youssefsassi/Le-Mat-Bulk_matgen_constrained

immutable_id large_stringlengths 4 13	elements listlengths 1 7	nsites int64 1 20	nelements int64 1 7	chemical_formula_anonymous large_stringclasses 529 values	chemical_formula_reduced large_stringlengths 1 17	lattice_vectors listlengths 3 3	cartesian_site_positions listlengths 1 20	species_at_sites listlengths 1 20	dft_hull float64 0 0.1	energy float64 -948.71 -0.22
agm005912441	[ "B", "Si", "Ta" ]	16	3	A5B2C	B2SiTa5	[ [ 6.2420713776242085, 0, 0 ], [ 0, 6.2420713776242085, 0 ], [ -3.1210356888121042, -3.1210356888121042, 5.8152218492283785 ] ]	[ [ 1.0450557671553509, 2.0759799216567525, 4.19864797844807 ], [ 4.166091455967455, 5.197015610468857, 1.6165738707803081 ], [ 0, 0, 0 ], [ 3.1210356888121034, 3.1210356888121034, 0 ], [ -1.0450557671553506, -2.0759799216567534, 4.1986479784...	[ "Ta", "Ta", "Ta", "Ta", "Ta", "Ta", "Ta", "Ta", "Ta", "Ta", "Si", "Si", "B", "B", "B", "B" ]	0	-166.870156
agm002338904	[ "Ba", "Br", "Ge" ]	6	3	A4BC	BaBr4Ge	[ [ 4.9543393861499085, 0, 0 ], [ -2.463519409600393, 6.475147259214868, 0 ], [ -0.0022342970255617212, -1.8243057316839988, 7.55857997027574 ] ]	[ [ 2.092941616956643, 4.646096257228703, 7.539822295878303 ], [ -0.09401223907626592, 5.559548525798846, 3.758977737597947 ], [ 2.8415303856085923, -0.05864758963927902, 6.89126431280697 ], [ -0.13212167001127192, 0.9225258752020952, 2.69591040356028 ], ...	[ "Ge", "Ba", "Br", "Br", "Br", "Br" ]	0.039859	-21.318325
agm002330493	[ "Ba", "C", "Cl" ]	6	3	ABC	BaCCl	[ [ -4.71103616947951, 0, 0 ], [ 2.3353877260063696, -4.619257472759168, 0 ], [ -0.0031226096183971258, -0.01556992895597111, 7.87488306603107 ] ]	[ [ -0.009496913870102233, -3.986571762264038, 0.004830689519196509 ], [ -2.369274139221435, -0.6482556394511004, 7.870052376511874 ], [ -2.369497028110791, -3.129854798207069, 6.1712745691269255 ], [ -0.00927402498074562, -1.50497260350807, 1.70360849690414...	[ "C", "C", "Ba", "Ba", "Cl", "Cl" ]	0.089804	-33.316747
agm005857410	[ "Ba", "Ca", "Ge" ]	12	3	A3B2C	Ba3CaGe2	[ [ 0, 0, 7.375039236769738 ], [ 7.779579964915543, 0, 0 ], [ -3.8897899824577715, 8.093268677169098, -3.687519618384869 ] ]	[ [ 2.340882574167155, 5.053491429722582, -5.44940010295211e-16 ], [ 1.5489074082906178, 3.0397772474465157, 3.6875196183848686 ], [ 6.230672556624926, 3.039777247446516, -1.0384765875924422e-16 ], [ -2.3408825741671544, 5.053491429722582, 3.687519618384868 ...	[ "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ca", "Ca", "Ge", "Ge", "Ge", "Ge" ]	0.038177	-40.025337
agm002913978	[ "Ba", "Ca", "Hg" ]	5	3	A2B2C	BaCa2Hg2	[ [ 5.0949558, 0, 0 ], [ 0, 5.0949558, 0 ], [ -2.5474779, -2.5474779, 6.99309931 ] ]	[ [ 2.220446049250313e-16, 2.5474778999999996, 3.496549655 ], [ 2.5474778999999996, 0, 3.496549655 ], [ 2.5474779, 2.5474779, 1.5037097108459239 ], [ 7.289666917614569e-17, 2.94941274101177e-16, 5.4893895991540775 ], [ 0, 0, 0 ] ]	[ "Ca", "Ca", "Hg", "Hg", "Ba" ]	0.089854	-8.383677
agm005805489	[ "Ba", "Cd", "Ge" ]	5	3	A3BC	BaCd3Ge	[ [ 4.62669117, 0, 0 ], [ 0, 4.62669117, 0 ], [ 0, 0, 6.34418416 ] ]	[ [ 2.313345585, 2.313345585, 5.540436360119361 ], [ 0, 0, 4.019535638608163 ], [ 2.313345585, 0, 2.171258519562148 ], [ 0, 2.313345585, 2.171258519562148 ], [ 0, 0, 0.4590182822966573 ] ]	[ "Ba", "Cd", "Cd", "Cd", "Ge" ]	0.026932	-10.760167
agm003510578	[ "Ba", "Cd", "In" ]	10	3	A7B2C	Ba2Cd7In	[ [ 4.78865921, 0, 0 ], [ 0, 4.78865921, 0 ], [ 0, 0, 12.8239547 ] ]	[ [ 2.394329605, 0, 9.63480041505333 ], [ 0, 2.394329605, 3.189154284946669 ], [ 0, 2.394329605, 11.072556300890174 ], [ 2.394329605, 0, 4.649168195998113 ], [ 2.394329605, 0, 1.7513983991098252 ], [ 0, 2.394329605, 8.17478650...	[ "Ba", "Ba", "Cd", "Cd", "Cd", "Cd", "Cd", "Cd", "Cd", "In" ]	0.000598	-15.8685
agm005953056	[ "Ba", "Cd", "Pd" ]	14	3	A4B2C	BaCd4Pd2	[ [ 0, 0, 4.56857053 ], [ 8.48045505, 0, 0 ], [ 0, 8.48045505, 0 ] ]	[ [ 0, 0, 2.2842852649999994 ], [ 4.240227525, 4.240227525, 0 ], [ 0.759442558683105, 2.9034768863289884, 0 ], [ 7.721012491316895, 5.576978163671011, 0 ], [ 1.3367506386710115, 4.999670083683105, 2.2842852649999994 ], [ 7.14370441132...	[ "Ba", "Ba", "Cd", "Cd", "Cd", "Cd", "Cd", "Cd", "Cd", "Cd", "Pd", "Pd", "Pd", "Pd" ]	0	-37.991532
agm005783620	[ "Ba", "Cd", "Pt" ]	12	3	A4BC	Ba4CdPt	[ [ 0, 7.751905490856776, 0 ], [ 2.5402476445890723, 0, -8.080809366995249 ], [ -9.067139961339345, -3.875952745428388, 0 ] ]	[ [ -0.5666295432069195, 4.509597027368019, -3.8153847688943068 ], [ -7.230386595837889, 0.6336442819396296, -0.22501991460331663 ], [ -5.960262773543352, -0.6336442819396298, -4.2654245981009415 ], [ 0.7034942790876169, 3.242308463488759, -7.855789452391932...	[ "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Cd", "Cd", "Pt", "Pt" ]	0.083207	-33.591818
agm002187184	[ "Ba", "Cd", "Si" ]	6	3	ABC	BaCdSi	[ [ -2.328690751273994, -4.033410696322297, 0 ], [ -2.328690751273994, 4.033410696322297, 0 ], [ 0, 0, -9.69752786 ] ]	[ [ -2.328690751273994, -1.3444702321074327, -7.273145894999999 ], [ -2.328690751273994, 1.3444702321074327, -2.4243819650000007 ], [ 0, 0, -4.84876393 ], [ 0, 0, 0 ], [ -2.3286907512739945, 1.3444702321074322, -7.273145894999999 ], [ ...	[ "Si", "Si", "Ba", "Ba", "Cd", "Cd" ]	0.036421	-18.534624
agm005790658	[ "Ba", "Cl", "Rh" ]	8	3	A6BC	Ba6ClRh	[ [ 7.89328462935872, 0, 0 ], [ 3.942224152733225, 6.8491015508012625, 0 ], [ 3.9350085449101635, 2.271727448221885, 7.5601421829753495 ] ]	[ [ 9.148133133643427, 6.9361116734553105, 5.773286777331962 ], [ 5.199028842900995, 4.456416858711994, 5.77013858292413 ], [ 6.459546637434344, 6.853290443720417, 1.7948965240720427 ], [ 10.571488484101113, 4.664412140311154, 1.7900036000512198 ], [ ...	[ "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Rh", "Cl" ]	0.053509	-25.126753
