75000 0.40057 1.0000 + Sn Sn130 1.0 0.30208 0.78125 0.40057 1.0000 + Sn Sn131 1.0 0.33333 0.81250 0.40057 1.0000 + Sn Sn132 1.0 0.36458 0.84375 0.40057 1.0000 + Sn Sn133 1.0 0.39583 0.87500 0.40057 1.0000 + Sn Sn134 1.0 0.42708 0.90625 0.40057 1.0000 + Sn Sn135 1.0 0.45833 0.93750 0.40057 1.0000 + Sn Sn136 1.0 0.48958 0.96875 0.40057 1.0000 + Sn Sn137 1.0 0.52083 0.00000 0.40057 1.0000 + Sn Sn138 1.0 0.55208 0.03125 0.40057 1.0000 + Sn Sn139 1.0 0.58333 0.06250 0.40057 1.0000 + Sn Sn140 1.0 0.61458 0.09375 0.40057 1.0000 + Sn Sn141 1.0 0.64583 0.12500 0.40057 1.0000 + Sn Sn142 1.0 0.67708 0.15625 0.40057 1.0000 + Sn Sn143 1.0 0.70833 0.18750 0.40057 1.0000 + Sn Sn144 1.0 0.73958 0.21875 0.40057 1.0000 + Sn Sn145 1.0 0.30208 0.71875 0.40057 1.0000 + Sn Sn146 1.0 0.33333 0.75000 0.40057 1.0000 + Sn Sn147 1.0 0.36458 0.78125 0.40057 1.0000 + Sn Sn148 1.0 0.39583 0.81250 0.40057 1.0000 + Sn Sn149 1.0 0.42708 0.84375 0.40057 1.0000 + Sn Sn150 1.0 0.45833 0.87500 0.40057 1.0000 + Sn Sn151 1.0 0.48958 0.90625 0.40057 1.0000 + Sn Sn152 1.0 0.52083 0.93750 0.40057 1.0000 + Sn Sn153 1.0 0.55208 0.96875 0.40057 1.0000 + Sn Sn154 1.0 0.58333 0.00000 0.40057 1.0000 + Sn Sn155 1.0 0.61458 0.03125 0.40057 1.0000 + Sn Sn156 1.0 0.64583 0.06250 0.40057 1.0000 + Sn Sn157 1.0 0.67708 0.09375 0.40057 1.0000 + Sn Sn158 1.0 0.70833 0.12500 0.40057 1.0000 + Sn Sn159 1.0 0.73958 0.15625 0.40057 1.0000 + Sn Sn160 1.0 0.77083 0.18750 0.40057 1.0000 + Sn Sn161 1.0 0.33333 0.68750 0.40057 1.0000 + Sn Sn162 1.0 0.36458 0.71875 0.40057 1.0000 + Sn Sn163 1.0 0.39583 0.75000 0.40057 1.0000 + Sn Sn164 1.0 0.42708 0.78125 0.40057 1.0000 + Sn Sn165 1.0 0.45833 0.81250 0.40057 1.0000 + Sn Sn166 1.0 0.48958 0.84375 0.40057 1.0000 + Sn Sn167 1.0 0.52083 0.87500 0.40057 1.0000 + Sn Sn168 1.0 0.55208 0.90625 0.40057 1.0000 + Sn Sn169 1.0 0.58333 0.93750 0.40057 1.0000 + Sn Sn170 1.0 0.61458 0.96875 0.40057 1.0000 + Sn Sn171 1.0 0.64583 0.00000 0.40057 1.0000 + Sn Sn172 1.0 0.67708 0.03125 0.40057 1.0000 + Sn Sn173 1.0 0.70833 0.06250 0.40057 1.0000 + Sn Sn174 1.0 0.73958 0.09375 0.40057 1.0000 + Sn Sn175 1.0 0.77083 0.12500 0.40057 1.0000 + Sn Sn176 1.0 0.80208 0.15625 0.40057 1.0000 + Sn Sn177 1.0 0.36458 0.65625 0.40057 1.0000 + Sn Sn178 1.0 0.39583 0.68750 0.40057 1.0000 + Sn Sn179 1.0 0.42708 0.71875 0.40057 1.0000 + Sn Sn180 1.0 0.45833 0.75000 0.40057 1.0000 + Sn Sn181 1.0 0.48958 0.78125 0.40057 1.0000 + Sn Sn182 1.0 0.52083 0.81250 0.40057 1.0000 + Sn Sn183 1.0 0.55208 0.84375 0.40057 1.0000 + Sn Sn184 1.0 0.58333 0.87500 0.40057 1.0000 + Sn Sn185 1.0 0.61458 0.90625 0.40057 1.0000 + Sn Sn186 1.0 0.64583 0.93750 0.40057 1.0000 + Sn Sn187 1.0 0.67708 0.96875 0.40057 1.0000 + Sn Sn188 1.0 0.70833 0.00000 0.40057 1.0000 + Sn Sn189 1.0 0.73958 0.03125 0.40057 1.0000 + Sn Sn190 1.0 0.77083 0.06250 0.40057 1.0000 + Sn Sn191 1.0 0.80208 0.09375 0.40057 1.0000 + Sn Sn192 1.0 0.83333 0.12500 0.40057 1.0000 + Sn Sn193 1.0 0.39583 0.62500 0.40057 1.0000 + Sn Sn194 1.0 0.42708 0.65625 0.40057 1.0000 + Sn Sn195 1.0 0.45833 0.68750 0.40057 1.0000 + Sn Sn196 1.0 0.48958 0.71875 0.40057 1.0000 + Sn Sn197 1.0 0.52083 0.75000 0.40057 1.0000 + Sn Sn198 1.0 0.55208 0.78125 0.40057 1.0000 + Sn Sn199 1.0 0.58333 0.81250 0.40057 1.0000 + Sn Sn200 1.0 0.61458 0.84375 0.40057 1.0000 + Sn Sn201 1.0 0.64583 0.87500 0.40057 1.0000 + Sn Sn202 1.0 0.67708 0.90625 0.40057 1.0000 + Sn Sn203 1.0 0.70833 0.93750 0.40057 1.0000 + Sn Sn204 1.0 0.73958 0.96875 0.40057 1.0000 + Sn Sn205 1.0 0.77083 0.00000 0.40057 1.0000 + Sn Sn206 1.0 0.80208 0.03125 0.40057 1.0000 + Sn Sn207 1.0 0.83333 0.06250 0.40057 1.0000 + Sn Sn208 1.0 0.86458 0.09375 0.40057 1.0000 + Sn Sn209 1.0 0.42708 0.59375 0.40057 1.0000 + Sn Sn210 1.0 0.45833 0.62500 0.40057 1.0000 + Sn Sn211 1.0 0.48958 0.65625 0.40057 1.0000 + Sn Sn212 1.0 0.52083 0.68750 0.40057 1.0000 + Sn Sn213 1.0 0.55208 0.71875 0.40057 1.0000 + Sn Sn214 1.0 0.58333 0.75000 0.40057 1.0000 + Sn Sn215 1.0 0.61458 0.78125 0.40057 1.0000 + Sn Sn216 1.0 0.64583 0.81250 0.40057 1.0000 + Sn Sn217 1.0 0.67708 0.84375 0.40057 1.0000 + Sn Sn218 1.0 0.70833 0.87500 0.40057 1.0000 + Sn Sn219 1.0 0.73958 0.90625 0.40057 1.0000 + Sn Sn220 1.0 0.77083 0.93750 0.40057 1.0000 + Sn Sn221 1.0 0.80208 0.96875 0.40057 1.0000 + Sn Sn222 1.0 0.83333 0.00000 0.40057 1.0000 + Sn Sn223 1.0 0.86458 0.03125 0.40057 1.0000 + Sn Sn224 1.0 0.89583 0.06250 0.40057 1.0000 + Sn Sn225 1.0 0.45833 0.56250 0.40057 1.0000 + Sn Sn226 1.0 0.48958 0.59375 0.40057 1.0000 + Sn Sn227 1.0 0.52083 0.62500 0.40057 1.0000 + Sn Sn228 1.0 0.55208 0.65625 0.40057 1.0000 + Sn Sn229 1.0 0.58333 0.68750 0.40057 1.0000 + Sn Sn230 1.0 0.61458 0.71875 0.40057 1.0000 + Sn Sn231 1.0 0.64583 0.75000 0.40057 1.0000 + Sn Sn232 1.0 0.67708 0.78125 0.40057 1.0000 + Sn Sn233 1.0 0.70833 0.81250 0.40057 1.0000 + Sn Sn234 1.0 0.73958 0.84375 0.40057 1.0000 + Sn Sn235 1.0 0.77083 0.87500 0.40057 1.0000 + Sn Sn236 1.0 0.80208 0.90625 0.40057 1.0000 + Sn Sn237 1.0 0.83333 0.93750 0.40057 1.0000 + Sn Sn238 1.0 0.86458 0.96875 0.40057 1.0000 + Sn Sn239 1.0 0.89583 0.00000 0.40057 1.0000 + Sn Sn240 1.0 0.92708 0.03125 0.40057 1.0000 + Sn Sn241 1.0 0.48958 0.53125 0.40057 1.0000 + Sn Sn242 1.0 0.52083 0.56250 0.40057 1.0000 + Sn Sn243 1.0 0.55208 0.59375 0.40057 1.0000 + Sn Sn244 1.0 0.58333 0.62500 0.40057 1.0000 + Sn Sn245 1.0 0.61458 0.65625 0.40057 1.0000 + Sn Sn246 1.0 0.64583 0.68750 0.40057 1.0000 + Sn Sn247 1.0 0.67708 0.71875 0.40057 1.0000 + Sn Sn248 1.0 0.70833 0.75000 0.40057 1.0000 + Sn Sn249 1.0 0.73958 0.78125 0.40057 1.0000 + Sn Sn250 1.0 0.77083 0.81250 0.40057 1.0000 + Sn Sn251 1.0 0.80208 0.84375 0.40057 1.0000 + Sn Sn252 1.0 0.83333 0.87500 0.40057 1.0000 + Sn Sn253 1.0 0.86458 0.90625 0.40057 1.0000 + Sn Sn254 1.0 0.89583 0.93750 0.40057 1.0000 + Sn Sn255 1.0 0.92708 0.96875 0.40057 1.0000 + Sn Sn256 1.0 0.95833 0.00000 0.40057 1.0000 + C C1 1.0 0.00000 0.00000 0.59943 1.0000 + C C2 1.0 0.03125 0.03125 0.59943 1.0000 + C C3 1.0 0.06250 0.06250 0.59943 1.0000 + C C4 1.0 0.59375 0.59375 0.59943 1.0000 + C C5 1.0 0.12500 0.12500 0.59943 1.0000 + C C6 1.0 0.15625 0.15625 0.59943 1.0000 + C C7 1.0 0.68750 0.68750 0.59943 1.0000 + C C8 1.0 0.21875 0.21875 0.59943 1.0000 + C C9 1.0 0.25000 0.25000 0.59943 1.0000 + C C10 1.0 0.28125 0.28125 0.59943 1.0000 + C C11 1.0 0.31250 0.31250 0.59943 1.0000 + C C12 1.0 0.34375 0.34375 0.59943 1.0000 + C C13 1.0 0.87500 0.87500 0.59943 1.0000 + C C14 1.0 0.90625 0.90625 0.59943 1.0000 + C C15 1.0 0.43750 0.43750 0.59943 1.0000 + C C16 1.0 0.96875 0.96875 0.59943 1.0000 + C C17 1.0 0.03125 0.96875 0.59943 1.0000 + C C18 1.0 0.06250 0.00000 0.59943 1.0000 + C C19 1.0 0.09375 0.03125 0.59943 1.0000 + C C20 1.0 0.12500 0.06250 0.59943 1.0000 + C C21 1.0 0.15625 0.09375 0.59943 1.0000 + C C22 1.0 0.18750 0.12500 0.59943 1.0000 + C C23 1.0 0.21875 0.15625 0.59943 1.0000 + C C24 1.0 0.25000 0.18750 0.59943 1.0000 + C C25 1.0 0.28125 0.21875 0.59943 1.0000 + C C26 1.0 0.31250 0.25000 0.59943 1.0000 + C C27 1.0 0.34375 0.28125 0.59943 1.0000 + C C28 1.0 0.37500 0.31250 0.59943 1.0000 + C C29 1.0 0.40625 0.34375 0.59943 1.0000 + C C30 1.0 0.43750 0.37500 0.59943 1.0000 + C C31 1.0 0.46875 0.40625 0.59943 1.0000 + C C32 1.0 0.50000 0.43750 0.59943 1.0000 + C C33 1.0 0.06250 0.93750 0.59943 1.0000 + C C34 1.0 0.09375 0.96875 0.59943 1.0000 + C C35 1.0 0.12500 0.00000 0.59943 1.0000 + C C36 1.0 0.15625 0.03125 0.59943 1.0000 + C C37 1.0 0.18750 0.06250 0.59943 1.0000 + C C38 1.0 0.21875 0.09375 0.59943 1.0000 + C C39 1.0 0.25000 0.12500 0.59943 1.0000 + C C40 1.0 0.28125 0.15625 0.59943 1.0000 + C C41 1.0 0.31250 0.18750 0.59943 1.0000 + C C42 1.0 0.34375 0.21875 0.59943 1.0000 + C C43 1.0 0.37500 0.25000 0.59943 1.0000 + C C44 1.0 0.40625 0.28125 0.59943 1.0000 + C C45 1.0 0.43750 0.31250 0.59943 1.0000 + C C46 1.0 0.46875 0.34375 0.59943 1.0000 + C C47 1.0 0.50000 0.37500 0.59943 1.0000 + C C48 1.0 0.53125 0.40625 0.59943 1.0000 + C C49 1.0 0.09375 0.90625 0.59943 1.0000 + C C50 1.0 0.12500 0.93750 0.59943 1.0000 + C C51 1.0 0.15625 0.96875 0.59943 1.0000 + C C52 1.0 0.18750 0.00000 0.59943 1.0000 + C C53 1.0 0.21875 0.03125 0.59943 1.0000 + C C54 1.0 0.25000 0.06250 0.59943 1.0000 + C C55 1.0 0.28125 0.09375 0.59943 1.0000 + C C56 1.0 0.31250 0.12500 0.59943 1.0000 + C C57 1.0 0.34375 0.15625 0.59943 1.0000 + C C58 1.0 0.37500 0.18750 0.59943 1.0000 + C C59 1.0 0.40625 0.21875 0.59943 1.0000 + C C60 1.0 0.43750 0.25000 0.59943 1.0000 + C C61 1.0 0.46875 0.28125 0.59943 1.0000 + C C62 1.0 0.50000 0.31250 0.59943 1.0000 + C C63 1.0 0.53125 0.34375 0.59943 1.0000 + C C64 1.0 0.56250 0.37500 0.59943 1.0000 + C C65 1.0 0.12500 0.87500 0.59943 1.0000 + C C66 1.0 0.15625 0.90625 0.59943 1.0000 + C C67 1.0 0.18750 0.93750 0.59943 1.0000 + C C68 1.0 0.21875 0.96875 0.59943 1.0000 + C C69 1.0 0.25000 0.00000 0.59943 1.0000 + C C70 1.0 0.28125 0.03125 0.59943 1.0000 + C C71 1.0 0.31250 0.06250 0.59943 1.0000 + C C72 1.0 0.34375 0.09375 0.59943 1.0000 + C C73 1.0 0.37500 0.12500 0.59943 1.0000 + C C74 1.0 0.40625 0.15625 0.59943 1.0000 + C C75 1.0 0.43750 0.18750 0.59943 1.0000 + C C76 1.0 0.46875 0.21875 0.59943 1.0000 + C C77 1.0 0.50000 0.25000 0.59943 1.0000 + C C78 1.0 0.53125 0.28125 0.59943 1.0000 + C C79 1.0 0.56250 0.31250 0.59943 1.0000 + C C80 1.0 0.59375 0.34375 0.59943 1.0000 + C C81 1.0 0.15625 0.84375 0.59943 1.0000 + C C82 1.0 0.18750 0.87500 0.59943 1.0000 + C C83 1.0 0.21875 0.90625 0.59943 1.0000 + C C84 1.0 0.25000 0.93750 0.59943 1.0000 + C C85 1.0 0.28125 0.96875 0.59943 1.0000 + C C86 1.0 0.31250 0.00000 0.59943 1.0000 + C C87 1.0 0.34375 0.03125 0.59943 1.0000 + C C88 1.0 0.37500 0.06250 0.59943 1.0000 + C C89 1.0 0.40625 0.09375 0.59943 1.0000 + C C90 1.0 0.43750 0.12500 0.59943 1.0000 + C C91 1.0 0.46875 0.15625 0.59943 1.0000 + C C92 1.0 0.50000 0.18750 0.59943 1.0000 + C C93 1.0 0.53125 0.21875 0.59943 1.0000 + C C94 1.0 0.56250 0.25000 0.59943 1.0000 + C C95 1.0 0.59375 0.28125 0.59943 1.0000 + C C96 1.0 0.62500 0.31250 0.59943 1.0000 + C C97 1.0 0.18750 0.81250 0.59943 1.0000 + C C98 1.0 0.21875 0.84375 0.59943 1.0000 + C C99 1.0 0.25000 0.87500 0.59943 1.0000 + C C100 1.0 0.28125 0.90625 0.59943 1.0000 + C C101 1.0 0.31250 0.93750 0.59943 1.0000 + C C102 1.0 0.34375 0.96875 0.59943 1.0000 + C C103 1.0 0.37500 0.00000 0.59943 1.0000 + C C104 1.0 0.40625 0.03125 0.59943 1.0000 + C C105 1.0 0.43750 0.06250 0.59943 1.0000 + C C106 1.0 0.46875 0.09375 0.59943 1.0000 + C C107 1.0 0.50000 0.12500 0.59943 1.0000 + C C108 1.0 0.53125 0.15625 0.59943 1.0000 + C C109 1.0 0.56250 0.18750 0.59943 1.0000 + C C110 1.0 0.59375 0.21875 0.59943 1.0000 + C C111 1.0 0.62500 0.25000 0.59943 1.0000 + C C112 1.0 0.65625 0.28125 0.59943 1.0000 + C C113 1.0 0.21875 0.78125 0.59943 1.0000 + C C114 1.0 0.25000 0.81250 0.59943 1.0000 + C C115 1.0 0.28125 0.84375 0.59943 1.0000 + C C116 1.0 0.31250 0.87500 0.59943 1.0000 + C C117 1.0 0.34375 0.90625 0.59943 1.0000 + C C118 1.0 0.37500 0.93750 0.59943 1.0000 + C C119 1.0 0.40625 0.96875 0.59943 1.0000 + C C120 1.0 0.43750 0.00000 0.59943 1.0000 + C C121 1.0 0.46875 0.03125 0.59943 1.0000 + C C122 1.0 0.50000 0.06250 0.59943 1.0000 + C C123 1.0 0.53125 0.09375 0.59943 1.0000 + C C124 1.0 0.56250 0.12500 0.59943 1.0000 + C C125 1.0 0.59375 0.15625 0.59943 1.0000 + C C126 1.0 0.62500 0.18750 0.59943 1.0000 + C C127 1.0 0.65625 0.21875 0.59943 1.0000 + C C128 1.0 0.68750 0.25000 0.59943 1.0000 + C C129 1.0 0.25000 0.75000 0.59943 1.0000 + C C130 1.0 0.28125 0.78125 0.59943 1.0000 + C C131 1.0 0.31250 0.81250 0.59943 1.0000 + C C132 1.0 0.34375 0.84375 0.59943 1.0000 + C C133 1.0 0.37500 0.87500 0.59943 1.0000 + C C134 1.0 0.40625 0.90625 0.59943 1.0000 + C C135 1.0 0.43750 0.93750 0.59943 1.0000 + C C136 1.0 0.46875 0.96875 0.59943 1.0000 + C C137 1.0 0.50000 0.00000 0.59943 1.0000 + C C138 1.0 0.53125 0.03125 0.59943 1.0000 + C C139 1.0 0.56250 0.06250 0.59943 1.0000 + C C140 1.0 0.59375 0.09375 0.59943 1.0000 + C C141 1.0 0.62500 0.12500 0.59943 1.0000 + C C142 1.0 0.65625 0.15625 0.59943 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Cl Cl523 1.0 0.36518 0.31250 0.42801 1.0000 + Cl Cl524 1.0 0.39643 0.34375 0.42801 1.0000 + Cl Cl525 1.0 0.42768 0.37500 0.42801 1.0000 + Cl Cl526 1.0 0.45893 0.40625 0.42801 1.0000 + Cl Cl527 1.0 0.49018 0.43750 0.42801 1.0000 + Cl Cl528 1.0 0.52143 0.46875 0.42801 1.0000 + Cl Cl529 1.0 0.08393 0.96875 0.42801 1.0000 + Cl Cl530 1.0 0.11518 0.00000 0.42801 1.0000 + Cl Cl531 1.0 0.14643 0.03125 0.42801 1.0000 + Cl Cl532 1.0 0.17768 0.06250 0.42801 1.0000 + Cl Cl533 1.0 0.20893 0.09375 0.42801 1.0000 + Cl Cl534 1.0 0.24018 0.12500 0.42801 1.0000 + Cl Cl535 1.0 0.27143 0.15625 0.42801 1.0000 + Cl Cl536 1.0 0.30268 0.18750 0.42801 1.0000 + Cl Cl537 1.0 0.33393 0.21875 0.42801 1.0000 + Cl Cl538 1.0 0.36518 0.25000 0.42801 1.0000 + Cl Cl539 1.0 0.39643 0.28125 0.42801 1.0000 + Cl Cl540 1.0 0.42768 0.31250 0.42801 1.0000 + Cl Cl541 1.0 0.45893 0.34375 0.42801 1.0000 + Cl Cl542 1.0 0.49018 0.37500 0.42801 1.0000 + Cl Cl543 1.0 0.52143 0.40625 0.42801 1.0000 + Cl Cl544 1.0 0.55268 0.43750 0.42801 1.0000 + Cl Cl545 1.0 0.11518 0.93750 0.42801 1.0000 + Cl Cl546 1.0 0.14643 0.96875 0.42801 1.0000 + Cl Cl547 1.0 0.17768 0.00000 0.42801 1.0000 + Cl Cl548 1.0 0.20893 0.03125 0.42801 1.0000 + Cl Cl549 1.0 0.24018 0.06250 0.42801 1.0000 + Cl Cl550 1.0 0.27143 0.09375 0.42801 1.0000 + Cl Cl551 1.0 0.30268 0.12500 0.42801 1.0000 + Cl Cl552 1.0 0.33393 0.15625 0.42801 1.0000 + Cl Cl553 1.0 0.36518 0.18750 0.42801 1.0000 + Cl Cl554 1.0 0.39643 0.21875 0.42801 1.0000 + Cl Cl555 1.0 0.42768 0.25000 0.42801 1.0000 + Cl Cl556 1.0 0.45893 0.28125 0.42801 1.0000 + Cl Cl557 1.0 0.49018 0.31250 0.42801 1.0000 + Cl Cl558 1.0 0.52143 0.34375 0.42801 1.0000 + Cl Cl559 1.0 0.55268 0.37500 0.42801 1.0000 + Cl Cl560 1.0 0.58393 0.40625 0.42801 1.0000 + Cl Cl561 1.0 0.14643 0.90625 0.42801 1.0000 + Cl Cl562 1.0 0.17768 0.93750 0.42801 1.0000 + Cl Cl563 1.0 0.20893 0.96875 0.42801 1.0000 + Cl Cl564 1.0 0.24018 0.00000 0.42801 1.0000 + Cl Cl565 1.0 0.27143 0.03125 0.42801 1.0000 + Cl Cl566 1.0 0.30268 0.06250 0.42801 1.0000 + Cl Cl567 1.0 0.33393 0.09375 0.42801 1.0000 + Cl Cl568 1.0 0.36518 0.12500 0.42801 1.0000 + Cl Cl569 1.0 0.39643 0.15625 0.42801 1.0000 + Cl Cl570 1.0 0.42768 0.18750 0.42801 1.0000 + Cl Cl571 1.0 0.45893 0.21875 0.42801 1.0000 + Cl Cl572 1.0 0.49018 0.25000 0.42801 1.0000 + Cl Cl573 1.0 0.52143 0.28125 0.42801 1.0000 + Cl Cl574 1.0 0.55268 0.31250 0.42801 1.0000 + Cl Cl575 1.0 0.58393 0.34375 0.42801 1.0000 + Cl Cl576 1.0 0.61518 0.37500 0.42801 1.0000 + Cl Cl577 1.0 0.17768 0.87500 0.42801 1.0000 + Cl Cl578 1.0 0.20893 0.90625 0.42801 1.0000 + Cl Cl579 1.0 0.24018 0.93750 0.42801 1.0000 + Cl Cl580 1.0 0.27143 0.96875 0.42801 1.0000 + Cl Cl581 1.0 0.30268 0.00000 0.42801 1.0000 + Cl Cl582 1.0 0.33393 0.03125 0.42801 1.0000 + Cl Cl583 1.0 0.36518 0.06250 0.42801 1.0000 + Cl Cl584 1.0 0.39643 0.09375 0.42801 1.0000 + Cl Cl585 1.0 0.42768 0.12500 0.42801 1.0000 + Cl Cl586 1.0 0.45893 0.15625 0.42801 1.0000 + Cl Cl587 1.0 0.49018 0.18750 0.42801 1.0000 + Cl Cl588 1.0 0.52143 0.21875 0.42801 1.0000 + Cl Cl589 1.0 0.55268 0.25000 0.42801 1.0000 + Cl Cl590 1.0 0.58393 0.28125 0.42801 1.0000 + Cl Cl591 1.0 0.61518 0.31250 0.42801 1.0000 + Cl Cl592 1.0 0.64643 0.34375 0.42801 1.0000 + Cl Cl593 1.0 0.20893 0.84375 0.42801 1.0000 + Cl Cl594 1.0 0.24018 0.87500 0.42801 1.0000 + Cl Cl595 1.0 0.27143 0.90625 0.42801 1.0000 + Cl Cl596 1.0 0.30268 0.93750 0.42801 1.0000 + Cl Cl597 1.0 0.33393 0.96875 0.42801 1.0000 + Cl Cl598 1.0 0.36518 0.00000 0.42801 1.0000 + Cl Cl599 1.0 0.39643 0.03125 0.42801 1.0000 + Cl Cl600 1.0 0.42768 0.06250 0.42801 1.0000 + Cl Cl601 1.0 0.45893 0.09375 0.42801 1.0000 + Cl Cl602 1.0 0.49018 0.12500 0.42801 1.0000 + Cl Cl603 1.0 0.52143 0.15625 0.42801 1.0000 + Cl Cl604 1.0 0.55268 0.18750 0.42801 1.0000 + Cl Cl605 1.0 0.58393 0.21875 0.42801 1.0000 + Cl Cl606 1.0 0.61518 0.25000 0.42801 1.0000 + Cl Cl607 1.0 0.64643 0.28125 0.42801 1.0000 + Cl Cl608 1.0 0.67768 0.31250 0.42801 1.0000 + Cl Cl609 1.0 0.24018 0.81250 0.42801 1.0000 + Cl Cl610 1.0 0.27143 0.84375 0.42801 1.0000 + Cl Cl611 1.0 0.30268 0.87500 0.42801 1.0000 + Cl Cl612 1.0 0.33393 0.90625 0.42801 1.0000 + Cl Cl613 1.0 0.36518 0.93750 0.42801 1.0000 + Cl Cl614 1.0 0.39643 0.96875 0.42801 1.0000 + Cl Cl615 1.0 0.42768 0.00000 0.42801 1.0000 + Cl Cl616 1.0 0.45893 0.03125 0.42801 1.0000 + Cl Cl617 1.0 0.49018 0.06250 0.42801 1.0000 + Cl Cl618 1.0 0.52143 0.09375 0.42801 1.0000 + Cl Cl619 1.0 0.55268 0.12500 0.42801 1.0000 + Cl Cl620 1.0 0.58393 0.15625 0.42801 1.0000 + Cl Cl621 1.0 0.61518 0.18750 0.42801 1.0000 + Cl Cl622 1.0 0.64643 0.21875 0.42801 1.0000 + Cl Cl623 1.0 0.67768 0.25000 0.42801 1.0000 + Cl Cl624 1.0 0.70893 0.28125 0.42801 1.0000 + Cl Cl625 1.0 0.27143 0.78125 0.42801 1.0000 + Cl Cl626 1.0 0.30268 0.81250 0.42801 1.0000 + Cl Cl627 1.0 0.33393 0.84375 0.42801 1.0000 + Cl Cl628 1.0 0.36518 0.87500 0.42801 1.0000 + Cl Cl629 1.0 0.39643 0.90625 0.42801 1.0000 + Cl Cl630 1.0 0.42768 0.93750 0.42801 1.0000 + Cl Cl631 1.0 0.45893 0.96875 0.42801 1.0000 + Cl Cl632 1.0 0.49018 0.00000 0.42801 1.0000 + Cl Cl633 1.0 0.52143 0.03125 0.42801 1.0000 + Cl Cl634 1.0 0.55268 0.06250 0.42801 1.0000 + Cl Cl635 1.0 0.58393 0.09375 0.42801 1.0000 + Cl Cl636 1.0 0.61518 0.12500 0.42801 1.0000 + Cl Cl637 1.0 0.64643 0.15625 0.42801 1.0000 + Cl Cl638 1.0 0.67768 0.18750 0.42801 1.0000 + Cl Cl639 1.0 0.70893 0.21875 0.42801 1.0000 + Cl Cl640 1.0 0.74018 0.25000 0.42801 1.0000 + Cl Cl641 1.0 0.30268 0.75000 0.42801 1.0000 + Cl Cl642 1.0 0.33393 0.78125 0.42801 1.0000 + Cl Cl643 1.0 0.36518 0.81250 0.42801 1.0000 + Cl Cl644 1.0 0.39643 0.84375 0.42801 1.0000 + Cl Cl645 1.0 0.42768 0.87500 0.42801 1.0000 + Cl Cl646 1.0 0.45893 0.90625 0.42801 1.0000 + Cl Cl647 1.0 0.49018 0.93750 0.42801 1.0000 + Cl Cl648 1.0 0.52143 0.96875 0.42801 1.0000 + Cl Cl649 1.0 0.55268 0.00000 0.42801 1.0000 + Cl Cl650 1.0 0.58393 0.03125 0.42801 1.0000 + Cl Cl651 1.0 0.61518 0.06250 0.42801 1.0000 + Cl Cl652 1.0 0.64643 0.09375 0.42801 1.0000 + Cl Cl653 1.0 0.67768 0.12500 0.42801 1.0000 + Cl Cl654 1.0 0.70893 0.15625 0.42801 1.0000 + Cl Cl655 1.0 0.74018 0.18750 0.42801 1.0000 + Cl Cl656 1.0 0.77143 0.21875 0.42801 1.0000 + Cl Cl657 1.0 0.33393 0.71875 0.42801 1.0000 + Cl Cl658 1.0 0.36518 0.75000 0.42801 1.0000 + Cl Cl659 1.0 0.39643 0.78125 0.42801 1.0000 + Cl Cl660 1.0 0.42768 0.81250 0.42801 1.0000 + Cl Cl661 1.0 0.45893 0.84375 0.42801 1.0000 + Cl Cl662 1.0 0.49018 0.87500 0.42801 1.0000 + Cl Cl663 1.0 0.52143 0.90625 0.42801 1.0000 + Cl Cl664 1.0 0.55268 0.93750 0.42801 1.0000 + Cl Cl665 1.0 0.58393 0.96875 0.42801 1.0000 + Cl Cl666 1.0 0.61518 0.00000 0.42801 1.0000 + Cl Cl667 1.0 0.64643 0.03125 0.42801 1.0000 + Cl Cl668 1.0 0.67768 0.06250 0.42801 1.0000 + Cl Cl669 1.0 0.70893 0.09375 0.42801 1.0000 + Cl Cl670 1.0 0.74018 0.12500 0.42801 1.0000 + Cl Cl671 1.0 0.77143 0.15625 0.42801 1.0000 + Cl Cl672 1.0 0.80268 0.18750 0.42801 1.0000 + Cl Cl673 1.0 0.36518 0.68750 0.42801 1.0000 + Cl Cl674 1.0 0.39643 0.71875 0.42801 1.0000 + Cl Cl675 1.0 0.42768 0.75000 0.42801 1.0000 + Cl Cl676 1.0 0.45893 0.78125 0.42801 1.0000 + Cl Cl677 1.0 0.49018 0.81250 0.42801 1.0000 + Cl Cl678 1.0 0.52143 0.84375 0.42801 1.0000 + Cl Cl679 1.0 0.55268 0.87500 0.42801 1.0000 + Cl Cl680 1.0 0.58393 0.90625 0.42801 1.0000 + Cl Cl681 1.0 0.61518 0.93750 0.42801 1.0000 + Cl Cl682 1.0 0.64643 0.96875 0.42801 1.0000 + Cl Cl683 1.0 0.67768 0.00000 0.42801 1.0000 + Cl Cl684 1.0 0.70893 0.03125 0.42801 1.0000 + Cl Cl685 1.0 0.74018 0.06250 0.42801 1.0000 + Cl Cl686 1.0 0.77143 0.09375 0.42801 1.0000 + Cl Cl687 1.0 0.80268 0.12500 0.42801 1.0000 + Cl Cl688 1.0 0.83393 0.15625 0.42801 1.0000 + Cl Cl689 1.0 0.39643 0.65625 0.42801 1.0000 + Cl Cl690 1.0 0.42768 0.68750 0.42801 1.0000 + Cl Cl691 1.0 0.45893 0.71875 0.42801 1.0000 + Cl Cl692 1.0 0.49018 0.75000 0.42801 1.0000 + Cl Cl693 1.0 0.52143 0.78125 0.42801 1.0000 + Cl Cl694 1.0 0.55268 0.81250 0.42801 1.0000 + Cl Cl695 1.0 0.58393 0.84375 0.42801 1.0000 + Cl Cl696 1.0 0.61518 0.87500 0.42801 1.0000 + Cl Cl697 1.0 0.64643 0.90625 0.42801 1.0000 + Cl Cl698 1.0 0.67768 0.93750 0.42801 1.0000 + Cl Cl699 1.0 0.70893 0.96875 0.42801 1.0000 + Cl Cl700 1.0 0.74018 0.00000 0.42801 1.0000 + Cl Cl701 1.0 0.77143 0.03125 0.42801 1.0000 + Cl Cl702 1.0 0.80268 0.06250 0.42801 1.0000 + Cl Cl703 1.0 0.83393 0.09375 0.42801 1.0000 + Cl Cl704 1.0 0.86518 0.12500 0.42801 1.0000 + Cl Cl705 1.0 0.42768 0.62500 0.42801 1.0000 + Cl Cl706 1.0 0.45893 0.65625 0.42801 1.0000 + Cl Cl707 1.0 0.49018 0.68750 0.42801 1.0000 + Cl Cl708 1.0 0.52143 0.71875 0.42801 1.0000 + Cl Cl709 1.0 0.55268 0.75000 0.42801 1.0000 + Cl Cl710 1.0 0.58393 0.78125 0.42801 1.0000 + Cl Cl711 1.0 0.61518 0.81250 0.42801 1.0000 + Cl Cl712 1.0 0.64643 0.84375 0.42801 1.0000 + Cl Cl713 1.0 0.67768 0.87500 0.42801 1.0000 + Cl Cl714 1.0 0.70893 0.90625 0.42801 1.0000 + Cl Cl715 1.0 0.74018 0.93750 0.42801 1.0000 + Cl Cl716 1.0 0.77143 0.96875 0.42801 1.0000 + Cl Cl717 1.0 0.80268 0.00000 0.42801 1.0000 + Cl Cl718 1.0 0.83393 0.03125 0.42801 1.0000 + Cl Cl719 1.0 0.86518 0.06250 0.42801 1.0000 + Cl Cl720 1.0 0.89643 0.09375 0.42801 1.0000 + Cl Cl721 1.0 0.45893 0.59375 0.42801 1.0000 + Cl Cl722 1.0 0.49018 0.62500 0.42801 1.0000 + Cl Cl723 1.0 0.52143 0.65625 0.42801 1.0000 + Cl Cl724 1.0 0.55268 0.68750 0.42801 1.0000 + Cl Cl725 1.0 0.58393 0.71875 0.42801 1.0000 + Cl Cl726 1.0 0.61518 0.75000 0.42801 1.0000 + Cl Cl727 1.0 0.64643 0.78125 0.42801 1.0000 + Cl Cl728 1.0 0.67768 0.81250 0.42801 1.0000 + Cl Cl729 1.0 0.70893 0.84375 0.42801 1.0000 + Cl Cl730 1.0 0.74018 0.87500 0.42801 1.0000 + Cl Cl731 1.0 0.77143 0.90625 0.42801 1.0000 + Cl Cl732 1.0 0.80268 0.93750 0.42801 1.0000 + Cl Cl733 1.0 0.83393 0.96875 0.42801 1.0000 + Cl Cl734 1.0 0.86518 0.00000 0.42801 1.0000 + Cl Cl735 1.0 0.89643 0.03125 0.42801 1.0000 + Cl Cl736 1.0 0.92768 0.06250 0.42801 1.0000 + Cl Cl737 1.0 0.49018 0.56250 0.42801 1.0000 + Cl Cl738 1.0 0.52143 0.59375 0.42801 1.0000 + Cl Cl739 1.0 0.55268 0.62500 0.42801 1.0000 + Cl Cl740 1.0 0.58393 0.65625 0.42801 1.0000 + Cl Cl741 1.0 0.61518 0.68750 0.42801 1.0000 + Cl Cl742 1.0 0.64643 0.71875 0.42801 1.0000 + Cl Cl743 1.0 0.67768 0.75000 0.42801 1.0000 + Cl Cl744 1.0 0.70893 0.78125 0.42801 1.0000 + Cl Cl745 1.0 0.74018 0.81250 0.42801 1.0000 + Cl Cl746 1.0 0.77143 0.84375 0.42801 1.0000 + Cl Cl747 1.0 0.80268 0.87500 0.42801 1.0000 + Cl Cl748 1.0 0.83393 0.90625 0.42801 1.0000 + Cl Cl749 1.0 0.86518 0.93750 0.42801 1.0000 + Cl Cl750 1.0 0.89643 0.96875 0.42801 1.0000 + Cl Cl751 1.0 0.92768 0.00000 0.42801 1.0000 + Cl Cl752 1.0 0.95893 0.03125 0.42801 1.0000 + Cl Cl753 1.0 0.52143 0.53125 0.42801 1.0000 + Cl Cl754 1.0 0.55268 0.56250 0.42801 1.0000 + Cl Cl755 1.0 0.58393 0.59375 0.42801 1.0000 + Cl Cl756 1.0 0.61518 0.62500 0.42801 1.0000 + Cl Cl757 1.0 0.64643 0.65625 0.42801 1.0000 + Cl Cl758 1.0 0.67768 0.68750 0.42801 1.0000 + Cl Cl759 1.0 0.70893 0.71875 0.42801 1.0000 + Cl Cl760 1.0 0.74018 0.75000 0.42801 1.0000 + Cl Cl761 1.0 0.77143 0.78125 0.42801 1.0000 + Cl Cl762 1.0 0.80268 0.81250 0.42801 1.0000 + Cl Cl763 1.0 0.83393 0.84375 0.42801 1.0000 + Cl Cl764 1.0 0.86518 0.87500 0.42801 1.0000 + Cl Cl765 1.0 0.89643 0.90625 0.42801 1.0000 + Cl Cl766 1.0 0.92768 0.93750 