Split (1)

train · 45.2k rows

text stringlengths 140 560
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<forme>-0.34<forme><bg>0.0<bg><abc>7.472 7.472 8.166<abc><angles>106.180 105.518 113.770<angles><comp>Cr7 Te8<comp><coord>Cr 0.733 0.233 0.500 Cr 0.267 0.767 0.500 Cr 0.000 0.000 0.500 Cr 0.500 0.500 0.500 Cr 0.264 0.746 0.010 Cr 0.736 0.254 0.990 Cr 0.000 0.000 0.000 Te 0.035 0.297 0.332 Te 0.965 0.703 0.668 Te 0.968 0.708 0.169 Te 0.032 0.292 0.831 Te 0.540 0.799 0.831 Te 0.460 0.201 0.169 Te 0.548 0.786 0.334 Te 0.452 0.214 0.666 <coord>
<forme>-2.64<forme><bg>1.9<bg><abc>6.138 6.138 6.138<abc><angles>60.000 60.000 60.000<angles><comp>Mg4 Sn2 O8<comp><coord>Mg 0.875 0.375 0.875 Mg 0.375 0.875 0.875 Mg 0.875 0.875 0.375 Mg 0.875 0.875 0.875 Sn 0.250 0.250 0.250 Sn 0.500 0.500 0.500 O 0.117 0.117 0.117 O 0.117 0.117 0.648 O 0.648 0.117 0.117 O 0.633 0.102 0.633 O 0.117 0.648 0.117 O 0.633 0.633 0.633 O 0.633 0.633 0.102 O 0.102 0.633 0.633 <coord>
<forme>-0.27<forme><bg>0.0<bg><abc>3.610 3.610 5.007<abc><angles>90.000 90.000 120.000<angles><comp>Co1 Ni1 As2<comp><coord>Co 0.000 0.000 0.500 Ni 0.000 0.000 0.000 As 0.333 0.667 0.740 As 0.667 0.333 0.260 <coord>
<forme>-1.67<forme><bg>4.02<bg><abc>5.071 5.723 8.586<abc><angles>107.219 90.000 90.000<angles><comp>Li4 H4 Se2 O10<comp><coord>Li 0.589 0.438 0.103 Li 0.101 0.312 0.496 Li 0.089 0.562 0.897 Li 0.601 0.688 0.504 H 0.216 0.003 0.943 H 0.974 0.957 0.818 H 0.716 0.997 0.057 H 0.474 0.043 0.182 Se 0.103 0.715 0.292 Se 0.603 0.285 0.708 O 0.231 0.606 0.436 O 0.731 0.394 0.564 O 0.554 0.093 0.092 O 0.722 0.446 0.890 O 0.187 0.007 0.326 O 0.687 0.993 0.674 O 0.222 0.554 0.110 O 0.054 0.907 0.908 O 0.775 0.678 0.290 O 0.275 0.322 0.710 <coord>
<forme>-2.03<forme><bg>0.0<bg><abc>5.813 6.802 6.821<abc><angles>60.094 71.603 90.000<angles><comp>Ca2 Bi3 O8<comp><coord>Ca 0.356 0.279 0.442 Ca 0.644 0.721 0.558 Bi 0.500 0.000 0.000 Bi 0.000 0.737 0.000 Bi 0.000 0.263 0.000 O 0.914 0.604 0.792 O 0.086 0.396 0.208 O 0.941 0.109 0.783 O 0.059 0.891 0.217 O 0.613 0.113 0.242 O 0.613 0.646 0.242 O 0.387 0.354 0.758 O 0.387 0.887 0.758 <coord>

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