agm006089926	[ "Ba", "Cl", "Rh" ]	13	3	A8B4C	Ba8ClRh4	[ [ -4.572191706407677, -7.919268337443139, 0 ], [ -9.144383412815355, 0, 0 ], [ -4.572191706407677, -2.6397561124810465, -7.512209137567731 ] ]	[ [ -13.716575119223032, -7.919268337443139, -5.843318090239637 ], [ -4.5721917064076765, -2.6397561124810465, -1.6688910473280945 ], [ -9.144383412815356, -7.87968382186331, -5.86948596930526 ], [ -6.892568755700149, -6.579598023412702, -1.6427231682624728 ...	[ "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Rh", "Rh", "Rh", "Rh", "Cl" ]	0.051485	-51.746357
agm002919295	[ "Ba", "Cu", "Se" ]	5	3	A2B2C	BaCu2Se2	[ [ 4.08203026, 0, 0 ], [ 0, 4.08203026, 0 ], [ -2.04101513, -2.04101513, 6.59730391 ] ]	[ [ 0, 2.04101513, 3.298651955 ], [ 2.04101513, 0, 3.298651955 ], [ 0, 0, 0 ], [ 2.04101513, 2.04101513, 1.8108791063221013 ], [ 6.424799523394141e-17, 6.424799523394141e-17, 4.786424803677897 ] ]	[ "Cu", "Cu", "Ba", "Se", "Se" ]	0.036538	-21.354196
agm005687956	[ "Ba", "F", "O" ]	9	3	A4B3C2	Ba4F2O3	[ [ 0, -3.932856919287626, 0 ], [ -6.651087795176545, -1.966428459643813, 0 ], [ -1.0720098054304676, -1.966428459643813, -8.372834947084183 ] ]	[ [ -6.278083162061437, -3.932856919287626, -5.903755080805721 ], [ -1.445014438545576, -3.932856919287626, -2.469079866278462 ], [ -4.841083547843911, -3.9328569192876257, -0.9276763696120904 ], [ -2.882014052763101, -3.932856919287626, -7.4451585774720925 ...	[ "Ba", "Ba", "Ba", "Ba", "O", "O", "O", "F", "F" ]	0.047565	-52.383178
agm003527842	[ "Ba", "F", "In" ]	11	3	A8B2C	Ba2F8In	[ [ 4.608321699138872, 0, 0 ], [ -0.555583560141143, 5.468205969162136, 0 ], [ -1.9075820103699836, -2.473891525661918, 7.0647267528796895 ] ]	[ [ -0.1668198417176555, 2.7767543170163833, 2.2728320996660645 ], [ 2.3119759703454013, 0.21756012648383408, 4.791894653213625 ], [ 2.304160849569436, 0, 0 ], [ 2.209287126394179, 3.8818602494068446, 1.2970159398046153 ], [ 0.1925350393169404, 1...	[ "Ba", "Ba", "In", "F", "F", "F", "F", "F", "F", "F", "F" ]	0.068872	-54.500767
agm005745404	[ "Ba", "F", "V" ]	14	3	A5BC	BaF5V	[ [ 4.932201528899455, 3.5644801210895256, 0 ], [ 4.932201528899455, -3.5644801210895256, 0 ], [ 3.414618344305189, 0, -7.498561153743363 ] ]	[ [ 5.7858561149757515, 0.35068424775315155, -1.8746402884358417 ], [ 7.493165287128347, -0.35068424775315077, -5.6239208653075226 ], [ 0, 0, 0 ], [ 6.63951070105205, -3.5644801210895256, -3.7492805768716817 ], [ 8.12821059464561, 0.1413546633427...	[ "Ba", "Ba", "V", "V", "F", "F", "F", "F", "F", "F", "F", "F", "F", "F" ]	0	-84.04097
agm002213408	[ "Ba", "Ga", "Hg" ]	4	3	A2BC	Ba2GaHg	[ [ -4.1537487413778384, -4.1537487413778384, 0 ], [ -4.1537487413778384, 0, -4.1537487413778384 ], [ 0, -4.1537487413778384, -4.1537487413778384 ] ]	[ [ 0, 0, 0 ], [ -4.1537487413778384, -4.1537487413778384, -4.1537487413778384 ], [ -2.0768743706889192, -2.0768743706889197, -2.0768743706889197 ], [ -6.230623112066757, -6.230623112066757, -6.230623112066757 ] ]	[ "Hg", "Ga", "Ba", "Ba" ]	0.036483	-8.867933
agm003312777	[ "Ba", "Ga", "Li" ]	7	3	A3B2C2	Ba2Ga2Li3	[ [ 0, -4.75126562, 0 ], [ -6.1531234347396175, -2.37563281, 0 ], [ -2.0981904631542196, -2.37563281, -6.7615536446852 ] ]	[ [ -3.4183740828755407, -2.37563281, -1.5956601940733806 ], [ -4.832939815018296, -7.12689843, -5.165893450611819 ], [ 0, -2.37563281, 0 ], [ -6.3986892712537555, -4.75126562, -2.919062711789007 ], [ -1.8526246266400797, -4.75126562, -3.8424...	[ "Ba", "Ba", "Li", "Li", "Li", "Ga", "Ga" ]	0.049437	-17.095496
agm001136899	[ "Ba", "Ga", "Mg" ]	4	3	A2BC	Ba2GaMg	[ [ 4.15560397, 0, 0 ], [ 0, 4.15560397, 0 ], [ 0, 0, 8.75563813 ] ]	[ [ 2.077801985, 2.077801985, 4.377819065 ], [ 0, 0, 6.771942806209032 ], [ 0, 0, 1.983695323790967 ], [ 2.077801985, 2.077801985, 0 ] ]	[ "Mg", "Ba", "Ba", "Ga" ]	0.04979	-9.22002
agm005829189	[ "Ba", "Ga", "Mg" ]	10	3	A3BC	BaGa3Mg	[ [ 0, 0, 4.3863239 ], [ 4.722443400173773, 0, 0 ], [ -2.3612217000868867, 12.589011450621866, 0 ] ]	[ [ 5.217007267323272e-16, 2.025088020804896, 1.096580975 ], [ 2.3612217000868867, 10.56392342981697, 3.2897429249999997 ], [ 2.3612217000868867, 7.416708208305743, 1.096580975 ], [ 3.951593155542174e-17, 5.172303242316123, 3.2897429249999997 ], [ 9....	[ "Ba", "Ba", "Mg", "Mg", "Ga", "Ga", "Ga", "Ga", "Ga", "Ga" ]	0.095494	-28.216902
agm002151085	[ "Ba", "Ga", "Se" ]	7	3	A4B2C	BaGa2Se4	[ [ 0, 0, -6.335341530046646 ], [ -4.078211710329198, -4.078211710329198, -3.167670765023323 ], [ -4.078211710329198, 4.078211710329198, -3.167670765023323 ] ]	[ [ -4.078211710329198, 0, -6.335341530046646 ], [ -4.078211710329198, 0, -3.167670765023323 ], [ 0, 0, 0 ], [ -2.7550643460485102, -1.3231473642806884, -4.751506147534985 ], [ -5.401359074609886, -1.3231473642806884, -7.919176912558308 ], ...	[ "Ga", "Ga", "Ba", "Se", "Se", "Se", "Se" ]	0.011593	-29.530925
agm003066821	[ "Ba", "Ge", "Hg" ]	6	3	ABC	BaGeHg	[ [ 4.247809055761527, 0, 0 ], [ 0.00015585433095617967, 4.7807805426073005, 0 ], [ 2.1186581929035064, 0.00835485352769082, 9.875287312012924 ] ]	[ [ 4.245081918262894, 3.738493756957328, 4.7123792671551215 ], [ 2.1207740531300203, 3.7387877538956364, 3.2159668092198705 ], [ 2.1209820120987333, 1.3473307746095087, 5.905552758893487 ], [ 4.245659641577565, 1.3477577480570124, 2.0232879706229645 ], ...	[ "Ge", "Ge", "Ba", "Ba", "Hg", "Hg" ]	0.099039	-16.200192
agm003484772	[ "Ba", "Ge", "N" ]	18	3	A6B2C	Ba6Ge2N	[ [ 7.70928294616994, 0, 0 ], [ 0, 8.21840203, 0 ], [ 0.013054678241011253, 0, 11.140488572900432 ] ]	[ [ 3.0958880474385158, 3.861055816866486, 8.508848160909974 ], [ 2.4895623042404833, 1.7055237990917296, 0.5715212122102817 ], [ 2.2506282357058236, 1.4557915453422015, 4.961121808613568 ], [ 1.6105405764996523, 5.564992560342201, 0.609122477836648 ], [...	[ "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ge", "Ge", "Ge", "Ge", "N", "N" ]	0.006675	-66.390851
agm003628645	[ "Ba", "Ge", "Sn" ]	8	3	A2BC	Ba2GeSn	[ [ 0, -4.52869114, 0 ], [ -6.794776193622831, 0, 0 ], [ 2.7384952423404036, 0, -9.654624103003393 ] ]	[ [ -3.8846939381705505, -1.1321727849999996, -5.545266297733899 ], [ -0.17158701311187655, -3.3965183550000004, -4.109357805269495 ], [ -2.281613601657267, -3.3965183550000004, -9.046262101712891 ], [ -1.7746673496251604, -1.1321727849999996, -0.60836200129...	[ "Ba", "Ba", "Ba", "Ba", "Sn", "Sn", "Ge", "Ge" ]	0.011858	-30.044238