0.42801 1.0000 + Cl Cl767 1.0 0.95893 0.96875 0.42801 1.0000 + Cl Cl768 1.0 0.99018 0.00000 0.42801 1.0000 + Sn Sn257 1.0 0.52083 0.50000 0.40057 1.0000 + Sn Sn258 1.0 0.55208 0.53125 0.40057 1.0000 + Sn Sn259 1.0 0.58333 0.56250 0.40057 1.0000 + Sn Sn260 1.0 0.61458 0.59375 0.40057 1.0000 + Sn Sn261 1.0 0.64583 0.62500 0.40057 1.0000 + Sn Sn262 1.0 0.67708 0.65625 0.40057 1.0000 + Sn Sn263 1.0 0.70833 0.68750 0.40057 1.0000 + Sn Sn264 1.0 0.73958 0.71875 0.40057 1.0000 + Sn Sn265 1.0 0.77083 0.75000 0.40057 1.0000 + Sn Sn266 1.0 0.80208 0.78125 0.40057 1.0000 + Sn Sn267 1.0 0.83333 0.81250 0.40057 1.0000 + Sn Sn268 1.0 0.86458 0.84375 0.40057 1.0000 + Sn Sn269 1.0 0.89583 0.87500 0.40057 1.0000 + Sn Sn270 1.0 0.92708 0.90625 0.40057 1.0000 + Sn Sn271 1.0 0.95833 0.93750 0.40057 1.0000 + Sn Sn272 1.0 0.98958 0.96875 0.40057 1.0000 + Sn Sn273 1.0 0.55208 0.46875 0.40057 1.0000 + Sn Sn274 1.0 0.58333 0.50000 0.40057 1.0000 + Sn Sn275 1.0 0.61458 0.53125 0.40057 1.0000 + Sn Sn276 1.0 0.64583 0.56250 0.40057 1.0000 + Sn Sn277 1.0 0.67708 0.59375 0.40057 1.0000 + Sn Sn278 1.0 0.70833 0.62500 0.40057 1.0000 + Sn Sn279 1.0 0.73958 0.65625 0.40057 1.0000 + Sn Sn280 1.0 0.77083 0.68750 0.40057 1.0000 + Sn Sn281 1.0 0.80208 0.71875 0.40057 1.0000 + Sn Sn282 1.0 0.83333 0.75000 0.40057 1.0000 + Sn Sn283 1.0 0.86458 0.78125 0.40057 1.0000 + Sn Sn284 1.0 0.89583 0.81250 0.40057 1.0000 + Sn Sn285 1.0 0.92708 0.84375 0.40057 1.0000 + Sn Sn286 1.0 0.95833 0.87500 0.40057 1.0000 + Sn Sn287 1.0 0.98958 0.90625 0.40057 1.0000 + Sn Sn288 1.0 0.02083 0.93750 0.40057 1.0000 + Sn Sn289 1.0 0.58333 0.43750 0.40057 1.0000 + Sn Sn290 1.0 0.61458 0.46875 0.40057 1.0000 + Sn Sn291 1.0 0.64583 0.50000 0.40057 1.0000 + Sn Sn292 1.0 0.67708 0.53125 0.40057 1.0000 + Sn Sn293 1.0 0.70833 0.56250 0.40057 1.0000 + Sn Sn294 1.0 0.73958 0.59375 0.40057 1.0000 + Sn Sn295 1.0 0.77083 0.62500 0.40057 1.0000 + Sn Sn296 1.0 0.80208 0.65625 0.40057 1.0000 + Sn Sn297 1.0 0.83333 0.68750 0.40057 1.0000 + Sn Sn298 1.0 0.86458 0.71875 0.40057 1.0000 + Sn Sn299 1.0 0.89583 0.75000 0.40057 1.0000 + Sn Sn300 1.0 0.92708 0.78125 0.40057 1.0000 + Sn Sn301 1.0 0.95833 0.81250 0.40057 1.0000 + Sn Sn302 1.0 0.98958 0.84375 0.40057 1.0000 + Sn Sn303 1.0 0.02083 0.87500 0.40057 1.0000 + Sn Sn304 1.0 0.05208 0.90625 0.40057 1.0000 + Sn Sn305 1.0 0.61458 0.40625 0.40057 1.0000 + Sn Sn306 1.0 0.64583 0.43750 0.40057 1.0000 + Sn Sn307 1.0 0.67708 0.46875 0.40057 1.0000 + Sn Sn308 1.0 0.70833 0.50000 0.40057 1.0000 + Sn Sn309 1.0 0.73958 0.53125 0.40057 1.0000 + Sn Sn310 1.0 0.77083 0.56250 0.40057 1.0000 + Sn Sn311 1.0 0.80208 0.59375 0.40057 1.0000 + Sn Sn312 1.0 0.83333 0.62500 0.40057 1.0000 + Sn Sn313 1.0 0.86458 0.65625 0.40057 1.0000 + Sn Sn314 1.0 0.89583 0.68750 0.40057 1.0000 + Sn Sn315 1.0 0.92708 0.71875 0.40057 1.0000 + Sn Sn316 1.0 0.95833 0.75000 0.40057 1.0000 + Sn Sn317 1.0 0.98958 0.78125 0.40057 1.0000 + Sn Sn318 1.0 0.02083 0.81250 0.40057 1.0000 + Sn Sn319 1.0 0.05208 0.84375 0.40057 1.0000 + Sn Sn320 1.0 0.08333 0.87500 0.40057 1.0000 + Sn Sn321 1.0 0.64583 0.37500 0.40057 1.0000 + Sn Sn322 1.0 0.67708 0.40625 0.40057 1.0000 + Sn Sn323 1.0 0.70833 0.43750 0.40057 1.0000 + Sn Sn324 1.0 0.73958 0.46875 0.40057 1.0000 + Sn Sn325 1.0 0.77083 0.50000 0.40057 1.0000 + Sn Sn326 1.0 0.80208 0.53125 0.40057 1.0000 + Sn Sn327 1.0 0.83333 0.56250 0.40057 1.0000 + Sn Sn328 1.0 0.86458 0.59375 0.40057 1.0000 + Sn Sn329 1.0 0.89583 0.62500 0.40057 1.0000 + Sn Sn330 1.0 0.92708 0.65625 0.40057 1.0000 + Sn Sn331 1.0 0.95833 0.68750 0.40057 1.0000 + Sn Sn332 1.0 0.98958 0.71875 0.40057 1.0000 + Sn Sn333 1.0 0.02083 0.75000 0.40057 1.0000 + Sn Sn334 1.0 0.05208 0.78125 0.40057 1.0000 + Sn Sn335 1.0 0.08333 0.81250 0.40057 1.0000 + Sn Sn336 1.0 0.11458 0.84375 0.40057 1.0000 + Sn Sn337 1.0 0.67708 0.34375 0.40057 1.0000 + Sn Sn338 1.0 0.70833 0.37500 0.40057 1.0000 + Sn Sn339 1.0 0.73958 0.40625 0.40057 1.0000 + Sn Sn340 1.0 0.77083 0.43750 0.40057 1.0000 + Sn Sn341 1.0 0.80208 0.46875 0.40057 1.0000 + Sn Sn342 1.0 0.83333 0.50000 0.40057 1.0000 + Sn Sn343 1.0 0.86458 0.53125 0.40057 1.0000 + Sn Sn344 1.0 0.89583 0.56250 0.40057 1.0000 + Sn Sn345 1.0 0.92708 0.59375 0.40057 1.0000 + Sn Sn346 1.0 0.95833 0.62500 0.40057 1.0000 + Sn Sn347 1.0 0.98958 0.65625 0.40057 1.0000 + Sn Sn348 1.0 0.02083 0.68750 0.40057 1.0000 + Sn Sn349 1.0 0.05208 0.71875 0.40057 1.0000 + Sn Sn350 1.0 0.08333 0.75000 0.40057 1.0000 + Sn Sn351 1.0 0.11458 0.78125 0.40057 1.0000 + Sn Sn352 1.0 0.14583 0.81250 0.40057 1.0000 + Sn Sn353 1.0 0.70833 0.31250 0.40057 1.0000 + Sn Sn354 1.0 0.73958 0.34375 0.40057 1.0000 + Sn Sn355 1.0 0.77083 0.37500 0.40057 1.0000 + Sn Sn356 1.0 0.80208 0.40625 0.40057 1.0000 + Sn Sn357 1.0 0.83333 0.43750 0.40057 1.0000 + Sn Sn358 1.0 0.86458 0.46875 0.40057 1.0000 + Sn Sn359 1.0 0.89583 0.50000 0.40057 1.0000 + Sn Sn360 1.0 0.92708 0.53125 0.40057 1.0000 + Sn Sn361 1.0 0.95833 0.56250 0.40057 1.0000 + Sn Sn362 1.0 0.98958 0.59375 0.40057 1.0000 + Sn Sn363 1.0 0.02083 0.62500 0.40057 1.0000 + Sn Sn364 1.0 0.05208 0.65625 0.40057 1.0000 + Sn Sn365 1.0 0.08333 0.68750 0.40057 1.0000 + Sn Sn366 1.0 0.11458 0.71875 0.40057 1.0000 + Sn Sn367 1.0 0.14583 0.75000 0.40057 1.0000 + Sn Sn368 1.0 0.17708 0.78125 0.40057 1.0000 + Sn Sn369 1.0 0.73958 0.28125 0.40057 1.0000 + Sn Sn370 1.0 0.77083 0.31250 0.40057 1.0000 + Sn Sn371 1.0 0.80208 0.34375 0.40057 1.0000 + Sn Sn372 1.0 0.83333 0.37500 0.40057 1.0000 + Sn Sn373 1.0 0.86458 0.40625 0.40057 1.0000 + Sn Sn374 1.0 0.89583 0.43750 0.40057 1.0000 + Sn Sn375 1.0 0.92708 0.46875 0.40057 1.0000 + Sn Sn376 1.0 0.95833 0.50000 0.40057 1.0000 + Sn Sn377 1.0 0.98958 0.53125 0.40057 1.0000 + Sn Sn378 1.0 0.02083 0.56250 0.40057 1.0000 + Sn Sn379 1.0 0.05208 0.59375 0.40057 1.0000 + Sn Sn380 1.0 0.08333 0.62500 0.40057 1.0000 + Sn Sn381 1.0 0.11458 0.65625 0.40057 1.0000 + Sn Sn382 1.0 0.14583 0.68750 0.40057 1.0000 + Sn Sn383 1.0 0.17708 0.71875 0.40057 1.0000 + Sn Sn384 1.0 0.20833 0.75000 0.40057 1.0000 + Sn Sn385 1.0 0.77083 0.25000 0.40057 1.0000 + Sn Sn386 1.0 0.80208 0.28125 0.40057 1.0000 + Sn Sn387 1.0 0.83333 0.31250 0.40057 1.0000 + Sn Sn388 1.0 0.86458 0.34375 0.40057 1.0000 + Sn Sn389 1.0 0.89583 0.37500 0.40057 1.0000 + Sn Sn390 1.0 0.92708 0.40625 0.40057 1.0000 + Sn Sn391 1.0 0.95833 0.43750 0.40057 1.0000 + Sn Sn392 1.0 0.98958 0.46875 0.40057 1.0000 + Sn Sn393 1.0 0.02083 0.50000 0.40057 1.0000 + Sn Sn394 1.0 0.05208 0.53125 0.40057 1.0000 + Sn Sn395 1.0 0.08333 0.56250 0.40057 1.0000 + Sn Sn396 1.0 0.11458 0.59375 0.40057 1.0000 + Sn Sn397 1.0 0.14583 0.62500 0.40057 1.0000 + Sn Sn398 1.0 0.17708 0.65625 0.40057 1.0000 + Sn Sn399 1.0 0.20833 0.68750 0.40057 1.0000 + Sn Sn400 1.0 0.23958 0.71875 0.40057 1.0000 + Sn Sn401 1.0 0.80208 0.21875 0.40057 1.0000 + Sn Sn402 1.0 0.83333 0.25000 0.40057 1.0000 + Sn Sn403 1.0 0.86458 0.28125 0.40057 1.0000 + Sn Sn404 1.0 0.89583 0.31250 0.40057 1.0000 + Sn Sn405 1.0 0.92708 0.34375 0.40057 1.0000 + Sn Sn406 1.0 0.95833 0.37500 0.40057 1.0000 + Sn Sn407 1.0 0.98958 0.40625 0.40057 1.0000 + Sn Sn408 1.0 0.02083 0.43750 0.40057 1.0000 + Sn Sn409 1.0 0.05208 0.46875 0.40057 1.0000 + Sn Sn410 1.0 0.08333 0.50000 0.40057 1.0000 + Sn Sn411 1.0 0.11458 0.53125 0.40057 1.0000 + Sn Sn412 1.0 0.14583 0.56250 0.40057 1.0000 + Sn Sn413 1.0 0.17708 0.59375 0.40057 1.0000 + Sn Sn414 1.0 0.20833 0.62500 0.40057 1.0000 + Sn Sn415 1.0 0.23958 0.65625 0.40057 1.0000 + Sn Sn416 1.0 0.27083 0.68750 0.40057 1.0000 + Sn Sn417 1.0 0.83333 0.18750 0.40057 1.0000 + Sn Sn418 1.0 0.86458 0.21875 0.40057 1.0000 + Sn Sn419 1.0 0.89583 0.25000 0.40057 1.0000 + Sn Sn420 1.0 0.92708 0.28125 0.40057 1.0000 + Sn Sn421 1.0 0.95833 0.31250 0.40057 1.0000 + Sn Sn422 1.0 0.98958 0.34375 0.40057 1.0000 + Sn Sn423 1.0 0.02083 0.37500 0.40057 1.0000 + Sn Sn424 1.0 0.05208 0.40625 0.40057 1.0000 + Sn Sn425 1.0 0.08333 0.43750 0.40057 1.0000 + Sn Sn426 1.0 0.11458 0.46875 0.40057 1.0000 + Sn Sn427 1.0 0.14583 0.50000 0.40057 1.0000 + Sn Sn428 1.0 0.17708 0.53125 0.40057 1.0000 + Sn Sn429 1.0 0.20833 0.56250 0.40057 1.0000 + Sn Sn430 1.0 0.23958 0.59375 0.40057 1.0000 + Sn Sn431 1.0 0.27083 0.62500 0.40057 1.0000 + Sn Sn432 1.0 0.30208 0.65625 0.40057 1.0000 + Sn Sn433 1.0 0.86458 0.15625 0.40057 1.0000 + Sn Sn434 1.0 0.89583 0.18750 0.40057 1.0000 + Sn Sn435 1.0 0.92708 0.21875 0.40057 1.0000 + Sn Sn436 1.0 0.95833 0.25000 0.40057 1.0000 + Sn Sn437 1.0 0.98958 0.28125 0.40057 1.0000 + Sn Sn438 1.0 0.02083 0.31250 0.40057 1.0000 + Sn Sn439 1.0 0.05208 0.34375 0.40057 1.0000 + Sn Sn440 1.0 0.08333 0.37500 0.40057 1.0000 + Sn Sn441 1.0 0.11458 0.40625 0.40057 1.0000 + Sn Sn442 1.0 0.14583 0.43750 0.40057 1.0000 + Sn Sn443 1.0 0.17708 0.46875 0.40057 1.0000 + Sn Sn444 1.0 0.20833 0.50000 0.40057 1.0000 + Sn Sn445 1.0 0.23958 0.53125 0.40057 1.0000 + Sn Sn446 1.0 0.27083 0.56250 0.40057 1.0000 + Sn Sn447 1.0 0.30208 0.59375 0.40057 1.0000 + Sn Sn448 1.0 0.33333 0.62500 0.40057 1.0000 + Sn Sn449 1.0 0.89583 0.12500 0.40057 1.0000 + Sn Sn450 1.0 0.92708 0.15625 0.40057 1.0000 + Sn Sn451 1.0 0.95833 0.18750 0.40057 1.0000 + Sn Sn452 1.0 0.98958 0.21875 0.40057 1.0000 + Sn Sn453 1.0 0.02083 0.25000 0.40057 1.0000 + Sn Sn454 1.0 0.05208 0.28125 0.40057 1.0000 + Sn Sn455 1.0 0.08333 0.31250 0.40057 1.0000 + Sn Sn456 1.0 0.11458 0.34375 0.40057 1.0000 + Sn Sn457 1.0 0.14583 0.37500 0.40057 1.0000 + Sn Sn458 1.0 0.17708 0.40625 0.40057 1.0000 + Sn Sn459 1.0 0.20833 0.43750 0.40057 1.0000 + Sn Sn460 1.0 0.23958 0.46875 0.40057 1.0000 + Sn Sn461 1.0 0.27083 0.50000 0.40057 1.0000 + Sn Sn462 1.0 0.30208 0.53125 0.40057 1.0000 + Sn Sn463 1.0 0.33333 0.56250 0.40057 1.0000 + Sn Sn464 1.0 0.36458 0.59375 0.40057 1.0000 + Sn Sn465 1.0 0.92708 0.09375 0.40057 1.0000 + Sn Sn466 1.0 0.95833 0.12500 0.40057 1.0000 + Sn Sn467 1.0 0.98958 0.15625 0.40057 1.0000 + Sn Sn468 1.0 0.02083 0.18750 0.40057 1.0000 + Sn Sn469 1.0 0.05208 0.21875 0.40057 1.0000 + Sn Sn470 1.0 0.08333 0.25000 0.40057 1.0000 + Sn Sn471 1.0 0.11458 0.28125 0.40057 1.0000 + Sn Sn472 1.0 0.14583 0.31250 0.40057 1.0000 + Sn Sn473 1.0 0.17708 0.34375 0.40057 1.0000 + Sn Sn474 1.0 0.20833 0.37500 0.40057 1.0000 + Sn Sn475 1.0 0.23958 0.40625 0.40057 1.0000 + Sn Sn476 1.0 0.27083 0.43750 0.40057 1.0000 + Sn Sn477 1.0 0.30208 0.46875 0.40057 1.0000 + Sn Sn478 1.0 0.33333 0.50000 0.40057 1.0000 + Sn Sn479 1.0 0.36458 0.53125 0.40057 1.0000 + Sn Sn480 1.0 0.39583 0.56250 0.40057 1.0000 + Sn Sn481 1.0 0.95833 0.06250 0.40057 1.0000 + Sn Sn482 1.0 0.98958 0.09375 0.40057 1.0000 + Sn Sn483 1.0 0.02083 0.12500 0.40057 1.0000 + Sn Sn484 1.0 0.05208 0.15625 0.40057 1.0000 + Sn Sn485 1.0 0.08333 0.18750 0.40057 1.0000 + Sn Sn486 1.0 0.11458 0.21875 0.40057 1.0000 + Sn Sn487 1.0 0.14583 0.25000 0.40057 1.0000 + Sn Sn488 1.0 0.17708 0.28125 0.40057 1.0000 + Sn Sn489 1.0 0.20833 0.31250 0.40057 1.0000 + Sn Sn490 1.0 0.23958 0.34375 0.40057 1.0000 + Sn Sn491 1.0 0.27083 0.37500 0.40057 1.0000 + Sn Sn492 1.0 0.30208 0.40625 0.40057 1.0000 + Sn Sn493 1.0 0.33333 0.43750 0.40057 1.0000 + Sn Sn494 1.0 0.36458 0.46875 0.40057 1.0000 + Sn Sn495 1.0 0.39583 0.50000 0.40057 1.0000 + Sn Sn496 1.0 0.42708 0.53125 0.40057 1.0000 + Sn Sn497 1.0 0.98958 0.03125 0.40057 1.0000 + Sn Sn498 1.0 0.02083 0.06250 0.40057 1.0000 + Sn Sn499 1.0 0.05208 0.09375 0.40057 1.0000 + Sn Sn500 1.0 0.08333 0.12500 0.40057 1.0000 + Sn Sn501 1.0 0.11458 0.15625 0.40057 1.0000 + Sn Sn502 1.0 0.14583 0.18750 0.40057 1.0000 + Sn Sn503 1.0 0.17708 0.21875 0.40057 1.0000 + Sn Sn504 1.0 0.20833 0.25000 0.40057 1.0000 + Sn Sn505 1.0 0.23958 0.28125 0.40057 1.0000 + Sn Sn506 1.0 0.27083 0.31250 0.40057 1.0000 + Sn Sn507 1.0 0.30208 0.34375 0.40057 1.0000 + Sn Sn508 1.0 0.33333 0.37500 0.40057 1.0000 + Sn Sn509 1.0 0.36458 0.40625 0.40057 1.0000 + Sn Sn510 1.0 0.39583 0.43750 0.40057 1.0000 + Sn Sn511 1.0 0.42708 0.46875 0.40057 1.0000 + Sn Sn512 1.0 0.45833 0.50000 0.40057 1.0000 + C C257 1.0 0.50000 0.50000 0.59943 1.0000 + C C258 1.0 0.53125 0.53125 0.59943 1.0000 + C C259 1.0 0.56250 0.56250 0.59943 1.0000 + C C260 1.0 0.09375 0.09375 0.59943 1.0000 + C C261 1.0 0.62500 0.62500 0.59943 1.0000 + C C262 1.0 0.65625 0.65625 0.59943 1.0000 + C C263 1.0 0.18750 0.18750 0.59943 1.0000 + C C264 1.0 0.71875 0.71875 0.59943 1.0000 + C C265 1.0 0.75000 0.75000 0.59943 1.0000 + C C266 1.0 0.78125 0.78125 0.59943 1.0000 + C C267 1.0 0.81250 0.81250 0.59943 1.0000 + C C268 1.0 0.84375 0.84375 0.59943 1.0000 + C C269 1.0 0.37500 0.37500 0.59943 1.0000 + C C270 1.0 0.40625 0.40625 0.59943 1.0000 + C C271 1.0 0.93750 0.93750 0.59943 1.0000 + C C272 1.0 0.46875 0.46875 0.59943 1.0000 + C C273 1.0 0.53125 0.46875 0.59943 1.0000 + C C274 1.0 0.56250 0.50000 0.59943 1.0000 + C C275 1.0 0.59375 0.53125 0.59943 1.0000 + C C276 1.0 0.62500 0.56250 0.59943 1.0000 + C C277 1.0 0.65625 0.59375 0.59943 1.0000 + C C278 1.0 0.68750 0.62500 0.59943 1.0000 + C C279 1.0 0.71875 0.65625 0.59943 1.0000 + C C280 1.0 0.75000 0.68750 0.59943 1.0000 + C C281 1.0 0.78125 0.71875 0.59943 1.0000 + C C282 1.0 0.81250 0.75000 0.59943 1.0000 + C C283 1.0 0.84375 0.78125 0.59943 1.0000 + C C284 1.0 0.87500 0.81250 0.59943 1.0000 + C C285 1.0 0.90625 0.84375 0.59943 1.0000 + C C286 1.0 0.93750 0.87500 0.59943 1.0000 + C C287 1.0 0.96875 0.90625 0.59943 1.0000 + C C288 1.0 0.00000 0.93750 0.59943 1.0000 + C C289 1.0 0.56250 0.43750 0.59943 1.0000 + C C290 1.0 0.59375 0.46875 0.59943 1.0000 + C C291 1.0 0.62500 0.50000 0.59943 1.0000 + C C292 1.0 0.65625 0.53125 0.59943 1.0000 + C C293 1.0 0.68750 0.56250 0.59943 1.0000 + C C294 1.0 0.71875 0.59375 0.59943 1.0000 + C C295 1.0 0.75000 0.62500 0.59943 1.0000 + C C296 1.0 0.78125 0.65625 0.59943 1.0000 + C C297 1.0 0.81250 0.68750 0.59943 1.0000 + C C298 1.0 0.84375 0.71875 0.59943 1.0000 + C C299 1.0 0.87500 0.75000 0.59943 1.0000 + C C300 1.0 0.90625 0.78125 0.59943 1.0000 + C C301 1.0 0.93750 0.81250 0.59943 1.0000 + C C302 1.0 0.96875 0.84375 0.59943 1.0000 + C C303 1.0 0.00000 0.87500 0.59943 1.0000 + C C304 1.0 0.03125 0.90625 0.59943 1.0000 + C C305 1.0 0.59375 0.40625 0.59943 1.0000 + C C306 1.0 0.62500 0.43750 0.59943 1.0000 + C C307 1.0 0.65625 0.46875 0.59943 1.0000 + C C308 1.0 0.68750 0.50000 0.59943 1.0000 + C C309 1.0 0.71875 0.53125 0.59943 1.0000 + C C310 1.0 0.75000 0.56250 0.59943 1.0000 + C C311 1.0 0.78125 0.59375 0.59943 1.0000 + C C312 1.0 0.81250 0.62500 0.59943 1.0000 + C C313 1.0 0.84375 0.65625 0.59943 1.0000 + C C314 1.0 0.87500 0.68750 0.59943 1.0000 + C C315 1.0 0.90625 0.71875 0.59943 1.0000 + C C316 1.0 0.93750 0.75000 0.59943 1.0000 + C C317 1.0 0.96875 0.78125 0.59943 1.0000 + C C318 1.0 0.00000 0.81250 0.59943 1.0000 + C C319 1.0 0.03125 0.84375 0.59943 1.0000 + C C320 1.0 0.06250 0.87500 0.59943 1.0000 + C C321 1.0 0.62500 0.37500 0.59943 1.0000 + C C322 1.0 0.65625 0.40625 0.59943 1.0000 + C C323 1.0 0.68750 0.43750 0.59943 1.0000 + C C324 1.0 0.71875 0.46875 0.59943 1.0000 + C C325 1.0 0.75000 0.50000 0.59943 1.0000 + C C326 1.0 0.78125 0.53125 0.59943 1.0000 + C C327 1.0 0.81250 0.56250 0.59943 1.0000 + C C328 1.0 0.84375 0.59375 0.59943 1.0000 + C C329 1.0 0.87500 0.62500 0.59943 1.0000 + C C330 1.0 0.90625 0.65625 0.59943 1.0000 + C C331 1.0 0.93750 0.68750 0.59943 1.0000 + C C332 1.0 0.96875 0.71875 0.59943 1.0000 + C C333 1.0 0.00000 0.75000 0.59943 1.0000 + C C334 1.0 0.03125 0.78125 0.59943 1.0000 + C C335 1.0 0.06250 0.81250 0.59943 1.0000 + C C336 1.0 0.09375 0.84375 0.59943 1.0000 + C C337 1.0 0.65625 0.34375 0.59943 1.0000 + C C338 1.0 0.68750 0.37500 0.59943 1.0000 + C C339 1.0 0.71875 0.40625 0.59943 1.0000 + C C340 1.0 0.75000 0.43750 0.59943 1.0000 + C C341 1.0 0.78125 0.46875 0.59943 1.0000 + C C342 1.0 0.81250 0.50000 0.59943 1.0000 + C C343 1.0 0.84375 0.53125 0.59943 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Cl Cl954 1.0 0.16116 0.45401 0.42801 1.0000 + Cl Cl955 1.0 0.19241 0.48526 0.42801 1.0000 + Cl Cl956 1.0 0.22366 0.51651 0.42801 1.0000 + Cl Cl957 1.0 0.25491 0.54776 0.42801 1.0000 + Cl Cl958 1.0 0.28616 0.57901 0.42801 1.0000 + Cl Cl959 1.0 0.31741 0.61026 0.42801 1.0000 + Cl Cl960 1.0 0.34866 0.64151 0.42801 1.0000 + Cl Cl961 1.0 0.91116 0.14151 0.42801 1.0000 + Cl Cl962 1.0 0.94241 0.17276 0.42801 1.0000 + Cl Cl963 1.0 0.97366 0.20401 0.42801 1.0000 + Cl Cl964 1.0 0.00491 0.23526 0.42801 1.0000 + Cl Cl965 1.0 0.03616 0.26651 0.42801 1.0000 + Cl Cl966 1.0 0.06741 0.29776 0.42801 1.0000 + Cl Cl967 1.0 0.09866 0.32901 0.42801 1.0000 + Cl Cl968 1.0 0.12991 0.36026 0.42801 1.0000 + Cl Cl969 1.0 0.16116 0.39151 0.42801 1.0000 + Cl Cl970 1.0 0.19241 0.42276 0.42801 1.0000 + Cl Cl971 1.0 0.22366 0.45401 0.42801 1.0000 + Cl Cl972 1.0 0.25491 0.48526 0.42801 1.0000 + Cl Cl973 1.0 0.28616 0.51651 0.42801 1.0000 + Cl Cl974 1.0 0.31741 0.54776 0.42801 1.0000 + Cl Cl975 1.0 0.34866 0.57901 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Cl1061 1.0 0.72366 0.54599 0.42801 1.0000 + Cl Cl1062 1.0 0.75491 0.57724 0.42801 1.0000 + Cl Cl1063 1.0 0.78616 0.60849 0.42801 1.0000 + Cl Cl1064 1.0 0.81741 0.63974 0.42801 1.0000 + Cl Cl1065 1.0 0.84866 0.67099 0.42801 1.0000 + Cl Cl1066 1.0 0.87991 0.70224 0.42801 1.0000 + Cl Cl1067 1.0 0.91116 0.73349 0.42801 1.0000 + Cl Cl1068 1.0 0.94241 0.76474 0.42801 1.0000 + Cl Cl1069 1.0 0.97366 0.79599 0.42801 1.0000 + Cl Cl1070 1.0 0.00491 0.82724 0.42801 1.0000 + Cl Cl1071 1.0 0.03616 0.85849 0.42801 1.0000 + Cl Cl1072 1.0 0.06741 0.88974 0.42801 1.0000 + Cl Cl1073 1.0 0.62991 0.38974 0.42801 1.0000 + Cl Cl1074 1.0 0.66116 0.42099 0.42801 1.0000 + Cl Cl1075 1.0 0.69241 0.45224 0.42801 1.0000 + Cl Cl1076 1.0 0.72366 0.48349 0.42801 1.0000 + Cl Cl1077 1.0 0.75491 0.51474 0.42801 1.0000 + Cl Cl1078 1.0 0.78616 0.54599 0.42801 1.0000 + Cl Cl1079 1.0 0.81741 0.57724 0.42801 1.0000 + Cl Cl1080 1.0 0.84866 0.60849 0.42801 1.0000 + Cl Cl1081 1.0 0.87991 0.63974 0.42801 1.0000 + Cl Cl1082 1.0 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Cl1167 1.0 0.22366 0.67099 0.42801 1.0000 + Cl Cl1168 1.0 0.25491 0.70224 0.42801 1.0000 + Cl Cl1169 1.0 0.81741 0.20224 0.42801 1.0000 + Cl Cl1170 1.0 0.84866 0.23349 0.42801 1.0000 + Cl Cl1171 1.0 0.87991 0.26474 0.42801 1.0000 + Cl Cl1172 1.0 0.91116 0.29599 0.42801 1.0000 + Cl Cl1173 1.0 0.94241 0.32724 0.42801 1.0000 + Cl Cl1174 1.0 0.97366 0.35849 0.42801 1.0000 + Cl Cl1175 1.0 0.00491 0.38974 0.42801 1.0000 + Cl Cl1176 1.0 0.03616 0.42099 0.42801 1.0000 + Cl Cl1177 1.0 0.06741 0.45224 0.42801 1.0000 + Cl Cl1178 1.0 0.09866 0.48349 0.42801 1.0000 + Cl Cl1179 1.0 0.12991 0.51474 0.42801 1.0000 + Cl Cl1180 1.0 0.16116 0.54599 0.42801 1.0000 + Cl Cl1181 1.0 0.19241 0.57724 0.42801 1.0000 + Cl Cl1182 1.0 0.22366 0.60849 0.42801 1.0000 + Cl Cl1183 1.0 0.25491 0.63974 0.42801 1.0000 + Cl Cl1184 1.0 0.28616 0.67099 0.42801 1.0000 + Cl Cl1185 1.0 0.84866 0.17099 0.42801 1.0000 + Cl Cl1186 1.0 0.87991 0.20224 0.42801 1.0000 + Cl Cl1187 1.0 0.91116 0.23349 0.42801 1.0000 + Cl Cl1188 1.0 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0.21875 0.42801 1.0000 + Cl Cl1528 1.0 0.24018 0.25000 0.42801 1.0000 + Cl Cl1529 1.0 0.27143 0.28125 0.42801 1.0000 + Cl Cl1530 1.0 0.30268 0.31250 0.42801 1.0000 + Cl Cl1531 1.0 0.33393 0.34375 0.42801 1.0000 + Cl Cl1532 1.0 0.36518 0.37500 0.42801 1.0000 + Cl Cl1533 1.0 0.39643 0.40625 0.42801 1.0000 + Cl Cl1534 1.0 0.42768 0.43750 0.42801 1.0000 + Cl Cl1535 1.0 0.45893 0.46875 0.42801 1.0000 + Cl Cl1536 1.0 0.49018 0.50000 0.42801 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-5492_supercell_16x16x1.cif b/tier3/cif_file/orthogonal_2dm-5492_supercell_16x16x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..43d1f3a9ac4ab78a272802ec9db67066d89ac5df --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-5492_supercell_16x16x1.cif @@ -0,0 +1,1561 @@ +data_image0 +_chemical_formula_structural Mn256Sb256O1024 +_chemical_formula_sum "Mn256 Sb256 O1024" +_cell_length_a 48.4596 +_cell_length_b 90.3972 +_cell_length_c 6.2358 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Mn Mn1 1.0 0.00000 0.02357 0.50002 1.0000 + Mn Mn2 1.0 0.00000 0.08607 0.50002 1.0000 + Mn Mn3 1.0 0.00000 0.14857 0.50002 1.0000 + Mn Mn4 1.0 0.00000 0.21107 0.50002 1.0000 + Mn Mn5 1.0 0.00000 0.27357 0.50002 1.0000 + Mn Mn6 1.0 0.00000 0.33607 0.50002 1.0000 + Mn Mn7 1.0 0.00000 0.39857 0.50002 1.0000 + Mn Mn8 1.0 0.00000 0.46107 0.50002 1.0000 + Mn Mn9 1.0 0.00000 0.52357 0.50002 1.0000 + Mn Mn10 1.0 0.00000 0.58607 0.50002 1.0000 + Mn Mn11 1.0 0.00000 0.64857 0.50002 1.0000 + Mn Mn12 1.0 0.00000 0.71107 0.50002 1.0000 + Mn Mn13 1.0 0.00000 0.77357 0.50002 1.0000 + Mn Mn14 1.0 0.00000 0.83607 0.50002 1.0000 + Mn Mn15 1.0 0.00000 0.89857 0.50002 1.0000 + Mn Mn16 1.0 0.00000 0.96107 0.50002 1.0000 + Mn Mn17 1.0 0.06250 0.02357 0.50002 1.0000 + Mn Mn18 1.0 0.06250 0.08607 0.50002 1.0000 + Mn Mn19 1.0 0.06250 0.14857 0.50002 1.0000 + Mn Mn20 1.0 0.06250 0.21107 0.50002 1.0000 + Mn Mn21 1.0 0.06250 0.27357 0.50002 1.0000 + Mn Mn22 1.0 0.06250 0.33607 0.50002 1.0000 + Mn Mn23 1.0 0.06250 0.39857 0.50002 1.0000 + Mn Mn24 1.0 0.06250 0.46107 0.50002 1.0000 + Mn Mn25 1.0 0.06250 0.52357 0.50002 1.0000 + Mn Mn26 1.0 0.06250 0.58607 0.50002 1.0000 + Mn Mn27 1.0 0.06250 0.64857 0.50002 1.0000 + Mn Mn28 1.0 0.06250 0.71107 0.50002 1.0000 + Mn Mn29 1.0 0.06250 0.77357 0.50002 1.0000 + Mn Mn30 1.0 0.06250 0.83607 0.50002 1.0000 + Mn Mn31 1.0 0.06250 0.89857 0.50002 1.0000 + Mn Mn32 1.0 0.06250 0.96107 0.50002 1.0000 + Mn Mn33 1.0 0.12500 0.02357 0.50002 1.0000 + Mn Mn34 1.0 0.12500 0.08607 0.50002 1.0000 + Mn Mn35 1.0 0.12500 0.14857 0.50002 1.0000 + Mn Mn36 1.0 0.12500 0.21107 0.50002 1.0000 + Mn Mn37 1.0 0.12500 0.27357 0.50002 1.0000 + Mn Mn38 1.0 0.12500 0.33607 0.50002 1.0000 + Mn Mn39 1.0 0.12500 0.39857 0.50002 1.0000 + Mn Mn40 1.0 0.12500 0.46107 0.50002 1.0000 + Mn Mn41 1.0 0.12500 0.52357 0.50002 1.0000 + Mn Mn42 1.0 0.12500 0.58607 0.50002 1.0000 + Mn Mn43 1.0 0.12500 0.64857 0.50002 1.0000 + Mn Mn44 1.0 0.12500 0.71107 0.50002 1.0000 + Mn Mn45 1.0 0.12500 0.77357 0.50002 1.0000 + Mn Mn46 1.0 0.12500 0.83607 0.50002 1.0000 + Mn Mn47 1.0 0.12500 0.89857 0.50002 1.0000 + Mn Mn48 1.0 0.12500 0.96107 0.50002 1.0000 + Mn Mn49 1.0 0.18750 0.02357 0.50002 1.0000 + Mn Mn50 1.0 0.18750 0.08607 0.50002 1.0000 + Mn Mn51 1.0 0.18750 0.14857 0.50002 1.0000 + Mn Mn52 1.0 0.18750 0.21107 0.50002 1.0000 + Mn Mn53 1.0 0.18750 0.27357 0.50002 1.0000 + Mn Mn54 1.0 0.18750 0.33607 0.50002 1.0000 + Mn Mn55 1.0 0.18750 0.39857 0.50002 1.0000 + Mn Mn56 1.0 0.18750 0.46107 0.50002 1.0000 + Mn Mn57 1.0 0.18750 0.52357 0.50002 1.0000 + Mn Mn58 1.0 0.18750 0.58607 0.50002 1.0000 + Mn Mn59 1.0 0.18750 0.64857 0.50002 1.0000 + Mn Mn60 1.0 0.18750 0.71107 0.50002 1.0000 + Mn Mn61 1.0 0.18750 0.77357 0.50002 1.0000 + Mn Mn62 1.0 0.18750 0.83607 0.50002 1.0000 + Mn Mn63 1.0 0.18750 0.89857 0.50002 1.0000 + Mn Mn64 1.0 0.18750 0.96107 0.50002 1.0000 + Mn Mn65 1.0 0.25000 0.02357 0.50002 1.0000 + Mn Mn66 1.0 0.25000 0.08607 0.50002 1.0000 + Mn Mn67 1.0 0.25000 0.14857 0.50002 1.0000 + Mn Mn68 1.0 0.25000 0.21107 0.50002 1.0000 + Mn Mn69 1.0 0.25000 0.27357 0.50002 1.0000 + Mn Mn70 1.0 0.25000 0.33607 0.50002 1.0000 + Mn Mn71 1.0 0.25000 0.39857 0.50002 1.0000 + Mn Mn72 1.0 0.25000 0.46107 0.50002 1.0000 + Mn Mn73 1.0 0.25000 0.52357 0.50002 1.0000 + Mn Mn74 1.0 0.25000 0.58607 0.50002 1.0000 + Mn Mn75 1.0 0.25000 0.64857 