agm002153562	[ "Ba", "H", "Ir" ]	9	3	A6B2C	Ba2H6Ir	[ [ -4.039437380196922, -4.039437380196922, 0 ], [ -4.039437380196922, 0, -4.039437380196922 ], [ 0, -4.039437380196922, -4.039437380196922 ] ]	[ [ -4.039437380196922, -1.7187491784509716, -4.039437380196922 ], [ -1.7187491784509712, -4.039437380196923, -4.039437380196922 ], [ -4.039437380196922, -4.039437380196922, -1.7187491784509716 ], [ -4.039437380196922, -6.360125581942874, -4.039437380196922 ...	[ "H", "H", "H", "H", "H", "H", "Ir", "Ba", "Ba" ]	0	-38.031045
agm003463259	[ "Ba", "H", "N" ]	7	3	A4B2C	Ba4H2N	[ [ 6.86727651, 0, 0 ], [ 0, 6.86727651, 0 ], [ -3.433638255, -3.433638255, 5.40936871 ] ]	[ [ 1.9445656573595527, 1.9445656573595522, 1.42899255346489 ], [ 4.922710852640447, 4.922710852640447, 1.428992553464889 ], [ 1.4890725976404466, -1.4890725976404466, 3.9803761565351095 ], [ -1.4890725976404466, 1.4890725976404466, 3.9803761565351095 ], ...	[ "Ba", "Ba", "Ba", "Ba", "H", "H", "N" ]	0.080912	-24.920422
agm006048716	[ "Ba", "Hg", "In" ]	11	3	A6B4C	BaHg6In4	[ [ 0, 0, -4.78328349 ], [ -4.336973311962608, -7.5118581273895035, 0 ], [ -4.336973311962608, 7.5118581273895035, 0 ] ]	[ [ -4.336973311962609, 2.503952709129835, 0 ], [ -1.8465899479377372, 0.5498545186198056, -2.391641745 ], [ -3.889866319504156, 5.637737062792537, -2.391641745 ], [ -4.336973311962608, -2.5039527091298344, 0 ], [ -7.274463668445931, 1.3242665459...	[ "Ba", "In", "In", "In", "In", "Hg", "Hg", "Hg", "Hg", "Hg", "Hg" ]	0.029427	-16.430593
agm003507157	[ "Ba", "Hg", "Pb" ]	9	3	A6B2C	Ba2Hg6Pb	[ [ 0.0016837005530398142, 0, -6.5857249040215 ], [ 0, 6.992775066464034, 0 ], [ 6.057002117137977, -3.496387533232017, 0 ] ]	[ [ 2.0222212847909122, 3.496387533232017, -1.1458511980521875 ], [ 4.036464532900106, 2.1033145938919855e-16, -5.439873705969313 ], [ 1.1045785814716393, 5.085108756841542, -4.362325761043944 ], [ 3.8389822984633333, 3.4963875332320176, -4.370035405760085 ...	[ "Ba", "Ba", "Hg", "Hg", "Hg", "Hg", "Hg", "Hg", "Pb" ]	0	-12.969545
agm005727053	[ "Ba", "Hg", "Pb" ]	12	3	A3B2C	Ba3Hg2Pb	[ [ 5.99181669688031, 0, 0 ], [ 0.006863582617884925, 0, -8.519420560919839 ], [ 2.995908348440155, 9.024753300000015, 0 ] ]	[ [ 5.9918028206450025, 3.011652860426399, -2.1250650960195827 ], [ 5.996672626748868, 9.024753300000015, -6.38724055601301 ], [ 3.002785807293348, 6.013100439573616, -6.394355464900256 ], [ 5.998694155733503, 3.0116528604263975, -6.394355464900256 ], [ ...	[ "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Hg", "Hg", "Hg", "Hg", "Pb", "Pb" ]	0.033802	-26.631823
agm003679496	[ "Ba", "Hg", "Sn" ]	13	3	A7B5C	BaHg7Sn5	[ [ 3.448774387403774, 0, -5.602033596931078 ], [ 6.0939289653066355, 5.434696063063444, 0 ], [ 6.0939289653066355, -5.434696063063444, 0 ] ]	[ [ 12.106226595355823, -1.2125260404964423e-15, -0.04421416220445087 ], [ 4.820001262507248, -2.6609756140253453, -2.7557775201331864 ], [ 6.549820470711858, -2.680172373541062, -5.570448603247212 ], [ 4.8200012625072475, 2.6609756140253435, -2.755777520133...	[ "Ba", "Sn", "Sn", "Sn", "Sn", "Sn", "Hg", "Hg", "Hg", "Hg", "Hg", "Hg", "Hg" ]	0.075166	-25.115898
agm005799904	[ "Ba", "Hg", "Sr" ]	14	3	A5BC	BaHgSr5	[ [ 0, -4.22719793, 0 ], [ -10.279549854494638, 0, 0 ], [ 1.4039869158455391, 0, -16.294859016477126 ] ]	[ [ -4.844931772806393, -1.0567994825, -10.089496268478962 ], [ -4.030631165842706, -3.1703984475, -6.205362747998164 ], [ -8.49722511480988, -1.0567994825, -11.623235696877527 ], [ -8.891758002455289, -3.1703984475, -1.0818531682796555 ], [ -7.82615...	[ "Ba", "Ba", "Sr", "Sr", "Sr", "Sr", "Sr", "Sr", "Sr", "Sr", "Sr", "Sr", "Hg", "Hg" ]	0.051984	-22.833925
agm003511182	[ "Ba", "Hg", "Tl" ]	10	3	A7B2C	Ba2HgTl7	[ [ 5.24416591, 0, 0 ], [ 0, 5.24416591, 0 ], [ 0, 0, 12.54414609 ] ]	[ [ 2.622082955, 0, 9.483275094402966 ], [ 0, 2.622082955, 3.0608709955970332 ], [ 0, 2.622082955, 10.933765996521151 ], [ 2.622082955, 0, 4.5707269436446785 ], [ 2.622082955, 0, 1.6103800934788484 ], [ 0, 2.622082955, 7.97341...	[ "Ba", "Ba", "Tl", "Tl", "Tl", "Tl", "Tl", "Tl", "Tl", "Hg" ]	0.042423	-23.001624
agm002926216	[ "Ba", "In", "Ir" ]	5	3	A2B2C	BaIn2Ir2	[ [ 4.63216042, 0, 0 ], [ 0, 4.63216042, 0 ], [ -2.31608021, -2.31608021, 5.60857083 ] ]	[ [ 2.31608021, 2.31608021, 1.233655462938845 ], [ 4.8330753521696555e-18, 4.8330753521696555e-18, 4.3749153670611545 ], [ 0, 0, 0 ], [ -9.347632612399792e-17, 2.31608021, 2.8042854149999994 ], [ 2.31608021, -9.347632612399792e-17, 2.80428541...	[ "Ir", "Ir", "Ba", "In", "In" ]	0.02159	-26.494189
agm003747322	[ "Ba", "In", "Rh" ]	12	3	A4BC	BaIn4Rh	[ [ -5.09164066, 0, 0 ], [ 0, 0, -7.00840549 ], [ 2.54582033, -9.57260209, 0 ] ]	[ [ -2.54582033, -1.9485611653881647, -5.2563041175 ], [ -9.205213224892076e-17, -7.624040924611835, -1.7521013725 ], [ -2.5458203300000006, -5.6193021780503365, -3.452313562012863 ], [ -1.0206017840962998e-16, -3.953299911949664, -3.556091927987137 ], [...	[ "Ba", "Ba", "In", "In", "In", "In", "In", "In", "In", "In", "Rh", "Rh" ]	0.090401	-44.390966
agm005753809	[ "Ba", "Ir", "O" ]	12	3	A4BC	BaIrO4	[ [ -3.7074594509700463, -5.018090713497907, 0 ], [ -3.7074594509700463, 5.018090713497907, 0 ], [ 2.461291348321518, 0, -5.769205879983173 ] ]	[ [ -1.8614909397289083, -1.4789433370525578, -4.32690440998738 ], [ -3.0921366138896667, 1.4789433370525589, -1.4423014699957926 ], [ -3.0921366138896667, -5.002732345060177, -1.4423014699957926 ], [ -1.861490939728908, 5.002732345060178, -4.32690440998738 ...	[ "Ba", "Ba", "Ir", "Ir", "O", "O", "O", "O", "O", "O", "O", "O" ]	0.036187	-78.073554
agm005810082	[ "Ba", "K", "Pd" ]	9	3	A6B2C	Ba6K2Pd	[ [ 2.64155995610834, 4.587416515959404, 7.489142192316971 ], [ -2.64155995610834, 4.587416515959404, -7.489142192316971 ], [ -7.941918619074473, -4.587416515959404, 0 ] ]	[ [ -2.648196159095585, 4.587416515959404, -1.8700647927449556 ], [ -5.293722459978886, 2.0970293115387002e-15, 1.8700647927449552 ], [ -7.88114463661791, 1.646371662770364e-16, -5.57104578612159 ], [ -6.585468060294446, -2.240453260765086, -1.91462496411497...	[ "K", "K", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Pd" ]	0.0463	-19.930629
agm003172138	[ "Ba", "K", "Sr" ]	4	3	A2BC	BaKSr2	[ [ 4.243858243197234, 0, 0 ], [ 0, 7.0335933, 0 ], [ -1.4016635025494222, 0, 8.096405001244449 ] ]	[ [ 2.283239966527863, 0, 6.109157776858501 ], [ 0.5589547741199493, 0, 1.987247224385948 ], [ -0.7008317512747111, 3.51679665, 4.048202500622224 ], [ 2.121929121598617, 3.51679665, 0 ] ]	[ "Sr", "Sr", "K", "Ba" ]	0.082837	-6.069336
agm003041281	[ "Ba", "La", "Tl" ]	6	3	ABC	BaLaTl	[ [ 0, -4.219533922693473, 0 ], [ -0.006861260870143139, 0, 5.9209974611985 ], [ -9.464451444927771, 2.1097669613467365, 0 ] ]	[ [ -7.632608676612456, 4.724633395062882e-17, 1.4872198003508468 ], [ -1.8387040291854617, -2.109766961346737, 4.433777660847653 ], [ -8.099089176788105, -2.1097669613467365, 4.444919024140467 ], [ -1.3722235290098077, 1.97506946414817e-18, 1.47607843705803...	[ "Tl", "Tl", "Ba", "Ba", "La", "La" ]	0.066962	-19.938736
agm003620357	[ "Ba", "Li", "Na" ]	8	3	A2BC	BaLiNa2	[ [ -6.158093416184427, 0, 0 ], [ 2.914682776605583, 0, -5.447735979491549 ], [ 0, -9.76696324, 0 ] ]	[ [ -1.5407433063520617, -2.44174081, -2.779043313474382 ], [ -1.7026673332267828, -7.32522243, -2.668692666017167 ], [ 1.3815867098480876, -5.51782419977961, -4.526136327899307 ], [ -4.624997349426932, -4.249139040220391, -0.9215996515922419 ], [ 1....	[ "Ba", "Ba", "Na", "Na", "Na", "Na", "Li", "Li" ]	0.094545	-12.312716
agm003302730	[ "Ba", "Li", "Na" ]	19	3	A15B2C2	Ba2Li15Na2	[ [ 5.338272672930458, 3.082053164724023, 5.220829487600787 ], [ -5.338272672930458, 3.082053164724023, 5.220829487600787 ], [ 0, -6.164106329448046, 5.220829487600787 ] ]	[ [ 8.807479558340819e-17, -9.099535415316633e-16, 5.454276476557291 ], [ -4.578749486977685e-16, 4.658643316816006e-16, 10.208211986245068 ], [ 2.559310941693784e-16, -5.552953913226841e-16, 1.5414028143321525 ], [ -1.5506429127106773e-15, 8.137789213357038e-16...	[ "Ba", "Ba", "Na", "Na", "Li", "Li", "Li", "Li", "Li", "Li", "Li", "Li", "Li", "Li", "Li", "Li", "Li", "Li", "Li" ]	0.035468	-34.598088
agm003586986	[ "Ba", "Na", "Pb" ]	12	3	A8B3C	Ba3NaPb8	[ [ -3.388903289952948, -5.869752680135827, 0 ], [ -6.777806579905896, 0, 0 ], [ -3.388903289952948, -1.9565842267119424, -10.76105265 ] ]	[ [ -6.777806579905895, -3.9131684534238844, -1.3554260346570968 ], [ -3.388903289952948, -1.9565842267119427, -10.609204189329533 ], [ -6.777806579905896, -3.9131684534238853, -5.489256861859813 ], [ -3.388903289952948, -1.9565842267119427, -6.6223821469784...	[ "Ba", "Ba", "Ba", "Na", "Pb", "Pb", "Pb", "Pb", "Pb", "Pb", "Pb", "Pb" ]	0.003286	-41.339231
agm006009633	[ "Ba", "O", "Sr" ]	8	3	A4B3C	Ba3O4Sr	[ [ 0, 0, -3.8977427 ], [ -3.9013457643775, -5.522746193106696, 0 ], [ -3.9013457643775, 5.522746193106696, 0 ] ]	[ [ 0, 0, -1.94887135 ], [ -5.8520186465662505, 2.761373096553348, 0 ], [ -3.9013457643775, 0, -1.94887135 ], [ -5.8520186465662505, -2.761373096553348, 0 ], [ -1.8751482900744738, 1.0650983279666165e-16, 0 ], [ -3.9013457643775, ...	[ "Sr", "Ba", "Ba", "Ba", "O", "O", "O", "O" ]	0.027895	-47.378927
agm005758333	[ "Ba", "P", "Rh" ]	9	3	A6B2C	Ba6P2Rh	[ [ 0, 4.645645660894461, 0 ], [ 2.541197322316746, 0, -9.188797013336455 ], [ -10.363105657815264, -2.3228228304472305, 0 ] ]	[ [ -2.9142606868864274, 2.3228228304472305, -0.9583423684269723 ], [ -8.2269846666985, 2.322822830447231, -7.096306147417332 ], [ -5.6577520162496295, -5.440986780616624e-17, -3.9639785750155982 ], [ 0.40507633119998016, 2.8721590574569514e-18, -2.092490865...	[ "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "P", "P", "Rh" ]	0.024697	-35.164624
agm005933005	[ "Ba", "Pb", "Tl" ]	16	3	A5B2C	Ba5PbTl2	[ [ 8.982561278391964, 0, 0 ], [ 0, 8.982561278391964, 0 ], [ -4.491280639195982, -4.491280639195982, 9.003819796453374 ] ]	[ [ -2.918265556674355, -1.5730150825216274, 6.35783584953853 ], [ 1.5730150825216267, 2.918265556674355, 2.645983946914845 ], [ 4.491280639195982, 4.491280639195982, 0 ], [ 0, 0, 0 ], [ 2.9182655566743545, 1.573015082521627, 6.35783584953853...	[ "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Tl", "Tl", "Tl", "Tl", "Pb", "Pb" ]	0.03797	-42.227051
agm003346697	[ "Ba", "Pd", "Tl" ]	20	3	A5B3C2	Ba2Pd5Tl3	[ [ 0, 0, 6.50530033 ], [ 5.686803653827525, 6.769825368313961, 3.252650165 ], [ -5.686803653827525, 6.769825368313961, 3.252650165 ] ]	[ [ 2.6802878063913926, 8.48101205703198, 9.757950495 ], [ -2.680287806391392, 8.48101205703198, 6.50530033 ], [ -2.6802878063913926, 5.058638679595941, 3.252650165 ], [ 2.680287806391392, 5.058638679595941, 6.50530033 ], [ -1.113761519226777, 4....	[ "Ba", "Ba", "Ba", "Ba", "Tl", "Tl", "Tl", "Tl", "Tl", "Tl", "Pd", "Pd", "Pd", "Pd", "Pd", "Pd", "Pd", "Pd", "Pd", "Pd" ]	0.026109	-81.900086
agm003391993	[ "Ba", "Pd", "Zn" ]	10	3	A2B2C	Ba2Pd2Zn	[ [ 5.267650029947263, 3.138708112869834, 0 ], [ 5.267650029947263, -3.138708112869834, 0 ], [ 1.928987218572927, 0, -8.270566442438154 ] ]	[ [ 3.9649220464788506, 0.827804572590671, -1.2402404972733958 ], [ 7.534871622702139, 0.8278045725906712, -2.8950427239456813 ], [ 8.499365231988602, -0.8278045725906701, -7.030325945164758 ], [ 4.929415655765315, -0.8278045725906702, -5.375523718492472 ]...	[ "Ba", "Ba", "Ba", "Ba", "Zn", "Zn", "Pd", "Pd", "Pd", "Pd" ]	0.075387	-35.994147
agm002182941	[ "Ba", "S", "Ta" ]	12	3	A7B3C2	Ba3S7Ta2	[ [ 4.8608455984665175, 0, 0 ], [ 0, 4.8608455984665175, 0 ], [ -2.4304227992332588, -2.4304227992332588, 12.760351185227103 ] ]	[ [ 2.4304227992332588, 2.4304227992332588, 0 ], [ 2.4304227992332588, 2.4304227992332588, 4.977007691593792 ], [ -7.431583688258367e-17, -7.431583688258367e-17, 7.783343493633311 ], [ 2.4304227992332588, 1.9881712752055285e-17, 2.442887312957118 ], [ ...	[ "S", "S", "S", "S", "S", "S", "S", "Ba", "Ba", "Ba", "Ta", "Ta" ]	0.032878	-77.022178