0.50002 1.0000 + Mn Mn76 1.0 0.25000 0.71107 0.50002 1.0000 + Mn Mn77 1.0 0.25000 0.77357 0.50002 1.0000 + Mn Mn78 1.0 0.25000 0.83607 0.50002 1.0000 + Mn Mn79 1.0 0.25000 0.89857 0.50002 1.0000 + Mn Mn80 1.0 0.25000 0.96107 0.50002 1.0000 + Mn Mn81 1.0 0.31250 0.02357 0.50002 1.0000 + Mn Mn82 1.0 0.31250 0.08607 0.50002 1.0000 + Mn Mn83 1.0 0.31250 0.14857 0.50002 1.0000 + Mn Mn84 1.0 0.31250 0.21107 0.50002 1.0000 + Mn Mn85 1.0 0.31250 0.27357 0.50002 1.0000 + Mn Mn86 1.0 0.31250 0.33607 0.50002 1.0000 + Mn Mn87 1.0 0.31250 0.39857 0.50002 1.0000 + Mn Mn88 1.0 0.31250 0.46107 0.50002 1.0000 + Mn Mn89 1.0 0.31250 0.52357 0.50002 1.0000 + Mn Mn90 1.0 0.31250 0.58607 0.50002 1.0000 + Mn Mn91 1.0 0.31250 0.64857 0.50002 1.0000 + Mn Mn92 1.0 0.31250 0.71107 0.50002 1.0000 + Mn Mn93 1.0 0.31250 0.77357 0.50002 1.0000 + Mn Mn94 1.0 0.31250 0.83607 0.50002 1.0000 + Mn Mn95 1.0 0.31250 0.89857 0.50002 1.0000 + Mn Mn96 1.0 0.31250 0.96107 0.50002 1.0000 + Mn Mn97 1.0 0.37500 0.02357 0.50002 1.0000 + Mn Mn98 1.0 0.37500 0.08607 0.50002 1.0000 + Mn Mn99 1.0 0.37500 0.14857 0.50002 1.0000 + Mn Mn100 1.0 0.37500 0.21107 0.50002 1.0000 + Mn Mn101 1.0 0.37500 0.27357 0.50002 1.0000 + Mn Mn102 1.0 0.37500 0.33607 0.50002 1.0000 + Mn Mn103 1.0 0.37500 0.39857 0.50002 1.0000 + Mn Mn104 1.0 0.37500 0.46107 0.50002 1.0000 + Mn Mn105 1.0 0.37500 0.52357 0.50002 1.0000 + Mn Mn106 1.0 0.37500 0.58607 0.50002 1.0000 + Mn Mn107 1.0 0.37500 0.64857 0.50002 1.0000 + Mn Mn108 1.0 0.37500 0.71107 0.50002 1.0000 + Mn Mn109 1.0 0.37500 0.77357 0.50002 1.0000 + Mn Mn110 1.0 0.37500 0.83607 0.50002 1.0000 + Mn Mn111 1.0 0.37500 0.89857 0.50002 1.0000 + Mn Mn112 1.0 0.37500 0.96107 0.50002 1.0000 + Mn Mn113 1.0 0.43750 0.02357 0.50002 1.0000 + Mn Mn114 1.0 0.43750 0.08607 0.50002 1.0000 + Mn Mn115 1.0 0.43750 0.14857 0.50002 1.0000 + Mn Mn116 1.0 0.43750 0.21107 0.50002 1.0000 + Mn Mn117 1.0 0.43750 0.27357 0.50002 1.0000 + Mn Mn118 1.0 0.43750 0.33607 0.50002 1.0000 + Mn Mn119 1.0 0.43750 0.39857 0.50002 1.0000 + Mn Mn120 1.0 0.43750 0.46107 0.50002 1.0000 + Mn Mn121 1.0 0.43750 0.52357 0.50002 1.0000 + Mn Mn122 1.0 0.43750 0.58607 0.50002 1.0000 + Mn Mn123 1.0 0.43750 0.64857 0.50002 1.0000 + Mn Mn124 1.0 0.43750 0.71107 0.50002 1.0000 + Mn Mn125 1.0 0.43750 0.77357 0.50002 1.0000 + Mn Mn126 1.0 0.43750 0.83607 0.50002 1.0000 + Mn Mn127 1.0 0.43750 0.89857 0.50002 1.0000 + Mn Mn128 1.0 0.43750 0.96107 0.50002 1.0000 + Mn Mn129 1.0 0.50000 0.02357 0.50002 1.0000 + Mn Mn130 1.0 0.50000 0.08607 0.50002 1.0000 + Mn Mn131 1.0 0.50000 0.14857 0.50002 1.0000 + Mn Mn132 1.0 0.50000 0.21107 0.50002 1.0000 + Mn Mn133 1.0 0.50000 0.27357 0.50002 1.0000 + Mn Mn134 1.0 0.50000 0.33607 0.50002 1.0000 + Mn Mn135 1.0 0.50000 0.39857 0.50002 1.0000 + Mn Mn136 1.0 0.50000 0.46107 0.50002 1.0000 + Mn Mn137 1.0 0.50000 0.52357 0.50002 1.0000 + Mn Mn138 1.0 0.50000 0.58607 0.50002 1.0000 + Mn Mn139 1.0 0.50000 0.64857 0.50002 1.0000 + Mn Mn140 1.0 0.50000 0.71107 0.50002 1.0000 + Mn Mn141 1.0 0.50000 0.77357 0.50002 1.0000 + Mn Mn142 1.0 0.50000 0.83607 0.50002 1.0000 + Mn Mn143 1.0 0.50000 0.89857 0.50002 1.0000 + Mn Mn144 1.0 0.50000 0.96107 0.50002 1.0000 + Mn Mn145 1.0 0.56250 0.02357 0.50002 1.0000 + Mn Mn146 1.0 0.56250 0.08607 0.50002 1.0000 + Mn Mn147 1.0 0.56250 0.14857 0.50002 1.0000 + Mn Mn148 1.0 0.56250 0.21107 0.50002 1.0000 + Mn Mn149 1.0 0.56250 0.27357 0.50002 1.0000 + Mn Mn150 1.0 0.56250 0.33607 0.50002 1.0000 + Mn Mn151 1.0 0.56250 0.39857 0.50002 1.0000 + Mn Mn152 1.0 0.56250 0.46107 0.50002 1.0000 + Mn Mn153 1.0 0.56250 0.52357 0.50002 1.0000 + Mn Mn154 1.0 0.56250 0.58607 0.50002 1.0000 + Mn Mn155 1.0 0.56250 0.64857 0.50002 1.0000 + Mn Mn156 1.0 0.56250 0.71107 0.50002 1.0000 + Mn Mn157 1.0 0.56250 0.77357 0.50002 1.0000 + Mn Mn158 1.0 0.56250 0.83607 0.50002 1.0000 + Mn Mn159 1.0 0.56250 0.89857 0.50002 1.0000 + Mn Mn160 1.0 0.56250 0.96107 0.50002 1.0000 + Mn Mn161 1.0 0.62500 0.02357 0.50002 1.0000 + Mn Mn162 1.0 0.62500 0.08607 0.50002 1.0000 + Mn Mn163 1.0 0.62500 0.14857 0.50002 1.0000 + Mn Mn164 1.0 0.62500 0.21107 0.50002 1.0000 + Mn Mn165 1.0 0.62500 0.27357 0.50002 1.0000 + Mn Mn166 1.0 0.62500 0.33607 0.50002 1.0000 + Mn Mn167 1.0 0.62500 0.39857 0.50002 1.0000 + Mn Mn168 1.0 0.62500 0.46107 0.50002 1.0000 + Mn Mn169 1.0 0.62500 0.52357 0.50002 1.0000 + Mn Mn170 1.0 0.62500 0.58607 0.50002 1.0000 + Mn Mn171 1.0 0.62500 0.64857 0.50002 1.0000 + Mn Mn172 1.0 0.62500 0.71107 0.50002 1.0000 + Mn Mn173 1.0 0.62500 0.77357 0.50002 1.0000 + Mn Mn174 1.0 0.62500 0.83607 0.50002 1.0000 + Mn Mn175 1.0 0.62500 0.89857 0.50002 1.0000 + Mn Mn176 1.0 0.62500 0.96107 0.50002 1.0000 + Mn Mn177 1.0 0.68750 0.02357 0.50002 1.0000 + Mn Mn178 1.0 0.68750 0.08607 0.50002 1.0000 + Mn Mn179 1.0 0.68750 0.14857 0.50002 1.0000 + Mn Mn180 1.0 0.68750 0.21107 0.50002 1.0000 + Mn Mn181 1.0 0.68750 0.27357 0.50002 1.0000 + Mn Mn182 1.0 0.68750 0.33607 0.50002 1.0000 + Mn Mn183 1.0 0.68750 0.39857 0.50002 1.0000 + Mn Mn184 1.0 0.68750 0.46107 0.50002 1.0000 + Mn Mn185 1.0 0.68750 0.52357 0.50002 1.0000 + Mn Mn186 1.0 0.68750 0.58607 0.50002 1.0000 + Mn Mn187 1.0 0.68750 0.64857 0.50002 1.0000 + Mn Mn188 1.0 0.68750 0.71107 0.50002 1.0000 + Mn Mn189 1.0 0.68750 0.77357 0.50002 1.0000 + Mn Mn190 1.0 0.68750 0.83607 0.50002 1.0000 + Mn Mn191 1.0 0.68750 0.89857 0.50002 1.0000 + Mn Mn192 1.0 0.68750 0.96107 0.50002 1.0000 + Mn Mn193 1.0 0.75000 0.02357 0.50002 1.0000 + Mn Mn194 1.0 0.75000 0.08607 0.50002 1.0000 + Mn Mn195 1.0 0.75000 0.14857 0.50002 1.0000 + Mn Mn196 1.0 0.75000 0.21107 0.50002 1.0000 + Mn Mn197 1.0 0.75000 0.27357 0.50002 1.0000 + Mn Mn198 1.0 0.75000 0.33607 0.50002 1.0000 + Mn Mn199 1.0 0.75000 0.39857 0.50002 1.0000 + Mn Mn200 1.0 0.75000 0.46107 0.50002 1.0000 + Mn Mn201 1.0 0.75000 0.52357 0.50002 1.0000 + Mn Mn202 1.0 0.75000 0.58607 0.50002 1.0000 + Mn Mn203 1.0 0.75000 0.64857 0.50002 1.0000 + Mn Mn204 1.0 0.75000 0.71107 0.50002 1.0000 + Mn Mn205 1.0 0.75000 0.77357 0.50002 1.0000 + Mn Mn206 1.0 0.75000 0.83607 0.50002 1.0000 + Mn Mn207 1.0 0.75000 0.89857 0.50002 1.0000 + Mn Mn208 1.0 0.75000 0.96107 0.50002 1.0000 + Mn Mn209 1.0 0.81250 0.02357 0.50002 1.0000 + Mn Mn210 1.0 0.81250 0.08607 0.50002 1.0000 + Mn Mn211 1.0 0.81250 0.14857 0.50002 1.0000 + Mn Mn212 1.0 0.81250 0.21107 0.50002 1.0000 + Mn Mn213 1.0 0.81250 0.27357 0.50002 1.0000 + Mn Mn214 1.0 0.81250 0.33607 0.50002 1.0000 + Mn Mn215 1.0 0.81250 0.39857 0.50002 1.0000 + Mn Mn216 1.0 0.81250 0.46107 0.50002 1.0000 + Mn Mn217 1.0 0.81250 0.52357 0.50002 1.0000 + Mn Mn218 1.0 0.81250 0.58607 0.50002 1.0000 + Mn Mn219 1.0 0.81250 0.64857 0.50002 1.0000 + Mn Mn220 1.0 0.81250 0.71107 0.50002 1.0000 + Mn Mn221 1.0 0.81250 0.77357 0.50002 1.0000 + Mn Mn222 1.0 0.81250 0.83607 0.50002 1.0000 + Mn Mn223 1.0 0.81250 0.89857 0.50002 1.0000 + Mn Mn224 1.0 0.81250 0.96107 0.50002 1.0000 + Mn Mn225 1.0 0.87500 0.02357 0.50002 1.0000 + Mn Mn226 1.0 0.87500 0.08607 0.50002 1.0000 + Mn Mn227 1.0 0.87500 0.14857 0.50002 1.0000 + Mn Mn228 1.0 0.87500 0.21107 0.50002 1.0000 + Mn Mn229 1.0 0.87500 0.27357 0.50002 1.0000 + Mn Mn230 1.0 0.87500 0.33607 0.50002 1.0000 + Mn Mn231 1.0 0.87500 0.39857 0.50002 1.0000 + Mn Mn232 1.0 0.87500 0.46107 0.50002 1.0000 + Mn Mn233 1.0 0.87500 0.52357 0.50002 1.0000 + Mn Mn234 1.0 0.87500 0.58607 0.50002 1.0000 + Mn Mn235 1.0 0.87500 0.64857 0.50002 1.0000 + Mn Mn236 1.0 0.87500 0.71107 0.50002 1.0000 + Mn Mn237 1.0 0.87500 0.77357 0.50002 1.0000 + Mn Mn238 1.0 0.87500 0.83607 0.50002 1.0000 + Mn Mn239 1.0 0.87500 0.89857 0.50002 1.0000 + Mn Mn240 1.0 0.87500 0.96107 0.50002 1.0000 + Mn Mn241 1.0 0.93750 0.02357 0.50002 1.0000 + Mn Mn242 1.0 0.93750 0.08607 0.50002 1.0000 + Mn Mn243 1.0 0.93750 0.14857 0.50002 1.0000 + Mn Mn244 1.0 0.93750 0.21107 0.50002 1.0000 + Mn Mn245 1.0 0.93750 0.27357 0.50002 1.0000 + Mn Mn246 1.0 0.93750 0.33607 0.50002 1.0000 + Mn Mn247 1.0 0.93750 0.39857 0.50002 1.0000 + Mn Mn248 1.0 0.93750 0.46107 0.50002 1.0000 + Mn Mn249 1.0 0.93750 0.52357 0.50002 1.0000 + Mn Mn250 1.0 0.93750 0.58607 0.50002 1.0000 + Mn Mn251 1.0 0.93750 0.64857 0.50002 1.0000 + Mn Mn252 1.0 0.93750 0.71107 0.50002 1.0000 + Mn Mn253 1.0 0.93750 0.77357 0.50002 1.0000 + Mn Mn254 1.0 0.93750 0.83607 0.50002 1.0000 + Mn Mn255 1.0 0.93750 0.89857 0.50002 1.0000 + Mn Mn256 1.0 0.93750 0.96107 0.50002 1.0000 + 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+_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Ti Ti1 1.0 0.00000 0.00000 0.50000 1.0000 + Ti Ti2 1.0 0.95833 0.04167 0.50000 1.0000 + Ti Ti3 1.0 0.91667 0.08333 0.50000 1.0000 + Ti Ti4 1.0 0.87500 0.12500 0.50000 1.0000 + Ti Ti5 1.0 0.83333 0.16667 0.50000 1.0000 + Ti Ti6 1.0 0.79167 0.20833 0.50000 1.0000 + Ti Ti7 1.0 0.75000 0.25000 0.50000 1.0000 + Ti Ti8 1.0 0.20833 0.79167 0.50000 1.0000 + Ti Ti9 1.0 0.66667 0.33333 0.50000 1.0000 + Ti Ti10 1.0 0.62500 0.37500 0.50000 1.0000 + Ti Ti11 1.0 0.58333 0.41667 0.50000 1.0000 + Ti Ti12 1.0 0.54167 0.45833 0.50000 1.0000 + Ti Ti13 1.0 0.04167 0.04167 0.50000 1.0000 + Ti Ti14 1.0 0.00000 0.08333 0.50000 1.0000 + Ti Ti15 1.0 0.95833 0.12500 0.50000 1.0000 + Ti Ti16 1.0 0.91667 0.16667 0.50000 1.0000 + Ti Ti17 1.0 0.87500 0.20833 0.50000 1.0000 + Ti Ti18 1.0 0.83333 0.25000 0.50000 1.0000 + Ti Ti19 1.0 0.79167 0.29167 0.50000 1.0000 + Ti Ti20 1.0 0.75000 0.33333 0.50000 1.0000 + Ti Ti21 1.0 0.70833 0.37500 0.50000 1.0000 + Ti Ti22 1.0 0.66667 0.41667 0.50000 1.0000 + Ti Ti23 1.0 0.62500 0.45833 0.50000 1.0000 + Ti Ti24 1.0 0.58333 0.50000 0.50000 1.0000 + Ti Ti25 1.0 0.08333 0.08333 0.50000 1.0000 + Ti Ti26 1.0 0.04167 0.12500 0.50000 1.0000 + Ti Ti27 1.0 0.00000 0.16667 0.50000 1.0000 + Ti Ti28 1.0 0.95833 0.20833 0.50000 1.0000 + Ti Ti29 1.0 0.91667 0.25000 0.50000 1.0000 + Ti Ti30 1.0 0.87500 0.29167 0.50000 1.0000 + Ti Ti31 1.0 0.83333 0.33333 0.50000 1.0000 + Ti Ti32 1.0 0.79167 0.37500 0.50000 1.0000 + Ti Ti33 1.0 0.75000 0.41667 0.50000 1.0000 + Ti Ti34 1.0 0.70833 0.45833 0.50000 1.0000 + Ti Ti35 1.0 0.66667 0.50000 0.50000 1.0000 + Ti Ti36 1.0 0.62500 0.54167 0.50000 1.0000 + Ti Ti37 1.0 0.12500 0.12500 0.50000 1.0000 + Ti Ti38 1.0 0.08333 0.16667 0.50000 1.0000 + Ti Ti39 1.0 0.04167 0.20833 0.50000 1.0000 + Ti Ti40 1.0 0.00000 0.25000 0.50000 1.0000 + Ti Ti41 1.0 0.95833 0.29167 0.50000 1.0000 + Ti Ti42 1.0 0.91667 0.33333 0.50000 1.0000 + Ti Ti43 1.0 0.87500 0.37500 0.50000 1.0000 + Ti Ti44 1.0 0.83333 0.41667 0.50000 1.0000 + Ti Ti45 1.0 0.79167 0.45833 0.50000 1.0000 + Ti Ti46 1.0 0.75000 0.50000 0.50000 1.0000 + Ti Ti47 1.0 0.70833 0.54167 0.50000 1.0000 + Ti Ti48 1.0 0.66667 0.58333 0.50000 1.0000 + Ti Ti49 1.0 0.16667 0.16667 0.50000 1.0000 + Ti Ti50 1.0 0.12500 0.20833 0.50000 1.0000 + Ti Ti51 1.0 0.08333 0.25000 0.50000 1.0000 + Ti Ti52 1.0 0.04167 0.29167 0.50000 1.0000 + Ti Ti53 1.0 0.00000 0.33333 0.50000 1.0000 + Ti Ti54 1.0 0.95833 0.37500 0.50000 1.0000 + Ti Ti55 1.0 0.91667 0.41667 0.50000 1.0000 + Ti Ti56 1.0 0.87500 0.45833 0.50000 1.0000 + Ti Ti57 1.0 0.83333 0.50000 0.50000 1.0000 + Ti Ti58 1.0 0.79167 0.54167 0.50000 1.0000 + Ti Ti59 1.0 0.75000 0.58333 0.50000 1.0000 + Ti Ti60 1.0 0.70833 0.62500 0.50000 1.0000 + Ti Ti61 1.0 0.20833 0.20833 0.50000 1.0000 + Ti Ti62 1.0 0.16667 0.25000 0.50000 1.0000 + Ti Ti63 1.0 0.12500 0.29167 0.50000 1.0000 + Ti Ti64 1.0 0.08333 0.33333 0.50000 1.0000 + Ti Ti65 1.0 0.04167 0.37500 0.50000 1.0000 + Ti Ti66 1.0 0.00000 0.41667 0.50000 1.0000 + Ti Ti67 1.0 0.95833 0.45833 0.50000 1.0000 + Ti Ti68 1.0 0.91667 0.50000 0.50000 1.0000 + Ti Ti69 1.0 0.87500 0.54167 0.50000 1.0000 + Ti Ti70 1.0 0.83333 0.58333 0.50000 1.0000 + Ti Ti71 1.0 0.79167 0.62500 0.50000 1.0000 + Ti Ti72 1.0 0.75000 0.66667 0.50000 1.0000 + Ti Ti73 1.0 0.25000 0.25000 0.50000 1.0000 + Ti Ti74 1.0 0.20833 0.29167 0.50000 1.0000 + Ti Ti75 1.0 0.16667 0.33333 0.50000 1.0000 + Ti Ti76 1.0 0.12500 0.37500 0.50000 1.0000 + Ti Ti77 1.0 0.08333 0.41667 0.50000 1.0000 + Ti Ti78 1.0 0.04167 0.45833 0.50000 1.0000 + Ti Ti79 1.0 0.00000 0.50000 0.50000 1.0000 + Ti Ti80 1.0 0.95833 0.54167 0.50000 1.0000 + Ti Ti81 1.0 0.91667 0.58333 0.50000 1.0000 + Ti Ti82 1.0 0.87500 0.62500 0.50000 1.0000 + Ti Ti83 1.0 0.83333 0.66667 0.50000 1.0000 + Ti Ti84 1.0 0.79167 0.70833 0.50000 1.0000 + Ti Ti85 1.0 0.29167 0.29167 0.50000 1.0000 + Ti Ti86 1.0 0.25000 0.33333 0.50000 1.0000 + Ti Ti87 1.0 0.20833 0.37500 0.50000 1.0000 + Ti Ti88 1.0 0.16667 0.41667 0.50000 1.0000 + Ti Ti89 1.0 0.12500 0.45833 0.50000 1.0000 + Ti Ti90 1.0 0.08333 0.50000 0.50000 1.0000 + Ti Ti91 1.0 0.04167 0.54167 0.50000 1.0000 + Ti Ti92 1.0 0.00000 0.58333 0.50000 1.0000 + Ti Ti93 1.0 0.95833 0.62500 0.50000 1.0000 + Ti Ti94 1.0 0.91667 0.66667 0.50000 1.0000 + Ti Ti95 1.0 0.87500 0.70833 0.50000 1.0000 + Ti Ti96 1.0 0.83333 0.75000 0.50000 1.0000 + Ti Ti97 1.0 0.33333 0.33333 0.50000 1.0000 + Ti Ti98 1.0 0.29167 0.37500 0.50000 1.0000 + Ti Ti99 1.0 0.25000 0.41667 0.50000 1.0000 + Ti Ti100 1.0 0.20833 0.45833 0.50000 1.0000 + Ti Ti101 1.0 0.16667 0.50000 0.50000 1.0000 + Ti Ti102 1.0 0.12500 0.54167 0.50000 1.0000 + Ti Ti103 1.0 0.08333 0.58333 0.50000 1.0000 + Ti Ti104 1.0 0.04167 0.62500 0.50000 1.0000 + Ti Ti105 1.0 0.00000 0.66667 0.50000 1.0000 + Ti Ti106 1.0 0.95833 0.70833 0.50000 1.0000 + Ti Ti107 1.0 0.91667 0.75000 0.50000 1.0000 + Ti Ti108 1.0 0.87500 0.79167 0.50000 1.0000 + Ti Ti109 1.0 0.37500 0.37500 0.50000 1.0000 + Ti Ti110 1.0 0.33333 0.41667 0.50000 1.0000 + Ti Ti111 1.0 0.29167 0.45833 0.50000 1.0000 + Ti Ti112 1.0 0.25000 0.50000 0.50000 1.0000 + Ti Ti113 1.0 0.20833 0.54167 0.50000 1.0000 + Ti Ti114 1.0 0.16667 0.58333 0.50000 1.0000 + Ti Ti115 1.0 0.12500 0.62500 0.50000 1.0000 + Ti Ti116 1.0 0.08333 0.66667 0.50000 1.0000 + Ti Ti117 1.0 0.04167 0.70833 0.50000 1.0000 + Ti Ti118 1.0 0.00000 0.75000 0.50000 1.0000 + Ti Ti119 1.0 0.95833 0.79167 0.50000 1.0000 + Ti Ti120 1.0 0.91667 0.83333 0.50000 1.0000 + Ti Ti121 1.0 0.41667 0.41667 0.50000 1.0000 + Ti Ti122 1.0 0.37500 0.45833 0.50000 1.0000 + Ti Ti123 1.0 0.33333 0.50000 0.50000 1.0000 + Ti Ti124 1.0 0.29167 0.54167 0.50000 1.0000 + Ti Ti125 1.0 0.25000 0.58333 0.50000 1.0000 + Ti Ti126 1.0 0.20833 0.62500 0.50000 1.0000 + Ti Ti127 1.0 0.16667 0.66667 0.50000 1.0000 + Ti Ti128 1.0 0.12500 0.70833 0.50000 1.0000 + Ti Ti129 1.0 0.08333 0.75000 0.50000 1.0000 + Ti Ti130 1.0 0.04167 0.79167 0.50000 1.0000 + Ti Ti131 1.0 1.00000 0.83333 0.50000 1.0000 + Ti Ti132 1.0 0.95833 0.87500 0.50000 1.0000 + Ti Ti133 1.0 0.45833 0.45833 0.50000 1.0000 + Ti Ti134 1.0 0.41667 0.50000 0.50000 1.0000 + Ti Ti135 1.0 0.37500 0.54167 0.50000 1.0000 + Ti Ti136 1.0 0.33333 0.58333 0.50000 1.0000 + Ti Ti137 1.0 0.29167 0.62500 0.50000 1.0000 + Ti Ti138 1.0 0.25000 0.66667 0.50000 1.0000 + Ti Ti139 1.0 0.20833 0.70833 0.50000 1.0000 + Ti Ti140 1.0 0.16667 0.75000 0.50000 1.0000 + Ti Ti141 1.0 0.12500 0.79167 0.50000 1.0000 + Ti Ti142 1.0 0.08333 0.83333 0.50000 1.0000 + Ti Ti143 1.0 0.04167 0.87500 0.50000 1.0000 + Ti Ti144 1.0 1.00000 0.91667 0.50000 1.0000 + Tl Tl1 1.0 0.98611 0.04167 0.30350 1.0000 + Tl Tl2 1.0 0.94444 0.08333 0.30350 1.0000 + Tl Tl3 1.0 0.90278 0.12500 0.30350 1.0000 + Tl Tl4 1.0 0.86111 0.16667 0.30350 1.0000 + Tl Tl5 1.0 0.81944 0.20833 0.30350 1.0000 + Tl Tl6 1.0 0.77778 0.25000 0.30350 1.0000 + Tl Tl7 1.0 0.73611 0.29167 0.30350 1.0000 + Tl Tl8 1.0 0.69444 0.33333 0.30350 1.0000 + Tl Tl9 1.0 0.65278 0.37500 0.30350 1.0000 + Tl Tl10 1.0 0.61111 0.41667 0.30350 1.0000 + Tl Tl11 1.0 0.56944 0.45833 0.30350 1.0000 + Tl Tl12 1.0 0.52778 0.50000 0.30350 1.0000 + Tl Tl13 1.0 0.02778 0.08333 0.30350 1.0000 + Tl Tl14 1.0 0.98611 0.12500 0.30350 1.0000 + Tl Tl15 1.0 0.94444 0.16667 0.30350 1.0000 + Tl Tl16 1.0 0.90278 0.20833 0.30350 1.0000 + Tl Tl17 1.0 0.86111 0.25000 0.30350 1.0000 + Tl Tl18 1.0 0.81944 0.29167 0.30350 1.0000 + Tl Tl19 1.0 0.77778 0.33333 0.30350 1.0000 + Tl Tl20 1.0 0.73611 0.37500 0.30350 1.0000 + Tl Tl21 1.0 0.69444 0.41667 0.30350 1.0000 + Tl Tl22 1.0 0.65278 0.45833 0.30350 1.0000 + Tl Tl23 1.0 0.61111 0.50000 0.30350 1.0000 + Tl Tl24 1.0 0.56944 0.54167 0.30350 1.0000 + Tl Tl25 1.0 0.06944 0.12500 0.30350 1.0000 + Tl Tl26 1.0 0.02778 0.16667 0.30350 1.0000 + Tl Tl27 1.0 0.98611 0.20833 0.30350 1.0000 + Tl Tl28 1.0 0.94444 0.25000 0.30350 1.0000 + Tl Tl29 1.0 0.90278 0.29167 0.30350 1.0000 + Tl Tl30 1.0 0.86111 0.33333 0.30350 1.0000 + Tl Tl31 1.0 0.81944 0.37500 0.30350 1.0000 + Tl Tl32 1.0 0.77778 0.41667 0.30350 1.0000 + Tl Tl33 1.0 0.73611 0.45833 0.30350 1.0000 + Tl Tl34 1.0 0.69444 0.50000 0.30350 1.0000 + Tl Tl35 1.0 0.65278 0.54167 0.30350 1.0000 + Tl Tl36 1.0 0.61111 0.58333 0.30350 1.0000 + Tl Tl37 1.0 0.11111 0.16667 0.30350 1.0000 + Tl Tl38 1.0 0.06944 0.20833 0.30350 1.0000 + Tl Tl39 1.0 0.02778 0.25000 0.30350 1.0000 + Tl Tl40 1.0 0.98611 0.29167 0.30350 1.0000 + Tl Tl41 1.0 0.94444 0.33333 0.30350 1.0000 + Tl Tl42 1.0 0.90278 0.37500 0.30350 1.0000 + Tl Tl43 1.0 0.86111 0.41667 0.30350 1.0000 + Tl Tl44 1.0 0.81944 0.45833 0.30350 1.0000 + Tl Tl45 1.0 0.77778 0.50000 0.30350 1.0000 + Tl Tl46 1.0 0.73611 0.54167 0.30350 1.0000 + Tl Tl47 1.0 0.69444 0.58333 0.30350 1.0000 + Tl Tl48 1.0 0.65278 0.62500 0.30350 1.0000 + Tl Tl49 1.0 0.15278 0.20833 0.30350 1.0000 + Tl Tl50 1.0 0.11111 0.25000 0.30350 1.0000 + Tl Tl51 1.0 0.06944 0.29167 0.30350 1.0000 + Tl Tl52 1.0 0.02778 0.33333 0.30350 1.0000 + Tl Tl53 1.0 0.98611 0.37500 0.30350 1.0000 + Tl Tl54 1.0 0.94444 0.41667 0.30350 1.0000 + Tl Tl55 1.0 0.90278 0.45833 0.30350 1.0000 + Tl Tl56 1.0 0.86111 0.50000 0.30350 1.0000 + Tl Tl57 1.0 0.81944 0.54167 0.30350 1.0000 + Tl Tl58 1.0 0.77778 0.58333 0.30350 1.0000 + Tl Tl59 1.0 0.73611 0.62500 0.30350 1.0000 + Tl Tl60 1.0 0.69444 0.66667 0.30350 1.0000 + Tl Tl61 1.0 0.19444 0.25000 0.30350 1.0000 + Tl Tl62 1.0 0.15278 0.29167 0.30350 1.0000 + Tl Tl63 1.0 0.11111 0.33333 0.30350 1.0000 + Tl Tl64 1.0 0.06944 0.37500 0.30350 1.0000 + Tl Tl65 1.0 0.02778 0.41667 0.30350 1.0000 + Tl Tl66 1.0 0.98611 0.45833 0.30350 1.0000 + Tl Tl67 1.0 0.94444 0.50000 0.30350 1.0000 + Tl Tl68 1.0 0.90278 0.54167 0.30350 1.0000 + Tl Tl69 1.0 0.86111 0.58333 0.30350 1.0000 + Tl Tl70 1.0 0.81944 0.62500 0.30350 1.0000 + Tl Tl71 1.0 0.77778 0.66667 0.30350 1.0000 + Tl Tl72 1.0 0.73611 0.70833 0.30350 1.0000 + Tl Tl73 1.0 0.23611 0.29167 0.30350 1.0000 + Tl Tl74 1.0 0.19444 0.33333 0.30350 1.0000 + Tl Tl75 1.0 0.15278 0.37500 0.30350 1.0000 + Tl Tl76 1.0 0.11111 0.41667 0.30350 1.0000 + Tl Tl77 1.0 0.06944 0.45833 0.30350 1.0000 + Tl Tl78 1.0 0.02778 0.50000 0.30350 1.0000 + Tl Tl79 1.0 0.98611 0.54167 0.30350 1.0000 + Tl Tl80 1.0 0.94444 0.58333 0.30350 1.0000 + Tl Tl81 1.0 0.90278 0.62500 0.30350 1.0000 + Tl Tl82 1.0 0.86111 0.66667 0.30350 1.0000 + Tl Tl83 1.0 0.81944 0.70833 0.30350 1.0000 + Tl Tl84 1.0 0.77778 0.75000 0.30350 1.0000 + Tl Tl85 1.0 0.27778 0.33333 0.30350 1.0000 + Tl Tl86 1.0 0.23611 0.37500 0.30350 1.0000 + Tl Tl87 1.0 0.19444 0.41667 0.30350 1.0000 + Tl Tl88 1.0 0.15278 0.45833 0.30350 1.0000 + Tl Tl89 1.0 0.11111 0.50000 0.30350 1.0000 + Tl Tl90 1.0 0.06944 0.54167 0.30350 1.0000 + Tl Tl91 1.0 0.02778 0.58333 0.30350 1.0000 + Tl Tl92 1.0 0.98611 0.62500 0.30350 1.0000 + Tl Tl93 1.0 0.94444 0.66667 0.30350 1.0000 + Tl Tl94 1.0 0.90278 0.70833 0.30350 1.0000 + Tl Tl95 1.0 0.86111 0.75000 0.30350 1.0000 + Tl Tl96 1.0 0.81944 0.79167 0.30350 1.0000 + Tl Tl97 1.0 0.31944 0.37500 0.30350 1.0000 + Tl Tl98 1.0 0.27778 0.41667 0.30350 1.0000 + Tl Tl99 1.0 0.23611 0.45833 0.30350 1.0000 + Tl Tl100 1.0 0.19444 0.50000 0.30350 1.0000 + Tl Tl101 1.0 0.15278 0.54167 0.30350 1.0000 + Tl Tl102 1.0 0.11111 0.58333 0.30350 1.0000 + Tl Tl103 1.0 0.06944 0.62500 0.30350 1.0000 + Tl Tl104 1.0 0.02778 0.66667 0.30350 1.0000 + Tl Tl105 1.0 0.98611 0.70833 0.30350 1.0000 + Tl Tl106 1.0 0.94444 0.75000 0.30350 1.0000 + Tl Tl107 1.0 0.90278 0.79167 0.30350 1.0000 + Tl Tl108 1.0 0.86111 0.83333 0.30350 1.0000 + Tl Tl109 1.0 0.36111 0.41667 0.30350 1.0000 + Tl Tl110 1.0 0.31944 0.45833 0.30350 1.0000 + Tl Tl111 1.0 0.27778 0.50000 0.30350 1.0000 + Tl Tl112 1.0 0.23611 0.54167 0.30350 1.0000 + Tl Tl113 1.0 0.19444 0.58333 0.30350 1.0000 + Tl Tl114 1.0 0.15278 0.62500 0.30350 1.0000 + Tl Tl115 1.0 0.11111 0.66667 0.30350 1.0000 + Tl Tl116 1.0 0.06944 0.70833 0.30350 1.0000 + Tl Tl117 1.0 0.02778 0.75000 0.30350 1.0000 + Tl Tl118 1.0 0.98611 0.79167 0.30350 1.0000 + Tl Tl119 1.0 0.94444 0.83333 0.30350 1.0000 + Tl Tl120 1.0 0.90278 0.87500 0.30350 1.0000 + Tl Tl121 1.0 0.40278 0.45833 0.30350 1.0000 + Tl Tl122 1.0 0.36111 0.50000 0.30350 1.0000 + Tl Tl123 1.0 0.31944 0.54167 0.30350 1.0000 + Tl Tl124 1.0 0.27778 0.58333 0.30350 1.0000 + Tl Tl125 1.0 0.23611 0.62500 0.30350 1.0000 + Tl Tl126 1.0 0.19444 0.66667 0.30350 1.0000 + Tl Tl127 1.0 0.15278 0.70833 0.30350 1.0000 + Tl Tl128 1.0 0.11111 0.75000 0.30350 1.0000 + Tl Tl129 1.0 0.06944 0.79167 0.30350 1.0000 + Tl Tl130 1.0 0.02778 0.83333 0.30350 1.0000 + Tl Tl131 1.0 0.98611 0.87500 0.30350 1.0000 + Tl Tl132 1.0 0.94444 0.91667 0.30350 1.0000 + Tl Tl133 1.0 0.44444 0.50000 0.30350 1.0000 + Tl Tl134 1.0 0.40278 0.54167 0.30350 1.0000 + Tl Tl135 1.0 0.36111 0.58333 0.30350 1.0000 + Tl Tl136 1.0 0.31944 0.62500 0.30350 1.0000 + Tl Tl137 1.0 0.27778 0.66667 0.30350 1.0000 + Tl Tl138 1.0 0.23611 0.70833 0.30350 1.0000 + Tl Tl139 1.0 0.19444 0.75000 0.30350 1.0000 + Tl Tl140 1.0 0.15278 0.79167 0.30350 1.0000 + Tl Tl141 1.0 0.11111 0.83333 0.30350 1.0000 + Tl Tl142 1.0 0.06944 0.87500 0.30350 1.0000 + Tl Tl143 1.0 0.02778 0.91667 0.30350 1.0000 + Tl Tl144 1.0 0.98611 0.95833 0.30350 1.0000 + Tl Tl145 1.0 0.01389 0.04167 0.69650 1.0000 + Tl Tl146 1.0 0.97222 0.08333 0.69650 1.0000 + Tl Tl147 1.0 0.93056 0.12500 0.69650 1.0000 + Tl Tl148 1.0 0.88889 0.16667 0.69650 1.0000 + Tl Tl149 1.0 0.84722 0.20833 0.69650 1.0000 + Tl Tl150 1.0 0.80556 0.25000 0.69650 1.0000 + Tl Tl151 1.0 0.76389 0.29167 0.69650 1.0000 + Tl Tl152 1.0 0.72222 0.33333 0.69650 1.0000 + Tl Tl153 1.0 0.68056 0.37500 0.69650 1.0000 + Tl Tl154 1.0 0.63889 0.41667 0.69650 1.0000 + Tl Tl155 1.0 0.59722 0.45833 0.69650 1.0000 + Tl Tl156 1.0 0.55556 0.50000 0.69650 1.0000 + Tl Tl157 1.0 0.05556 0.08333 0.69650 1.0000 + Tl Tl158 1.0 0.01389 0.12500 0.69650 1.0000 + Tl Tl159 1.0 0.97222 0.16667 0.69650 1.0000 + Tl Tl160 1.0 0.93056 0.20833 0.69650 1.0000 + Tl Tl161 1.0 0.88889 0.25000 0.69650 1.0000 + Tl Tl162 1.0 0.84722 0.29167 0.69650 1.0000 + Tl Tl163 1.0 0.80556 0.33333 0.69650 1.0000 + Tl Tl164 1.0 0.76389 0.37500 0.69650 1.0000 + Tl Tl165 1.0 0.72222 0.41667 0.69650 1.0000 + Tl Tl166 1.0 0.68056 0.45833 0.69650 1.0000 + Tl Tl167 1.0 0.63889 0.50000 0.69650 1.0000 + Tl Tl168 1.0 0.59722 0.54167 0.69650 1.0000 + Tl Tl169 1.0 0.09722 0.12500 0.69650 1.0000 + Tl Tl170 1.0 0.05556 0.16667 0.69650 1.0000 + Tl Tl171 1.0 0.01389 0.20833 0.69650 1.0000 + Tl Tl172 1.0 0.97222 0.25000 0.69650 1.0000 + Tl Tl173 1.0 0.93056 0.29167 0.69650 1.0000 + Tl Tl174 1.0 0.88889 0.33333 0.69650 1.0000 + Tl Tl175 1.0 0.84722 0.37500 0.69650 1.0000 + Tl Tl176 1.0 0.80556 0.41667 0.69650 1.0000 + Tl Tl177 1.0 0.76389 0.45833 0.69650 1.0000 + Tl Tl178 1.0 0.72222 0.50000 0.69650 1.0000 + Tl Tl179 1.0 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0.89423 0.33942 1.0000 + F F864 1.0 0.00641 0.93589 0.33942 1.0000 + Ti Ti145 1.0 0.50000 0.50000 0.50000 1.0000 + Ti Ti146 1.0 0.45833 0.54167 0.50000 1.0000 + Ti