agm002628553	[ "Ba", "Sr", "Zn" ]	5	3	A3BC	BaSr3Zn	[ [ 6.332690239999999, 0, 0 ], [ 0, 6.332690239999999, 0 ], [ 0, 0, 6.332690239999999 ] ]	[ [ 0, 3.1663451199999995, 0 ], [ 0, 0, 3.1663451199999995 ], [ 3.1663451199999995, 0, 0 ], [ 0, 0, 0 ], [ 3.1663451199999995, 3.1663451199999995, 3.1663451199999995 ] ]	[ "Sr", "Sr", "Sr", "Zn", "Ba" ]	0.057343	-8.376186
agm006039189	[ "Ba", "Te", "Tl" ]	14	3	A4B2C	Ba2Te4Tl	[ [ 0, -6.645132, 0 ], [ -8.626788800015014, 0, 0 ], [ 2.9853014782756504, 0, -9.678204567806292 ] ]	[ [ 0.6591445535336417, -1.661283, -9.011219776516576 ], [ -6.300631875273004, -4.983849, -0.6669847912897165 ], [ -4.7862941431844845, -4.983849, -5.397159076346292 ], [ -0.8551931785548786, -1.661283, -4.2810454914600005 ], [ -4.311567580689025, ...	[ "Ba", "Ba", "Ba", "Ba", "Tl", "Tl", "Te", "Te", "Te", "Te", "Te", "Te", "Te", "Te" ]	0.085711	-51.740048
agm005859114	[ "Be", "Br", "Cs" ]	14	3	A4B2C	BeBr4Cs2	[ [ 0, -7.4872836699999965, 0 ], [ -7.518231458233174, 0, 0 ], [ 1.9771913943931867, 0, -9.99667611298282 ] ]	[ [ -3.237431856103272, -5.615462752499997, -9.651144701907736 ], [ -2.303608207736715, -1.8718209174999991, -0.34553141107508367 ], [ -5.18208659141394, -1.8718209174999991, -6.1107317864430915 ], [ -0.3589534724260466, -5.615462752499997, -3.88594432653972...	[ "Cs", "Cs", "Cs", "Cs", "Be", "Be", "Br", "Br", "Br", "Br", "Br", "Br", "Br", "Br" ]	0	-45.594652
agm2000102806	[ "Be", "Cl", "Rb" ]	10	3	A3BC	BeCl3Rb	[ [ 0, 6.800487900000113, 0 ], [ 0, 0, 11.99114667000297 ], [ 16.23936387, 0, 0 ] ]	[ [ 8.119681935, 3.4002439500000565, 9.27580474727201 ], [ 8.119681935, 0, 3.280231412270525 ], [ 8.119681935, 3.4002439500000565, 5.279443109857168 ], [ 8.119681935, 0, 11.275016444858654 ], [ 8.73936339357538, 4.949650179921211, 6.223499492...	[ "Rb", "Rb", "Be", "Be", "Cl", "Cl", "Cl", "Cl", "Cl", "Cl" ]	0.081351	-36.601621
agm006107605	[ "Be", "Co", "Er" ]	8	3	A4B3C	BeCo3Er4	[ [ 3.84775955, 0, 0 ], [ 0, 3.946426750000001, 0 ], [ 0, 0, 10.24356311 ] ]	[ [ 1.923879775, 1.9732133750000005, 9.701940037211566 ], [ 1.923879775, 0, 4.490921170000647 ], [ 0, 0, 5.756462379296857 ], [ 0, 1.9732133750000005, 0.5318388310482839 ], [ 1.923879775, 1.9732133750000005, 6.550161204244424 ], [ 1.9...	[ "Be", "Co", "Co", "Co", "Er", "Er", "Er", "Er" ]	0.04187	-44.894421
agm005789368	[ "Be", "Co", "Pd" ]	6	3	A3B2C	Be3CoPd2	[ [ 2.75192463, 0, 0 ], [ 0, 2.75192463, 0 ], [ 0, 0, 8.26174703 ] ]	[ [ 0, 0, 0 ], [ 0, 0, 5.277044765107539 ], [ 0, 0, 2.9847022648924613 ], [ 1.375962315, 1.375962315, 4.130873515 ], [ 1.375962315, 1.375962315, 6.827049218631836 ], [ 1.375962315, 1.375962315, 1.4346978113681648 ] ]	[ "Be", "Be", "Be", "Co", "Pd", "Pd" ]	0	-31.764895
agm005980963	[ "Be", "Co", "Ti" ]	8	3	A4B3C	Be3CoTi4	[ [ 2.9823738099999995, 0, 0 ], [ 0, 4.141900930000001, 0 ], [ 0, 0, 8.27271753 ] ]	[ [ 1.4911869049999997, 0, 2.06387194393648 ], [ 1.4911869049999997, 2.0709504650000006, 4.136358765 ], [ 1.4911869049999997, 0, 6.20884558606352 ], [ 1.4911869049999997, 2.0709504650000006, 0 ], [ 0, 0, 4.136358765 ], [ 0, 2.0709...	[ "Be", "Be", "Be", "Co", "Ti", "Ti", "Ti", "Ti" ]	0.025282	-51.447831
agm005634197	[ "Be", "Cu", "Pd" ]	9	3	A4B3C2	Be4Cu2Pd3	[ [ -1.9864042141037799, -3.4405530231966726, 0 ], [ -1.9864042141037799, 3.4405530231966726, 0 ], [ 0, 0, -7.438311577518478 ] ]	[ [ -1.98640421410378, 1.1468510077322243, -0.7356011122900195 ], [ 0, 0, -4.964757667965814 ], [ 0, 0, -2.4735539095526655 ], [ -1.9864042141037799, -1.1468510077322238, -6.702710465228459 ], [ -1.9864042141037799, -1.1468510077322245, -1.57...	[ "Be", "Be", "Be", "Be", "Cu", "Cu", "Pd", "Pd", "Pd" ]	0.092296	-41.630116
agm006136481	[ "Be", "Cu", "Tm" ]	12	3	A6B5C	BeCu5Tm6	[ [ -4.827566225127029, 0, 0 ], [ 0, -6.7959635911852985, 0 ], [ 2.4088814234645386, 0, 7.23632553187606 ] ]	[ [ 0, 0, 0 ], [ -2.414730866905353, -1.6925012962438302, 4.831939941432433 ], [ -2.414730866905353, -5.103462294941468, 4.831939941432433 ], [ -2.4137831125635145, -5.1038086172460755, 0 ], [ -2.4137831125635145, -1.692154973939223, 0 ], ...	[ "Be", "Tm", "Tm", "Tm", "Tm", "Tm", "Tm", "Cu", "Cu", "Cu", "Cu", "Cu" ]	0.031886	-53.795172
agm001270333	[ "Be", "Er", "Ir" ]	3	3	ABC	BeErIr	[ [ -1.9542186202301166, -3.3848059393357106, 0 ], [ -1.9542186202301166, 3.3848059393357106, 0 ], [ 0, 0, -3.93964681 ] ]	[ [ -1.954218620230117, 1.1282686464452365, 0 ], [ 0, 0, 0 ], [ -1.9542186202301166, -1.1282686464452372, -1.969823405 ] ]	[ "Be", "Ir", "Er" ]	0.026253	-19.21168
agm005838364	[ "Be", "I", "Sn" ]	6	3	A4BC	BeI4Sn	[ [ 7.0205749846461085, 0, 0 ], [ 0, 7.0205749846461085, 0 ], [ -3.5102874923230543, -3.5102874923230543, 5.684071079068492 ] ]	[ [ 3.510287492323054, 0, 2.842035539534246 ], [ 3.5102874923230543, 3.5102874923230543, 0 ], [ 5.087519723642796, 1.2863901693733109, 1.513596906945321 ], [ 1.9330552610033123, 5.7341848152727986, 1.513596906945321 ], [ 2.223897322949744, 1.5772...	[ "Be", "Sn", "I", "I", "I", "I" ]	0.083853	-16.656147
agm003302089	[ "Be", "Mn", "Ni" ]	19	3	A15B2C2	Be15Mn2Ni2	[ [ 3.6413244348394698, 2.10231964266133, 3.579186294500718 ], [ -3.6413244348394698, 2.10231964266133, 3.579186294500718 ], [ 0, -4.20463928532266, 3.579186294500718 ] ]	[ [ 4.075959854849894e-16, -4.618847503247901e-16, 3.7550841164368896 ], [ -2.054618741005412e-16, 9.28693484805658e-16, 6.982474767065264 ], [ -1.8206622174197349, 3.153479463991995, 5.368779441751077 ], [ -1.3475607425629883e-16, -2.10231964266133, 1.78959...	[ "Mn", "Mn", "Be", "Be", "Be", "Be", "Be", "Be", "Be", "Be", "Be", "Be", "Be", "Be", "Be", "Be", "Be", "Ni", "Ni" ]	0.092695	-88.614096