Ti147 1.0 0.41667 0.58333 0.50000 1.0000 + Ti Ti148 1.0 0.37500 0.62500 0.50000 1.0000 + Ti Ti149 1.0 0.33333 0.66667 0.50000 1.0000 + Ti Ti150 1.0 0.29167 0.70833 0.50000 1.0000 + Ti Ti151 1.0 0.25000 0.75000 0.50000 1.0000 + Ti Ti152 1.0 0.70833 0.29167 0.50000 1.0000 + Ti Ti153 1.0 0.16667 0.83333 0.50000 1.0000 + Ti Ti154 1.0 0.12500 0.87500 0.50000 1.0000 + Ti Ti155 1.0 0.08333 0.91667 0.50000 1.0000 + Ti Ti156 1.0 0.04167 0.95833 0.50000 1.0000 + Ti Ti157 1.0 0.54167 0.54167 0.50000 1.0000 + Ti Ti158 1.0 0.50000 0.58333 0.50000 1.0000 + Ti Ti159 1.0 0.45833 0.62500 0.50000 1.0000 + Ti Ti160 1.0 0.41667 0.66667 0.50000 1.0000 + Ti Ti161 1.0 0.37500 0.70833 0.50000 1.0000 + Ti Ti162 1.0 0.33333 0.75000 0.50000 1.0000 + Ti Ti163 1.0 0.29167 0.79167 0.50000 1.0000 + Ti Ti164 1.0 0.25000 0.83333 0.50000 1.0000 + Ti Ti165 1.0 0.20833 0.87500 0.50000 1.0000 + Ti Ti166 1.0 0.16667 0.91667 0.50000 1.0000 + Ti Ti167 1.0 0.12500 0.95833 0.50000 1.0000 + Ti Ti168 1.0 0.08333 0.00000 0.50000 1.0000 + Ti Ti169 1.0 0.58333 0.58333 0.50000 1.0000 + Ti Ti170 1.0 0.54167 0.62500 0.50000 1.0000 + Ti Ti171 1.0 0.50000 0.66667 0.50000 1.0000 + Ti Ti172 1.0 0.45833 0.70833 0.50000 1.0000 + Ti Ti173 1.0 0.41667 0.75000 0.50000 1.0000 + Ti Ti174 1.0 0.37500 0.79167 0.50000 1.0000 + Ti Ti175 1.0 0.33333 0.83333 0.50000 1.0000 + Ti Ti176 1.0 0.29167 0.87500 0.50000 1.0000 + Ti Ti177 1.0 0.25000 0.91667 0.50000 1.0000 + Ti Ti178 1.0 0.20833 0.95833 0.50000 1.0000 + Ti Ti179 1.0 0.16667 0.00000 0.50000 1.0000 + Ti Ti180 1.0 0.12500 0.04167 0.50000 1.0000 + Ti Ti181 1.0 0.62500 0.62500 0.50000 1.0000 + Ti Ti182 1.0 0.58333 0.66667 0.50000 1.0000 + Ti Ti183 1.0 0.54167 0.70833 0.50000 1.0000 + Ti Ti184 1.0 0.50000 0.75000 0.50000 1.0000 + Ti Ti185 1.0 0.45833 0.79167 0.50000 1.0000 + Ti Ti186 1.0 0.41667 0.83333 0.50000 1.0000 + Ti Ti187 1.0 0.37500 0.87500 0.50000 1.0000 + Ti Ti188 1.0 0.33333 0.91667 0.50000 1.0000 + Ti Ti189 1.0 0.29167 0.95833 0.50000 1.0000 + Ti Ti190 1.0 0.25000 0.00000 0.50000 1.0000 + Ti Ti191 1.0 0.20833 0.04167 0.50000 1.0000 + Ti Ti192 1.0 0.16667 0.08333 0.50000 1.0000 + Ti Ti193 1.0 0.66667 0.66667 0.50000 1.0000 + Ti Ti194 1.0 0.62500 0.70833 0.50000 1.0000 + Ti Ti195 1.0 0.58333 0.75000 0.50000 1.0000 + Ti Ti196 1.0 0.54167 0.79167 0.50000 1.0000 + Ti Ti197 1.0 0.50000 0.83333 0.50000 1.0000 + Ti Ti198 1.0 0.45833 0.87500 0.50000 1.0000 + Ti Ti199 1.0 0.41667 0.91667 0.50000 1.0000 + Ti Ti200 1.0 0.37500 0.95833 0.50000 1.0000 + Ti Ti201 1.0 0.33333 0.00000 0.50000 1.0000 + Ti Ti202 1.0 0.29167 0.04167 0.50000 1.0000 + Ti Ti203 1.0 0.25000 0.08333 0.50000 1.0000 + Ti Ti204 1.0 0.20833 0.12500 0.50000 1.0000 + Ti Ti205 1.0 0.70833 0.70833 0.50000 1.0000 + Ti Ti206 1.0 0.66667 0.75000 0.50000 1.0000 + Ti Ti207 1.0 0.62500 0.79167 0.50000 1.0000 + Ti Ti208 1.0 0.58333 0.83333 0.50000 1.0000 + Ti Ti209 1.0 0.54167 0.87500 0.50000 1.0000 + Ti Ti210 1.0 0.50000 0.91667 0.50000 1.0000 + Ti Ti211 1.0 0.45833 0.95833 0.50000 1.0000 + Ti Ti212 1.0 0.41667 0.00000 0.50000 1.0000 + Ti Ti213 1.0 0.37500 0.04167 0.50000 1.0000 + Ti Ti214 1.0 0.33333 0.08333 0.50000 1.0000 + Ti Ti215 1.0 0.29167 0.12500 0.50000 1.0000 + Ti Ti216 1.0 0.25000 0.16667 0.50000 1.0000 + Ti Ti217 1.0 0.75000 0.75000 0.50000 1.0000 + Ti Ti218 1.0 0.70833 0.79167 0.50000 1.0000 + Ti Ti219 1.0 0.66667 0.83333 0.50000 1.0000 + Ti Ti220 1.0 0.62500 0.87500 0.50000 1.0000 + Ti Ti221 1.0 0.58333 0.91667 0.50000 1.0000 + Ti Ti222 1.0 0.54167 0.95833 0.50000 1.0000 + Ti Ti223 1.0 0.50000 0.00000 0.50000 1.0000 + Ti Ti224 1.0 0.45833 0.04167 0.50000 1.0000 + Ti Ti225 1.0 0.41667 0.08333 0.50000 1.0000 + Ti Ti226 1.0 0.37500 0.12500 0.50000 1.0000 + Ti Ti227 1.0 0.33333 0.16667 0.50000 1.0000 + Ti Ti228 1.0 0.29167 0.20833 0.50000 1.0000 + Ti Ti229 1.0 0.79167 0.79167 0.50000 1.0000 + Ti Ti230 1.0 0.75000 0.83333 0.50000 1.0000 + Ti Ti231 1.0 0.70833 0.87500 0.50000 1.0000 + Ti Ti232 1.0 0.66667 0.91667 0.50000 1.0000 + Ti Ti233 1.0 0.62500 0.95833 0.50000 1.0000 + Ti Ti234 1.0 0.58333 0.00000 0.50000 1.0000 + Ti Ti235 1.0 0.54167 0.04167 0.50000 1.0000 + Ti Ti236 1.0 0.50000 0.08333 0.50000 1.0000 + Ti Ti237 1.0 0.45833 0.12500 0.50000 1.0000 + Ti Ti238 1.0 0.41667 0.16667 0.50000 1.0000 + Ti Ti239 1.0 0.37500 0.20833 0.50000 1.0000 + Ti Ti240 1.0 0.33333 0.25000 0.50000 1.0000 + Ti Ti241 1.0 0.83333 0.83333 0.50000 1.0000 + Ti Ti242 1.0 0.79167 0.87500 0.50000 1.0000 + Ti Ti243 1.0 0.75000 0.91667 0.50000 1.0000 + Ti Ti244 1.0 0.70833 0.95833 0.50000 1.0000 + Ti Ti245 1.0 0.66667 0.00000 0.50000 1.0000 + Ti Ti246 1.0 0.62500 0.04167 0.50000 1.0000 + Ti Ti247 1.0 0.58333 0.08333 0.50000 1.0000 + Ti Ti248 1.0 0.54167 0.12500 0.50000 1.0000 + Ti Ti249 1.0 0.50000 0.16667 0.50000 1.0000 + Ti Ti250 1.0 0.45833 0.20833 0.50000 1.0000 + Ti Ti251 1.0 0.41667 0.25000 0.50000 1.0000 + Ti Ti252 1.0 0.37500 0.29167 0.50000 1.0000 + Ti Ti253 1.0 0.87500 0.87500 0.50000 1.0000 + Ti Ti254 1.0 0.83333 0.91667 0.50000 1.0000 + Ti Ti255 1.0 0.79167 0.95833 0.50000 1.0000 + Ti Ti256 1.0 0.75000 0.00000 0.50000 1.0000 + Ti Ti257 1.0 0.70833 0.04167 0.50000 1.0000 + Ti Ti258 1.0 0.66667 0.08333 0.50000 1.0000 + Ti Ti259 1.0 0.62500 0.12500 0.50000 1.0000 + Ti Ti260 1.0 0.58333 0.16667 0.50000 1.0000 + Ti Ti261 1.0 0.54167 0.20833 0.50000 1.0000 + Ti Ti262 1.0 0.50000 0.25000 0.50000 1.0000 + Ti Ti263 1.0 0.45833 0.29167 0.50000 1.0000 + Ti Ti264 1.0 0.41667 0.33333 0.50000 1.0000 + Ti Ti265 1.0 0.91667 0.91667 0.50000 1.0000 + Ti Ti266 1.0 0.87500 0.95833 0.50000 1.0000 + Ti Ti267 1.0 0.83333 0.00000 0.50000 1.0000 + Ti Ti268 1.0 0.79167 0.04167 0.50000 1.0000 + Ti Ti269 1.0 0.75000 0.08333 0.50000 1.0000 + Ti Ti270 1.0 0.70833 0.12500 0.50000 1.0000 + Ti Ti271 1.0 0.66667 0.16667 0.50000 1.0000 + Ti Ti272 1.0 0.62500 0.20833 0.50000 1.0000 + Ti Ti273 1.0 0.58333 0.25000 0.50000 1.0000 + Ti Ti274 1.0 0.54167 0.29167 0.50000 1.0000 + Ti Ti275 1.0 0.50000 0.33333 0.50000 1.0000 + Ti Ti276 1.0 0.45833 0.37500 0.50000 1.0000 + Ti Ti277 1.0 0.95833 0.95833 0.50000 1.0000 + Ti Ti278 1.0 0.91667 0.00000 0.50000 1.0000 + Ti Ti279 1.0 0.87500 0.04167 0.50000 1.0000 + Ti Ti280 1.0 0.83333 0.08333 0.50000 1.0000 + Ti Ti281 1.0 0.79167 0.12500 0.50000 1.0000 + Ti Ti282 1.0 0.75000 0.16667 0.50000 1.0000 + Ti Ti283 1.0 0.70833 0.20833 0.50000 1.0000 + Ti Ti284 1.0 0.66667 0.25000 0.50000 1.0000 + Ti Ti285 1.0 0.62500 0.29167 0.50000 1.0000 + Ti Ti286 1.0 0.58333 0.33333 0.50000 1.0000 + Ti Ti287 1.0 0.54167 0.37500 0.50000 1.0000 + Ti Ti288 1.0 0.50000 0.41667 0.50000 1.0000 + Tl Tl289 1.0 0.48611 0.54167 0.30350 1.0000 + Tl Tl290 1.0 0.44444 0.58333 0.30350 1.0000 + Tl Tl291 1.0 0.40278 0.62500 0.30350 1.0000 + Tl Tl292 1.0 0.36111 0.66667 0.30350 1.0000 + Tl Tl293 1.0 0.31944 0.70833 0.30350 1.0000 + Tl Tl294 1.0 0.27778 0.75000 0.30350 1.0000 + Tl Tl295 1.0 0.23611 0.79167 0.30350 1.0000 + Tl Tl296 1.0 0.19444 0.83333 0.30350 1.0000 + Tl Tl297 1.0 0.15278 0.87500 0.30350 1.0000 + Tl Tl298 1.0 0.11111 0.91667 0.30350 1.0000 + Tl Tl299 1.0 0.06944 0.95833 0.30350 1.0000 + Tl Tl300 1.0 0.02778 1.00000 0.30350 1.0000 + Tl Tl301 1.0 0.52778 0.58333 0.30350 1.0000 + Tl Tl302 1.0 0.48611 0.62500 0.30350 1.0000 + Tl Tl303 1.0 0.44444 0.66667 0.30350 1.0000 + Tl Tl304 1.0 0.40278 0.70833 0.30350 1.0000 + Tl Tl305 1.0 0.36111 0.75000 0.30350 1.0000 + Tl Tl306 1.0 0.31944 0.79167 0.30350 1.0000 + Tl Tl307 1.0 0.27778 0.83333 0.30350 1.0000 + Tl Tl308 1.0 0.23611 0.87500 0.30350 1.0000 + Tl Tl309 1.0 0.19444 0.91667 0.30350 1.0000 + Tl Tl310 1.0 0.15278 0.95833 0.30350 1.0000 + Tl Tl311 1.0 0.11111 0.00000 0.30350 1.0000 + Tl Tl312 1.0 0.06944 0.04167 0.30350 1.0000 + Tl Tl313 1.0 0.56944 0.62500 0.30350 1.0000 + Tl Tl314 1.0 0.52778 0.66667 0.30350 1.0000 + Tl Tl315 1.0 0.48611 0.70833 0.30350 1.0000 + Tl Tl316 1.0 0.44444 0.75000 0.30350 1.0000 + Tl Tl317 1.0 0.40278 0.79167 0.30350 1.0000 + Tl Tl318 1.0 0.36111 0.83333 0.30350 1.0000 + Tl Tl319 1.0 0.31944 0.87500 0.30350 1.0000 + Tl Tl320 1.0 0.27778 0.91667 0.30350 1.0000 + Tl Tl321 1.0 0.23611 0.95833 0.30350 1.0000 + Tl Tl322 1.0 0.19444 0.00000 0.30350 1.0000 + Tl Tl323 1.0 0.15278 0.04167 0.30350 1.0000 + Tl Tl324 1.0 0.11111 0.08333 0.30350 1.0000 + Tl Tl325 1.0 0.61111 0.66667 0.30350 1.0000 + Tl Tl326 1.0 0.56944 0.70833 0.30350 1.0000 + Tl Tl327 1.0 0.52778 0.75000 0.30350 1.0000 + Tl Tl328 1.0 0.48611 0.79167 0.30350 1.0000 + Tl Tl329 1.0 0.44444 0.83333 0.30350 1.0000 + Tl Tl330 1.0 0.40278 0.87500 0.30350 1.0000 + Tl Tl331 1.0 0.36111 0.91667 0.30350 1.0000 + Tl Tl332 1.0 0.31944 0.95833 0.30350 1.0000 + Tl Tl333 1.0 0.27778 0.00000 0.30350 1.0000 + Tl Tl334 1.0 0.23611 0.04167 0.30350 1.0000 + Tl Tl335 1.0 0.19444 0.08333 0.30350 1.0000 + Tl Tl336 1.0 0.15278 0.12500 0.30350 1.0000 + Tl Tl337 1.0 0.65278 0.70833 0.30350 1.0000 + Tl Tl338 1.0 0.61111 0.75000 0.30350 1.0000 + Tl Tl339 1.0 0.56944 0.79167 0.30350 1.0000 + Tl Tl340 1.0 0.52778 0.83333 0.30350 1.0000 + Tl Tl341 1.0 0.48611 0.87500 0.30350 1.0000 + Tl Tl342 1.0 0.44444 0.91667 0.30350 1.0000 + Tl Tl343 1.0 0.40278 0.95833 0.30350 1.0000 + Tl Tl344 1.0 0.36111 0.00000 0.30350 1.0000 + Tl Tl345 1.0 0.31944 0.04167 0.30350 1.0000 + Tl Tl346 1.0 0.27778 0.08333 0.30350 1.0000 + Tl Tl347 1.0 0.23611 0.12500 0.30350 1.0000 + Tl Tl348 1.0 0.19444 0.16667 0.30350 1.0000 + Tl Tl349 1.0 0.69444 0.75000 0.30350 1.0000 + Tl Tl350 1.0 0.65278 0.79167 0.30350 1.0000 + Tl Tl351 1.0 0.61111 0.83333 0.30350 1.0000 + Tl Tl352 1.0 0.56944 0.87500 0.30350 1.0000 + Tl Tl353 1.0 0.52778 0.91667 0.30350 1.0000 + Tl Tl354 1.0 0.48611 0.95833 0.30350 1.0000 + Tl Tl355 1.0 0.44444 0.00000 0.30350 1.0000 + Tl Tl356 1.0 0.40278 0.04167 0.30350 1.0000 + Tl Tl357 1.0 0.36111 0.08333 0.30350 1.0000 + Tl Tl358 1.0 0.31944 0.12500 0.30350 1.0000 + Tl Tl359 1.0 0.27778 0.16667 0.30350 1.0000 + Tl Tl360 1.0 0.23611 0.20833 0.30350 1.0000 + Tl Tl361 1.0 0.73611 0.79167 0.30350 1.0000 + Tl Tl362 1.0 0.69444 0.83333 0.30350 1.0000 + Tl Tl363 1.0 0.65278 0.87500 0.30350 1.0000 + Tl Tl364 1.0 0.61111 0.91667 0.30350 1.0000 + Tl Tl365 1.0 0.56944 0.95833 0.30350 1.0000 + Tl Tl366 1.0 0.52778 0.00000 0.30350 1.0000 + Tl Tl367 1.0 0.48611 0.04167 0.30350 1.0000 + Tl Tl368 1.0 0.44444 0.08333 0.30350 1.0000 + Tl Tl369 1.0 0.40278 0.12500 0.30350 1.0000 + Tl Tl370 1.0 0.36111 0.16667 0.30350 1.0000 + Tl Tl371 1.0 0.31944 0.20833 0.30350 1.0000 + Tl Tl372 1.0 0.27778 0.25000 0.30350 1.0000 + Tl Tl373 1.0 0.77778 0.83333 0.30350 1.0000 + Tl Tl374 1.0 0.73611 0.87500 0.30350 1.0000 + Tl Tl375 1.0 0.69444 0.91667 0.30350 1.0000 + Tl Tl376 1.0 0.65278 0.95833 0.30350 1.0000 + Tl Tl377 1.0 0.61111 0.00000 0.30350 1.0000 + Tl Tl378 1.0 0.56944 0.04167 0.30350 1.0000 + Tl Tl379 1.0 0.52778 0.08333 0.30350 1.0000 + Tl Tl380 1.0 0.48611 0.12500 0.30350 1.0000 + Tl Tl381 1.0 0.44444 0.16667 0.30350 1.0000 + Tl Tl382 1.0 0.40278 0.20833 0.30350 1.0000 + Tl Tl383 1.0 0.36111 0.25000 0.30350 1.0000 + Tl Tl384 1.0 0.31944 0.29167 0.30350 1.0000 + Tl Tl385 1.0 0.81944 0.87500 0.30350 1.0000 + Tl Tl386 1.0 0.77778 0.91667 0.30350 1.0000 + Tl Tl387 1.0 0.73611 0.95833 0.30350 1.0000 + Tl Tl388 1.0 0.69444 0.00000 0.30350 1.0000 + Tl Tl389 1.0 0.65278 0.04167 0.30350 1.0000 + Tl Tl390 1.0 0.61111 0.08333 0.30350 1.0000 + Tl Tl391 1.0 0.56944 0.12500 0.30350 1.0000 + Tl Tl392 1.0 0.52778 0.16667 0.30350 1.0000 + Tl Tl393 1.0 0.48611 0.20833 0.30350 1.0000 + Tl Tl394 1.0 0.44444 0.25000 0.30350 1.0000 + Tl Tl395 1.0 0.40278 0.29167 0.30350 1.0000 + Tl Tl396 1.0 0.36111 0.33333 0.30350 1.0000 + Tl Tl397 1.0 0.86111 0.91667 0.30350 1.0000 + Tl Tl398 1.0 0.81944 0.95833 0.30350 1.0000 + Tl Tl399 1.0 0.77778 0.00000 0.30350 1.0000 + Tl Tl400 1.0 0.73611 0.04167 0.30350 1.0000 + Tl Tl401 1.0 0.69444 0.08333 0.30350 1.0000 + Tl Tl402 1.0 0.65278 0.12500 0.30350 1.0000 + Tl Tl403 1.0 0.61111 0.16667 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0.18589 0.33942 1.0000 + F F1712 1.0 0.63141 0.22756 0.33942 1.0000 + F F1713 1.0 0.58974 0.26923 0.33942 1.0000 + F F1714 1.0 0.54808 0.31089 0.33942 1.0000 + F F1715 1.0 0.50641 0.35256 0.33942 1.0000 + F F1716 1.0 0.46474 0.39423 0.33942 1.0000 + F F1717 1.0 0.96474 0.97756 0.33942 1.0000 + F F1718 1.0 0.92308 0.01923 0.33942 1.0000 + F F1719 1.0 0.88141 0.06089 0.33942 1.0000 + F F1720 1.0 0.83974 0.10256 0.33942 1.0000 + F F1721 1.0 0.79808 0.14423 0.33942 1.0000 + F F1722 1.0 0.75641 0.18589 0.33942 1.0000 + F F1723 1.0 0.71474 0.22756 0.33942 1.0000 + F F1724 1.0 0.67308 0.26923 0.33942 1.0000 + F F1725 1.0 0.63141 0.31089 0.33942 1.0000 + F F1726 1.0 0.58974 0.35256 0.33942 1.0000 + F F1727 1.0 0.54808 0.39423 0.33942 1.0000 + F F1728 1.0 0.50641 0.43589 0.33942 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-5515_supercell_12x12x1.cif b/tier3/cif_file/orthogonal_2dm-5515_supercell_12x12x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..6f31f2078dacc223766b32ea90424a0fc5cf72cd --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-5515_supercell_12x12x1.cif @@ -0,0 +1,1897 @@ +data_image0 +_chemical_formula_structural Zn288Ni432O1152 +_chemical_formula_sum "Zn288 Ni432 O1152" +_cell_length_a 58.8744 +_cell_length_b 68.9588 +_cell_length_c 6.79806 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Zn Zn1 1.0 0.03975 0.00000 0.70580 1.0000 + Zn Zn2 1.0 0.03975 0.08333 0.70580 1.0000 + Zn Zn3 1.0 0.03975 0.16667 0.70580 1.0000 + Zn Zn4 1.0 0.03975 0.25000 0.70580 1.0000 + Zn Zn5 1.0 0.03975 0.33333 0.70580 1.0000 + Zn Zn6 1.0 0.03975 0.41667 0.70580 1.0000 + Zn Zn7 1.0 0.03975 0.50000 0.70580 1.0000 + Zn Zn8 1.0 0.03975 0.58333 0.70580 1.0000 + Zn Zn9 1.0 0.03975 0.66667 0.70580 1.0000 + Zn Zn10 1.0 0.03975 0.75000 0.70580 1.0000 + Zn Zn11 1.0 0.03975 0.83333 0.70580 1.0000 + Zn Zn12 1.0 0.03975 0.91667 0.70580 1.0000 + Zn Zn13 1.0 0.12309 0.00000 0.70580 1.0000 + Zn Zn14 1.0 0.12309 0.08333 0.70580 1.0000 + Zn Zn15 1.0 0.12309 0.16667 0.70580 1.0000 + Zn Zn16 1.0 0.12309 0.25000 0.70580 1.0000 + Zn Zn17 1.0 0.12309 0.33333 0.70580 1.0000 + Zn Zn18 1.0 0.12309 0.41667 0.70580 1.0000 + Zn Zn19 1.0 0.12309 0.50000 0.70580 1.0000 + Zn Zn20 1.0 0.12309 0.58333 0.70580 1.0000 + Zn Zn21 1.0 0.12309 0.66667 0.70580 1.0000 + Zn Zn22 1.0 0.12309 0.75000 0.70580 1.0000 + Zn Zn23 1.0 0.12309 0.83333 0.70580 1.0000 + Zn Zn24 1.0 0.12309 0.91667 0.70580 1.0000 + Zn Zn25 1.0 0.20642 0.00000 0.70580 1.0000 + Zn Zn26 1.0 0.20642 0.08333 0.70580 1.0000 + Zn Zn27 1.0 0.20642 0.16667 0.70580 1.0000 + Zn Zn28 1.0 0.20642 0.25000 0.70580 1.0000 + Zn Zn29 1.0 0.20642 0.33333 0.70580 1.0000 + Zn Zn30 1.0 0.20642 0.41667 0.70580 1.0000 + Zn Zn31 1.0 0.20642 0.50000 0.70580 1.0000 + Zn Zn32 1.0 0.20642 0.58333 0.70580 1.0000 + Zn Zn33 1.0 0.20642 0.66667 0.70580 1.0000 + Zn Zn34 1.0 0.20642 0.75000 0.70580 1.0000 + Zn Zn35 1.0 0.20642 0.83333 0.70580 1.0000 + Zn Zn36 1.0 0.20642 0.91667 0.70580 1.0000 + Zn Zn37 1.0 0.28975 0.00000 0.70580 1.0000 + Zn Zn38 1.0 0.28975 0.08333 0.70580 1.0000 + Zn Zn39 1.0 0.28975 0.16667 0.70580 1.0000 + Zn Zn40 1.0 0.28975 0.25000 0.70580 1.0000 + Zn Zn41 1.0 0.28975 0.33333 0.70580 1.0000 + Zn Zn42 1.0 0.28975 0.41667 0.70580 1.0000 + Zn Zn43 1.0 0.28975 0.50000 0.70580 1.0000 + Zn Zn44 1.0 0.28975 0.58333 0.70580 1.0000 + Zn Zn45 1.0 0.28975 0.66667 0.70580 1.0000 + Zn Zn46 1.0 0.28975 0.75000 0.70580 1.0000 + Zn Zn47 1.0 0.28975 0.83333 0.70580 1.0000 + Zn Zn48 1.0 0.28975 0.91667 0.70580 1.0000 + Zn Zn49 1.0 0.37309 0.00000 0.70580 1.0000 + Zn Zn50 1.0 0.37309 0.08333 0.70580 1.0000 + Zn Zn51 1.0 0.37309 0.16667 0.70580 1.0000 + Zn Zn52 1.0 0.37309 0.25000 0.70580 1.0000 + Zn Zn53 1.0 0.37309 0.33333 0.70580 1.0000 + Zn Zn54 1.0 0.37309 0.41667 0.70580 1.0000 + Zn Zn55 1.0 0.37309 0.50000 0.70580 1.0000 + Zn Zn56 1.0 0.37309 0.58333 0.70580 1.0000 + Zn Zn57 1.0 0.37309 0.66667 0.70580 1.0000 + Zn Zn58 1.0 0.37309 0.75000 0.70580 1.0000 + Zn Zn59 1.0 0.37309 0.83333 0.70580 1.0000 + Zn Zn60 1.0 0.37309 0.91667 0.70580 1.0000 + Zn Zn61 1.0 0.45642 0.00000 0.70580 1.0000 + Zn Zn62 1.0 0.45642 0.08333 0.70580 1.0000 + Zn Zn63 1.0 0.45642 0.16667 0.70580 1.0000 + Zn Zn64 1.0 0.45642 0.25000 0.70580 1.0000 + Zn Zn65 1.0 0.45642 0.33333 0.70580 1.0000 + Zn Zn66 1.0 0.45642 0.41667 0.70580 1.0000 + Zn Zn67 1.0 0.45642 0.50000 0.70580 1.0000 + Zn Zn68 1.0 0.45642 0.58333 0.70580 1.0000 + Zn Zn69 1.0 0.45642 0.66667 0.70580 1.0000 + Zn Zn70 1.0 0.45642 0.75000 0.70580 1.0000 + Zn Zn71 1.0 0.45642 0.83333 0.70580 1.0000 + Zn Zn72 1.0 0.45642 0.91667 0.70580 1.0000 + Zn Zn73 1.0 0.53975 0.00000 0.70580 1.0000 + Zn Zn74 1.0 0.53975 0.08333 0.70580 1.0000 + Zn Zn75 1.0 0.53975 0.16667 0.70580 1.0000 + Zn Zn76 1.0 0.53975 0.25000 0.70580 1.0000 + Zn Zn77 1.0 0.53975 0.33333 0.70580 1.0000 + Zn Zn78 1.0 0.53975 0.41667 0.70580 1.0000 + Zn Zn79 1.0 0.53975 0.50000 0.70580 1.0000 + Zn Zn80 1.0 0.53975 0.58333 0.70580 1.0000 + Zn Zn81 1.0 0.53975 0.66667 0.70580 1.0000 + Zn Zn82 1.0 0.53975 0.75000 0.70580 1.0000 + Zn Zn83 1.0 0.53975 0.83333 0.70580 1.0000 + Zn Zn84 1.0 0.53975 0.91667 0.70580 1.0000 + Zn Zn85 1.0 0.62309 0.00000 0.70580 1.0000 + Zn Zn86 1.0 0.62309 0.08333 0.70580 1.0000 + Zn Zn87 1.0 0.62309 0.16667 0.70580 1.0000 + Zn Zn88 1.0 0.62309 0.25000 0.70580 1.0000 + Zn Zn89 1.0 0.62309 0.33333 0.70580 1.0000 + Zn Zn90 1.0 0.62309 0.41667 0.70580 1.0000 + Zn Zn91 1.0 0.62309 0.50000 0.70580 1.0000 + Zn Zn92 1.0 0.62309 0.58333 0.70580 1.0000 + Zn Zn93 1.0 0.62309 0.66667 0.70580 1.0000 + Zn Zn94 1.0 0.62309 0.75000 0.70580 1.0000 + Zn Zn95 1.0 0.62309 0.83333 0.70580 1.0000 + Zn Zn96 1.0 0.62309 0.91667 0.70580 1.0000 + Zn Zn97 1.0 0.70642 0.00000 0.70580 1.0000 + Zn Zn98 1.0 0.70642 0.08333 0.70580 1.0000 + Zn Zn99 1.0 0.70642 0.16667 0.70580 1.0000 + Zn Zn100 1.0 0.70642 0.25000 0.70580 1.0000 + Zn Zn101 1.0 0.70642 0.33333 0.70580 1.0000 + Zn Zn102 1.0 0.70642 0.41667 0.70580 1.0000 + Zn Zn103 1.0 0.70642 0.50000 0.70580 1.0000 + Zn Zn104 1.0 0.70642 0.58333 0.70580 1.0000 + Zn Zn105 1.0 0.70642 0.66667 0.70580 1.0000 + Zn Zn106 1.0 0.70642 0.75000 0.70580 1.0000 + Zn Zn107 1.0 0.70642 0.83333 0.70580 1.0000 + Zn Zn108 1.0 0.70642 0.91667 0.70580 1.0000 + Zn Zn109 1.0 0.78975 0.00000 0.70580 1.0000 + Zn Zn110 1.0 0.78975 0.08333 0.70580 1.0000 + Zn Zn111 1.0 0.78975 0.16667 0.70580 1.0000 + Zn Zn112 1.0 0.78975 0.25000 0.70580 1.0000 + Zn Zn113 1.0 0.78975 0.33333 0.70580 1.0000 + Zn Zn114 1.0 0.78975 0.41667 0.70580 1.0000 + Zn Zn115 1.0 0.78975 0.50000 0.70580 1.0000 + Zn Zn116 1.0 0.78975 0.58333 0.70580 1.0000 + Zn Zn117 1.0 0.78975 0.66667 0.70580 1.0000 + Zn Zn118 1.0 0.78975 0.75000 0.70580 1.0000 + Zn Zn119 1.0 0.78975 0.83333 0.70580 1.0000 + Zn Zn120 1.0 0.78975 0.91667 0.70580 1.0000 + Zn Zn121 1.0 0.87309 0.00000 0.70580 1.0000 + Zn Zn122 1.0 0.87309 0.08333 0.70580 1.0000 + Zn Zn123 1.0 0.87309 0.16667 0.70580 1.0000 + Zn Zn124 1.0 0.87309 0.25000 0.70580 1.0000 + Zn Zn125 1.0 0.87309 0.33333 0.70580 1.0000 + Zn Zn126 1.0 0.87309 0.41667 0.70580 1.0000 + Zn Zn127 1.0 0.87309 0.50000 0.70580 1.0000 + Zn Zn128 1.0 0.87309 0.58333 0.70580 1.0000 + Zn Zn129 1.0 0.87309 0.66667 0.70580 1.0000 + Zn Zn130 1.0 0.87309 0.75000 0.70580 1.0000 + Zn Zn131 1.0 0.87309 0.83333 0.70580 1.0000 + Zn Zn132 1.0 0.87309 0.91667 0.70580 1.0000 + Zn Zn133 1.0 0.95642 0.00000 0.70580 1.0000 + Zn Zn134 1.0 0.95642 0.08333 0.70580 1.0000 + Zn Zn135 1.0 0.95642 0.16667 0.70580 1.0000 + Zn Zn136 1.0 0.95642 0.25000 0.70580 1.0000 + Zn Zn137 1.0 0.95642 0.33333 0.70580 1.0000 + Zn Zn138 1.0 0.95642 0.41667 0.70580 1.0000 + Zn Zn139 1.0 0.95642 0.50000 0.70580 1.0000 + Zn Zn140 1.0 0.95642 0.58333 0.70580 1.0000 + Zn Zn141 1.0 0.95642 0.66667 0.70580 1.0000 + Zn Zn142 1.0 0.95642 0.75000 0.70580 1.0000 + Zn Zn143 1.0 0.95642 0.83333 0.70580 1.0000 + Zn Zn144 1.0 0.95642 0.91667 0.70580 1.0000 + Zn Zn145 1.0 0.04001 0.00000 0.29420 1.0000 + Zn Zn146 1.0 0.04001 0.08333 0.29420 1.0000 + Zn Zn147 1.0 0.04001 0.16667 0.29420 1.0000 + Zn Zn148 1.0 0.04001 0.25000 0.29420 1.0000 + Zn Zn149 1.0 0.04001 0.33333 0.29420 1.0000 + Zn Zn150 1.0 0.04001 0.41667 0.29420 1.0000 + Zn Zn151 1.0 0.04001 0.50000 0.29420 1.0000 + Zn Zn152 1.0 0.04001 0.58333 0.29420 1.0000 + Zn Zn153 1.0 0.04001 0.66667 0.29420 1.0000 + Zn Zn154 1.0 0.04001 0.75000 0.29420 1.0000 + Zn Zn155 1.0 0.04001 0.83333 0.29420 1.0000 + Zn Zn156 1.0 0.04001 0.91667 0.29420 1.0000 + Zn Zn157 1.0 0.12334 0.00000 0.29420 1.0000 + Zn Zn158 1.0 0.12334 0.08333 0.29420 1.0000 + Zn Zn159 1.0 0.12334 0.16667 0.29420 1.0000 + Zn Zn160 1.0 0.12334 0.25000 0.29420 1.0000 + Zn Zn161 1.0 0.12334 0.33333 0.29420 1.0000 + Zn Zn162 1.0 0.12334 0.41667 0.29420 1.0000 + Zn Zn163 1.0 0.12334 0.50000 0.29420 1.0000 + Zn Zn164 1.0 0.12334 0.58333 0.29420 1.0000 + Zn Zn165 1.0 0.12334 0.66667 0.29420 1.0000 + Zn Zn166 1.0 0.12334 0.75000 0.29420 1.0000 + Zn Zn167 1.0 0.12334 0.83333 0.29420 1.0000 + Zn Zn168 1.0 0.12334 0.91667 0.29420 1.0000 + Zn Zn169 1.0 0.20668 0.00000 0.29420 1.0000 + Zn Zn170 1.0 0.20668 0.08333 0.29420 1.0000 + Zn Zn171 1.0 0.20668 0.16667 0.29420 1.0000 + Zn Zn172 1.0 0.20668 0.25000 0.29420 1.0000 + Zn Zn173 1.0 0.20668 0.33333 0.29420 1.0000 + Zn Zn174 1.0 0.20668 0.41667 0.29420 1.0000 + Zn Zn175 1.0 0.20668 0.50000 0.29420 1.0000 + Zn Zn176 1.0 0.20668 0.58333 0.29420 1.0000 + Zn Zn177 1.0 0.20668 0.66667 0.29420 1.0000 + Zn Zn178 1.0 0.20668 0.75000 0.29420 1.0000 + Zn Zn179 1.0 0.20668 0.83333 0.29420 1.0000 + Zn Zn180 1.0 0.20668 0.91667 0.29420 1.0000 + Zn Zn181 1.0 0.29001 0.00000 0.29420 1.0000 + Zn Zn182 1.0 0.29001 0.08333 0.29420 1.0000 + Zn Zn183 1.0 0.29001 0.16667 0.29420 1.0000 + Zn Zn184 1.0 0.29001 0.25000 0.29420 1.0000 + Zn Zn185 1.0 0.29001 0.33333 0.29420 1.0000 + Zn Zn186 1.0 0.29001 0.41667 0.29420 1.0000 + Zn Zn187 1.0 0.29001 0.50000 0.29420 1.0000 + Zn Zn188 1.0 0.29001 0.58333 0.29420 1.0000 + Zn Zn189 1.0 0.29001 0.66667 0.29420 1.0000 + Zn Zn190 1.0 0.29001 0.75000 0.29420 1.0000 + Zn Zn191 1.0 0.29001 0.83333 0.29420 1.0000 + Zn Zn192 1.0 0.29001 0.91667 0.29420 1.0000 + Zn Zn193 1.0 0.37334 0.00000 0.29420 1.0000 + Zn Zn194 1.0 0.37334 0.08333 0.29420 1.0000 + Zn Zn195 1.0 0.37334 0.16667 0.29420 1.0000 + Zn Zn196 1.0 0.37334 0.25000 0.29420 1.0000 + Zn Zn197 1.0 0.37334 0.33333 0.29420 1.0000 + Zn Zn198 1.0 0.37334 0.41667 0.29420 1.0000 + Zn Zn199 1.0 0.37334 0.50000 0.29420 1.0000 + Zn Zn200 1.0 0.37334 0.58333 0.29420 1.0000 + Zn Zn201 1.0 0.37334 0.66667 0.29420 1.0000 + Zn Zn202 1.0 0.37334 0.75000 0.29420 1.0000 + Zn Zn203 1.0 0.37334 0.83333 0.29420 1.0000 + Zn Zn204 1.0 0.37334 0.91667 0.29420 1.0000 + Zn Zn205 1.0 0.45668 0.00000 0.29420 1.0000 + Zn Zn206 1.0 0.45668 0.08333 0.29420 1.0000 + Zn Zn207 1.0 0.45668 0.16667 0.29420 1.0000 + Zn Zn208 1.0 0.45668 0.25000 0.29420 1.0000 + Zn Zn209 1.0 0.45668 0.33333 0.29420 1.0000 + Zn Zn210 1.0 0.45668 0.41667 0.29420 1.0000 + Zn Zn211 1.0 0.45668 0.50000 0.29420 1.0000 + Zn Zn212 1.0 0.45668 0.58333 0.29420 1.0000 + Zn Zn213 1.0 0.45668 0.66667 0.29420 1.0000 + Zn Zn214 1.0 0.45668 0.75000 0.29420 1.0000 + Zn Zn215 1.0 0.45668 0.83333 0.29420 1.0000 + Zn Zn216 1.0 0.45668 0.91667 0.29420 1.0000 + Zn Zn217 1.0 0.54001 0.00000 0.29420 1.0000 + Zn Zn218 1.0 0.54001 0.08333 0.29420 1.0000 + Zn Zn219 1.0 0.54001 0.16667 0.29420 1.0000 + Zn Zn220 1.0 0.54001 0.25000 0.29420 1.0000 + Zn Zn221 1.0 0.54001 0.33333 0.29420 1.0000 + Zn