agm005597360	[ "Be", "Nb", "Ti" ]	9	3	A6B2C	Be6Nb2Ti	[ [ 0, 0, -2.97844875 ], [ -3.184170983425116, -5.515145923278858, 0 ], [ -3.184170983425116, 5.515145923278858, 0 ] ]	[ [ 0, 0, 0 ], [ -2.117490771134174, -5.109619759071659e-16, -1.489224375 ], [ -4.250851195716058, -8.213056536430219e-16, -1.489224375 ], [ -2.125425597858029, -3.681345123197563, -1.489224375 ], [ -5.309596581283144, -1.8338008000812942, -1...	[ "Ti", "Be", "Be", "Be", "Be", "Be", "Be", "Nb", "Nb" ]	0.039132	-52.081691
agm005826926	[ "Be", "Nb", "Zr" ]	6	3	A4BC	Be4NbZr	[ [ 3.1241475742744456, 0, 0 ], [ 0, 3.7308627961190886, 0 ], [ 0, 0, 6.496778977149185 ] ]	[ [ 1.5620737871372228, 1.8654313980595443, 0 ], [ 0, 1.8654313980595443, 4.29116396385691 ], [ 0, 1.8654313980595443, 2.2056150132922743 ], [ 0, 0, 1.1376123108536786 ], [ 0, 0, 5.359166666295506 ], [ 1.5620737871372228, 0, 3...	[ "Zr", "Be", "Be", "Be", "Be", "Nb" ]	0.059533	-34.562195
agm005844632	[ "Be", "Os", "Sc" ]	6	3	A3B2C	BeOs3Sc2	[ [ 4.268323964970967, 2.6008257554476137, 0 ], [ 4.268323964970967, -2.6008257554476137, 0 ], [ 2.665556500379993, 0, -4.232111132495101 ] ]	[ [ 6.994053225833947, -1.039740147920297e-16, -2.6402986835719995 ], [ 4.208151204487979, -7.048287670485955e-18, -1.5918124489231011 ], [ 0, 0, 0 ], [ 6.40248594745645, 1.3004128777238069, 0 ], [ 6.40248594745645, -1.3004128777238069, 0 ]...	[ "Sc", "Sc", "Be", "Os", "Os", "Os" ]	0.025529	-52.285871
agm002646562	[ "Be", "Os", "V" ]	4	3	A2BC	BeOs2V	[ [ -2.93296458, -2.93296458, 0 ], [ -2.93296458, 0, -2.93296458 ], [ 0, -2.93296458, -2.93296458 ] ]	[ [ 0, 0, 0 ], [ -4.39944687, -4.39944687, -4.39944687 ], [ -1.46648229, -1.4664822900000003, -1.4664822900000003 ], [ -2.93296458, -2.93296458, -2.93296458 ] ]	[ "Be", "Os", "Os", "V" ]	0.034912	-36.330562
agm001272303	[ "Be", "Rh", "Sm" ]	3	3	ABC	BeRhSm	[ [ -1.9710328570088376, -3.4139290517269485, 0 ], [ -1.9710328570088376, 3.4139290517269485, 0 ], [ 0, 0, -4.11502666 ] ]	[ [ -1.9710328570088378, 1.1379763505756495, -2.05751333 ], [ 0, 0, -2.05751333 ], [ -1.9710328570088378, -1.13797635057565, 0 ] ]	[ "Be", "Rh", "Sm" ]	0.039126	-17.448332
agm005010117	[ "In", "O", "Pr", "S" ]	10	4	A2BCD	InO2PrS	[ [ 0, -4.19697817, 0 ], [ -7.123899285757164, 0, 0 ], [ 3.198625476163547, 0, -6.694387609336596 ] ]	[ [ -5.0944839439441285, -3.1477336275, -0.30698995505531335 ], [ 1.1692101343505121, -1.0492445425000005, -6.3873976542812825 ], [ 0.2995529796151825, -3.1477336275, -3.602534149338039 ], [ -4.224826789208799, -1.0492445425000005, -3.091853459998557 ], ...	[ "Pr", "Pr", "In", "In", "S", "S", "O", "O", "O", "O" ]	0.062509	-63.932753
agm003584053	[ "Bi", "Br", "S" ]	11	3	A7B3C	Bi3Br7S	[ [ 0, 0, -7.15343627 ], [ -4.171090371342065, -7.224540446125792, 0 ], [ -4.171090371342065, 7.224540446125792, 0 ] ]	[ [ -2.1601740426187606, -3.5691832324148116, -1.6119818683303608 ], [ -4.171090371342065, -0.0861739812961708, -1.6119818683303608 ], [ -6.1820067000653705, -3.569183232414811, -1.6119818683303608 ], [ -4.171090371342065, -2.408180148708598, -3.054280794686...	[ "Bi", "Bi", "Bi", "S", "Br", "Br", "Br", "Br", "Br", "Br", "Br" ]	0.010628	-34.979788
agm002203826	[ "Bi", "Ca", "Ni" ]	8	3	A2BC	Bi2CaNi	[ [ 4.5693178, 0, 0 ], [ 0, 4.5693178, 0 ], [ 0, 0, 9.77318083 ] ]	[ [ 2.2846589, 2.2846589, 0 ], [ 0, 0, 0 ], [ 0, 2.2846589, 2.2641427365098448 ], [ 2.2846589, 0, 7.509038093490155 ], [ 2.2846589, 0, 1.3806669313031215 ], [ 0, 2.2846589, 8.392513898696878 ], [ 0, 0, 4.886590...	[ "Ni", "Ni", "Ca", "Ca", "Bi", "Bi", "Bi", "Bi" ]	0.043731	-34.137805
agm005887212	[ "Bi", "Ca", "Pd" ]	12	3	A9B2C	BiCa2Pd9	[ [ 4.12937188, 0, 0 ], [ 0, 4.12937188, 0 ], [ 0, 0, 12.3865546 ] ]	[ [ 0, 0, 4.143884310169562 ], [ 0, 0, 8.242670289830437 ], [ 0, 0, 0 ], [ 2.06468594, 2.06468594, 0 ], [ 2.06468594, 2.06468594, 4.084820882542652 ], [ 2.06468594, 2.06468594, 8.301733717457347 ], [ 2.06468594, 0,...	[ "Ca", "Ca", "Bi", "Pd", "Pd", "Pd", "Pd", "Pd", "Pd", "Pd", "Pd", "Pd" ]	0.035583	-59.777145
agm002967720	[ "Bi", "Cd", "In" ]	10	3	A2B2C	BiCd2In2	[ [ 0, 0, 3.47078066 ], [ 8.80694014, 0, 0 ], [ 0, 8.80694014, 0 ] ]	[ [ 3.329829912498021, 7.733299982498021, 0 ], [ 7.733299982498021, 5.477110227501979, 0 ], [ 5.477110227501979, 1.073640157501979, 0 ], [ 1.073640157501979, 3.329829912498021, 0 ], [ 0, 0, 0 ], [ 4.40347007, 4.40347007, 0 ]...	[ "Cd", "Cd", "Cd", "Cd", "Bi", "Bi", "In", "In", "In", "In" ]	0.084785	-21.676127
agm005907065	[ "Bi", "Cd", "Sb" ]	10	3	A3BC	BiCd3Sb	[ [ 0, -6.229214470000105, 0 ], [ -6.480417155949016, 0, 0 ], [ 0.6416705719360094, 0, -6.838787433388369 ] ]	[ [ -4.7756621719943215, -1.5573036175000263, -4.409460565861167 ], [ -1.9027589090381705, -1.5573036175000263, -5.66598770528613 ], [ 0, 0, 0 ], [ -1.063084412018685, -4.671910852500079, -2.429326867527201 ], [ -3.935987674974836, -4.67191085250...	[ "Cd", "Cd", "Cd", "Cd", "Cd", "Cd", "Bi", "Bi", "Sb", "Sb" ]	0.084127	-20.93923
agm006006689	[ "Bi", "Ce", "Rh" ]	16	3	A5B2C	Bi2Ce5Rh	[ [ 0, 0, 4.67044975 ], [ 7.98707587, 0, 0 ], [ 0, 12.58651529, 0 ] ]	[ [ 0, 6.293257644999999, 0 ], [ 3.9935379349999995, 0, 0 ], [ 7.021551094957526, 2.4591999274667713, 0 ], [ 0.9655247750424728, 10.127315362533228, 0 ], [ 4.959062710042473, 8.752457572466772, 0 ], [ 3.0280131599575264, 3.8340577...	[ "Ce", "Ce", "Ce", "Ce", "Ce", "Ce", "Ce", "Ce", "Ce", "Ce", "Bi", "Bi", "Bi", "Bi", "Rh", "Rh" ]	0.022546	-98.919788
agm001268766	[ "Bi", "Cs", "Rb" ]	3	3	ABC	BiCsRb	[ [ 0, 0, -3.80666902 ], [ -3.1770264951690432, -5.502771306625261, 0 ], [ -3.1770264951690432, 5.502771306625261, 0 ] ]	[ [ 0, 0, -3.0973418139511697 ], [ -3.1770264951690432, -1.8342571022084204, -1.2556053754985816 ], [ -3.1770264951690437, 1.8342571022084206, -3.260390850550249 ] ]	[ "Cs", "Bi", "Rb" ]	0.095889	-6.489352
agm005804565	[ "Bi", "Ga", "La" ]	18	3	A6B2C	BiGa2La6	[ [ 4.993592880060746, 5.173084595228141, 5.640177528178624 ], [ 4.993592880060746, -5.173084595228141, -5.640177528178624 ], [ -4.993592880060746, 5.173084595228141, -5.640177528178624 ] ]	[ [ -2.1790415412180506, 3.2076966023034887, -5.640177528178624 ], [ 7.172634421278796, 1.9653879929246518, 5.749554626671167e-16 ], [ 2.1790415412180515, 3.2076966023034887, -5.640177528178624 ], [ 2.814551338842694, 1.965387992924652, 4.1840908879818396e-1...	[ "La", "La", "La", "La", "La", "La", "La", "La", "La", "La", "La", "La", "Ga", "Ga", "Ga", "Ga", "Bi", "Bi" ]	0.056521	-87.556542