Zn222 1.0 0.54001 0.41667 0.29420 1.0000 + Zn Zn223 1.0 0.54001 0.50000 0.29420 1.0000 + Zn Zn224 1.0 0.54001 0.58333 0.29420 1.0000 + Zn Zn225 1.0 0.54001 0.66667 0.29420 1.0000 + Zn Zn226 1.0 0.54001 0.75000 0.29420 1.0000 + Zn Zn227 1.0 0.54001 0.83333 0.29420 1.0000 + Zn Zn228 1.0 0.54001 0.91667 0.29420 1.0000 + Zn Zn229 1.0 0.62334 0.00000 0.29420 1.0000 + Zn Zn230 1.0 0.62334 0.08333 0.29420 1.0000 + Zn Zn231 1.0 0.62334 0.16667 0.29420 1.0000 + Zn Zn232 1.0 0.62334 0.25000 0.29420 1.0000 + Zn Zn233 1.0 0.62334 0.33333 0.29420 1.0000 + Zn Zn234 1.0 0.62334 0.41667 0.29420 1.0000 + Zn Zn235 1.0 0.62334 0.50000 0.29420 1.0000 + Zn Zn236 1.0 0.62334 0.58333 0.29420 1.0000 + Zn Zn237 1.0 0.62334 0.66667 0.29420 1.0000 + Zn Zn238 1.0 0.62334 0.75000 0.29420 1.0000 + Zn Zn239 1.0 0.62334 0.83333 0.29420 1.0000 + Zn Zn240 1.0 0.62334 0.91667 0.29420 1.0000 + Zn Zn241 1.0 0.70668 0.00000 0.29420 1.0000 + Zn Zn242 1.0 0.70668 0.08333 0.29420 1.0000 + Zn Zn243 1.0 0.70668 0.16667 0.29420 1.0000 + Zn Zn244 1.0 0.70668 0.25000 0.29420 1.0000 + Zn Zn245 1.0 0.70668 0.33333 0.29420 1.0000 + Zn Zn246 1.0 0.70668 0.41667 0.29420 1.0000 + Zn Zn247 1.0 0.70668 0.50000 0.29420 1.0000 + Zn Zn248 1.0 0.70668 0.58333 0.29420 1.0000 + Zn Zn249 1.0 0.70668 0.66667 0.29420 1.0000 + Zn Zn250 1.0 0.70668 0.75000 0.29420 1.0000 + Zn Zn251 1.0 0.70668 0.83333 0.29420 1.0000 + Zn Zn252 1.0 0.70668 0.91667 0.29420 1.0000 + Zn Zn253 1.0 0.79001 0.00000 0.29420 1.0000 + Zn Zn254 1.0 0.79001 0.08333 0.29420 1.0000 + Zn Zn255 1.0 0.79001 0.16667 0.29420 1.0000 + Zn Zn256 1.0 0.79001 0.25000 0.29420 1.0000 + Zn Zn257 1.0 0.79001 0.33333 0.29420 1.0000 + Zn Zn258 1.0 0.79001 0.41667 0.29420 1.0000 + Zn Zn259 1.0 0.79001 0.50000 0.29420 1.0000 + Zn Zn260 1.0 0.79001 0.58333 0.29420 1.0000 + Zn Zn261 1.0 0.79001 0.66667 0.29420 1.0000 + Zn Zn262 1.0 0.79001 0.75000 0.29420 1.0000 + Zn Zn263 1.0 0.79001 0.83333 0.29420 1.0000 + Zn Zn264 1.0 0.79001 0.91667 0.29420 1.0000 + Zn Zn265 1.0 0.87334 0.00000 0.29420 1.0000 + Zn Zn266 1.0 0.87334 0.08333 0.29420 1.0000 + Zn Zn267 1.0 0.87334 0.16667 0.29420 1.0000 + Zn Zn268 1.0 0.87334 0.25000 0.29420 1.0000 + Zn Zn269 1.0 0.87334 0.33333 0.29420 1.0000 + Zn Zn270 1.0 0.87334 0.41667 0.29420 1.0000 + Zn Zn271 1.0 0.87334 0.50000 0.29420 1.0000 + Zn Zn272 1.0 0.87334 0.58333 0.29420 1.0000 + Zn Zn273 1.0 0.87334 0.66667 0.29420 1.0000 + Zn Zn274 1.0 0.87334 0.75000 0.29420 1.0000 + Zn Zn275 1.0 0.87334 0.83333 0.29420 1.0000 + Zn Zn276 1.0 0.87334 0.91667 0.29420 1.0000 + Zn Zn277 1.0 0.95668 0.00000 0.29420 1.0000 + Zn Zn278 1.0 0.95668 0.08333 0.29420 1.0000 + Zn Zn279 1.0 0.95668 0.16667 0.29420 1.0000 + Zn Zn280 1.0 0.95668 0.25000 0.29420 1.0000 + Zn Zn281 1.0 0.95668 0.33333 0.29420 1.0000 + Zn Zn282 1.0 0.95668 0.41667 0.29420 1.0000 + Zn Zn283 1.0 0.95668 0.50000 0.29420 1.0000 + Zn Zn284 1.0 0.95668 0.58333 0.29420 1.0000 + Zn Zn285 1.0 0.95668 0.66667 0.29420 1.0000 + Zn Zn286 1.0 0.95668 0.75000 0.29420 1.0000 + Zn Zn287 1.0 0.95668 0.83333 0.29420 1.0000 + Zn Zn288 1.0 0.95668 0.91667 0.29420 1.0000 + Ni Ni1 1.0 0.03988 0.04167 0.50000 1.0000 + Ni Ni2 1.0 0.03988 0.12500 0.50000 1.0000 + Ni Ni3 1.0 0.03988 0.20833 0.50000 1.0000 + Ni Ni4 1.0 0.03988 0.29167 0.50000 1.0000 + Ni Ni5 1.0 0.03988 0.37500 0.50000 1.0000 + Ni Ni6 1.0 0.03988 0.45833 0.50000 1.0000 + Ni Ni7 1.0 0.03988 0.54167 0.50000 1.0000 + Ni Ni8 1.0 0.03988 0.62500 0.50000 1.0000 + Ni Ni9 1.0 0.03988 0.70833 0.50000 1.0000 + Ni Ni10 1.0 0.03988 0.79167 0.50000 1.0000 + Ni Ni11 1.0 0.03988 0.87500 0.50000 1.0000 + Ni Ni12 1.0 0.03988 0.95833 0.50000 1.0000 + Ni Ni13 1.0 0.12321 0.04167 0.50000 1.0000 + Ni Ni14 1.0 0.12321 0.12500 0.50000 1.0000 + Ni Ni15 1.0 0.12321 0.20833 0.50000 1.0000 + Ni Ni16 1.0 0.12321 0.29167 0.50000 1.0000 + Ni Ni17 1.0 0.12321 0.37500 0.50000 1.0000 + Ni Ni18 1.0 0.12321 0.45833 0.50000 1.0000 + Ni Ni19 1.0 0.12321 0.54167 0.50000 1.0000 + Ni Ni20 1.0 0.12321 0.62500 0.50000 1.0000 + Ni Ni21 1.0 0.12321 0.70833 0.50000 1.0000 + Ni Ni22 1.0 0.12321 0.79167 0.50000 1.0000 + Ni Ni23 1.0 0.12321 0.87500 0.50000 1.0000 + Ni Ni24 1.0 0.12321 0.95833 0.50000 1.0000 + Ni Ni25 1.0 0.20655 0.04167 0.50000 1.0000 + Ni Ni26 1.0 0.20655 0.12500 0.50000 1.0000 + Ni Ni27 1.0 0.20655 0.20833 0.50000 1.0000 + Ni Ni28 1.0 0.20655 0.29167 0.50000 1.0000 + Ni Ni29 1.0 0.20655 0.37500 0.50000 1.0000 + Ni Ni30 1.0 0.20655 0.45833 0.50000 1.0000 + Ni Ni31 1.0 0.20655 0.54167 0.50000 1.0000 + Ni Ni32 1.0 0.20655 0.62500 0.50000 1.0000 + Ni Ni33 1.0 0.20655 0.70833 0.50000 1.0000 + Ni Ni34 1.0 0.20655 0.79167 0.50000 1.0000 + Ni Ni35 1.0 0.20655 0.87500 0.50000 1.0000 + Ni Ni36 1.0 0.20655 0.95833 0.50000 1.0000 + Ni Ni37 1.0 0.28988 0.04167 0.50000 1.0000 + Ni Ni38 1.0 0.28988 0.12500 0.50000 1.0000 + Ni Ni39 1.0 0.28988 0.20833 0.50000 1.0000 + Ni Ni40 1.0 0.28988 0.29167 0.50000 1.0000 + Ni Ni41 1.0 0.28988 0.37500 0.50000 1.0000 + Ni Ni42 1.0 0.28988 0.45833 0.50000 1.0000 + Ni Ni43 1.0 0.28988 0.54167 0.50000 1.0000 + Ni Ni44 1.0 0.28988 0.62500 0.50000 1.0000 + Ni Ni45 1.0 0.28988 0.70833 0.50000 1.0000 + Ni Ni46 1.0 0.28988 0.79167 0.50000 1.0000 + Ni Ni47 1.0 0.28988 0.87500 0.50000 1.0000 + Ni Ni48 1.0 0.28988 0.95833 0.50000 1.0000 + Ni Ni49 1.0 0.37321 0.04167 0.50000 1.0000 + Ni Ni50 1.0 0.37321 0.12500 0.50000 1.0000 + Ni Ni51 1.0 0.37321 0.20833 0.50000 1.0000 + Ni Ni52 1.0 0.37321 0.29167 0.50000 1.0000 + Ni Ni53 1.0 0.37321 0.37500 0.50000 1.0000 + Ni Ni54 1.0 0.37321 0.45833 0.50000 1.0000 + Ni Ni55 1.0 0.37321 0.54167 0.50000 1.0000 + Ni Ni56 1.0 0.37321 0.62500 0.50000 1.0000 + Ni Ni57 1.0 0.37321 0.70833 0.50000 1.0000 + Ni Ni58 1.0 0.37321 0.79167 0.50000 1.0000 + Ni Ni59 1.0 0.37321 0.87500 0.50000 1.0000 + Ni Ni60 1.0 0.37321 0.95833 0.50000 1.0000 + Ni Ni61 1.0 0.45655 0.04167 0.50000 1.0000 + Ni Ni62 1.0 0.45655 0.12500 0.50000 1.0000 + Ni Ni63 1.0 0.45655 0.20833 0.50000 1.0000 + Ni Ni64 1.0 0.45655 0.29167 0.50000 1.0000 + Ni Ni65 1.0 0.45655 0.37500 0.50000 1.0000 + Ni Ni66 1.0 0.45655 0.45833 0.50000 1.0000 + Ni Ni67 1.0 0.45655 0.54167 0.50000 1.0000 + Ni Ni68 1.0 0.45655 0.62500 0.50000 1.0000 + Ni Ni69 1.0 0.45655 0.70833 0.50000 1.0000 + Ni Ni70 1.0 0.45655 0.79167 0.50000 1.0000 + Ni Ni71 1.0 0.45655 0.87500 0.50000 1.0000 + Ni Ni72 1.0 0.45655 0.95833 0.50000 1.0000 + Ni Ni73 1.0 0.53988 0.04167 0.50000 1.0000 + Ni Ni74 1.0 0.53988 0.12500 0.50000 1.0000 + Ni Ni75 1.0 0.53988 0.20833 0.50000 1.0000 + Ni Ni76 1.0 0.53988 0.29167 0.50000 1.0000 + Ni Ni77 1.0 0.53988 0.37500 0.50000 1.0000 + Ni Ni78 1.0 0.53988 0.45833 0.50000 1.0000 + Ni Ni79 1.0 0.53988 0.54167 0.50000 1.0000 + Ni Ni80 1.0 0.53988 0.62500 0.50000 1.0000 + Ni Ni81 1.0 0.53988 0.70833 0.50000 1.0000 + Ni Ni82 1.0 0.53988 0.79167 0.50000 1.0000 + Ni Ni83 1.0 0.53988 0.87500 0.50000 1.0000 + Ni Ni84 1.0 0.53988 0.95833 0.50000 1.0000 + Ni Ni85 1.0 0.62321 0.04167 0.50000 1.0000 + Ni Ni86 1.0 0.62321 0.12500 0.50000 1.0000 + Ni Ni87 1.0 0.62321 0.20833 0.50000 1.0000 + Ni Ni88 1.0 0.62321 0.29167 0.50000 1.0000 + Ni Ni89 1.0 0.62321 0.37500 0.50000 1.0000 + Ni Ni90 1.0 0.62321 0.45833 0.50000 1.0000 + Ni Ni91 1.0 0.62321 0.54167 0.50000 1.0000 + Ni Ni92 1.0 0.62321 0.62500 0.50000 1.0000 + Ni Ni93 1.0 0.62321 0.70833 0.50000 1.0000 + Ni Ni94 1.0 0.62321 0.79167 0.50000 1.0000 + Ni Ni95 1.0 0.62321 0.87500 0.50000 1.0000 + Ni Ni96 1.0 0.62321 0.95833 0.50000 1.0000 + Ni Ni97 1.0 0.70655 0.04167 0.50000 1.0000 + Ni Ni98 1.0 0.70655 0.12500 0.50000 1.0000 + Ni Ni99 1.0 0.70655 0.20833 0.50000 1.0000 + Ni Ni100 1.0 0.70655 0.29167 0.50000 1.0000 + Ni Ni101 1.0 0.70655 0.37500 0.50000 1.0000 + Ni Ni102 1.0 0.70655 0.45833 0.50000 1.0000 + Ni Ni103 1.0 0.70655 0.54167 0.50000 1.0000 + Ni Ni104 1.0 0.70655 0.62500 0.50000 1.0000 + Ni Ni105 1.0 0.70655 0.70833 0.50000 1.0000 + Ni Ni106 1.0 0.70655 0.79167 0.50000 1.0000 + Ni Ni107 1.0 0.70655 0.87500 0.50000 1.0000 + Ni Ni108 1.0 0.70655 0.95833 0.50000 1.0000 + Ni Ni109 1.0 0.78988 0.04167 0.50000 1.0000 + Ni Ni110 1.0 0.78988 0.12500 0.50000 1.0000 + Ni Ni111 1.0 0.78988 0.20833 0.50000 1.0000 + Ni Ni112 1.0 0.78988 0.29167 0.50000 1.0000 + Ni Ni113 1.0 0.78988 0.37500 0.50000 1.0000 + Ni Ni114 1.0 0.78988 0.45833 0.50000 1.0000 + Ni Ni115 1.0 0.78988 0.54167 0.50000 1.0000 + Ni Ni116 1.0 0.78988 0.62500 0.50000 1.0000 + Ni Ni117 1.0 0.78988 0.70833 0.50000 1.0000 + Ni Ni118 1.0 0.78988 0.79167 0.50000 1.0000 + Ni Ni119 1.0 0.78988 0.87500 0.50000 1.0000 + Ni Ni120 1.0 0.78988 0.95833 0.50000 1.0000 + Ni Ni121 1.0 0.87321 0.04167 0.50000 1.0000 + Ni Ni122 1.0 0.87321 0.12500 0.50000 1.0000 + Ni Ni123 1.0 0.87321 0.20833 0.50000 1.0000 + Ni Ni124 1.0 0.87321 0.29167 0.50000 1.0000 + Ni Ni125 1.0 0.87321 0.37500 0.50000 1.0000 + Ni Ni126 1.0 0.87321 0.45833 0.50000 1.0000 + Ni Ni127 1.0 0.87321 0.54167 0.50000 1.0000 + Ni Ni128 1.0 0.87321 0.62500 0.50000 1.0000 + Ni Ni129 1.0 0.87321 0.70833 0.50000 1.0000 + Ni Ni130 1.0 0.87321 0.79167 0.50000 1.0000 + Ni Ni131 1.0 0.87321 0.87500 0.50000 1.0000 + Ni Ni132 1.0 0.87321 0.95833 0.50000 1.0000 + Ni Ni133 1.0 0.95655 0.04167 0.50000 1.0000 + Ni Ni134 1.0 0.95655 0.12500 0.50000 1.0000 + Ni Ni135 1.0 0.95655 0.20833 0.50000 1.0000 + Ni Ni136 1.0 0.95655 0.29167 0.50000 1.0000 + Ni Ni137 1.0 0.95655 0.37500 0.50000 1.0000 + Ni Ni138 1.0 0.95655 0.45833 0.50000 1.0000 + Ni Ni139 1.0 0.95655 0.54167 0.50000 1.0000 + Ni Ni140 1.0 0.95655 0.62500 0.50000 1.0000 + Ni Ni141 1.0 0.95655 0.70833 0.50000 1.0000 + Ni Ni142 1.0 0.95655 0.79167 0.50000 1.0000 + Ni Ni143 1.0 0.95655 0.87500 0.50000 1.0000 + Ni Ni144 1.0 0.95655 0.95833 0.50000 1.0000 + Ni Ni145 1.0 0.08155 0.02107 0.50000 1.0000 + Ni Ni146 1.0 0.08155 0.10440 0.50000 1.0000 + Ni Ni147 1.0 0.08155 0.18774 0.50000 1.0000 + Ni Ni148 1.0 0.08155 0.27107 0.50000 1.0000 + Ni Ni149 1.0 0.08155 0.35440 0.50000 1.0000 + Ni Ni150 1.0 0.08155 0.43774 0.50000 1.0000 + Ni Ni151 1.0 0.08155 0.52107 0.50000 1.0000 + Ni Ni152 1.0 0.08155 0.60440 0.50000 1.0000 + Ni Ni153 1.0 0.08155 0.68774 0.50000 1.0000 + Ni Ni154 1.0 0.08155 0.77107 0.50000 1.0000 + Ni Ni155 1.0 0.08155 0.85440 0.50000 1.0000 + Ni Ni156 1.0 0.08155 0.93774 0.50000 1.0000 + Ni Ni157 1.0 0.16488 0.02107 0.50000 1.0000 + Ni Ni158 1.0 0.16488 0.10440 0.50000 1.0000 + Ni Ni159 1.0 0.16488 0.18774 0.50000 1.0000 + Ni Ni160 1.0 0.16488 0.27107 0.50000 1.0000 + Ni Ni161 1.0 0.16488 0.35440 0.50000 1.0000 + Ni Ni162 1.0 0.16488 0.43774 0.50000 1.0000 + Ni Ni163 1.0 0.16488 0.52107 0.50000 1.0000 + Ni Ni164 1.0 0.16488 0.60440 0.50000 1.0000 + Ni Ni165 1.0 0.16488 0.68774 0.50000 1.0000 + Ni Ni166 1.0 0.16488 0.77107 0.50000 1.0000 + Ni Ni167 1.0 0.16488 0.85440 0.50000 1.0000 + Ni Ni168 1.0 0.16488 0.93774 0.50000 1.0000 + Ni Ni169 1.0 0.24821 0.02107 0.50000 1.0000 + Ni Ni170 1.0 0.24821 0.10440 0.50000 1.0000 + Ni Ni171 1.0 0.24821 0.18774 0.50000 1.0000 + Ni Ni172 1.0 0.24821 0.27107 0.50000 1.0000 + Ni Ni173 1.0 0.24821 0.35440 0.50000 1.0000 + Ni Ni174 1.0 0.24821 0.43774 0.50000 1.0000 + Ni Ni175 1.0 0.24821 0.52107 0.50000 1.0000 + Ni Ni176 1.0 0.24821 0.60440 0.50000 1.0000 + Ni Ni177 1.0 0.24821 0.68774 0.50000 1.0000 + Ni Ni178 1.0 0.24821 0.77107 0.50000 1.0000 + Ni Ni179 1.0 0.24821 0.85440 0.50000 1.0000 + Ni Ni180 1.0 0.24821 0.93774 0.50000 1.0000 + Ni Ni181 1.0 0.33155 0.02107 0.50000 1.0000 + Ni Ni182 1.0 0.33155 0.10440 0.50000 1.0000 + Ni Ni183 1.0 0.33155 0.18774 0.50000 1.0000 + Ni Ni184 1.0 0.33155 0.27107 0.50000 1.0000 + Ni Ni185 1.0 0.33155 0.35440 0.50000 1.0000 + Ni Ni186 1.0 0.33155 0.43774 0.50000 1.0000 + Ni Ni187 1.0 0.33155 0.52107 0.50000 1.0000 + Ni Ni188 1.0 0.33155 0.60440 0.50000 1.0000 + Ni Ni189 1.0 0.33155 0.68774 0.50000 1.0000 + Ni Ni190 1.0 0.33155 0.77107 0.50000 1.0000 + Ni Ni191 1.0 0.33155 0.85440 0.50000 1.0000 + Ni Ni192 1.0 0.33155 0.93774 0.50000 1.0000 + Ni Ni193 1.0 0.41488 0.02107 0.50000 1.0000 + Ni Ni194 1.0 0.41488 0.10440 0.50000 1.0000 + Ni Ni195 1.0 0.41488 0.18774 0.50000 1.0000 + Ni Ni196 1.0 0.41488 0.27107 0.50000 1.0000 + Ni Ni197 1.0 0.41488 0.35440 0.50000 1.0000 + Ni Ni198 1.0 0.41488 0.43774 0.50000 1.0000 + Ni Ni199 1.0 0.41488 0.52107 0.50000 1.0000 + Ni Ni200 1.0 0.41488 0.60440 0.50000 1.0000 + Ni Ni201 1.0 0.41488 0.68774 0.50000 1.0000 + Ni Ni202 1.0 0.41488 0.77107 0.50000 1.0000 + Ni Ni203 1.0 0.41488 0.85440 0.50000 1.0000 + Ni Ni204 1.0 0.41488 0.93774 0.50000 1.0000 + Ni Ni205 1.0 0.49821 0.02107 0.50000 1.0000 + Ni Ni206 1.0 0.49821 0.10440 0.50000 1.0000 + Ni Ni207 1.0 0.49821 0.18774 0.50000 1.0000 + Ni Ni208 1.0 0.49821 0.27107 0.50000 1.0000 + Ni Ni209 1.0 0.49821 0.35440 0.50000 1.0000 + Ni Ni210 1.0 0.49821 0.43774 0.50000 1.0000 + Ni Ni211 1.0 0.49821 0.52107 0.50000 1.0000 + Ni Ni212 1.0 0.49821 0.60440 0.50000 1.0000 + Ni Ni213 1.0 0.49821 0.68774 0.50000 1.0000 + Ni Ni214 1.0 0.49821 0.77107 0.50000 1.0000 + Ni Ni215 1.0 0.49821 0.85440 0.50000 1.0000 + Ni Ni216 1.0 0.49821 0.93774 0.50000 1.0000 + Ni Ni217 1.0 0.58155 0.02107 0.50000 1.0000 + Ni Ni218 1.0 0.58155 0.10440 0.50000 1.0000 + Ni Ni219 1.0 0.58155 0.18774 0.50000 1.0000 + Ni Ni220 1.0 0.58155 0.27107 0.50000 1.0000 + Ni Ni221 1.0 0.58155 0.35440 0.50000 1.0000 + Ni Ni222 1.0 0.58155 0.43774 0.50000 1.0000 + Ni Ni223 1.0 0.58155 0.52107 0.50000 1.0000 + Ni Ni224 1.0 0.58155 0.60440 0.50000 1.0000 + Ni Ni225 1.0 0.58155 0.68774 0.50000 1.0000 + Ni Ni226 1.0 0.58155 0.77107 0.50000 1.0000 + Ni Ni227 1.0 0.58155 0.85440 0.50000 1.0000 + Ni Ni228 1.0 0.58155 0.93774 0.50000 1.0000 + Ni Ni229 1.0 0.66488 0.02107 0.50000 1.0000 + Ni Ni230 1.0 0.66488 0.10440 0.50000 1.0000 + Ni Ni231 1.0 0.66488 0.18774 0.50000 1.0000 + Ni Ni232 1.0 0.66488 0.27107 0.50000 1.0000 + Ni Ni233 1.0 0.66488 0.35440 0.50000 1.0000 + Ni Ni234 1.0 0.66488 0.43774 0.50000 1.0000 + Ni Ni235 1.0 0.66488 0.52107 0.50000 1.0000 + Ni Ni236 1.0 0.66488 0.60440 0.50000 1.0000 + Ni Ni237 1.0 0.66488 0.68774 0.50000 1.0000 + Ni Ni238 1.0 0.66488 0.77107 0.50000 1.0000 + Ni Ni239 1.0 0.66488 0.85440 0.50000 1.0000 + Ni Ni240 1.0 0.66488 0.93774 0.50000 1.0000 + Ni Ni241 1.0 0.74821 0.02107 0.50000 1.0000 + Ni Ni242 1.0 0.74821 0.10440 0.50000 1.0000 + Ni Ni243 1.0 0.74821 0.18774 0.50000 1.0000 + Ni Ni244 1.0 0.74821 0.27107 0.50000 1.0000 + Ni Ni245 1.0 0.74821 0.35440 0.50000 1.0000 + Ni Ni246 1.0 0.74821 0.43774 0.50000 1.0000 + Ni Ni247 1.0 0.74821 0.52107 0.50000 1.0000 + Ni Ni248 1.0 0.74821 0.60440 0.50000 1.0000 + Ni Ni249 1.0 0.74821 0.68774 0.50000 1.0000 + Ni Ni250 1.0 0.74821 0.77107 0.50000 1.0000 + Ni Ni251 1.0 0.74821 0.85440 0.50000 1.0000 + Ni Ni252 1.0 0.74821 0.93774 0.50000 1.0000 + Ni Ni253 1.0 0.83155 0.02107 0.50000 1.0000 + Ni Ni254 1.0 0.83155 0.10440 0.50000 1.0000 + Ni Ni255 1.0 0.83155 0.18774 0.50000 1.0000 + Ni Ni256 1.0 0.83155 0.27107 0.50000 1.0000 + Ni Ni257 1.0 0.83155 0.35440 0.50000 1.0000 + Ni Ni258 1.0 0.83155 0.43774 0.50000 1.0000 + Ni Ni259 1.0 0.83155 0.52107 0.50000 1.0000 + Ni Ni260 1.0 0.83155 0.60440 0.50000 1.0000 + Ni Ni261 1.0 0.83155 0.68774 0.50000 1.0000 + Ni Ni262 1.0 0.83155 0.77107 0.50000 1.0000 + Ni Ni263 1.0 0.83155 0.85440 0.50000 1.0000 + Ni Ni264 1.0 0.83155 0.93774 0.50000 1.0000 + Ni Ni265 1.0 0.91488 0.02107 0.50000 1.0000 + Ni Ni266 1.0 0.91488 0.10440 0.50000 1.0000 + Ni Ni267 1.0 0.91488 0.18774 0.50000 1.0000 + Ni Ni268 1.0 0.91488 0.27107 0.50000 1.0000 + Ni Ni269 1.0 0.91488 0.35440 0.50000 1.0000 + Ni Ni270 1.0 0.91488 0.43774 0.50000 1.0000 + Ni Ni271 1.0 0.91488 0.52107 0.50000 1.0000 + Ni Ni272 1.0 0.91488 0.60440 0.50000 1.0000 + Ni Ni273 1.0 0.91488 0.68774 0.50000 1.0000 + Ni Ni274 1.0 0.91488 0.77107 0.50000 1.0000 + Ni Ni275 1.0 0.91488 0.85440 0.50000 1.0000 + Ni Ni276 1.0 0.91488 0.93774 0.50000 1.0000 + Ni Ni277 1.0 0.99821 0.02107 0.50000 1.0000 + Ni Ni278 1.0 0.99821 0.10440 0.50000 1.0000 + Ni Ni279 1.0 0.99821 0.18774 0.50000 1.0000 + Ni Ni280 1.0 0.99821 0.27107 0.50000 1.0000 + Ni Ni281 1.0 0.99821 0.35440 0.50000 1.0000 + Ni Ni282 1.0 0.99821 0.43774 0.50000 1.0000 + Ni Ni283 1.0 0.99821 0.52107 0.50000 1.0000 + Ni Ni284 1.0 0.99821 0.60440 0.50000 1.0000 + Ni Ni285 1.0 0.99821 0.68774 0.50000 1.0000 + Ni Ni286 1.0 0.99821 0.77107 0.50000 1.0000 + Ni Ni287 1.0 0.99821 0.85440 0.50000 1.0000 + Ni Ni288 1.0 0.99821 0.93774 0.50000 1.0000 + Ni Ni289 1.0 0.08155 0.06226 0.50000 1.0000 + Ni Ni290 1.0 0.08155 0.14560 0.50000 1.0000 + Ni Ni291 1.0 0.08155 0.22893 0.50000 1.0000 + Ni Ni292 1.0 0.08155 0.31226 0.50000 1.0000 + Ni Ni293 1.0 0.08155 0.39560 0.50000 1.0000 + Ni Ni294 1.0 0.08155 0.47893 0.50000 1.0000 + Ni Ni295 1.0 0.08155 0.56226 0.50000 1.0000 + Ni Ni296 1.0 0.08155 0.64560 0.50000 1.0000 + Ni Ni297 1.0 0.08155 0.72893 0.50000 1.0000 + Ni Ni298 1.0 0.08155 0.81226 0.50000 1.0000 + Ni Ni299 1.0 0.08155 0.89560 0.50000 1.0000 + Ni Ni300 1.0 0.08155 0.97893 0.50000 1.0000 + Ni Ni301 1.0 0.16488 0.06226 0.50000 1.0000 + Ni Ni302 1.0 0.16488 0.14560 0.50000 1.0000 + Ni Ni303 1.0 0.16488 0.22893 0.50000 1.0000 + Ni Ni304 1.0 0.16488 0.31226 0.50000 1.0000 + Ni Ni305 1.0 0.16488 0.39560 0.50000 1.0000 + Ni Ni306 1.0 0.16488 0.47893 0.50000 1.0000 + Ni Ni307 1.0 0.16488 0.56226 0.50000 1.0000 + Ni Ni308 1.0 0.16488 0.64560 0.50000 1.0000 + Ni Ni309 1.0 0.16488 0.72893 0.50000 1.0000 + Ni Ni310 1.0 0.16488 0.81226 0.50000 1.0000 + Ni Ni311 1.0 0.16488 0.89560 0.50000 1.0000 + Ni Ni312 1.0 0.16488 0.97893 0.50000 1.0000 + Ni Ni313 1.0 0.24821 0.06226 0.50000 1.0000 + Ni Ni314 1.0 0.24821 0.14560 0.50000 1.0000 + Ni Ni315 1.0 0.24821 0.22893 0.50000 1.0000 + Ni Ni316 1.0 0.24821 0.31226 0.50000 1.0000 + Ni Ni317 1.0 0.24821 0.39560 0.50000 1.0000 + Ni Ni318 1.0 0.24821 0.47893 0.50000 1.0000 + Ni Ni319 1.0 0.24821 0.56226 0.50000 1.0000 + Ni Ni320 1.0 0.24821 0.64560 0.50000 1.0000 + Ni Ni321 1.0 0.24821 0.72893 0.50000 1.0000 + Ni Ni322 1.0 0.24821 0.81226 0.50000 1.0000 + Ni Ni323 1.0 0.24821 0.89560 0.50000 1.0000 + Ni Ni324 1.0 0.24821 0.97893 0.50000 1.0000 + Ni Ni325 1.0 0.33155 0.06226 0.50000 1.0000 + Ni Ni326 1.0 0.33155 0.14560 0.50000 1.0000 + Ni Ni327 1.0 0.33155 0.22893 0.50000 1.0000 + Ni Ni328 1.0 0.33155 0.31226 0.50000 1.0000 + Ni Ni329 1.0 0.33155 0.39560 0.50000 1.0000 + Ni Ni330 1.0 0.33155 0.47893 0.50000 1.0000 + Ni Ni331 1.0 0.33155 0.56226 0.50000 1.0000 + Ni Ni332 1.0 0.33155 0.64560 0.50000 1.0000 + Ni Ni333 1.0 0.33155 0.72893 0.50000 1.0000 + Ni Ni334 1.0 0.33155 0.81226 0.50000 1.0000 + Ni Ni335 1.0 0.33155 0.89560 0.50000 1.0000 + Ni Ni336 1.0 0.33155 0.97893 0.50000 1.0000 + Ni Ni337 1.0 0.41488 0.06226 0.50000 1.0000 + Ni Ni338 1.0 0.41488 0.14560 0.50000 1.0000 + Ni Ni339 1.0 0.41488 0.22893 0.50000 1.0000 + Ni Ni340 1.0 0.41488 0.31226 0.50000 1.0000 + Ni Ni341 1.0 0.41488 0.39560 0.50000 1.0000 + Ni Ni342 1.0 0.41488 0.47893 0.50000 1.0000 + Ni Ni343 1.0 0.41488 0.56226 0.50000 1.0000 + Ni Ni344 1.0 0.41488 0.64560 0.50000 1.0000 + Ni Ni345 1.0 0.41488 0.72893 0.50000 1.0000 + Ni Ni346 1.0 0.41488 0.81226 0.50000 1.0000 + Ni Ni347 1.0 0.41488 0.89560 0.50000 1.0000 + Ni Ni348 1.0 0.41488 0.97893 0.50000 1.0000 + Ni Ni349 1.0 0.49821 0.06226 0.50000 1.0000 + Ni Ni350 1.0 0.49821 0.14560 0.50000 1.0000 + Ni Ni351 1.0 0.49821 0.22893 0.50000 1.0000 + Ni Ni352 1.0 0.49821 0.31226 0.50000 1.0000 + Ni Ni353 1.0 0.49821 0.39560 0.50000 1.0000 + Ni Ni354 1.0 0.49821 0.47893 0.50000 1.0000 + Ni Ni355 1.0 0.49821 0.56226 0.50000 1.0000 + Ni Ni356 1.0 0.49821 0.64560 0.50000 1.0000 + Ni Ni357 1.0 0.49821 0.72893 0.50000 1.0000 + Ni Ni358 1.0 0.49821 0.81226 0.50000 1.0000 + Ni Ni359 1.0 0.49821 0.89560 0.50000 1.0000 + Ni Ni360 1.0 0.49821 0.97893 0.50000 1.0000 + Ni Ni361 1.0 0.58155 0.06226 0.50000 1.0000 + Ni Ni362 1.0 0.58155 0.14560 0.50000 1.0000 + Ni Ni363 1.0 0.58155 0.22893 0.50000 1.0000 + Ni Ni364 1.0 0.58155 0.31226 0.50000 1.0000 + Ni Ni365 1.0 0.58155 0.39560 0.50000 1.0000 + Ni Ni366 1.0 0.58155 0.47893 0.50000 1.0000 + Ni Ni367 1.0 0.58155 0.56226 0.50000 1.0000 + Ni Ni368 1.0 0.58155 0.64560 0.50000 1.0000 + Ni Ni369 1.0 0.58155 0.72893 0.50000 1.0000 + Ni Ni370 1.0 0.58155 0.81226 0.50000 1.0000 + Ni Ni371 1.0 0.58155 0.89560 0.50000 1.0000 + Ni Ni372 1.0 0.58155 0.97893 0.50000 1.0000 + Ni Ni373 1.0 0.66488 0.06226 0.50000 1.0000 + Ni Ni374 1.0 0.66488 0.14560 0.50000 1.0000 + Ni Ni375 1.0 0.66488 0.22893 0.50000 1.0000 + Ni Ni376 1.0 0.66488 0.31226 0.50000 1.0000 + Ni Ni377 1.0 0.66488 0.39560 0.50000 1.0000 + Ni Ni378 1.0 0.66488 0.47893 0.50000 1.0000 + Ni Ni379 1.0 0.66488 0.56226 0.50000 1.0000 + Ni Ni380 1.0 0.66488 0.64560 0.50000 1.0000 + Ni Ni381 1.0 0.66488 0.72893 0.50000 1.0000 + Ni Ni382 1.0 0.66488 0.81226 0.50000 1.0000 + Ni Ni383 1.0 0.66488 0.89560 0.50000 1.0000 + Ni Ni384 1.0 0.66488 0.97893 0.50000 1.0000 + Ni Ni385 1.0 0.74821 0.06226 0.50000 1.0000 + Ni Ni386 1.0 0.74821 0.14560 0.50000 1.0000 + Ni Ni387 1.0 0.74821 0.22893 0.50000 1.0000 + Ni Ni388 1.0 0.74821 0.31226 0.50000 1.0000 + Ni Ni389 1.0 0.74821 0.39560 0.50000 1.0000 + Ni Ni390 1.0 0.74821 0.47893 0.50000 1.0000 + Ni Ni391 1.0 0.74821 0.56226 0.50000 1.0000 + Ni Ni392 1.0 0.74821 0.64560 0.50000 1.0000 + Ni Ni393 1.0 0.74821 0.72893 0.50000 1.0000 + Ni Ni394 1.0 0.74821 0.81226 0.50000 1.0000 + Ni Ni395 1.0 0.74821 0.89560 0.50000 1.0000 + Ni Ni396 1.0 0.74821 0.97893 0.50000 1.0000 + Ni Ni397 1.0 0.83155 0.06226 0.50000 1.0000 + Ni Ni398 1.0 0.83155 0.14560 0.50000 1.0000 + Ni Ni399 1.0 0.83155 0.22893 0.50000 1.0000 + Ni Ni400 1.0 0.83155 0.31226 0.50000 1.0000 + Ni Ni401 1.0 0.83155 0.39560 0.50000 1.0000 + Ni Ni402 1.0 0.83155 0.47893 0.50000 1.0000 + Ni Ni403 1.0 0.83155 0.56226 0.50000 1.0000 + Ni Ni404 1.0 0.83155 0.64560 0.50000 1.0000 + Ni Ni405 1.0 0.83155 0.72893 0.50000 1.0000 + Ni Ni406 1.0 0.83155 0.81226 0.50000 1.0000 + Ni Ni407 1.0 0.83155 0.89560 0.50000 1.0000 + Ni Ni408 1.0 0.83155 0.97893 0.50000 1.0000 + Ni Ni409 1.0 0.91488 0.06226 0.50000 1.0000 + Ni Ni410 1.0 0.91488 0.14560 0.50000 1.0000 + Ni Ni411 1.0 0.91488 0.22893 0.50000 1.0000 + Ni Ni412 1.0 0.91488 0.31226 0.50000 1.0000 + Ni Ni413 1.0 0.91488 0.39560 0.50000 1.0000 + Ni Ni414 1.0 0.91488 0.47893 0.50000 1.0000 + Ni Ni415 1.0 0.91488 0.56226 0.50000 1.0000 + Ni Ni416 1.0 0.91488 0.64560 0.50000 1.0000 + Ni Ni417 1.0 0.91488 0.72893 0.50000 1.0000 + Ni Ni418 1.0 0.91488 0.81226 0.50000 1.0000 + Ni Ni419 1.0 0.91488 0.89560 0.50000 1.0000 + Ni Ni420 1.0 0.91488 0.97893 0.50000 1.0000 + Ni Ni421 1.0 0.99821 0.06226 0.50000 1.0000 + Ni Ni422 1.0 0.99821 0.14560 0.50000 1.0000 + Ni Ni423 1.0 0.99821 0.22893 0.50000 1.0000 + Ni Ni424 1.0 0.99821 0.31226 0.50000 1.0000 + Ni Ni425 1.0 0.99821 0.39560 0.50000 1.0000 + Ni Ni426 1.0 0.99821 0.47893 0.50000 1.0000 + Ni Ni427 1.0 0.99821 0.56226 0.50000 1.0000 + Ni Ni428 1.0 0.99821 0.64560 0.50000 1.0000 + Ni Ni429 1.0 0.99821 0.72893 0.50000 1.0000 + Ni Ni430 1.0 0.99821 0.81226 0.50000 1.0000 + Ni Ni431 1.0 0.99821 0.89560 0.50000 1.0000 + Ni Ni432 1.0 0.99821 0.97893 0.50000 1.0000 + O O1 1.0 0.00821 0.00000 0.34396 1.0000 + O O2 1.0 0.00821 0.08333 0.34396 1.0000 + O O3 1.0 0.00821 0.16667 0.34396 1.0000 + O O4 1.0 0.00821 0.25000 0.34396 1.0000 + O O5 1.0 0.00821 0.33333 0.34396 1.0000 + O O6 1.0 0.00821 0.41667 0.34396 1.0000 + O O7 1.0 0.00821 0.50000 0.34396 1.0000 + 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1.0000 + F F1502 1.0 0.33097 0.48160 0.36114 1.0000 + F F1503 