agm003529767	[ "Bi", "H", "K" ]	11	3	A8B2C	Bi2HK8	[ [ 0, 6.14077232, 0 ], [ 1.9563527289558749, 0, -7.653814612813946 ], [ -10.521914144061029, -3.07038616, 0 ] ]	[ [ -8.285483073532978, 1.5677119513632988e-15, -1.399757705891044 ], [ -2.822279965030704, 3.0703861600000004, -3.121021624946096 ], [ -4.158345821340694, 3.0703861600000004, -6.626268264210175 ], [ -8.60000615435526, 3.0703861599999995, -5.587672868831343 ...	[ "K", "K", "K", "K", "K", "K", "K", "K", "Bi", "Bi", "H" ]	0.087373	-22.413508
agm005751751	[ "Bi", "Hg", "La" ]	8	3	A6BC	BiHg6La	[ [ 5.43958805, 0, 0 ], [ 0, 6.633382893031533, 0 ], [ 0, -3.3166914465157666, 6.140588672670048 ] ]	[ [ 2.719794025, 3.316691446515767, 4.1579436487462385 ], [ 2.719794025, 1.702145187661536, 1.050010758359743 ], [ 2.719794025, 4.931237705369996, 1.050010758359743 ], [ 0, -1.6346328719264487, 5.104214565199252 ], [ 0, 1.634632871926449, 5.1...	[ "La", "Hg", "Hg", "Hg", "Hg", "Hg", "Hg", "Bi" ]	0.08071	-12.29493
agm006051704	[ "Bi", "Hg", "Na" ]	9	3	A4B4C	BiHg4Na4	[ [ 0, 0, -4.811217594287242 ], [ -4.949808635078753, -4.949808635078753, -2.405608797143621 ], [ -4.949808635078753, 4.949808635078753, -2.405608797143621 ] ]	[ [ -6.602683828647472, -3.2969334415100344, -4.811217594287242 ], [ -3.296933441510036, 3.296933441510035, -4.811217594287243 ], [ -8.246742076588788, 1.6528751935687183, -7.216826391430864 ], [ -6.602683828647471, 3.296933441510035, -4.811217594287242 ],...	[ "Na", "Na", "Na", "Na", "Hg", "Hg", "Hg", "Hg", "Bi" ]	0.063535	-12.288469
agm001208710	[ "Bi", "Hg", "Pb" ]	4	3	A2BC	BiHgPb2	[ [ 0, 0, 4.59346132 ], [ 5.14945868, 0, 0 ], [ 0, 5.14945868, 0 ] ]	[ [ 0, 2.57472934, 0 ], [ 2.57472934, 0, 0 ], [ 0, 0, 2.29673066 ], [ 2.57472934, 2.57472934, 2.29673066 ] ]	[ "Pb", "Pb", "Bi", "Hg" ]	0.047412	-11.491799
agm006077843	[ "Bi", "Hg", "Pb" ]	12	3	A7B4C	Bi4HgPb7	[ [ -2.3653098159962083, -4.096836776946825, 0 ], [ -2.3653098159962083, 4.096836776946825, 0 ], [ 0, 0, -21.200249820000046 ] ]	[ [ 0, 0, -10.600124910000023 ], [ -2.3653098159962083, -1.3656122589822752, -1.8545393415641012 ], [ -2.3653098159962087, 1.3656122589822752, -19.345710478435944 ], [ -2.3653098159962083, -1.3656122589822752, -7.2141045377339035 ], [ -2.365309815996...	[ "Hg", "Bi", "Bi", "Bi", "Bi", "Pb", "Pb", "Pb", "Pb", "Pb", "Pb", "Pb" ]	0.093027	-40.763231
agm006043434	[ "Bi", "Hg", "Tl" ]	11	3	A6B4C	BiHg4Tl6	[ [ 6.660463855664735, 0, 0 ], [ 0, 6.660463855664735, 0 ], [ -3.3302319278323673, -3.3302319278323673, 7.939555400657914 ] ]	[ [ 1.9833281833166212, 4.677135672348115, 2.756576239802492 ], [ 4.677135672348115, 1.9833281833166212, 2.756576239802492 ], [ -1.3469037445157468, -1.3469037445157468, 5.182979160855423 ], [ 0, 3.3302319278323673, 0 ], [ 1.346903744515747, 1.34...	[ "Tl", "Tl", "Tl", "Tl", "Tl", "Tl", "Hg", "Hg", "Hg", "Hg", "Bi" ]	0.049765	-19.096138
agm003636868	[ "Bi", "Ho", "P" ]	4	3	A2BC	BiHo2P	[ [ -2.0735577695416856, -3.591507409275396, 0 ], [ -4.147115539083371, 0, 0 ], [ -2.0735577695416856, -1.197169136425132, -7.097320939110387 ] ]	[ [ -2.0735577695416856, -1.1971691364251322, -1.5342251704255367 ], [ -6.220673308625056, -3.591507409275396, -5.563095768684851 ], [ -4.147115539083371, -2.394338272850265, -3.548660469555195 ], [ -2.637914907518305e-16, -2.7021539876130445e-16, 0 ] ]	[ "Ho", "Ho", "Bi", "P" ]	0.091398	-23.18318
agm004479922	[ "Bi", "I", "Rb" ]	10	3	A6B3C	BiI6Rb3	[ [ -6.549965743001159, -6.549965743001159, 0 ], [ -6.549965743001159, 0, -6.549965743001159 ], [ 0, -6.549965743001159, -6.549965743001159 ] ]	[ [ -6.549965743001159, -6.549965743001158, -3.0808087440513647 ], [ -6.549965743001159, -6.549965743001159, -10.019122741950952 ], [ -10.019122741950952, -6.549965743001158, -6.549965743001158 ], [ -3.080808744051365, -6.549965743001158, -6.549965743001158 ...	[ "I", "I", "I", "I", "I", "I", "Bi", "Rb", "Rb", "Rb" ]	0.082928	-26.202869
agm005701284	[ "Bi", "K", "Rb" ]	14	3	A7B4C3	Bi4K7Rb3	[ [ 0, -6.25723197294596, 0 ], [ -9.659496156650821, -3.12861598647298, 0 ], [ -0.6792684699826843, -3.12861598647298, -11.232923609457902 ] ]	[ [ -8.383975926582796, -6.25723197294596, -5.836169590495712 ], [ -3.3687958191362486, -6.25723197294596, -9.029382552203876 ], [ -5.178941850901059, -9.38584795941894, -9.869008994606137 ], [ -1.9547887000507083, -6.25723197294596, -5.3967540189621905 ],...	[ "K", "K", "K", "K", "K", "K", "K", "Rb", "Rb", "Rb", "Bi", "Bi", "Bi", "Bi" ]	0.077948	-30.185639
agm003484188	[ "Bi", "K", "Tl" ]	9	3	A6B2C	Bi2KTl6	[ [ 5.19538958, 0, 0 ], [ 0, 5.19538958, 0 ], [ 0, 0, 11.73592176 ] ]	[ [ 0, 0, 0 ], [ 0, 2.59769479, 3.5252583591609263 ], [ 2.59769479, 0, 3.5252583591609263 ], [ 0, 2.59769479, 8.210663400839074 ], [ 2.59769479, 0, 8.210663400839074 ], [ 2.59769479, 2.59769479, 5.86796088 ], [ 0, ...	[ "K", "Tl", "Tl", "Tl", "Tl", "Tl", "Tl", "Bi", "Bi" ]	0.041412	-23.71828
agm003531983	[ "Bi", "Li", "Sb" ]	11	3	A8B2C	BiLi8Sb2	[ [ 4.5891714, 0, 0 ], [ 0, 6.781128146863382, 0 ], [ -2.2945857, -3.390564073431691, 6.897814278183964 ] ]	[ [ -1.7589093948473076e-16, 1.5563901901820534, 4.702732152486758 ], [ 2.294585699999999, 4.946954263613745, 2.1950821256972057 ], [ 2.2945857000000003, 3.390564073431692, 4.574421701431545 ], [ 8.671402158711305e-18, 1.9259503497021022, 4.455273361841228e-...	[ "Li", "Li", "Li", "Li", "Li", "Li", "Li", "Li", "Bi", "Sb", "Sb" ]	0.023211	-33.666034
agm002222721	[ "Bi", "Mn", "Tm" ]	9	3	A6B2C	Bi2MnTm6	[ [ 0, 0, -4.19862415 ], [ -4.0912512552441465, -7.086255040612806, 0 ], [ -4.0912512552441465, 7.086255040612806, 0 ] ]	[ [ -5.667026767354413, -4.356931792314959, -2.099312075 ], [ -5.667026767354413, 4.356931792314959, -2.099312075 ], [ -5.030951486267761, 1.5434025829920515e-16, -2.099312075 ], [ -7.243504338180077, -1.6263925426521442, 0 ], [ -3.152253082935931, ...	[ "Tm", "Tm", "Tm", "Tm", "Tm", "Tm", "Bi", "Bi", "Mn" ]	0.022804	-47.277599