1.0 0.36222 0.51285 0.36114 1.0000 + F F1504 1.0 0.39347 0.54410 0.36114 1.0000 + F F1505 1.0 0.95597 0.04410 0.36114 1.0000 + F F1506 1.0 0.98722 0.07535 0.36114 1.0000 + F F1507 1.0 0.01847 0.10660 0.36114 1.0000 + F F1508 1.0 0.04972 0.13785 0.36114 1.0000 + F F1509 1.0 0.08097 0.16910 0.36114 1.0000 + F F1510 1.0 0.11222 0.20035 0.36114 1.0000 + F F1511 1.0 0.14347 0.23160 0.36114 1.0000 + F F1512 1.0 0.17472 0.26285 0.36114 1.0000 + F F1513 1.0 0.20597 0.29410 0.36114 1.0000 + F F1514 1.0 0.23722 0.32535 0.36114 1.0000 + F F1515 1.0 0.26847 0.35660 0.36114 1.0000 + F F1516 1.0 0.29972 0.38785 0.36114 1.0000 + F F1517 1.0 0.33097 0.41910 0.36114 1.0000 + F F1518 1.0 0.36222 0.45035 0.36114 1.0000 + F F1519 1.0 0.39347 0.48160 0.36114 1.0000 + F F1520 1.0 0.42472 0.51285 0.36114 1.0000 + F F1521 1.0 0.98722 0.01285 0.36114 1.0000 + F F1522 1.0 0.01847 0.04410 0.36114 1.0000 + F F1523 1.0 0.04972 0.07535 0.36114 1.0000 + F F1524 1.0 0.08097 0.10660 0.36114 1.0000 + F F1525 1.0 0.11222 0.13785 0.36114 1.0000 + F F1526 1.0 0.14347 0.16910 0.36114 1.0000 + F F1527 1.0 0.17472 0.20035 0.36114 1.0000 + F F1528 1.0 0.20597 0.23160 0.36114 1.0000 + F F1529 1.0 0.23722 0.26285 0.36114 1.0000 + F F1530 1.0 0.26847 0.29410 0.36114 1.0000 + F F1531 1.0 0.29972 0.32535 0.36114 1.0000 + F F1532 1.0 0.33097 0.35660 0.36114 1.0000 + F F1533 1.0 0.36222 0.38785 0.36114 1.0000 + F F1534 1.0 0.39347 0.41910 0.36114 1.0000 + F F1535 1.0 0.42472 0.45035 0.36114 1.0000 + F F1536 1.0 0.45597 0.48160 0.36114 1.0000 diff --git a/tier3/cif_file/orthogonal_2dm-5548_supercell_16x16x1.cif b/tier3/cif_file/orthogonal_2dm-5548_supercell_16x16x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..9e40bf9ebfc0a2e486c5c7126c58fd920c71277b --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-5548_supercell_16x16x1.cif @@ -0,0 +1,1561 @@ +data_image0 +_chemical_formula_structural Sn512Cl512F512 +_chemical_formula_sum "Sn512 Cl512 F512" +_cell_length_a 69.9101 +_cell_length_b 96.0928 +_cell_length_c 6.8468 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Sn Sn1 1.0 0.04688 0.04867 0.37074 1.0000 + Sn Sn2 1.0 0.04688 0.11117 0.37074 1.0000 + Sn Sn3 1.0 0.04688 0.17367 0.37074 1.0000 + Sn Sn4 1.0 0.04688 0.23617 0.37074 1.0000 + Sn Sn5 1.0 0.04688 0.29867 0.37074 1.0000 + Sn Sn6 1.0 0.04688 0.36117 0.37074 1.0000 + Sn Sn7 1.0 0.04688 0.42367 0.37074 1.0000 + Sn Sn8 1.0 0.04688 0.48617 0.37074 1.0000 + Sn Sn9 1.0 0.04688 0.54867 0.37074 1.0000 + Sn Sn10 1.0 0.04688 0.61117 0.37074 1.0000 + Sn Sn11 1.0 0.04688 0.67367 0.37074 1.0000 + Sn Sn12 1.0 0.04688 0.73617 0.37074 1.0000 + Sn Sn13 1.0 0.04688 0.79867 0.37074 1.0000 + Sn Sn14 1.0 0.04688 0.86117 0.37074 1.0000 + Sn Sn15 1.0 0.04688 0.92367 0.37074 1.0000 + Sn Sn16 1.0 0.04688 0.98617 0.37074 1.0000 + Sn Sn17 1.0 0.10938 0.04867 0.37074 1.0000 + Sn Sn18 1.0 0.10938 0.11117 0.37074 1.0000 + Sn Sn19 1.0 0.10938 0.17367 0.37074 1.0000 + Sn Sn20 1.0 0.10938 0.23617 0.37074 1.0000 + Sn Sn21 1.0 0.10938 0.29867 0.37074 1.0000 + Sn Sn22 1.0 0.10938 0.36117 0.37074 1.0000 + Sn Sn23 1.0 0.10938 0.42367 0.37074 1.0000 + Sn Sn24 1.0 0.10938 0.48617 0.37074 1.0000 + Sn Sn25 1.0 0.10938 0.54867 0.37074 1.0000 + Sn Sn26 1.0 0.10938 0.61117 0.37074 1.0000 + Sn Sn27 1.0 0.10938 0.67367 0.37074 1.0000 + Sn Sn28 1.0 0.10938 0.73617 0.37074 1.0000 + Sn Sn29 1.0 0.10938 0.79867 0.37074 1.0000 + Sn Sn30 1.0 0.10938 0.86117 0.37074 1.0000 + Sn Sn31 1.0 0.10938 0.92367 0.37074 1.0000 + Sn Sn32 1.0 0.10938 0.98617 0.37074 1.0000 + Sn Sn33 1.0 0.17188 0.04867 0.37074 1.0000 + Sn Sn34 1.0 0.17188 0.11117 0.37074 1.0000 + Sn Sn35 1.0 0.17188 0.17367 0.37074 1.0000 + Sn Sn36 1.0 0.17188 0.23617 0.37074 1.0000 + Sn Sn37 1.0 0.17188 0.29867 0.37074 1.0000 + Sn Sn38 1.0 0.17188 0.36117 0.37074 1.0000 + Sn Sn39 1.0 0.17188 0.42367 0.37074 1.0000 + Sn Sn40 1.0 0.17188 0.48617 0.37074 1.0000 + Sn Sn41 1.0 0.17188 0.54867 0.37074 1.0000 + Sn Sn42 1.0 0.17188 0.61117 0.37074 1.0000 + Sn Sn43 1.0 0.17188 0.67367 0.37074 1.0000 + Sn Sn44 1.0 0.17188 0.73617 0.37074 1.0000 + Sn Sn45 1.0 0.17188 0.79867 0.37074 1.0000 + Sn Sn46 1.0 0.17188 0.86117 0.37074 1.0000 + Sn Sn47 1.0 0.17188 0.92367 0.37074 1.0000 + Sn Sn48 1.0 0.17188 0.98617 0.37074 1.0000 + Sn Sn49 1.0 0.23438 0.04867 0.37074 1.0000 + Sn Sn50 1.0 0.23438 0.11117 0.37074 1.0000 + Sn Sn51 1.0 0.23438 0.17367 0.37074 1.0000 + Sn Sn52 1.0 0.23438 0.23617 0.37074 1.0000 + Sn Sn53 1.0 0.23438 0.29867 0.37074 1.0000 + Sn Sn54 1.0 0.23438 0.36117 0.37074 1.0000 + Sn Sn55 1.0 0.23438 0.42367 0.37074 1.0000 + Sn Sn56 1.0 0.23438 0.48617 0.37074 1.0000 + Sn Sn57 1.0 0.23438 0.54867 0.37074 1.0000 + Sn Sn58 1.0 0.23438 0.61117 0.37074 1.0000 + Sn Sn59 1.0 0.23438 0.67367 0.37074 1.0000 + Sn Sn60 1.0 0.23438 0.73617 0.37074 1.0000 + Sn Sn61 1.0 0.23438 0.79867 0.37074 1.0000 + Sn Sn62 1.0 0.23438 0.86117 0.37074 1.0000 + Sn Sn63 1.0 0.23438 0.92367 0.37074 1.0000 + Sn Sn64 1.0 0.23438 0.98617 0.37074 1.0000 + Sn Sn65 1.0 0.29688 0.04867 0.37074 1.0000 + Sn Sn66 1.0 0.29688 0.11117 0.37074 1.0000 + Sn Sn67 1.0 0.29688 0.17367 0.37074 1.0000 + Sn Sn68 1.0 0.29688 0.23617 0.37074 1.0000 + Sn Sn69 1.0 0.29688 0.29867 0.37074 1.0000 + Sn Sn70 1.0 0.29688 0.36117 0.37074 1.0000 + Sn Sn71 1.0 0.29688 0.42367 0.37074 1.0000 + Sn Sn72 1.0 0.29688 0.48617 0.37074 1.0000 + Sn Sn73 1.0 0.29688 0.54867 0.37074 1.0000 + Sn Sn74 1.0 0.29688 0.61117 0.37074 1.0000 + Sn Sn75 1.0 0.29688 0.67367 0.37074 1.0000 + Sn Sn76 1.0 0.29688 0.73617 0.37074 1.0000 + Sn Sn77 1.0 0.29688 0.79867 0.37074 1.0000 + Sn Sn78 1.0 0.29688 0.86117 0.37074 1.0000 + Sn Sn79 1.0 0.29688 0.92367 0.37074 1.0000 + Sn Sn80 1.0 0.29688 0.98617 0.37074 1.0000 + Sn Sn81 1.0 0.35938 0.04867 0.37074 1.0000 + Sn Sn82 1.0 0.35938 0.11117 0.37074 1.0000 + Sn Sn83 1.0 0.35938 0.17367 0.37074 1.0000 + Sn Sn84 1.0 0.35938 0.23617 0.37074 1.0000 + Sn Sn85 1.0 0.35938 0.29867 0.37074 1.0000 + Sn Sn86 1.0 0.35938 0.36117 0.37074 1.0000 + Sn Sn87 1.0 0.35938 0.42367 0.37074 1.0000 + Sn Sn88 1.0 0.35938 0.48617 0.37074 1.0000 + Sn Sn89 1.0 0.35938 0.54867 0.37074 1.0000 + Sn Sn90 1.0 0.35938 0.61117 0.37074 1.0000 + Sn Sn91 1.0 0.35938 0.67367 0.37074 1.0000 + Sn Sn92 1.0 0.35938 0.73617 0.37074 1.0000 + Sn Sn93 1.0 0.35938 0.79867 0.37074 1.0000 + Sn Sn94 1.0 0.35938 0.86117 0.37074 1.0000 + Sn Sn95 1.0 0.35938 0.92367 0.37074 1.0000 + Sn Sn96 1.0 0.35938 0.98617 0.37074 1.0000 + Sn Sn97 1.0 0.42188 0.04867 0.37074 1.0000 + Sn Sn98 1.0 0.42188 0.11117 0.37074 1.0000 + Sn Sn99 1.0 0.42188 0.17367 0.37074 1.0000 + Sn Sn100 1.0 0.42188 0.23617 0.37074 1.0000 + Sn Sn101 1.0 0.42188 0.29867 0.37074 1.0000 + Sn Sn102 1.0 0.42188 0.36117 0.37074 1.0000 + Sn Sn103 1.0 0.42188 0.42367 0.37074 1.0000 + Sn Sn104 1.0 0.42188 0.48617 0.37074 1.0000 + Sn Sn105 1.0 0.42188 0.54867 0.37074 1.0000 + Sn Sn106 1.0 0.42188 0.61117 0.37074 1.0000 + Sn Sn107 1.0 0.42188 0.67367 0.37074 1.0000 + Sn Sn108 1.0 0.42188 0.73617 0.37074 1.0000 + Sn Sn109 1.0 0.42188 0.79867 0.37074 1.0000 + Sn Sn110 1.0 0.42188 0.86117 0.37074 1.0000 + Sn Sn111 1.0 0.42188 0.92367 0.37074 1.0000 + Sn Sn112 1.0 0.42188 0.98617 0.37074 1.0000 + Sn Sn113 1.0 0.48438 0.04867 0.37074 1.0000 + Sn Sn114 1.0 0.48438 0.11117 0.37074 1.0000 + Sn Sn115 1.0 0.48438 0.17367 0.37074 1.0000 + Sn Sn116 1.0 0.48438 0.23617 0.37074 1.0000 + Sn Sn117 1.0 0.48438 0.29867 0.37074 1.0000 + Sn Sn118 1.0 0.48438 0.36117 0.37074 1.0000 + Sn Sn119 1.0 0.48438 0.42367 0.37074 1.0000 + Sn Sn120 1.0 0.48438 0.48617 0.37074 1.0000 + Sn Sn121 1.0 0.48438 0.54867 0.37074 1.0000 + Sn Sn122 1.0 0.48438 0.61117 0.37074 1.0000 + Sn Sn123 1.0 0.48438 0.67367 0.37074 1.0000 + Sn Sn124 1.0 0.48438 0.73617 0.37074 1.0000 + Sn Sn125 1.0 0.48438 0.79867 0.37074 1.0000 + Sn Sn126 1.0 0.48438 0.86117 0.37074 1.0000 + Sn Sn127 1.0 0.48438 0.92367 0.37074 1.0000 + Sn Sn128 1.0 0.48438 0.98617 0.37074 1.0000 + Sn Sn129 1.0 0.54688 0.04867 0.37074 1.0000 + Sn Sn130 1.0 0.54688 0.11117 0.37074 1.0000 + Sn Sn131 1.0 0.54688 0.17367 0.37074 1.0000 + Sn Sn132 1.0 0.54688 0.23617 0.37074 1.0000 + Sn Sn133 1.0 0.54688 0.29867 0.37074 1.0000 + Sn Sn134 1.0 0.54688 0.36117 0.37074 1.0000 + Sn Sn135 1.0 0.54688 0.42367 0.37074 1.0000 + Sn Sn136 1.0 0.54688 0.48617 0.37074 1.0000 + Sn Sn137 1.0 0.54688 0.54867 0.37074 1.0000 + Sn Sn138 1.0 0.54688 0.61117 0.37074 1.0000 + Sn Sn139 1.0 0.54688 0.67367 0.37074 1.0000 + Sn Sn140 1.0 0.54688 0.73617 0.37074 1.0000 + Sn Sn141 1.0 0.54688 0.79867 0.37074 1.0000 + Sn Sn142 1.0 0.54688 0.86117 0.37074 1.0000 + Sn Sn143 1.0 0.54688 0.92367 0.37074 1.0000 + Sn Sn144 1.0 0.54688 0.98617 0.37074 1.0000 + Sn Sn145 1.0 0.60938 0.04867 0.37074 1.0000 + Sn Sn146 1.0 0.60938 0.11117 0.37074 1.0000 + Sn Sn147 1.0 0.60938 0.17367 0.37074 1.0000 + Sn Sn148 1.0 0.60938 0.23617 0.37074 1.0000 + Sn Sn149 1.0 0.60938 0.29867 0.37074 1.0000 + Sn Sn150 1.0 0.60938 0.36117 0.37074 1.0000 + Sn Sn151 1.0 0.60938 0.42367 0.37074 1.0000 + Sn Sn152 1.0 0.60938 0.48617 0.37074 1.0000 + Sn Sn153 1.0 0.60938 0.54867 0.37074 1.0000 + Sn Sn154 1.0 0.60938 0.61117 0.37074 1.0000 + Sn Sn155 1.0 0.60938 0.67367 0.37074 1.0000 + Sn Sn156 1.0 0.60938 0.73617 0.37074 1.0000 + Sn Sn157 1.0 0.60938 0.79867 0.37074 1.0000 + Sn Sn158 1.0 0.60938 0.86117 0.37074 1.0000 + Sn Sn159 1.0 0.60938 0.92367 0.37074 1.0000 + Sn Sn160 1.0 0.60938 0.98617 0.37074 1.0000 + Sn Sn161 1.0 0.67188 0.04867 0.37074 1.0000 + Sn Sn162 1.0 0.67188 0.11117 0.37074 1.0000 + Sn Sn163 1.0 0.67188 0.17367 0.37074 1.0000 + Sn Sn164 1.0 0.67188 0.23617 0.37074 1.0000 + Sn Sn165 1.0 0.67188 0.29867 0.37074 1.0000 + Sn Sn166 1.0 0.67188 0.36117 0.37074 1.0000 + Sn Sn167 1.0 0.67188 0.42367 0.37074 1.0000 + Sn Sn168 1.0 0.67188 0.48617 0.37074 1.0000 + Sn Sn169 1.0 0.67188 0.54867 0.37074 1.0000 + Sn Sn170 1.0 0.67188 0.61117 0.37074 1.0000 + Sn Sn171 1.0 0.67188 0.67367 0.37074 1.0000 + Sn Sn172 1.0 0.67188 0.73617 0.37074 1.0000 + Sn Sn173 1.0 0.67188 0.79867 0.37074 1.0000 + Sn Sn174 1.0 0.67188 0.86117 0.37074 1.0000 + Sn Sn175 1.0 0.67188 0.92367 0.37074 1.0000 + Sn Sn176 1.0 0.67188 0.98617 0.37074 1.0000 + Sn Sn177 1.0 0.73438 0.04867 0.37074 1.0000 + Sn Sn178 1.0 0.73438 0.11117 0.37074 1.0000 + Sn Sn179 1.0 0.73438 0.17367 0.37074 1.0000 + Sn Sn180 1.0 0.73438 0.23617 0.37074 1.0000 + Sn Sn181 1.0 0.73438 0.29867 0.37074 1.0000 + Sn Sn182 1.0 0.73438 0.36117 0.37074 1.0000 + Sn Sn183 1.0 0.73438 0.42367 0.37074 1.0000 + Sn Sn184 1.0 0.73438 0.48617 0.37074 1.0000 + Sn Sn185 1.0 0.73438 0.54867 0.37074 1.0000 + Sn Sn186 1.0 0.73438 0.61117 0.37074 1.0000 + Sn Sn187 1.0 0.73438 0.67367 0.37074 1.0000 + Sn Sn188 1.0 0.73438 0.73617 0.37074 1.0000 + Sn Sn189 1.0 0.73438 0.79867 0.37074 1.0000 + Sn Sn190 1.0 0.73438 0.86117 0.37074 1.0000 + Sn Sn191 1.0 0.73438 0.92367 0.37074 1.0000 + Sn Sn192 1.0 0.73438 0.98617 0.37074 1.0000 + Sn Sn193 1.0 0.79688 0.04867 0.37074 1.0000 + Sn Sn194 1.0 0.79688 0.11117 0.37074 1.0000 + Sn Sn195 1.0 0.79688 0.17367 0.37074 1.0000 + Sn Sn196 1.0 0.79688 0.23617 0.37074 1.0000 + Sn Sn197 1.0 0.79688 0.29867 0.37074 1.0000 + Sn Sn198 1.0 0.79688 0.36117 0.37074 1.0000 + Sn Sn199 1.0 0.79688 0.42367 0.37074 1.0000 + Sn Sn200 1.0 0.79688 0.48617 0.37074 1.0000 + Sn Sn201 1.0 0.79688 0.54867 0.37074 1.0000 + Sn Sn202 1.0 0.79688 0.61117 0.37074 1.0000 + Sn Sn203 1.0 0.79688 0.67367 0.37074 1.0000 + Sn Sn204 1.0 0.79688 0.73617 0.37074 1.0000 + Sn Sn205 1.0 0.79688 0.79867 0.37074 1.0000 + Sn Sn206 1.0 0.79688 0.86117 0.37074 1.0000 + Sn Sn207 1.0 0.79688 0.92367 0.37074 1.0000 + Sn Sn208 1.0 0.79688 0.98617 0.37074 1.0000 + Sn Sn209 1.0 0.85938 0.04867 0.37074 1.0000 + Sn Sn210 1.0 0.85938 0.11117 0.37074 1.0000 + Sn Sn211 1.0 0.85938 0.17367 0.37074 1.0000 + Sn Sn212 1.0 0.85938 0.23617 0.37074 1.0000 + Sn Sn213 1.0 0.85938 0.29867 0.37074 1.0000 + Sn Sn214 1.0 0.85938 0.36117 0.37074 1.0000 + Sn Sn215 1.0 0.85938 0.42367 0.37074 1.0000 + Sn Sn216 1.0 0.85938 0.48617 0.37074 1.0000 + Sn Sn217 1.0 0.85938 0.54867 0.37074 1.0000 + Sn Sn218 1.0 0.85938 0.61117 0.37074 1.0000 + Sn Sn219 1.0 0.85938 0.67367 0.37074 1.0000 + Sn Sn220 1.0 0.85938 0.73617 0.37074 1.0000 + Sn Sn221 1.0 0.85938 0.79867 0.37074 1.0000 + Sn Sn222 1.0 0.85938 0.86117 0.37074 1.0000 + Sn Sn223 1.0 0.85938 0.92367 0.37074 1.0000 + Sn Sn224 1.0 0.85938 0.98617 0.37074 1.0000 + Sn Sn225 1.0 0.92188 0.04867 0.37074 1.0000 + Sn Sn226 1.0 0.92188 0.11117 0.37074 1.0000 + Sn Sn227 1.0 0.92188 0.17367 0.37074 1.0000 + Sn Sn228 1.0 0.92188 0.23617 0.37074 1.0000 + Sn Sn229 1.0 0.92188 0.29867 0.37074 1.0000 + Sn Sn230 1.0 0.92188 0.36117 0.37074 1.0000 + Sn Sn231 1.0 0.92188 0.42367 0.37074 1.0000 + Sn Sn232 1.0 0.92188 0.48617 0.37074 1.0000 + Sn Sn233 1.0 0.92188 0.54867 0.37074 1.0000 + Sn Sn234 1.0 0.92188 0.61117 0.37074 1.0000 + Sn Sn235 1.0 0.92188 0.67367 0.37074 1.0000 + Sn Sn236 1.0 0.92188 0.73617 0.37074 1.0000 + Sn Sn237 1.0 0.92188 0.79867 0.37074 1.0000 + Sn Sn238 1.0 0.92188 0.86117 0.37074 1.0000 + Sn Sn239 1.0 0.92188 0.92367 0.37074 1.0000 + Sn Sn240 1.0 0.92188 0.98617 0.37074 1.0000 + Sn Sn241 1.0 0.98438 0.04867 0.37074 1.0000 + Sn Sn242 1.0 0.98438 0.11117 0.37074 1.0000 + Sn Sn243 1.0 0.98438 0.17367 0.37074 1.0000 + Sn Sn244 1.0 0.98438 0.23617 0.37074 1.0000 + Sn Sn245 1.0 0.98438 0.29867 0.37074 1.0000 + Sn Sn246 1.0 0.98438 0.36117 0.37074 1.0000 + Sn Sn247 1.0 0.98438 0.42367 0.37074 1.0000 + Sn Sn248 1.0 0.98438 0.48617 0.37074 1.0000 + Sn Sn249 1.0 0.98438 0.54867 0.37074 1.0000 + Sn Sn250 1.0 0.98438 0.61117 0.37074 1.0000 + Sn Sn251 1.0 0.98438 0.67367 0.37074 1.0000 + Sn Sn252 1.0 0.98438 0.73617 0.37074 1.0000 + Sn Sn253 1.0 0.98438 0.79867 0.37074 1.0000 + Sn Sn254 1.0 0.98438 0.86117 0.37074 1.0000 + Sn Sn255 1.0 0.98438 0.92367 0.37074 1.0000 + Sn Sn256 1.0 0.98438 0.98617 0.37074 1.0000 + Sn Sn257 1.0 0.01562 0.01383 0.62926 1.0000 + Sn Sn258 1.0 0.01562 0.07633 0.62926 1.0000 + Sn Sn259 1.0 0.01562 0.13883 0.62926 1.0000 + Sn Sn260 1.0 0.01562 0.20133 0.62926 1.0000 + Sn Sn261 1.0 0.01562 0.26383 0.62926 1.0000 + Sn Sn262 1.0 0.01562 0.32633 0.62926 1.0000 + Sn Sn263 1.0 0.01562 0.38883 0.62926 1.0000 + Sn Sn264 1.0 0.01562 0.45133 0.62926 1.0000 + Sn Sn265 1.0 0.01562 0.51383 0.62926 1.0000 + Sn Sn266 1.0 0.01562 0.57633 0.62926 1.0000 + Sn Sn267 1.0 0.01562 0.63883 0.62926 1.0000 + Sn Sn268 1.0 0.01562 0.70133 0.62926 1.0000 + Sn Sn269 1.0 0.01562 0.76383 0.62926 1.0000 + Sn Sn270 1.0 0.01562 0.82633 0.62926 1.0000 + Sn Sn271 1.0 0.01562 0.88883 0.62926 1.0000 + Sn Sn272 1.0 0.01562 0.95133 0.62926 1.0000 + Sn Sn273 1.0 0.07812 0.01383 0.62926 1.0000 + Sn Sn274 1.0 0.07812 0.07633 0.62926 1.0000 + Sn Sn275 1.0 0.07812 0.13883 0.62926 1.0000 + Sn Sn276 1.0 0.07812 0.20133 0.62926 1.0000 + Sn Sn277 1.0 0.07812 0.26383 0.62926 1.0000 + Sn Sn278 1.0 0.07812 0.32633 0.62926 1.0000 + Sn Sn279 1.0 0.07812 0.38883 0.62926 1.0000 + Sn Sn280 1.0 0.07812 0.45133 0.62926 1.0000 + Sn Sn281 1.0 0.07812 0.51383 0.62926 1.0000 + Sn Sn282 1.0 0.07812 0.57633 0.62926 1.0000 + Sn Sn283 1.0 0.07812 0.63883 0.62926 1.0000 + Sn Sn284 1.0 0.07812 0.70133 0.62926 1.0000 + Sn Sn285 1.0 0.07812 0.76383 0.62926 1.0000 + Sn Sn286 1.0 0.07812 0.82633 0.62926 1.0000 + Sn Sn287 1.0 0.07812 0.88883 0.62926 1.0000 + Sn Sn288 1.0 0.07812 0.95133 0.62926 1.0000 + Sn Sn289 1.0 0.14062 0.01383 0.62926 1.0000 + Sn Sn290 1.0 0.14062 0.07633 0.62926 1.0000 + Sn Sn291 1.0 0.14062 0.13883 0.62926 1.0000 + Sn Sn292 1.0 0.14062 0.20133 0.62926 1.0000 + Sn Sn293 1.0 0.14062 0.26383 0.62926 1.0000 + Sn Sn294 1.0 0.14062 0.32633 0.62926 1.0000 + Sn Sn295 1.0 0.14062 0.38883 0.62926 1.0000 + Sn Sn296 1.0 0.14062 0.45133 0.62926 1.0000 + Sn Sn297 1.0 0.14062 0.51383 0.62926 1.0000 + Sn Sn298 1.0 0.14062 0.57633 0.62926 1.0000 + Sn Sn299 1.0 0.14062 0.63883 0.62926 1.0000 + Sn Sn300 1.0 0.14062 0.70133 0.62926 1.0000 + Sn Sn301 1.0 0.14062 0.76383 0.62926 1.0000 + Sn Sn302 1.0 0.14062 0.82633 0.62926 1.0000 + Sn Sn303 1.0 0.14062 0.88883 0.62926 1.0000 + Sn Sn304 1.0 0.14062 0.95133 0.62926 1.0000 + Sn Sn305 1.0 0.20313 0.01383 0.62926 1.0000 + Sn Sn306 1.0 0.20313 0.07633 0.62926 1.0000 + Sn Sn307 1.0 0.20313 0.13883 0.62926 1.0000 + Sn Sn308 1.0 0.20313 0.20133 0.62926 1.0000 + Sn Sn309 1.0 0.20313 0.26383 0.62926 1.0000 + Sn Sn310 1.0 0.20313 0.32633 0.62926 1.0000 + Sn Sn311 1.0 0.20313 0.38883 0.62926 1.0000 + Sn Sn312 1.0 0.20313 0.45133 0.62926 1.0000 + Sn Sn313 1.0 0.20313 0.51383 0.62926 1.0000 + Sn Sn314 1.0 0.20313 0.57633 0.62926 1.0000 + Sn Sn315 1.0 0.20313 0.63883 0.62926 1.0000 + Sn Sn316 1.0 0.20313 0.70133 0.62926 1.0000 + Sn Sn317 1.0 0.20313 0.76383 0.62926 1.0000 + Sn Sn318 1.0 0.20313 0.82633 0.62926 1.0000 + Sn Sn319 1.0 0.20313 0.88883 0.62926 1.0000 + Sn Sn320 1.0 0.20313 0.95133 0.62926 1.0000 + Sn Sn321 1.0 0.26563 0.01383 0.62926 1.0000 + Sn Sn322 1.0 0.26563 0.07633 0.62926 1.0000 + Sn Sn323 1.0 0.26563 0.13883 0.62926 1.0000 + Sn Sn324 1.0 0.26563 0.20133 0.62926 1.0000 + Sn Sn325 1.0 0.26563 0.26383 0.62926 1.0000 + Sn Sn326 1.0 0.26563 0.32633 0.62926 1.0000 + Sn Sn327 1.0 0.26563 0.38883 0.62926 1.0000 + Sn Sn328 1.0 0.26563 0.45133 0.62926 1.0000 + Sn Sn329 1.0 0.26563 0.51383 0.62926 1.0000 + Sn Sn330 1.0 0.26563 0.57633 0.62926 1.0000 + Sn Sn331 1.0 0.26563 0.63883 0.62926 1.0000 + Sn Sn332 1.0 0.26563 0.70133 0.62926 1.0000 + Sn Sn333 1.0 0.26563 0.76383 0.62926 1.0000 + Sn Sn334 1.0 0.26563 0.82633 0.62926 1.0000 + Sn Sn335 1.0 0.26563 0.88883 0.62926 1.0000 + Sn Sn336 1.0 0.26563 0.95133 0.62926 1.0000 + Sn Sn337 1.0 0.32812 0.01383 0.62926 1.0000 + Sn Sn338 1.0 0.32812 0.07633 0.62926 1.0000 + Sn Sn339 1.0 0.32812 0.13883 0.62926 1.0000 + Sn Sn340 1.0 0.32812 0.20133 0.62926 1.0000 + Sn Sn341 1.0 0.32812 0.26383 0.62926 1.0000 + Sn Sn342 1.0 0.32812 0.32633 0.62926 1.0000 + Sn Sn343 1.0 0.32812 0.38883 0.62926 1.0000 + Sn Sn344 1.0 0.32812 0.45133 0.62926 1.0000 + Sn Sn345 1.0 0.32812 0.51383 0.62926 1.0000 + Sn Sn346 1.0 0.32812 0.57633 0.62926 1.0000 + Sn Sn347 1.0 0.32812 0.63883 0.62926 1.0000 + Sn Sn348 1.0 0.32812 0.70133 0.62926 1.0000 + Sn Sn349 1.0 0.32812 0.76383 0.62926 1.0000 + Sn Sn350 1.0 0.32812 0.82633 0.62926 1.0000 + Sn Sn351 1.0 0.32812 0.88883 0.62926 1.0000 + Sn Sn352 1.0 0.32812 0.95133 0.62926 1.0000 + Sn Sn353 1.0 0.39062 0.01383 0.62926 1.0000 + Sn Sn354 1.0 0.39062 0.07633 0.62926 1.0000 + Sn Sn355 1.0 0.39062 0.13883 0.62926 1.0000 + Sn Sn356 1.0 0.39062 0.20133 0.62926 1.0000 + Sn Sn357 1.0 0.39062 0.26383 0.62926 1.0000 + Sn Sn358 1.0 0.39062 0.32633 0.62926 1.0000 + Sn Sn359 1.0 0.39062 0.38883 0.62926 1.0000 + Sn Sn360 1.0 0.39062 0.45133 0.62926 1.0000 + Sn Sn361 1.0 0.39062 0.51383 0.62926 1.0000 + Sn Sn362 1.0 0.39062 0.57633 0.62926 1.0000 + Sn Sn363 1.0 0.39062 0.63883 0.62926 1.0000 + Sn Sn364 1.0 0.39062 0.70133 0.62926 1.0000 + Sn Sn365 1.0 0.39062 0.76383 0.62926 1.0000 + Sn Sn366 1.0 0.39062 0.82633 0.62926 1.0000 + Sn Sn367 1.0 0.39062 0.88883 0.62926 1.0000 + Sn Sn368 1.0 0.39062 0.95133 0.62926 1.0000 + Sn Sn369 1.0 0.45312 0.01383 0.62926 1.0000 + Sn Sn370 1.0 0.45312 0.07633 0.62926 1.0000 + Sn Sn371 1.0 0.45312 0.13883 0.62926 1.0000 + Sn Sn372 1.0 0.45312 0.20133 0.62926 1.0000 + Sn Sn373 1.0 0.45312 0.26383 0.62926 1.0000 + Sn Sn374 1.0 0.45312 0.32633 0.62926 1.0000 + Sn Sn375 1.0 0.45312 0.38883 0.62926 1.0000 + Sn Sn376 1.0 0.45312 0.45133 0.62926 1.0000 + Sn Sn377 1.0 0.45312 0.51383 0.62926 1.0000 + Sn Sn378 1.0 0.45312 0.57633 0.62926 1.0000 + Sn Sn379 1.0 0.45312 0.63883 0.62926 1.0000 + Sn Sn380 1.0 0.45312 0.70133 0.62926 1.0000 + Sn Sn381 1.0 0.45312 0.76383 0.62926 1.0000 + Sn Sn382 1.0 0.45312 0.82633 0.62926 1.0000 + Sn Sn383 1.0 0.45312 0.88883 0.62926 1.0000 + Sn Sn384 1.0 0.45312 0.95133 0.62926 1.0000 + Sn Sn385 1.0 0.51562 0.01383 0.62926 1.0000 + Sn Sn386 1.0 0.51562 0.07633 0.62926 1.0000 + Sn Sn387 1.0 0.51562 0.13883 0.62926 1.0000 + Sn Sn388 1.0 0.51562 0.20133 0.62926 1.0000 + Sn Sn389 1.0 0.51562 0.26383 0.62926 1.0000 + Sn Sn390 1.0 0.51562 0.32633 0.62926 1.0000 + Sn Sn391 1.0 0.51562 0.38883 0.62926 1.0000 + Sn Sn392 1.0 0.51562 0.45133 0.62926 1.0000 + Sn Sn393 1.0 0.51562 0.51383 0.62926 1.0000 + Sn Sn394 1.0 0.51562 0.57633 0.62926 1.0000 + Sn Sn395 1.0 0.51562 0.63883 0.62926 1.0000 + Sn Sn396 1.0 0.51562 0.70133 0.62926 1.0000 + Sn Sn397 1.0 0.51562 0.76383 0.62926 1.0000 + Sn Sn398 1.0 0.51562 0.82633 0.62926 1.0000 + Sn Sn399 1.0 0.51562 0.88883 0.62926 1.0000 + Sn Sn400 1.0 0.51562 0.95133 0.62926 1.0000 + Sn Sn401 1.0 0.57812 0.01383 0.62926 1.0000 + Sn Sn402 1.0 0.57812 0.07633 0.62926 1.0000 + Sn Sn403 1.0 0.57812 0.13883 0.62926 1.0000 + Sn Sn404 1.0 0.57812 0.20133 0.62926 1.0000 + Sn Sn405 1.0 0.57812 0.26383 0.62926 1.0000 + Sn Sn406 1.0 0.57812 0.32633 0.62926 1.0000 + Sn Sn407 1.0 0.57812 0.38883 0.62926 1.0000 + Sn Sn408 1.0 0.57812 0.45133 0.62926 1.0000 + Sn Sn409 1.0 0.57812 0.51383 0.62926 1.0000 + Sn Sn410 1.0 0.57812 0.57633 0.62926 1.0000 + Sn Sn411 1.0 0.57812 0.63883 0.62926 1.0000 + Sn Sn412 1.0 0.57812 0.70133 0.62926 1.0000 + Sn Sn413 1.0 0.57812 0.76383 0.62926 1.0000 + Sn Sn414 1.0 0.57812 0.82633 0.62926 1.0000 + Sn Sn415 1.0 0.57812 0.88883 0.62926 1.0000 + Sn Sn416 1.0 0.57812 0.95133 0.62926 1.0000 + Sn Sn417 1.0 0.64062 0.01383 0.62926 1.0000 + Sn Sn418 1.0 0.64062 0.07633 0.62926 1.0000 + Sn Sn419 1.0 0.64062 0.13883 0.62926 1.0000 + Sn Sn420 1.0 0.64062 0.20133 0.62926 1.0000 + Sn Sn421 1.0 0.64062 0.26383 0.62926 1.0000 + Sn Sn422 1.0 0.64062 0.32633 0.62926 1.0000 + Sn Sn423 1.0 0.64062 0.38883 0.62926 1.0000 + Sn Sn424 1.0 0.64062 0.45133 0.62926 1.0000 + Sn Sn425 1.0 0.64062 0.51383 0.62926 1.0000 + Sn Sn426 1.0 0.64062 0.57633 0.62926 1.0000 + Sn Sn427 1.0 0.64062 0.63883 0.62926 1.0000 + Sn Sn428 1.0 0.64062 0.70133 0.62926 1.0000 + Sn Sn429 1.0 0.64062 0.76383 0.62926 1.0000 + Sn Sn430 1.0 0.64062 0.82633 0.62926 1.0000 + Sn Sn431 1.0 0.64062 0.88883 0.62926 1.0000 + Sn Sn432 1.0 0.64062 0.95133 0.62926 1.0000 + Sn Sn433 1.0 0.70312 0.01383 0.62926 1.0000 + Sn Sn434 1.0 0.70312 0.07633 0.62926 1.0000 + Sn Sn435 1.0 0.70312 0.13883 0.62926 1.0000 + Sn Sn436 1.0 0.70312 0.20133 0.62926 1.0000 + Sn Sn437 1.0 0.70312 0.26383 0.62926 1.0000 + Sn Sn438 1.0 0.70312 0.32633 0.62926 1.0000 + Sn Sn439 1.0 0.70312 0.38883 0.62926 1.0000 + Sn Sn440 1.0 0.70312 0.45133 0.62926 1.0000 + Sn Sn441 1.0 0.70312 0.51383 0.62926 1.0000 + Sn Sn442 1.0 0.70312 0.57633 0.62926 1.0000 + Sn Sn443 1.0 0.70312 0.63883 0.62926 1.0000 + Sn Sn444 1.0 0.70312 0.70133 0.62926 1.0000 + Sn Sn445 1.0 0.70312 0.76383 0.62926 1.0000 + Sn Sn446 1.0 0.70312 0.82633 0.62926 1.0000 + Sn Sn447 1.0 0.70312 0.88883 0.62926 1.0000 + Sn Sn448 1.0 0.70312 0.95133 0.62926 1.0000 + Sn Sn449 1.0 0.76562 0.01383 0.62926 1.0000 + Sn Sn450 1.0 0.76562 0.07633 0.62926 1.0000 + Sn Sn451 1.0 0.76562 0.13883 0.62926 1.0000 + Sn Sn452 1.0 0.76562 0.20133 0.62926 1.0000 + Sn Sn453 1.0 0.76562 0.26383 0.62926 1.0000 + Sn Sn454 1.0 0.76562 0.32633 0.62926 1.0000 + Sn Sn455 1.0 0.76562 0.38883 0.62926 1.0000 + Sn Sn456 1.0 0.76562 0.45133 0.62926 1.0000 + Sn Sn457 1.0 0.76562 0.51383 0.62926 1.0000 + Sn Sn458 1.0 0.76562 0.57633 0.62926 1.0000 + Sn Sn459 1.0 0.76562 0.63883 0.62926 1.0000 + Sn Sn460 1.0 0.76562 0.70133 0.62926 1.0000 + Sn Sn461 1.0 0.76562 0.76383 0.62926 1.0000 + Sn Sn462 1.0 0.76562 0.82633 0.62926 1.0000 + Sn Sn463 1.0 0.76562 0.88883 0.62926 1.0000 + Sn Sn464 1.0 0.76562 0.95133 0.62926 1.0000 + Sn Sn465 1.0 0.82812 0.01383 0.62926 1.0000 + Sn Sn466 1.0 0.82812 0.07633 0.62926 1.0000 + Sn Sn467 1.0 0.82812 0.13883 0.62926 1.0000 + Sn Sn468 1.0 0.82812 0.20133 0.62926 1.0000 + Sn Sn469 1.0 0.82812 0.26383 0.62926 1.0000 + Sn Sn470 1.0 0.82812 0.32633 0.62926 1.0000 + Sn Sn471 1.0 0.82812 0.38883 0.62926 1.0000 + Sn Sn472 1.0 0.82812 0.45133 0.62926 1.0000 + Sn Sn473 1.0 0.82812 0.51383 0.62926 1.0000 + Sn Sn474 1.0 0.82812 0.57633 0.62926 1.0000 + Sn Sn475 1.0 0.82812 0.63883 0.62926 1.0000 + Sn Sn476 1.0 0.82812 0.70133 0.62926 1.0000 + Sn Sn477 1.0 0.82812 0.76383 0.62926 1.0000 + Sn Sn478 1.0 0.82812 0.82633 0.62926 1.0000 + Sn Sn479 1.0 0.82812 0.88883 0.62926 1.0000 + Sn Sn480 1.0 0.82812 0.95133 0.62926 1.0000 + Sn Sn481 1.0 0.89063 0.01383 0.62926 1.0000 + Sn Sn482 1.0 0.89063 0.07633 0.62926 1.0000 + Sn Sn483 1.0 0.89063 0.13883 0.62926 1.0000 + Sn Sn484 1.0 0.89063 0.20133 0.62926 1.0000 + Sn Sn485 1.0 0.89063 0.26383 0.62926 1.0000 + Sn Sn486 1.0 0.89063 0.32633 0.62926 1.0000 + Sn Sn487 1.0 0.89063 0.38883 0.62926 1.0000 + Sn Sn488 1.0 0.89063 0.45133 0.62926 1.0000 + Sn Sn489 1.0 0.89063 0.51383 0.62926 1.0000 + Sn Sn490 1.0 0.89063 0.57633 0.62926 1.0000 + Sn Sn491 1.0 0.89063 0.63883 0.62926 1.0000 + Sn Sn492 1.0 0.89063 0.70133 0.62926 1.0000 + Sn Sn493 1.0 0.89063 0.76383 0.62926 1.0000 + Sn Sn494 1.0 0.89063 0.82633 0.62926 1.0000 + Sn Sn495 1.0 0.89063 0.88883 0.62926 1.0000 + Sn Sn496 1.0 0.89063 0.95133 0.62926 1.0000 + Sn Sn497 1.0 0.95312 0.01383 0.62926 1.0000 + Sn Sn498 1.0 0.95312 0.07633 0.62926 1.0000 + Sn Sn499 1.0 0.95312 0.13883 0.62926 1.0000 + Sn Sn500 1.0 0.95312 0.20133 0.62926 1.0000 + Sn Sn501 1.0 0.95312 0.26383 0.62926 1.0000 + Sn Sn502 1.0 0.95312 0.32633 0.62926 1.0000 + Sn Sn503 1.0 0.95312 0.38883 0.62926 1.0000 + Sn Sn504 1.0 0.95312 0.45133 0.62926 1.0000 + Sn Sn505 1.0 0.95312 0.51383 0.62926 1.0000 + Sn Sn506 1.0 0.95312 0.57633 0.62926 1.0000 + Sn Sn507 1.0 0.95312 0.63883 0.62926 1.0000 + Sn Sn508 1.0 0.95312 0.70133 0.62926 1.0000 + Sn Sn509 1.0 0.95312 0.76383 0.62926 1.0000 + Sn Sn510 1.0 0.95312 0.82633 0.62926 1.0000 + Sn Sn511 1.0 0.95312 0.88883 0.62926 1.0000 + Sn Sn512 1.0 0.95312 0.95133 0.62926 1.0000 + Cl Cl1 1.0 0.04688 0.03773 0.70789 1.0000 + Cl Cl2 1.0 0.04688 0.10023 0.70789 1.0000 + Cl Cl3 1.0 0.04688 0.16273 0.70789 1.0000 + Cl Cl4 1.0 0.04688 0.22523 0.70789 1.0000 + Cl Cl5 1.0 0.04688 0.28773 0.70789 1.0000 + Cl Cl6 1.0 0.04688 0.35023 0.70789 1.0000 + Cl Cl7 1.0 0.04688 0.41273 0.70789 1.0000 + Cl Cl8 1.0 0.04688 0.47523 0.70789 1.0000 + Cl Cl9 1.0 0.04688 0.53773 0.70789 1.0000 + Cl Cl10 1.0 0.04688 0.60023 0.70789 1.0000 + Cl Cl11 1.0 0.04688 0.66273 0.70789 1.0000 + Cl Cl12 1.0 0.04688 0.72523 0.70789 1.0000 + Cl Cl13 1.0 0.04688 0.78773 0.70789 1.0000 + Cl Cl14 1.0 0.04688 0.85023 0.70789 1.0000 + Cl Cl15 1.0 0.04688 0.91273 0.70789 1.0000 + Cl Cl16 1.0 0.04688 0.97523 0.70789 1.0000 + Cl Cl17 1.0 0.10938 0.03773 0.70789 1.0000 + Cl Cl18 1.0 0.10938 0.10023 0.70789 1.0000 + Cl Cl19 1.0 0.10938 0.16273 0.70789 1.0000 + Cl Cl20 1.0 0.10938 0.22523 0.70789 1.0000 + Cl Cl21 1.0 0.10938 0.28773 0.70789 1.0000 + Cl Cl22 1.0 0.10938 0.35023 0.70789 1.0000 + Cl Cl23 1.0 0.10938 0.41273 0.70789 1.0000 + Cl Cl24 1.0 0.10938 0.47523 0.70789 1.0000 + Cl Cl25 1.0 0.10938 0.53773 0.70789 1.0000 + Cl Cl26 1.0 0.10938 0.60023 0.70789 1.0000 + Cl Cl27 1.0 0.10938 0.66273 0.70789 1.0000 + Cl Cl28 1.0 0.10938 0.72523 0.70789 1.0000 + Cl Cl29 1.0 0.10938 0.78773 0.70789 1.0000 + Cl Cl30 1.0 0.10938 0.85023 0.70789 1.0000 + Cl Cl31 1.0 0.10938 0.91273 0.70789 1.0000 + Cl Cl32 1.0 0.10938 0.97523 0.70789 1.0000 + Cl Cl33 1.0 0.17188 0.03773 0.70789 1.0000 + Cl Cl34 1.0 0.17188 0.10023 0.70789 1.0000 + Cl Cl35 1.0 0.17188 0.16273 0.70789 1.0000 + Cl Cl36 1.0 0.17188 0.22523 0.70789 1.0000 + Cl Cl37 1.0 0.17188 0.28773 0.70789 1.0000 + Cl Cl38 1.0 0.17188 0.35023 0.70789 1.0000 + Cl Cl39 1.0 0.17188 0.41273 0.70789 1.0000 + Cl Cl40 1.0 0.17188 0.47523 0.70789 1.0000 + Cl Cl41 1.0 0.17188 0.53773 0.70789 1.0000 + Cl Cl42 1.0 0.17188 0.60023 0.70789 1.0000 + Cl Cl43 1.0 0.17188 0.66273 0.70789 1.0000 + Cl Cl44 1.0 0.17188 0.72523 0.70789 1.0000 + Cl Cl45 1.0 0.17188 0.78773 0.70789 1.0000 + Cl Cl46 1.0 0.17188 0.85023 0.70789 1.0000 + Cl Cl47 1.0 0.17188 0.91273 0.70789 1.0000 + Cl Cl48 1.0 0.17188 0.97523 0.70789 1.0000 + Cl Cl49 1.0 0.23438 0.03773 0.70789 1.0000 + Cl Cl50 1.0 0.23438 0.10023 0.70789 1.0000 + Cl Cl51 1.0 0.23438 0.16273 0.70789 1.0000 + Cl Cl52 1.0 0.23438 0.22523 0.70789 1.0000 + Cl Cl53 1.0 0.23438 0.28773 0.70789 1.0000 + Cl Cl54 1.0 0.23438 0.35023 0.70789 1.0000 + Cl Cl55 1.0 0.23438 0.41273 0.70789 1.0000 + Cl Cl56 1.0 0.23438 0.47523 0.70789 1.0000 + Cl Cl57 1.0 0.23438 0.53773 0.70789 1.0000 + Cl Cl58 1.0 0.23438 0.60023 0.70789 1.0000 + Cl Cl59 1.0 0.23438 0.66273 0.70789 1.0000 + Cl Cl60 1.0 0.23438 0.72523 0.70789 1.0000 + Cl Cl61 1.0 0.23438 0.78773 0.70789 1.0000 + Cl Cl62 1.0 0.23438 0.85023 0.70789 1.0000 + Cl Cl63 1.0 0.23438 0.91273 0.70789 1.0000 + Cl Cl64 1.0 0.23438 0.97523 0.70789 1.0000 + Cl Cl65 1.0 0.29688 0.03773 0.70789 1.0000 + Cl Cl66 1.0 0.29688 0.10023 0.70789 1.0000 + Cl Cl67 1.0 0.29688 0.16273 0.70789 1.0000 + Cl Cl68 1.0 0.29688 0.22523 0.70789 1.0000 + Cl Cl69 1.0 0.29688 0.28773 0.70789 1.0000 + Cl Cl70 1.0 0.29688 0.35023 0.70789 1.0000 + Cl Cl71 1.0 0.29688 0.41273 0.70789 1.0000 + Cl Cl72 1.0 0.29688 0.47523 0.70789 1.0000 + Cl Cl73 1.0 0.29688 0.53773 0.70789 1.0000 + Cl Cl74 1.0 0.29688 0.60023 0.70789 1.0000 + Cl Cl75 1.0 0.29688 0.66273 0.70789 1.0000 + Cl Cl76 1.0 0.29688 0.72523 0.70789 1.0000 + Cl Cl77 1.0 0.29688 0.78773 0.70789 1.0000 + Cl Cl78 1.0 0.29688 0.85023 0.70789 1.0000 + Cl Cl79 1.0 0.29688 0.91273 0.70789 1.0000 + Cl Cl80 1.0 0.29688 0.97523 0.70789 1.0000 + Cl Cl81 1.0 0.35938 0.03773 0.70789 1.0000 + Cl Cl82 1.0 0.35938 0.10023 0.70789 1.0000 + Cl Cl83 1.0 0.35938 0.16273 0.70789 1.0000 + Cl Cl84 1.0 0.35938 0.22523 0.70789 1.0000 + Cl Cl85 1.0 0.35938 0.28773 0.70789 1.0000 + Cl Cl86 1.0 0.35938 0.35023 0.70789 1.0000 + Cl Cl87 1.0 0.35938 0.41273 0.70789 1.0000 + Cl Cl88 1.0 0.35938 0.47523 0.70789 1.0000 + Cl Cl89 1.0 0.35938 0.53773 0.70789 1.0000 + Cl Cl90 1.0 0.35938 0.60023 0.70789 1.0000 + Cl Cl91 1.0 0.35938 0.66273 0.70789 1.0000 + Cl Cl92 1.0 0.35938 0.72523 0.70789 1.0000 + Cl Cl93 1.0 0.35938 0.78773 0.70789 1.0000 + Cl Cl94 1.0 0.35938 0.85023 0.70789 1.0000 + Cl Cl95 1.0 0.35938 0.91273 0.70789 1.0000 + Cl Cl96 1.0 0.35938 0.97523 0.70789 1.0000 + Cl Cl97 1.0 0.42188 0.03773 0.70789 1.0000 + Cl Cl98 1.0 0.42188 0.10023 0.70789 1.0000 + Cl Cl99 1.0 0.42188 0.16273 0.70789 1.0000 + Cl Cl100 1.0 0.42188 0.22523 0.70789 1.0000 + Cl Cl101 1.0 0.42188 0.28773 0.70789 1.0000 + Cl Cl102 1.0 0.42188 0.35023 0.70789 1.0000 + Cl Cl103 1.0 0.42188 0.41273 0.70789 1.0000 + Cl Cl104 1.0 0.42188 0.47523 0.70789 1.0000 + Cl Cl105 1.0 0.42188 0.53773 0.70789 1.0000 + Cl Cl106 1.0 0.42188 0.60023 0.70789 1.0000 + Cl Cl107 1.0 0.42188 0.66273 0.70789 1.0000 + Cl Cl108 1.0 0.42188 0.72523 0.70789 1.0000 + Cl Cl109 1.0 0.42188 0.78773 0.70789 1.0000 + Cl Cl110 1.0 0.42188 0.85023 0.70789 1.0000 + Cl Cl111 1.0 0.42188 0.91273 0.70789 1.0000 + Cl Cl112 1.0 0.42188 0.97523 0.70789 1.0000 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b/tier3/cif_file/orthogonal_2dm-5854_supercell_12x12x1.cif new file mode 100644 index 0000000000000000000000000000000000000000..21d845177ad59932aa33521361c6411091eaa530 --- /dev/null +++ b/tier3/cif_file/orthogonal_2dm-5854_supercell_12x12x1.cif @@ -0,0 +1,2329 @@ +data_image0 +_chemical_formula_structural Hf144Fe144Cl864Hf144Fe144Cl864 +_chemical_formula_sum "Hf288 Fe288 Cl1728" +_cell_length_a 129.504 +_cell_length_b 74.7694 +_cell_length_c 6.82357 +_cell_angle_alpha 90 +_cell_angle_beta 90 +_cell_angle_gamma 90 + +_space_group_name_H-M_alt "P 1" +_space_group_IT_number 1 + +loop_ + _space_group_symop_operation_xyz + 'x, y, z' + +loop_ + _atom_site_type_symbol + _atom_site_label + _atom_site_symmetry_multiplicity + _atom_site_fract_x + _atom_site_fract_y + _atom_site_fract_z + _atom_site_occupancy + Hf Hf1 1.0 0.98611 0.04167 0.50000 1.0000 + Hf Hf2 1.0 0.94444 0.08333 0.50000 1.0000 + Hf Hf3 1.0 0.90278 0.12500 0.50000 1.0000 + Hf Hf4 1.0 0.86111 0.16667 0.50000 1.0000 + Hf Hf5 1.0 0.81944 0.20833 0.50000 1.0000 + Hf Hf6 1.0 0.77778 0.25000 0.50000 1.0000 + Hf Hf7 1.0 0.73611 0.29167 0.50000 1.0000 + Hf Hf8 1.0 0.69444 0.33333 0.50000 1.0000 + Hf Hf9 1.0 0.65278 0.37500 0.50000 1.0000 + Hf Hf10 1.0 0.61111 0.41667 0.50000 1.0000 + Hf Hf11 1.0 0.56944 0.45833 0.50000 1.0000 + Hf Hf12 1.0 0.52778 0.50000 0.50000 1.0000 + Hf Hf13 1.0 0.02778 0.08333 0.50000 1.0000 + Hf Hf14 1.0 0.98611 0.12500 0.50000 1.0000 + Hf Hf15 1.0 0.94444 0.16667 0.50000 1.0000 + Hf Hf16 1.0 0.90278 0.20833 0.50000 1.0000 + Hf Hf17 1.0 0.86111 0.25000 0.50000 1.0000 + Hf Hf18 1.0 0.81944 0.29167 0.50000 1.0000 + Hf Hf19 1.0 0.77778 0.33333 0.50000 1.0000 + Hf Hf20 1.0 0.73611 0.37500 0.50000 1.0000 + Hf Hf21 1.0 0.69444 0.41667 0.50000 1.0000 + Hf Hf22 1.0 0.65278 0.45833 0.50000 1.0000 + Hf Hf23 1.0 0.61111 0.50000 0.50000 1.0000 + Hf Hf24 1.0 0.56944 0.54167 0.50000 1.0000 + Hf Hf25 1.0 0.06944 0.12500 0.50000 1.0000 + Hf Hf26 1.0 0.02778 0.16667 0.50000 1.0000 + Hf Hf27 1.0 0.98611 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0.50000 1.0000 + Hf Hf50 1.0 0.11111 0.25000 0.50000 1.0000 + Hf Hf51 1.0 0.06944 0.29167 0.50000 1.0000 + Hf Hf52 1.0 0.02778 0.33333 0.50000 1.0000 + Hf Hf53 1.0 0.98611 0.37500 0.50000 1.0000 + Hf Hf54 1.0 0.94444 0.41667 0.50000 1.0000 + Hf Hf55 1.0 0.90278 0.45833 0.50000 1.0000 + Hf Hf56 1.0 0.86111 0.50000 0.50000 1.0000 + Hf Hf57 1.0 0.81944 0.54167 0.50000 1.0000 + Hf Hf58 1.0 0.77778 0.58333 0.50000 1.0000 + Hf Hf59 1.0 0.73611 0.62500 0.50000 1.0000 + Hf Hf60 1.0 0.69444 0.66667 0.50000 1.0000 + Hf Hf61 1.0 0.19444 0.25000 0.50000 1.0000 + Hf Hf62 1.0 0.15278 0.29167 0.50000 1.0000 + Hf Hf63 1.0 0.11111 0.33333 0.50000 1.0000 + Hf Hf64 1.0 0.06944 0.37500 0.50000 1.0000 + Hf Hf65 1.0 0.02778 0.41667 0.50000 1.0000 + Hf Hf66 1.0 0.98611 0.45833 0.50000 1.0000 + Hf Hf67 1.0 0.94444 0.50000 0.50000 1.0000 + Hf Hf68 1.0 0.90278 0.54167 0.50000 1.0000 + Hf Hf69 1.0 0.86111 0.58333 0.50000 1.0000 + Hf Hf70 1.0 0.81944 0.62500 0.50000 1.0000 + Hf Hf71 1.0 0.77778 0.66667 0.50000 1.0000 + Hf Hf72 1.0 0.73611 0.70833 0.50000 1.0000 + Hf Hf73 1.0 0.23611 0.29167 0.50000 1.0000 + Hf Hf74 1.0 0.19444 0.33333 0.50000 1.0000 + Hf Hf75 1.0 0.15278 0.37500 0.50000 1.0000 + Hf Hf76 1.0 0.11111 0.41667 0.50000 1.0000 + Hf Hf77 1.0 0.06944 0.45833 0.50000 1.0000 + Hf Hf78 1.0 0.02778 0.50000 0.50000 1.0000 + Hf Hf79 1.0 0.98611 0.54167 0.50000 1.0000 + Hf Hf80 1.0 0.94444 0.58333 0.50000 1.0000 + Hf Hf81 1.0 0.90278 0.62500 0.50000 1.0000 + Hf Hf82 1.0 0.86111 0.66667 0.50000 1.0000 + Hf Hf83 1.0 0.81944 0.70833 0.50000 1.0000 + Hf Hf84 1.0 0.77778 0.75000 0.50000 1.0000 + Hf Hf85 1.0 0.27778 0.33333 0.50000 1.0000 + Hf Hf86 1.0 0.23611 0.37500 0.50000 1.0000 + Hf Hf87 1.0 0.19444 0.41667 0.50000 1.0000 + Hf Hf88 1.0 0.15278 0.45833 0.50000 1.0000 + Hf Hf89 1.0 0.11111 0.50000 0.50000 1.0000 + Hf Hf90 1.0 0.06944 0.54167 0.50000 1.0000 + Hf Hf91 1.0 0.02778 0.58333 0.50000 1.0000 + Hf Hf92 1.0 0.98611 0.62500 0.50000 1.0000 + Hf Hf93 1.0 0.94444 0.66667 0.50000 1.0000 + Hf Hf94 1.0 0.90278 0.70833 0.50000 1.0000 + Hf Hf95 1.0 0.86111 0.75000 0.50000 1.0000 + Hf Hf96 1.0 0.81944 0.79167 0.50000 1.0000 + Hf Hf97 1.0 0.31944 0.37500 0.50000 1.0000 + Hf Hf98 1.0 0.27778 0.41667 0.50000 1.0000 + Hf Hf99 1.0 0.23611 0.45833 0.50000 1.0000 + Hf Hf100 1.0 0.19444 0.50000 0.50000 1.0000 + Hf Hf101 1.0 0.15278 0.54167 0.50000 1.0000 + Hf Hf102 1.0 0.11111 0.58333 0.50000 1.0000 + Hf Hf103 1.0 0.06944 0.62500 0.50000 1.0000 + Hf Hf104 1.0 0.02778 0.66667 0.50000 1.0000 + Hf Hf105 1.0 0.98611 0.70833 0.50000 1.0000 + Hf Hf106 1.0 0.94444 0.75000 0.50000 1.0000 + Hf Hf107 1.0 0.90278 0.79167 0.50000 1.0000 + Hf Hf108 1.0 0.86111 0.83333 0.50000 1.0000 + Hf Hf109 1.0 0.36111 0.41667 0.50000 1.0000 + Hf Hf110 1.0 0.31944 0.45833 0.50000 1.0000 + Hf Hf111 1.0 0.27778 0.50000 0.50000 1.0000 + Hf Hf112 1.0 0.23611 0.54167 0.50000 1.0000 + Hf Hf113 1.0 0.19444 0.58333 0.50000 1.0000 + Hf Hf114 1.0 0.15278 0.62500 0.50000 1.0000 + Hf Hf115 1.0 0.11111 0.66667 0.50000 1.0000 + Hf Hf116 1.0 0.06944 0.70833 0.50000 1.0000 + Hf Hf117 1.0 0.02778 0.75000 0.50000 1.0000 + Hf Hf118 1.0 0.98611 0.79167 0.50000 1.0000 + Hf Hf119 1.0 0.94444 0.83333 0.50000 1.0000 + Hf Hf120 1.0 0.90278 0.87500 0.50000 1.0000 + Hf Hf121 1.0 0.40278 0.45833 0.50000 1.0000 + Hf Hf122 1.0 0.36111 0.50000 0.50000 1.0000 + Hf Hf123 1.0 0.31944 0.54167 0.50000 1.0000 + Hf Hf124 1.0 0.27778 0.58333 0.50000 1.0000 + Hf Hf125 1.0 0.23611 0.62500 0.50000 1.0000 + Hf Hf126 1.0 0.19444 0.66667 0.50000 1.0000 + Hf Hf127 1.0 0.15278 0.70833 0.50000 1.0000 + Hf Hf128 1.0 0.11111 0.75000 0.50000 1.0000 + Hf Hf129 1.0 0.06944 0.79167 0.50000 1.0000 + Hf Hf130 1.0 0.02778 0.83333 0.50000 1.0000 + Hf Hf131 1.0 0.98611 0.87500 0.50000 1.0000 + Hf Hf132 1.0 0.94444 0.91667 0.50000 1.0000 + Hf Hf133 1.0 0.44444 0.50000 0.50000 1.0000 + Hf Hf134 1.0 0.40278 0.54167 0.50000 1.0000 + Hf Hf135 1.0 0.36111 0.58333 0.50000 1.0000 + Hf Hf136 1.0 0.31944 0.62500 0.50000 1.0000 + Hf Hf137 1.0 0.27778 0.66667 0.50000 1.0000 + Hf Hf138 1.0 0.23611 0.70833 0.50000 1.0000 + Hf Hf139 1.0 0.19444 0.75000 0.50000 1.0000 + Hf Hf140 1.0 0.15278 0.79167 0.50000 1.0000 + Hf Hf141 1.0 0.11111 0.83333 0.50000 1.0000 + Hf Hf142 1.0 0.06944 0.87500 0.50000 1.0000 + Hf Hf143 1.0 0.02778 0.91667 0.50000 1.0000 + Hf Hf144 1.0 0.98611 0.95833 0.50000 1.0000 + Fe Fe1 1.0 0.00000 0.00000 0.50000 1.0000 + Fe Fe2 1.0 0.95833 0.04167 0.50000 1.0000 + Fe Fe3 1.0 0.91667 0.08333 0.50000 1.0000 + Fe Fe4 1.0 0.87500 0.12500 0.50000 1.0000 + Fe Fe5 1.0 0.83333 0.16667 0.50000 1.0000 + Fe Fe6 1.0 0.79167 0.20833 0.50000 1.0000 + Fe Fe7 1.0 0.75000 0.25000 0.50000 1.0000 + Fe Fe8 1.0 0.70833 0.29167 0.50000 1.0000 + Fe Fe9 1.0 0.66667 0.33333 0.50000 1.0000 + Fe Fe10 1.0 0.62500 0.37500 0.50000 1.0000 + Fe Fe11 1.0 0.58333 0.41667 0.50000 1.0000 + Fe Fe12 1.0 0.54167 0.45833 0.50000 1.0000 + Fe Fe13 1.0 0.04167 0.04167 0.50000 1.0000 + Fe Fe14 1.0 0.00000 0.08333 0.50000 1.0000 + Fe Fe15 1.0 0.95833 0.12500 0.50000 1.0000 + Fe Fe16 1.0 0.91667 0.16667 0.50000 1.0000 + Fe Fe17 1.0 0.87500 0.20833 0.50000 1.0000 + Fe Fe18 1.0 0.83333 0.25000 0.50000 1.0000 + Fe Fe19 1.0 0.79167 0.29167 0.50000 1.0000 + Fe Fe20 1.0 0.75000 0.33333 0.50000 1.0000 + Fe Fe21 1.0 0.70833 0.37500 0.50000 1.0000 + Fe Fe22 1.0 0.66667 0.41667 0.50000 1.0000 + Fe Fe23 1.0 0.62500 0.45833 0.50000 1.0000 + Fe Fe24 1.0 0.58333 0.50000 0.50000 1.0000 + Fe Fe25 1.0 0.08333 0.08333 0.50000 1.0000 + Fe Fe26 1.0 0.04167 0.12500 0.50000 1.0000 + Fe Fe27 1.0 0.00000 0.16667 0.50000 1.0000 + Fe Fe28 1.0 0.95833 0.20833 0.50000 1.0000 + Fe Fe29 1.0 0.91667 0.25000 0.50000 1.0000 + Fe Fe30 1.0 0.87500 0.29167 0.50000 1.0000 + Fe Fe31 1.0 0.83333 0.33333 0.50000 1.0000 + Fe Fe32 1.0 0.79167 0.37500 0.50000 1.0000 + Fe Fe33 1.0 0.75000 0.41667 0.50000 1.0000 + Fe Fe34 1.0 0.70833 0.45833 0.50000 1.0000 + Fe Fe35 1.0 0.66667 0.50000 0.50000 1.0000 + Fe Fe36 1.0 0.62500 0.54167 0.50000 1.0000 + Fe Fe37 1.0 0.12500 0.12500 0.50000 1.0000 + Fe Fe38 1.0 0.08333 0.16667 0.50000 1.0000 + Fe Fe39 1.0 0.04167 0.20833 0.50000 1.0000 + Fe Fe40 1.0 0.00000 0.25000 0.50000 1.0000 + Fe Fe41 1.0 0.95833 0.29167 0.50000 1.0000 + Fe Fe42 1.0 0.91667 0.33333 0.50000 1.0000 + Fe Fe43 1.0 0.87500 0.37500 0.50000 1.0000 + Fe Fe44 1.0 0.83333 0.41667 0.50000 1.0000 + Fe Fe45 1.0 0.79167 0.45833 0.50000 1.0000 + Fe Fe46 1.0 0.75000 0.50000 0.50000 1.0000 + Fe Fe47 1.0 0.70833 0.54167 0.50000 1.0000 + Fe Fe48 1.0 0.66667 0.58333 0.50000 1.0000 + Fe Fe49 1.0 0.16667 0.16667 0.50000 1.0000 + Fe Fe50 1.0 0.12500 0.20833 0.50000 1.0000 + Fe Fe51 1.0 0.08333 0.25000 0.50000 1.0000 + Fe Fe52 1.0 0.04167 0.29167 0.50000 1.0000 + Fe Fe53 1.0 0.00000 0.33333 0.50000 1.0000 + Fe Fe54 1.0 0.95833 0.37500 0.50000 1.0000 + Fe Fe55 1.0 0.91667 0.41667 0.50000 1.0000 + Fe Fe56 1.0 0.87500 0.45833 0.50000 1.0000 + Fe Fe57 1.0 0.83333 0.50000 0.50000 1.0000 + Fe Fe58 1.0 0.79167 0.54167 0.50000 1.0000 + Fe Fe59 1.0 0.75000 0.58333 0.50000 1.0000 + Fe Fe60 1.0 0.70833 0.62500 0.50000 1.0000 + Fe Fe61 1.0 0.20833 0.20833 0.50000 1.0000 + Fe Fe62 1.0 0.16667 0.25000 0.50000 1.0000 + Fe Fe63 1.0 0.12500 0.29167 0.50000 1.0000 + Fe Fe64 1.0 0.08333 0.33333 0.50000 1.0000 + Fe Fe65 1.0 0.04167 0.37500 0.50000 1.0000 + Fe Fe66 1.0 0.00000 0.41667 0.50000 1.0000 + Fe Fe67 1.0 0.95833 0.45833 0.50000 1.0000 + Fe Fe68 1.0 0.91667 0.50000 0.50000 1.0000 + Fe Fe69 1.0 0.87500 0.54167 0.50000 1.0000 + Fe Fe70 1.0 0.83333 0.58333 0.50000 1.0000 + Fe Fe71 1.0 0.79167 0.62500 0.50000 1.0000 + Fe Fe72 1.0 0.75000 0.66667 0.50000 1.0000 + Fe Fe73 1.0 0.25000 0.25000 0.50000 1.0000 + Fe Fe74 1.0 0.20833 0.29167 0.50000 1.0000 + Fe Fe75 1.0 0.16667 0.33333 0.50000 1.0000 + Fe Fe76 1.0 0.12500 0.37500 0.50000 1.0000 + Fe Fe77 1.0 0.08333 0.41667 0.50000 1.0000 + Fe Fe78 1.0 0.04167 0.45833 0.50000 1.0000 + Fe Fe79 1.0 0.00000 0.50000 0.50000 1.0000 + Fe Fe80 1.0 0.95833 0.54167 0.50000 1.0000 + Fe Fe81 1.0 0.91667 0.58333 0.50000 1.0000 + Fe Fe82 1.0 0.87500 0.62500 0.50000 1.0000 + Fe Fe83 1.0 0.83333 0.66667 0.50000 1.0000 + Fe Fe84 1.0 0.79167 0.70833 0.50000 1.0000 + Fe Fe85 1.0 0.29167 0.29167 0.50000 1.0000 + Fe Fe86 1.0 0.25000 0.33333 0.50000 1.0000 + Fe Fe87 1.0 0.20833 0.37500 0.50000 1.0000 + Fe Fe88 1.0 0.16667 0.41667 0.50000 1.0000 + Fe Fe89 1.0 0.12500 0.45833 0.50000 1.0000 + Fe Fe90 1.0 0.08333 0.50000 0.50000 1.0000 + Fe Fe91 1.0 0.04167 0.54167 0.50000 1.0000 + Fe Fe92 1.0 0.00000 0.58333 0.50000 1.0000 + Fe Fe93 1.0 0.95833 0.62500 0.50000 1.0000 + Fe Fe94 1.0 0.91667 0.66667 0.50000 1.0000 + Fe Fe95 1.0 0.87500 0.70833 0.50000 1.0000 + Fe Fe96 1.0 0.83333 0.75000 0.50000 1.0000 + Fe Fe97 1.0 0.33333 0.33333 0.50000 1.0000 + Fe Fe98 1.0 0.29167 0.37500 0.50000 1.0000 + Fe Fe99 1.0 0.25000 0.41667 0.50000 1.0000 + Fe Fe100 1.0 0.20833 0.45833 0.50000 1.0000 + Fe Fe101 1.0 0.16667 0.50000 0.50000 1.0000 + Fe Fe102 1.0 0.12500 0.54167 0.50000 1.0000 + Fe Fe103 1.0 0.08333 0.58333 0.50000 1.0000 + Fe Fe104 1.0 0.04167 0.62500 0.50000 1.0000 + Fe Fe105 1.0 0.00000 0.66667 0.50000 1.0000 + Fe Fe106 1.0 0.95833 0.70833 0.50000 1.0000 + Fe Fe107 1.0 0.91667 0.75000 0.50000 1.0000 + Fe Fe108 1.0 0.87500 0.79167 0.50000 1.0000 + Fe Fe109 1.0 0.37500 0.37500 0.50000 1.0000 + Fe Fe110 1.0 0.33333 0.41667 0.50000 1.0000 + Fe Fe111 1.0 0.29167 0.45833 0.50000 1.0000 + Fe Fe112 1.0 0.25000 0.50000 0.50000 1.0000 + Fe Fe113 1.0 0.20833 0.54167 0.50000 1.0000 + Fe Fe114 1.0 0.16667 0.58333 0.50000 1.0000 + Fe Fe115 1.0 0.12500 0.62500 0.50000 1.0000 + Fe Fe116 1.0 0.08333 0.66667 0.50000 1.0000 + Fe Fe117 1.0 0.04167 0.70833 0.50000 1.0000 + Fe Fe118 1.0 0.00000 0.75000 0.50000 1.0000 + Fe Fe119 1.0 0.95833 0.79167 0.50000 1.0000 + Fe Fe120 1.0 0.91667 0.83333 0.50000 1.0000 + Fe Fe121 1.0 0.41667 0.41667 0.50000 1.0000 + Fe Fe122 1.0 0.37500 0.45833 0.50000 1.0000 + Fe Fe123 1.0 0.33333 0.50000 0.50000 1.0000 + Fe Fe124 1.0 0.29167 0.54167 0.50000 1.0000 + Fe Fe125 1.0 0.25000 0.58333 0.50000 1.0000 + Fe Fe126 1.0 0.20833 0.62500 0.50000 1.0000 + Fe Fe127 1.0 0.16667 0.66667 0.50000 1.0000 + Fe Fe128 1.0 0.12500 0.70833 0.50000 1.0000 + Fe Fe129 1.0 0.08333 0.75000 0.50000 1.0000 + Fe Fe130 1.0 0.04167 0.79167 0.50000 1.0000 + Fe Fe131 1.0 0.00000 0.83333 0.50000 1.0000 + Fe Fe132 1.0 0.95833 0.87500 0.50000 1.0000 + Fe Fe133 1.0 0.45833 0.45833 0.50000 1.0000 + Fe Fe134 1.0 0.41667 0.50000 0.50000 1.0000 + Fe Fe135 1.0 0.37500 0.54167 0.50000 1.0000 + Fe Fe136 1.0 0.33333 0.58333 0.50000 1.0000 + Fe Fe137 1.0 0.29167 0.62500 0.50000 1.0000 + Fe Fe138 1.0 0.25000 0.66667 0.50000 1.0000 + Fe Fe139 1.0 0.20833 0.70833 0.50000 1.0000 + Fe Fe140 1.0 0.16667 0.75000 0.50000 1.0000 + Fe Fe141 1.0 0.12500 0.79167 0.50000 1.0000 + Fe Fe142 1.0 0.08333 0.83333 0.50000 1.0000 + Fe Fe143 1.0 0.04167 0.87500 0.50000 1.0000 + Fe Fe144 1.0 0.00000 0.91667 0.50000 1.0000 + Cl Cl1 1.0 0.97228 0.05404 0.70690 1.0000 + Cl Cl2 1.0 0.93061 0.09571 0.70690 1.0000 + Cl Cl3 1.0 0.88894 0.13737 0.70690 1.0000 + Cl Cl4 1.0 0.84728 0.17904 0.70690 1.0000 + Cl Cl5 1.0 0.80561 0.22071 0.70690 1.0000 + Cl Cl6 1.0 0.76394 0.26237 0.70690 1.0000 + Cl Cl7 1.0 0.72228 0.30404 0.70690 1.0000 + Cl Cl8 1.0 0.68061 0.34571 0.70690 1.0000 + Cl Cl9 1.0 0.63894 0.38737 0.70690 1.0000 + Cl Cl10 1.0 0.59728 0.42904 0.70690 1.0000 + Cl Cl11 1.0 0.55561 0.47071 0.70690 1.0000 + Cl Cl12 1.0 0.51394 0.51237 0.70690 1.0000 + Cl Cl13 1.0 0.01394 0.09571 0.70690 1.0000 + Cl Cl14 1.0 0.97228 0.13737 0.70690 1.0000 + Cl Cl15 1.0 0.93061 0.17904 0.70690 1.0000 + Cl Cl16 1.0 0.88894 0.22071 0.70690 1.0000 + Cl Cl17 1.0 0.84728 0.26237 0.70690 1.0000 + Cl Cl18 1.0 0.80561 0.30404 0.70690 1.0000 + Cl Cl19 1.0 0.76394 0.34571 0.70690 1.0000 + Cl Cl20 1.0 0.72228 0.38737 0.70690 1.0000 + Cl Cl21 1.0 0.68061 0.42904 0.70690 1.0000 + Cl Cl22 1.0 0.63894 0.47071 0.70690 1.0000 + Cl Cl23 1.0 0.59728 0.51237 0.70690 1.0000 + Cl Cl24 1.0 0.55561 0.55404 0.70690 1.0000 + Cl Cl25 1.0 0.05561 0.13737 0.70690 1.0000 + Cl Cl26 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Hf Hf283 1.0 0.69444 0.25000 0.50000 1.0000 + Hf Hf284 1.0 0.65278 0.29167 0.50000 1.0000 + Hf Hf285 1.0 0.61111 0.33333 0.50000 1.0000 + Hf Hf286 1.0 0.56944 0.37500 0.50000 1.0000 + Hf Hf287 1.0 0.52778 0.41667 0.50000 1.0000 + Hf Hf288 1.0 0.48611 0.45833 0.50000 1.0000 + Fe Fe145 1.0 0.50000 0.50000 0.50000 1.0000 + Fe Fe146 1.0 0.45833 0.54167 0.50000 1.0000 + Fe Fe147 1.0 0.41667 0.58333 0.50000 1.0000 + Fe Fe148 1.0 0.37500 0.62500 0.50000 1.0000 + Fe Fe149 1.0 0.33333 0.66667 0.50000 1.0000 + Fe Fe150 1.0 0.29167 0.70833 0.50000 1.0000 + Fe Fe151 1.0 0.25000 0.75000 0.50000 1.0000 + Fe Fe152 1.0 0.20833 0.79167 0.50000 1.0000 + Fe Fe153 1.0 0.16667 0.83333 0.50000 1.0000 + Fe Fe154 1.0 0.12500 0.87500 0.50000 1.0000 + Fe Fe155 1.0 0.08333 0.91667 0.50000 1.0000 + Fe Fe156 1.0 0.04167 0.95833 0.50000 1.0000 + Fe Fe157 1.0 0.54167 0.54167 0.50000 1.0000 + Fe Fe158 1.0 0.50000 0.58333 0.50000 1.0000 + Fe Fe159 1.0 0.45833 0.62500 0.50000 1.0000 + Fe Fe160 1.0 0.41667 0.66667 0.50000 1.0000 + Fe Fe161 1.0 0.37500 0.70833 0.50000 1.0000 + Fe Fe162 1.0 0.33333 0.75000 0.50000 1.0000 + Fe Fe163 1.0 0.29167 0.79167 0.50000 1.0000 + Fe Fe164 1.0 0.25000 0.83333 0.50000 1.0000 + Fe Fe165 1.0 0.20833 0.87500 0.50000 1.0000 + Fe Fe166 1.0 0.16667 0.91667 0.50000 1.0000 + Fe Fe167 1.0 0.12500 0.95833 0.50000 1.0000 + Fe Fe168 1.0 0.08333 1.00000 0.50000 1.0000 + Fe Fe169 1.0 0.58333 0.58333 0.50000 1.0000 + Fe Fe170 1.0 0.54167 0.62500 0.50000 1.0000 + Fe Fe171 1.0 0.50000 0.66667 0.50000 1.0000 + Fe Fe172 1.0 0.45833 0.70833 0.50000 1.0000 + Fe Fe173 1.0 0.41667 0.75000 0.50000 1.0000 + Fe Fe174 1.0 0.37500 0.79167 0.50000 1.0000 + Fe Fe175 1.0 0.33333 0.83333 0.50000 1.0000 + Fe Fe176 1.0 0.29167 0.87500 0.50000 1.0000 + Fe Fe177 1.0 0.25000 0.91667 0.50000 1.0000 + Fe Fe178 1.0 0.20833 0.95833 0.50000 1.0000 + Fe Fe179 1.0 0.16667 1.00000 0.50000 1.0000 + Fe Fe180 1.0 0.12500 0.04167 0.50000 1.0000 + Fe Fe181 1.0 0.62500 0.62500 0.50000 1.0000 + Fe Fe182 1.0 0.58333 0.66667 0.50000 1.0000 + Fe Fe183 1.0 0.54167 0.70833 0.50000 1.0000 + Fe Fe184 1.0 0.50000 0.75000 0.50000 1.0000 + Fe Fe185 1.0 0.45833 0.79167 0.50000 1.0000 + Fe Fe186 1.0 0.41667 0.83333 0.50000 1.0000 + Fe Fe187 1.0 0.37500 0.87500 0.50000 1.0000 + Fe Fe188 1.0 0.33333 0.91667 0.50000 1.0000 + Fe Fe189 1.0 0.29167 0.95833 0.50000 1.0000 + Fe Fe190 1.0 0.25000 0.00000 0.50000 1.0000 + Fe Fe191 1.0 0.20833 0.04167 0.50000 1.0000 + Fe Fe192 1.0 0.16667 0.08333 0.50000 1.0000 + Fe Fe193 1.0 0.66667 0.66667 0.50000 1.0000 + Fe Fe194 1.0 0.62500 0.70833 0.50000 1.0000 + Fe Fe195 1.0 0.58333 0.75000 0.50000 1.0000 + Fe Fe196 1.0 0.54167 0.79167 0.50000 1.0000 + Fe Fe197 1.0 0.50000 0.83333 0.50000 1.0000 + Fe Fe198 1.0 0.45833 0.87500 0.50000 1.0000 + Fe Fe199 1.0 0.41667 0.91667 0.50000 1.0000 + Fe Fe200 1.0 0.37500 0.95833 0.50000 1.0000 + Fe Fe201 1.0 0.33333 1.00000 0.50000 1.0000 + Fe Fe202 1.0 0.29167 0.04167 0.50000 1.0000 + Fe Fe203 1.0 0.25000 0.08333 0.50000 1.0000 + Fe Fe204 1.0 0.20833 0.12500 0.50000 1.0000 + Fe Fe205 1.0 0.70833 0.70833 0.50000 1.0000 + Fe Fe206 1.0 0.66667 0.75000 0.50000 1.0000 + Fe Fe207 1.0 0.62500 0.79167 0.50000 1.0000 + Fe Fe208 1.0 0.58333 0.83333 0.50000 1.0000 + Fe Fe209 1.0 0.54167 0.87500 0.50000 1.0000 + Fe Fe210 1.0 0.50000 0.91667 0.50000 1.0000 + Fe Fe211 1.0 0.45833 0.95833 0.50000 1.0000 + Fe Fe212 1.0 0.41667 0.00000 0.50000 1.0000 + Fe Fe213 1.0 0.37500 0.04167 0.50000 1.0000 + Fe Fe214 1.0 0.33333 0.08333 0.50000 1.0000 + Fe Fe215 1.0 0.29167 0.12500 0.50000 1.0000 + Fe Fe216 1.0 0.25000 0.16667 0.50000 1.0000 + Fe Fe217 1.0 0.75000 0.75000 0.50000 1.0000 + Fe Fe218 1.0 0.70833 0.79167 0.50000 1.0000 + Fe Fe219 1.0 0.66667 0.83333 0.50000 1.0000 + Fe Fe220 1.0 0.62500 0.87500 0.50000 1.0000 + Fe Fe221 1.0 0.58333 0.91667 0.50000 1.0000 + Fe Fe222 1.0 0.54167 0.95833 0.50000 1.0000 + Fe Fe223 1.0 0.50000 1.00000 0.50000 1.0000 + Fe Fe224 1.0 0.45833 0.04167 0.50000 1.0000 + Fe Fe225 1.0 0.41667 0.08333 0.50000 1.0000 + Fe Fe226 1.0 0.37500 0.12500 0.50000 1.0000 + Fe Fe227 1.0 0.33333 0.16667 0.50000 1.0000 + Fe Fe228 1.0 0.29167 0.20833 0.50000 1.0000 + Fe Fe229 1.0 0.79167 0.79167 0.50000 1.0000 + Fe Fe230 1.0 0.75000 0.83333 0.50000 1.0000 + Fe Fe231 1.0 0.70833 0.87500 0.50000 1.0000 + Fe Fe232 1.0 0.66667 0.91667 0.50000 1.0000 + Fe Fe233 1.0 0.62500 0.95833 0.50000 1.0000 + Fe Fe234 1.0 0.58333 1.00000 0.50000 1.0000 + Fe Fe235 1.0 0.54167 0.04167 0.50000 1.0000 + Fe Fe236 1.0 0.50000 0.08333 0.50000 1.0000 + Fe Fe237 1.0 0.45833 0.12500 0.50000 1.0000 + Fe Fe238 1.0 0.41667 0.16667 0.50000 1.0000 + Fe Fe239 1.0 0.37500 0.20833 0.50000 1.0000 + Fe Fe240 1.0 0.33333 0.25000 0.50000 1.0000 + Fe Fe241 1.0 0.83333 0.83333 0.50000 1.0000 + Fe Fe242 1.0 0.79167 0.87500 0.50000 1.0000 + Fe Fe243 1.0 0.75000 0.91667 0.50000 1.0000 + Fe Fe244 1.0 0.70833 0.95833 0.50000 1.0000 + Fe Fe245 1.0 0.66667 0.00000 0.50000 1.0000 + Fe Fe246 1.0 0.62500 0.04167 0.50000 1.0000 + Fe Fe247 1.0 0.58333 0.08333 0.50000 1.0000 + Fe Fe248 1.0 0.54167 0.12500 0.50000 1.0000 + Fe Fe249 1.0 0.50000 0.16667 0.50000 1.0000 + Fe Fe250 1.0 0.45833 0.20833 0.50000 1.0000 + Fe Fe251 1.0 0.41667 0.25000 0.50000 1.0000 + Fe Fe252 1.0 0.37500 0.29167 0.50000 1.0000 + Fe Fe253 1.0 0.87500 0.87500 0.50000 1.0000 + Fe Fe254 1.0 0.83333 0.91667 0.50000 1.0000 + Fe Fe255 1.0 0.79167 0.95833 0.50000 1.0000 + Fe Fe256 1.0 0.75000 1.00000 0.50000 1.0000 + Fe Fe257 1.0 0.70833 0.04167 0.50000 1.0000 + Fe Fe258 1.0 0.66667 0.08333 0.50000 1.0000 + Fe Fe259 1.0 0.62500 0.12500 0.50000 1.0000 + Fe Fe260 1.0 0.58333 0.16667 0.50000 1.0000 + Fe Fe261 1.0 0.54167 0.20833 0.50000 1.0000 + Fe Fe262 1.0 0.50000 0.25000 0.50000 1.0000 + Fe Fe263 1.0 0.45833 0.29167 0.50000 1.0000 + Fe Fe264 1.0 0.41667 0.33333 0.50000 1.0000 + Fe Fe265 1.0 0.91667 0.91667 0.50000 1.0000 + Fe Fe266 1.0 0.87500 0.95833 0.50000 1.0000 + Fe Fe267 1.0 0.83333 0.00000 0.50000 1.0000 + Fe Fe268 1.0 0.79167 0.04167 0.50000 1.0000 + Fe Fe269 1.0 0.75000 0.08333 0.50000 1.0000 + Fe Fe270 1.0 0.70833 0.12500 0.50000 1.0000 + Fe Fe271 1.0 0.66667 0.16667 0.50000 1.0000 + Fe Fe272 1.0 0.62500 0.20833 0.50000 1.0000 + Fe Fe273 1.0 0.58333 0.25000 0.50000 1.0000 + Fe Fe274 1.0 0.54167 0.29167 0.50000 1.0000 + Fe Fe275 1.0 0.50000 0.33333 0.50000 1.0000 + Fe Fe276 1.0 0.45833 0.37500 0.50000 1.0000 + Fe Fe277 1.0 0.95833 0.95833 0.50000 1.0000 + Fe Fe278 1.0 0.91667 0.00000 0.50000 1.0000 + Fe Fe279 1.0 0.87500 0.04167 0.50000 1.0000 + Fe Fe280 1.0 0.83333 0.08333 0.50000 1.0000 + Fe Fe281 1.0 0.79167 0.12500 0.50000 1.0000 + Fe Fe282 1.0 0.75000 0.16667 0.50000 1.0000 + Fe Fe283 1.0 0.70833 0.20833 0.50000 1.0000 + Fe Fe284 1.0 0.66667 0.25000 0.50000 1.0000 + Fe Fe285 1.0 0.62500 0.29167 0.50000 1.0000 + Fe Fe286 1.0 0.58333 0.33333 0.50000 1.0000 + Fe Fe287 1.0 0.54167 0.37500 0.50000 1.0000 + Fe Fe288 1.0 0.50000 0.41667 0.50000 1.0000 + Cl Cl865 1.0 0.47228 0.55404 0.70690 1.0000 + Cl Cl866 1.0 0.43061 0.59571 0.70690 1.0000 + Cl Cl867 1.0 0.38894 0.63737 0.70690 1.0000 + Cl Cl868 1.0 0.34728 0.67904 0.70690 1.0000 + Cl Cl869 1.0 0.30561 0.72071 0.70690 1.0000 + Cl Cl870 1.0 0.26394 0.76237 0.70690 1.0000 + Cl Cl871 1.0 0.22228 0.80404 0.70690 1.0000 + Cl Cl872 1.0 0.18061 0.84571 0.70690 1.0000 + Cl Cl873 1.0 0.13894 0.88737 0.70690 1.0000 + Cl Cl874 1.0 0.09728 0.92904 0.70690 1.0000 + Cl Cl875 1.0 0.05561 0.97071 0.70690 1.0000 + Cl Cl876 1.0 0.01394 0.01237 0.70690 1.0000 + Cl Cl877 1.0 0.51394 0.59571 0.70690 1.0000 + Cl Cl878 1.0 0.47228 0.63737 0.70690 1.0000 + Cl Cl879 1.0 0.43061 0.67904 0.70690 1.0000 + Cl Cl880 1.0 0.38894 0.72071 0.70690 1.0000 + Cl Cl881 1.0 0.34728 0.76237 0.70690 1.0000 + Cl Cl882 1.0 0.30561 0.80404 0.70690 1.0000 + Cl Cl883 1.0 0.26394 0.84571 0.70690 1.0000 + Cl Cl884 1.0 0.22228 0.88737 0.70690 1.0000 + Cl Cl885 1.0 0.18061 0.92904 0.70690 1.0000 + Cl Cl886 1.0 0.13894 0.97071 0.70690 1.0000 + Cl Cl887 1.0 0.09728 0.01237 0.70690 1.0000 + Cl Cl888 1.0 0.05561 0.05404 0.70690 1.0000 + Cl Cl889 1.0 0.55561 0.63737 0.70690 1.0000 + Cl Cl890 1.0 0.51394 0.67904 0.70690 1.0000 + Cl Cl891 1.0 0.47228 0.72071 0.70690 1.0000 + Cl Cl892 1.0 0.43061 0.76237 0.70690 1.0000 + Cl Cl893 1.0 0.38894 0.80404 0.70690 1.0000 + Cl Cl894 1.0 0.34728 0.84571 0.70690 1.0000 + Cl Cl895 1.0 0.30561 0.88737 0.70690 1.0000 + Cl Cl896 1.0 0.26394 0.92904 0.70690 1.0000 + Cl Cl897 1.0 0.22228 0.97071 0.70690 1.0000 + Cl Cl898 1.0 0.18061 0.01237 0.70690 1.0000 + Cl Cl899 1.0 0.13894 0.05404 0.70690 1.0000 + Cl Cl900 1.0 0.09728 0.09571 0.70690 1.0000 + Cl Cl901 1.0 0.59728 0.67904 0.70690 1.0000 + Cl Cl902 1.0 0.55561 0.72071 0.70690 1.0000 + Cl Cl903 1.0 0.51394 0.76237 0.70690 1.0000 + Cl Cl904 1.0 0.47228 0.80404 0.70690 1.0000 + Cl Cl905 1.0 0.43061 0.84571 0.70690 1.0000 + Cl Cl906 1.0 0.38894 0.88737 0.70690 1.0000 + Cl Cl907 1.0 0.34728 0.92904 0.70690 1.0000 + Cl Cl908 1.0 0.30561 0.97071 0.70690 1.0000 + Cl Cl909 1.0 0.26394 0.01237 0.70690 1.0000 + Cl Cl910 1.0 0.22228 0.05404 0.70690 1.0000 + Cl Cl911 1.0 0.18061 0.09571 0.70690 1.0000 + Cl Cl912 1.0 0.13894 0.13737 0.70690 1.0000 + Cl Cl913 1.0 0.63894 0.72071 0.70690 1.0000 + Cl Cl914 1.0 0.59728 0.76237 0.70690 1.0000 + Cl Cl915 1.0 0.55561 0.80404 0.70690 1.0000 + Cl Cl916 1.0 0.51394 0.84571 0.70690 1.0000 + Cl Cl917 1.0 0.47228 0.88737 0.70690 1.0000 + Cl Cl918 1.0 0.43061 0.92904 0.70690 1.0000 + Cl Cl919 1.0 0.38894 0.97071 0.70690 1.0000 + Cl Cl920 1.0 0.34728 0.01237 0.70690 1.0000 + Cl Cl921 1.0 0.30561 0.05404 0.70690 1.0000 + Cl Cl922 1.0 0.26394 0.09571 0.70690 1.0000 + Cl Cl923 1.0 0.22228 0.13737 0.70690 1.0000 + Cl Cl924 1.0 0.18061 0.17904 0.70690 1.0000 + Cl Cl925 1.0 0.68061 0.76237 0.70690 1.0000 + Cl Cl926 1.0 0.63894 0.80404 0.70690 1.0000 + Cl Cl927 1.0 0.59728 0.84571 0.70690 1.0000 + Cl Cl928 1.0 0.55561 0.88737 0.70690 1.0000 + Cl Cl929 1.0 0.51394 0.92904 0.70690 1.0000 + Cl Cl930 1.0 0.47228 0.97071 0.70690 1.0000 + Cl Cl931 1.0 0.43061 0.01237 0.70690 1.0000 + Cl Cl932 1.0 0.38894 0.05404 0.70690 1.0000 + Cl Cl933 1.0 0.34728 0.09571 0.70690 1.0000 + Cl Cl934 1.0 0.30561 0.13737 0.70690 1.0000 + Cl Cl935 1.0 0.26394 0.17904 0.70690 1.0000 + Cl Cl936 1.0 0.22228 0.22071 0.70690 1.0000 + Cl Cl937 1.0 0.72228 0.80404 0.70690 1.0000 + Cl Cl938 1.0 0.68061 0.84571 0.70690 1.0000 + Cl Cl939 1.0 0.63894 0.88737 0.70690 1.0000 + Cl Cl940 1.0 0.59728 0.92904 0.70690 1.0000 + Cl Cl941 1.0 0.55561 0.97071 0.70690 1.0000 + Cl Cl942 1.0 0.51394 0.01237 0.70690 1.0000 + Cl Cl943 1.0 0.47228 0.05404 0.70690 1.0000 + Cl Cl944 1.0 0.43061 0.09571 0.70690 1.0000 + Cl Cl945 1.0 0.38894 0.13737 0.70690 1.0000 + Cl Cl946 1.0 0.34728 0.17904 0.70690 1.0000 + Cl Cl947 1.0 0.30561 0.22071 0.70690 1.0000 + Cl Cl948 1.0 0.26394 0.26237 0.70690 1.0000 + Cl Cl949 1.0 0.76394 0.84571 0.70690 1.0000 + Cl Cl950 1.0 0.72228 0.88737 0.70690 1.0000 + Cl Cl951 1.0 0.68061 0.92904 0.70690 1.0000 + Cl Cl952 1.0 0.63894 0.97071 0.70690 1.0000 + Cl Cl953 1.0 0.59728 0.01237 0.70690 1.0000 + Cl Cl954 1.0 0.55561 0.05404 0.70690 1.0000 + Cl Cl955 1.0 0.51394 0.09571 0.70690 1.0000 + Cl Cl956 1.0 0.47228 0.13737 0.70690 1.0000 + Cl Cl957 1.0 0.43061 0.17904 0.70690 1.0000 + Cl Cl958 1.0 0.38894 0.22071 0.70690 1.0000 + Cl Cl959 1.0 0.34728 0.26237 0.70690 1.0000 + Cl Cl960 1.0 0.30561 0.30404 0.70690 1.0000 + Cl Cl961 1.0 0.80561 0.88737 0.70690 1.0000 + Cl Cl962 1.0 0.76394 0.92904 0.70690 1.0000 + Cl Cl963 1.0 0.72228 0.97071 0.70690 1.0000 + Cl Cl964 1.0 0.68061 0.01237 0.70690 1.0000 + Cl Cl965 1.0 0.63894 0.05404 0.70690 1.0000 + Cl Cl966 1.0 0.59728 0.09571 0.70690 1.0000 + Cl Cl967 1.0 0.55561 0.13737 0.70690 1.0000 + Cl Cl968 1.0 0.51394 0.17904 0.70690 1.0000 + Cl Cl969 1.0 0.47228 0.22071 0.70690 1.0000 + Cl Cl970 1.0 0.43061 0.26237 0.70690 1.0000 + Cl Cl971 1.0 0.38894 0.30404 0.70690 1.0000 + Cl Cl972 1.0 0.34728 0.34571 0.70690 1.0000 + Cl Cl973 1.0 0.84728 0.92904 0.70690 1.0000 + Cl Cl974 1.0 0.80561 0.97071 0.70690 1.0000 + Cl Cl975 1.0 0.76394 0.01237 0.70690 1.0000 + Cl Cl976 1.0 0.72228 0.05404 0.70690 1.0000 + Cl Cl977 1.0 0.68061 0.09571 0.70690 1.0000 + Cl Cl978 1.0 0.63894 0.13737 0.70690 1.0000 + Cl Cl979 1.0 0.59728 0.17904 0.70690 1.0000 + Cl Cl980 1.0 0.55561 0.22071 0.70690 1.0000 + Cl Cl981 1.0 0.51394 0.26237 0.70690 1.0000 + Cl Cl982 1.0 0.47228 0.30404 0.70690 1.0000 + Cl Cl983 1.0 0.43061 0.34571 0.70690 1.0000 + Cl Cl984 1.0 0.38894 0.38737 0.70690 1.0000 + Cl Cl985 1.0 0.88894 0.97071 0.70690 1.0000 + Cl Cl986 1.0 0.84728 0.01237 0.70690 1.0000 + Cl Cl987 1.0 0.80561 0.05404 0.70690 1.0000 + Cl Cl988 1.0 0.76394 0.09571 0.70690 1.0000 + Cl Cl989 1.0 0.72228 0.13737 0.70690 1.0000 + Cl Cl990 1.0 0.68061 0.17904 0.70690 1.0000 + Cl Cl991 1.0 0.63894 0.22071 0.70690 1.0000 + Cl Cl992 1.0 0.59728 0.26237 0.70690 1.0000 + Cl Cl993 1.0 0.55561 0.30404 0.70690 1.0000 + Cl Cl994 1.0 0.51394 0.34571 0.70690 1.0000 + Cl Cl995 1.0 0.47228 0.38737 0.70690 1.0000 + Cl Cl996 1.0 0.43061 0.42904 0.70690 1.0000 + Cl Cl997 1.0 0.93061 0.01237 0.70690 1.0000 + Cl Cl998 1.0 0.88894 0.05404 0.70690 1.0000 + Cl Cl999 1.0 0.84728 0.09571 0.70690 1.0000 + Cl Cl1000 1.0 0.80561 0.13737 0.70690 1.0000 + Cl Cl1001 1.0 0.76394 0.17904 0.70690 1.0000 + Cl Cl1002 1.0 0.72228 0.22071 0.70690 1.0000 + Cl Cl1003 1.0 0.68061 0.26237 0.70690 1.0000 + Cl Cl1004 1.0 0.63894 0.30404 0.70690 1.0000 + Cl Cl1005 1.0 0.59728 0.34571 0.70690 1.0000 + Cl Cl1006 1.0 0.55561 0.38737 0.70690 1.0000 + Cl Cl1007 1.0 0.51394 0.42904 0.70690 1.0000 + Cl Cl1008 1.0 0.47228 0.47071 0.70690 1.0000 + Cl Cl1009 1.0 0.49921 0.55623 0.70690 1.0000 + Cl Cl1010 1.0 0.45755 0.59790 0.70690 1.0000 + Cl Cl1011 1.0 0.41588 0.63957 0.70690 1.0000 + Cl Cl1012 1.0 0.37421 0.68123 0.70690 1.0000 + Cl Cl1013 1.0 0.33255 0.72290 0.70690 1.0000 + Cl Cl1014 1.0 0.29088 0.76457 0.70690 1.0000 + Cl Cl1015 1.0 0.24921 0.80623 0.70690 1.0000 + Cl Cl1016 1.0 0.20755 0.84790 0.70690 1.0000 + Cl Cl1017 1.0 0.16588 0.88957 0.70690 1.0000 + Cl Cl1018 1.0 0.12421 0.93123 0.70690 1.0000 + Cl Cl1019 1.0 0.08255 0.97290 0.70690 1.0000 + Cl Cl1020 1.0 0.04088 0.01457 0.70690 1.0000 + Cl Cl1021 1.0 0.54088 0.59790 0.70690 1.0000 + Cl Cl1022 1.0 0.49921 0.63957 0.70690 1.0000 + Cl Cl1023 1.0 0.45755 0.68123 0.70690 1.0000 + Cl Cl1024 1.0 0.41588 0.72290 0.70690 1.0000 + Cl Cl1025 1.0 0.37421 0.76457 0.70690 1.0000 + Cl Cl1026 1.0 0.33255 0.80623 0.70690 1.0000 + Cl Cl1027 1.0 0.29088 0.84790 0.70690 1.0000 + Cl Cl1028 1.0 0.24921 0.88957 0.70690 1.0000 + Cl Cl1029 1.0 0.20755 0.93123 0.70690 1.0000 + Cl Cl1030 1.0 0.16588 0.97290 0.70690 1.0000 + Cl Cl1031 1.0 0.12421 0.01457 0.70690 1.0000 + Cl Cl1032 1.0 0.08255 0.05623 0.70690 1.0000 + Cl Cl1033 1.0 0.58255 0.63957 0.70690 1.0000 + Cl Cl1034 1.0 0.54088 0.68123 0.70690 1.0000 + Cl Cl1035 1.0 0.49921 0.72290 0.70690 1.0000 + Cl Cl1036 1.0 0.45755 0.76457 0.70690 1.0000 + Cl Cl1037 1.0 0.41588 0.80623 0.70690 1.0000 + Cl Cl1038 1.0 0.37421 0.84790 0.70690 1.0000 + Cl Cl1039 1.0 0.33255 0.88957 0.70690 1.0000 + Cl Cl1040 1.0 0.29088 0.93123 0.70690 1.0000 + Cl Cl1041 1.0 0.24921 0.97290 0.70690 1.0000 + Cl Cl1042 1.0 0.20755 0.01457 0.70690 1.0000 + Cl Cl1043 1.0 0.16588 0.05623 0.70690 1.0000 + Cl Cl1044 1.0 0.12421 0.09790 0.70690 1.0000 + Cl Cl1045 1.0 0.62421 0.68123 0.70690 1.0000 + Cl Cl1046 1.0 0.58255 0.72290 0.70690 1.0000 + Cl Cl1047 1.0 0.54088 0.76457 0.70690 1.0000 + Cl Cl1048 1.0 0.49921 0.80623 0.70690 1.0000 + Cl Cl1049 1.0 0.45755 0.84790 0.70690 1.0000 + Cl Cl1050 1.0 0.41588 0.88957 0.70690 1.0000 + Cl Cl1051 1.0 0.37421 0.93123 0.70690 1.0000 + Cl Cl1052 1.0 0.33255 0.97290 0.70690 1.0000 + Cl Cl1053 1.0 0.29088 0.01457 0.70690 1.0000 + Cl Cl1054 1.0 0.24921 0.05623 0.70690 1.0000 + Cl Cl1055 1.0 0.20755 0.09790 0.70690 1.0000 + Cl Cl1056 1.0 0.16588 0.13957 0.70690 1.0000 + Cl Cl1057 1.0 0.66588 0.72290 0.70690 1.0000 + Cl Cl1058 1.0 0.62421 0.76457 0.70690 1.0000 + Cl Cl1059 1.0 0.58255 0.80623 0.70690 1.0000 + Cl Cl1060 1.0 0.54088 0.84790 0.70690 1.0000 + Cl Cl1061 1.0 0.49921 0.88957 0.70690 1.0000 + Cl Cl1062 1.0 0.45755 0.93123 0.70690 1.0000 + Cl Cl1063 1.0 0.41588 0.97290 0.70690 1.0000 + Cl Cl1064 1.0 0.37421 0.01457 0.70690 1.0000 + Cl Cl1065 1.0 0.33255 0.05623 0.70690 1.0000 + Cl Cl1066 1.0 0.29088 0.09790 0.70690 1.0000 + Cl Cl1067 1.0 0.24921 0.13957 0.70690 1.0000 + Cl Cl1068 1.0 0.20755 0.18123 0.70690 1.0000 + Cl Cl1069 1.0 0.70755 0.76457 0.70690 1.0000 + Cl Cl1070 1.0 0.66588 0.80623 0.70690 1.0000 + Cl Cl1071 1.0 0.62421 0.84790 0.70690 1.0000 + Cl Cl1072 1.0 0.58255 0.88957 0.70690 1.0000 + Cl Cl1073 1.0 0.54088 0.93123 0.70690 1.0000 + Cl Cl1074 1.0 0.49921 0.97290 0.70690 1.0000 + Cl Cl1075 1.0 0.45755 0.01457 0.70690 1.0000 + Cl Cl1076 1.0 0.41588 0.05623 0.70690 1.0000 + Cl Cl1077 1.0 0.37421 0.09790 0.70690 1.0000 + Cl Cl1078 1.0 0.33255 0.13957 0.70690 1.0000 + Cl Cl1079 1.0 0.29088 0.18123 0.70690 1.0000 + Cl Cl1080 1.0 0.24921 0.22290 0.70690 1.0000 + Cl Cl1081 1.0 0.74921 0.80623 0.70690 1.0000 + Cl Cl1082 1.0 0.70755 0.84790 0.70690 1.0000 + Cl Cl1083 1.0 0.66588 0.88957 0.70690 1.0000 + Cl Cl1084 1.0 0.62421 0.93123 0.70690 1.0000 + Cl Cl1085 1.0 0.58255 0.97290 0.70690 1.0000 + Cl Cl1086 1.0 0.54088 0.01457 0.70690 1.0000 + Cl Cl1087 1.0 0.49921 0.05623 0.70690 1.0000 + Cl Cl1088 1.0 0.45755 0.09790 0.70690 1.0000 + Cl Cl1089 1.0 0.41588 0.13957 0.70690 1.0000 + Cl Cl1090 1.0 0.37421 0.18123 0.70690 1.0000 + Cl Cl1091 1.0 0.33255 0.22290 0.70690 1.0000 + Cl Cl1092 1.0 0.29088 0.26457 0.70690 1.0000 + Cl Cl1093 1.0 0.79088 0.84790 0.70690 1.0000 + Cl Cl1094 1.0 0.74921 0.88957 0.70690 1.0000 + Cl Cl1095 1.0 0.70755 0.93123 0.70690 1.0000 + Cl Cl1096 1.0 0.66588 0.97290 0.70690 1.0000 + Cl Cl1097 1.0 0.62421 0.01457 0.70690 1.0000 + Cl Cl1098 1.0 0.58255 0.05623 0.70690 1.0000 + Cl Cl1099 1.0 0.54088 0.09790 0.70690 1.0000 + Cl Cl1100 1.0 0.49921 0.13957 0.70690 1.0000 + Cl Cl1101 1.0 0.45755 0.18123 0.70690 1.0000 + Cl Cl1102 1.0 0.41588 0.22290 0.70690 1.0000 + Cl Cl1103 1.0 0.37421 0.26457 0.70690 1.0000 + Cl Cl1104 1.0 0.33255 0.30623 0.70690 1.0000 + Cl Cl1105 1.0 0.83255 0.88957 0.70690 1.0000 + Cl Cl1106 1.0 0.79088 0.93123 0.70690 1.0000 + Cl Cl1107 1.0 0.74921 0.97290 0.70690 1.0000 + Cl Cl1108 1.0 0.70755 0.01457 0.70690 1.0000 + Cl Cl1109 1.0 0.66588 0.05623 0.70690 1.0000 + Cl Cl1110 1.0 0.62421 0.09790 0.70690 1.0000 + Cl Cl1111 1.0 0.58255 0.13957 0.70690 1.0000 + Cl Cl1112 1.0 0.54088 0.18123 0.70690 1.0000 + Cl Cl1113 1.0 0.49921 0.22290 0.70690 1.0000 + Cl Cl1114 1.0 0.45755 0.26457 0.70690 1.0000 + Cl Cl1115 1.0 0.41588 0.30623 0.70690 1.0000 + Cl Cl1116 1.0 0.37421 0.34790 0.70690 1.0000 + Cl Cl1117 1.0 0.87421 0.93123 0.70690 1.0000 + Cl Cl1118 1.0 0.83255 0.97290 0.70690 1.0000 + Cl Cl1119 1.0 0.79088 0.01457 0.70690 1.0000 + Cl Cl1120 1.0 0.74921 0.05623 0.70690 1.0000 + Cl Cl1121 1.0 0.70755 0.09790 0.70690 1.0000 + Cl Cl1122 1.0 0.66588 0.13957 0.70690 1.0000 + Cl Cl1123 1.0 0.62421 0.18123 0.70690 1.0000 + Cl Cl1124 1.0 0.58255 0.22290 0.70690 1.0000 + Cl Cl1125 1.0 0.54088 0.26457 0.70690 1.0000 + Cl Cl1126 1.0 0.49921 0.30623 0.70690 1.0000 + Cl Cl1127 1.0 0.45755 0.34790 0.70690 1.0000 + Cl Cl1128 1.0 0.41588 0.38957 0.70690 1.0000 + Cl Cl1129 1.0 0.91588 0.97290 0.70690 1.0000 + Cl Cl1130 1.0 0.87421 0.01457 0.70690 1.0000 + Cl Cl1131 1.0 0.83255 0.05623 0.70690 1.0000 + Cl Cl1132 1.0 0.79088 0.09790 0.70690 1.0000 + Cl Cl1133 1.0 0.74921 0.13957 0.70690 1.0000 + Cl Cl1134 1.0 0.70755 0.18123 0.70690 1.0000 + Cl Cl1135 1.0 0.66588 0.22290 0.70690 1.0000 + Cl Cl1136 1.0 0.62421 0.26457 0.70690 1.0000 + Cl Cl1137 1.0 0.58255 0.30623 0.70690 1.0000 + Cl Cl1138 1.0 0.54088 0.34790 0.70690 1.0000 + Cl Cl1139 1.0 0.49921 0.38957 0.70690 1.0000 + Cl Cl1140 1.0 0.45755 0.43123 0.70690 1.0000 + Cl Cl1141 1.0 0.95755 0.01457 0.70690 1.0000 + Cl Cl1142 1.0 0.91588 0.05623 0.70690 1.0000 + Cl Cl1143 1.0 0.87421 0.09790 0.70690 1.0000 + Cl Cl1144 1.0 0.83255 0.13957 0.70690 1.0000 + Cl Cl1145 1.0 0.79088 0.18123 0.70690 1.0000 + Cl Cl1146 1.0 0.74921 0.22290 0.70690 1.0000 + Cl Cl1147 1.0 0.70755 0.26457 0.70690 1.0000 + Cl Cl1148 1.0 0.66588 0.30623 0.70690 1.0000 + Cl Cl1149 1.0 0.62421 0.34790 0.70690 1.0000 + Cl Cl1150 1.0 0.58255 0.38957 0.70690 1.0000 + Cl Cl1151 1.0 0.54088 0.43123 0.70690 1.0000 + Cl Cl1152 1.0 0.49921 0.47290 0.70690 1.0000 + Cl Cl1153 1.0 0.48684 0.51473 0.70690 1.0000 + Cl Cl1154 1.0 0.44518 0.55640 0.70690 1.0000 + Cl Cl1155 1.0 0.40351 0.59806 0.70690 1.0000 + Cl Cl1156 1.0 0.36184 0.63973 0.70690 1.0000 + Cl Cl1157 1.0 0.32018 0.68140 0.70690 1.0000 + Cl Cl1158 1.0 0.27851 0.72306 0.70690 1.0000 + Cl Cl1159 1.0 0.23684 0.76473 0.70690 1.0000 + Cl Cl1160 1.0 0.19518 0.80640 0.70690 1.0000 + Cl Cl1161 1.0 0.15351 0.84806 0.70690 1.0000 + Cl Cl1162 1.0 0.11184 0.88973 0.70690 1.0000 + Cl Cl1163 1.0 0.07018 0.93140 0.70690 1.0000 + Cl Cl1164 1.0 0.02851 0.97306 0.70690 1.0000 + Cl Cl1165 1.0 0.52851 0.55640 0.70690 1.0000 + Cl Cl1166 1.0 0.48684 0.59806 0.70690 1.0000 + Cl Cl1167 1.0 0.44518 0.63973 0.70690 1.0000 + Cl Cl1168 1.0 0.40351 0.68140 0.70690 1.0000 + Cl Cl1169 1.0 0.36184 0.72306 0.70690 1.0000 + Cl Cl1170 1.0 0.32018 0.76473 0.70690 1.0000 + Cl Cl1171 1.0 0.27851 0.80640 0.70690 1.0000 + Cl Cl1172 1.0 0.23684 0.84806 0.70690 1.0000 + Cl Cl1173 1.0 0.19518 0.88973 0.70690 1.0000 + Cl Cl1174 1.0 0.15351 0.93140 0.70690 1.0000 + Cl Cl1175 1.0 0.11184 0.97306 0.70690 1.0000 + Cl Cl1176 1.0 0.07018 0.01473 0.70690 1.0000 + Cl Cl1177 1.0 0.57018 0.59806 0.70690 1.0000 + Cl Cl1178 1.0 0.52851 0.63973 0.70690 1.0000 + Cl Cl1179 1.0 0.48684 0.68140 0.70690 1.0000 + Cl Cl1180 1.0 0.44518 0.72306 0.70690 1.0000 + Cl Cl1181 1.0 0.40351 0.76473 0.70690 1.0000 + Cl Cl1182 1.0 0.36184 0.80640 0.70690 1.0000 + Cl Cl1183 1.0 0.32018 0.84806 0.70690 1.0000 + Cl Cl1184 1.0 0.27851 0.88973 0.70690 1.0000 + Cl Cl1185 1.0 0.23684 0.93140 0.70690 1.0000 + Cl Cl1186 1.0 0.19518 0.97306 0.70690 1.0000 + Cl Cl1187 1.0 0.15351 0.01473 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1.0000 + Cl Cl1209 1.0 0.32018 0.01473 0.70690 1.0000 + Cl Cl1210 1.0 0.27851 0.05640 0.70690 1.0000 + Cl Cl1211 1.0 0.23684 0.09806 0.70690 1.0000 + Cl Cl1212 1.0 0.19518 0.13973 0.70690 1.0000 + Cl Cl1213 1.0 0.69518 0.72306 0.70690 1.0000 + Cl Cl1214 1.0 0.65351 0.76473 0.70690 1.0000 + Cl Cl1215 1.0 0.61184 0.80640 0.70690 1.0000 + Cl Cl1216 1.0 0.57018 0.84806 0.70690 1.0000 + Cl Cl1217 1.0 0.52851 0.88973 0.70690 1.0000 + Cl Cl1218 1.0 0.48684 0.93140 0.70690 1.0000 + Cl Cl1219 1.0 0.44518 0.97306 0.70690 1.0000 + Cl Cl1220 1.0 0.40351 0.01473 0.70690 1.0000 + Cl Cl1221 1.0 0.36184 0.05640 0.70690 1.0000 + Cl Cl1222 1.0 0.32018 0.09806 0.70690 1.0000 + Cl Cl1223 1.0 0.27851 0.13973 0.70690 1.0000 + Cl Cl1224 1.0 0.23684 0.18140 0.70690 1.0000 + Cl Cl1225 1.0 0.73684 0.76473 0.70690 1.0000 + Cl Cl1226 1.0 0.69518 0.80640 0.70690 1.0000 + Cl Cl1227 1.0 0.65351 0.84806 0.70690 1.0000 + Cl Cl1228 1.0 0.61184 0.88973 0.70690 1.0000 + Cl Cl1229 1.0 0.57018 0.93140 0.70690 1.0000 + Cl Cl1230 1.0 0.52851 0.97306 0.70690 1.0000 + Cl Cl1231 1.0 0.48684 0.01473 0.70690 1.0000 + Cl Cl1232 1.0 0.44518 0.05640 0.70690 1.0000 + Cl Cl1233 1.0 0.40351 0.09806 0.70690 1.0000 + Cl Cl1234 1.0 0.36184 0.13973 0.70690 1.0000 + Cl Cl1235 1.0 0.32018 0.18140 0.70690 1.0000 + Cl Cl1236 1.0 0.27851 0.22306 0.70690 1.0000 + Cl Cl1237 1.0 0.77851 0.80640 0.70690 1.0000 + Cl Cl1238 1.0 0.73684 0.84806 0.70690 1.0000 + Cl Cl1239 1.0 0.69518 0.88973 0.70690 1.0000 + Cl Cl1240 1.0 0.65351 0.93140 0.70690 1.0000 + Cl Cl1241 1.0 0.61184 0.97306 0.70690 1.0000 + Cl Cl1242 1.0 0.57018 0.01473 0.70690 1.0000 + Cl Cl1243 1.0 0.52851 0.05640 0.70690 1.0000 + Cl Cl1244 1.0 0.48684 0.09806 0.70690 1.0000 + Cl Cl1245 1.0 0.44518 0.13973 0.70690 1.0000 + Cl Cl1246 1.0 0.40351 0.18140 0.70690 1.0000 + Cl Cl1247 1.0 0.36184 0.22306 0.70690 1.0000 + Cl Cl1248 1.0 0.32018 0.26473 0.70690 1.0000 + Cl Cl1249 1.0 0.82018 0.84806 0.70690 1.0000 + Cl Cl1250 1.0 0.77851 0.88973 0.70690 1.0000 + Cl Cl1251 1.0 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Cl1654 1.0 0.32018 0.15194 0.29310 1.0000 + Cl Cl1655 1.0 0.27851 0.19360 0.29310 1.0000 + Cl Cl1656 1.0 0.23684 0.23527 0.29310 1.0000 + Cl Cl1657 1.0 0.73684 0.81860 0.29310 1.0000 + Cl Cl1658 1.0 0.69518 0.86027 0.29310 1.0000 + Cl Cl1659 1.0 0.65351 0.90194 0.29310 1.0000 + Cl Cl1660 1.0 0.61184 0.94360 0.29310 1.0000 + Cl Cl1661 1.0 0.57018 0.98527 0.29310 1.0000 + Cl Cl1662 1.0 0.52851 0.02694 0.29310 1.0000 + Cl Cl1663 1.0 0.48684 0.06860 0.29310 1.0000 + Cl Cl1664 1.0 0.44518 0.11027 0.29310 1.0000 + Cl Cl1665 1.0 0.40351 0.15194 0.29310 1.0000 + Cl Cl1666 1.0 0.36184 0.19360 0.29310 1.0000 + Cl Cl1667 1.0 0.32018 0.23527 0.29310 1.0000 + Cl Cl1668 1.0 0.27851 0.27694 0.29310 1.0000 + Cl Cl1669 1.0 0.77851 0.86027 0.29310 1.0000 + Cl Cl1670 1.0 0.73684 0.90194 0.29310 1.0000 + Cl Cl1671 1.0 0.69518 0.94360 0.29310 1.0000 + Cl Cl1672 1.0 0.65351 0.98527 0.29310 1.0000 + Cl Cl1673 1.0 0.61184 0.02694 0.29310 1.0000 + Cl Cl1674 1.0 0.57018 0.06860 0.29310 1.0000 + Cl Cl1675 1.0 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