agm003678589	[ "Bi", "Nd", "Sm" ]	12	3	A6B5C	Bi6NdSm5	[ [ 7.910852763971103, 0, 0 ], [ 2.6398899110016565, 0, -7.457465343415172 ], [ 3.9554263819855513, 6.85189542, 0 ] ]	[ [ 0, 0, 0 ], [ 9.23079771947193, 2.2718636420643143, -3.728732671707586 ], [ 7.910852763971103, 4.563142472395972, 0 ], [ 5.27537133748638, 0, -3.728732671707586 ], [ 3.9554263819855513, 2.288752947604028, 0 ], [ 5.27537133748638, ...	[ "Nd", "Sm", "Sm", "Sm", "Sm", "Sm", "Bi", "Bi", "Bi", "Bi", "Bi", "Bi" ]	0.098947	-62.806037
agm003215408	[ "Bi", "Ni", "Se" ]	14	3	A3B2C2	Bi2Ni3Se2	[ [ -5.628168741720923, -4.131729926758, 0 ], [ 5.628168741720923, -4.131729926758, 0 ], [ 0.08400861604151988, 4.131729926758, 5.959717252255046 ] ]	[ [ 2.8560886788812216, -1.8765552130952416, 2.979858626127523 ], [ -2.772080062839702, -2.2551747136627585, 2.979858626127523 ], [ 4.266949912949406, -4.131729926758, 1.2656557365081444 ], [ -4.182941296907885, 7.234952821134306e-17, 4.694061515746903 ], ...	[ "Ni", "Ni", "Ni", "Ni", "Ni", "Ni", "Bi", "Bi", "Bi", "Bi", "Se", "Se", "Se", "Se" ]	0	-67.424836
agm003368342	[ "Bi", "O", "Ti" ]	19	3	A12B5C2	Bi5O12Ti2	[ [ 0, -6.09132889, 0 ], [ -6.371988218445714, 3.045664445, 0 ], [ 2.189698060382783, 0, -7.059022753989722 ] ]	[ [ 0, -4.633816667372182, 0 ], [ 0, -1.457512222627818, 0 ], [ -2.5205318121348195, 4.3097895042274104e-17, -4.558045369691976 ], [ -3.5971059389918847, 1.6842829267960723e-17, -1.1548802644105376 ], [ 1.0948490301913916, -2.4363042025890114e-34...	[ "Ti", "Ti", "Bi", "Bi", "Bi", "Bi", "Bi", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]	0.033924	-128.15243
agm005899834	[ "Bi", "Pb", "Tl" ]	7	3	A4B2C	BiPb4Tl2	[ [ 0, 0, 3.46950735 ], [ 3.504225102941346, 0, 0 ], [ -1.752112551470673, 18.465073674870375, 0 ] ]	[ [ 6.870721855794737e-17, 7.705168539649664, 1.7347536749999999 ], [ 1.7521125514706728, 10.759905135220711, 1.7347536749999999 ], [ 1.752112551470673, 0, 0 ], [ 1.0697460102178274e-16, 2.629703836708135, 1.7347536749999999 ], [ 9.350215012627577e-1...	[ "Tl", "Tl", "Bi", "Pb", "Pb", "Pb", "Pb" ]	0.044495	-23.291462
agm003411222	[ "Bi", "Pb", "Tl" ]	12	3	A3B2C	Bi2PbTl3	[ [ 0, -5.06158845, 0 ], [ -9.094121086052873, 2.530794225, 0 ], [ 4.765920595035884, 0, -9.502861316394984 ] ]	[ [ -4.800033297780439, -2.5307942249999997, -7.814662513873473 ], [ 0.4718328067634488, -3.295009617588026e-18, -1.688198802521512 ], [ -2.4031774316968524, -1.9716225613066745e-17, -8.925510130658138 ], [ -1.9250230593201387, -2.530794225, -0.5773511857368...	[ "Tl", "Tl", "Tl", "Tl", "Tl", "Tl", "Bi", "Bi", "Bi", "Bi", "Pb", "Pb" ]	0.047062	-37.038314
agm003578410	[ "Bi", "Pr", "S" ]	20	3	A6B3C	Bi3PrS6	[ [ 0, 4.04715648, 0 ], [ 3.3714615498446485, 0, -11.232387388127528 ], [ -11.72731646164261, 0, 0 ] ]	[ [ -7.952667271594003, 3.03536736, -0.4574849168459125 ], [ -0.4031876402039583, 1.01178912, -10.774902471281615 ], [ -8.3277451271138, 3.03536736, -4.871576493977764 ], [ -0.028109784684162427, 1.01178912, -6.360810894149765 ], [ -3.274846804842809...	[ "Pr", "Pr", "Bi", "Bi", "Bi", "Bi", "Bi", "Bi", "S", "S", "S", "S", "S", "S", "S", "S", "S", "S", "S", "S" ]	0.048604	-98.18111
agm003578160	[ "Bi", "Pr", "Se" ]	20	3	A6B3C	Bi3PrSe6	[ [ 0, -4.19221498, 0 ], [ -12.298686902641398, 0, 0 ], [ 3.8898642118878177, 0, -11.730253227502164 ] ]	[ [ -8.354019441343349, -1.0480537449999996, -0.4739661602711755 ], [ -0.05480324941023218, -3.1441612350000003, -11.256287067230987 ], [ -8.600640569071714, -1.0480537449999996, -5.138129389857568 ], [ 0.19181787831813227, -3.1441612350000003, -6.5921238376...	[ "Pr", "Pr", "Bi", "Bi", "Bi", "Bi", "Bi", "Bi", "Se", "Se", "Se", "Se", "Se", "Se", "Se", "Se", "Se", "Se", "Se", "Se" ]	0.008307	-89.959073
agm003484546	[ "Bi", "Rb", "Tl" ]	9	3	A6B2C	Bi2Rb6Tl	[ [ -3.220041909865521, -5.577276190388206, 0 ], [ -6.440083819731042, 0, 0 ], [ -3.220041909865521, -1.8590920634627353, -13.00789322 ] ]	[ [ -6.440083819731041, -3.7181841269254705, -9.563107816167905 ], [ -3.220041909865521, -1.8590920634627355, -5.555881141658568 ], [ -3.2200419098655213, -1.8590920634627355, -1.5222715979625614 ], [ -9.660125729596562, -5.577276190388207, -7.45201207834143...	[ "Rb", "Rb", "Rb", "Rb", "Rb", "Rb", "Tl", "Bi", "Bi" ]	0.083804	-17.88101
agm003653156	[ "Bi", "Sb", "Sm" ]	10	3	A5B4C	BiSb4Sm5	[ [ 0, 0, -6.34722558 ], [ -5.018503151737998, -5.018503151737998, -3.17361279 ], [ -5.018503151737998, 5.018503151737998, -3.17361279 ] ]	[ [ -3.046702750920975, -1.0123738082345584, -6.347225579999999 ], [ -6.030876959972556, -1.9718004008170238, -9.52083837 ], [ -4.00612934350344, 1.9718004008170233, -3.1736127899999995 ], [ -6.990303552555021, 1.0123738082345577, -6.34722558 ], [ 0,...	[ "Sm", "Sm", "Sm", "Sm", "Sm", "Bi", "Sb", "Sb", "Sb", "Sb" ]	0.020805	-55.225944
agm003772327	[ "Bi", "Sb", "Tl" ]	8	3	A6BC	BiSbTl6	[ [ 4.99052717, 0, 0 ], [ 0, 4.99052717, 0 ], [ 0, 0, 9.9903589 ] ]	[ [ 2.495263585, 2.495263585, 0 ], [ 2.495263585, 2.495263585, 4.99517945 ], [ 2.495263585, 0, 2.532351178792549 ], [ 2.495263585, 0, 7.458007721207451 ], [ 0, 2.495263585, 2.532351178792549 ], [ 0, 2.495263585, 7.458007721207...	[ "Tl", "Tl", "Tl", "Tl", "Tl", "Tl", "Bi", "Sb" ]	0.012181	-22.314661
agm006109971	[ "Bi", "Sc", "Tl" ]	12	3	A6B5C	BiSc6Tl5	[ [ -2.271608876272723, 0, 4.138417355466299 ], [ -7.513777247286088, 0, -4.138417355466299 ], [ 4.892693061779405, -7.047017165044037, 0 ] ]	[ [ -3.0167578484821314, -4.693572057449285, 1.0337369265888698 ], [ 0.745148972209408, -4.693572057449285, 3.104680428877429 ], [ -1.8756340820187232, -7.047017165044037, -1.0337360989053976 ], [ 1.8756340820187227, -7.0470171650440365, 1.0337360989053972 ...	[ "Sc", "Sc", "Sc", "Sc", "Sc", "Sc", "Tl", "Tl", "Tl", "Tl", "Tl", "Bi" ]	0.049753	-57.04264
agm005705961	[ "Bi", "Se", "Sn" ]	8	3	A2BC	Bi2SeSn	[ [ 0, -4.4218733, 0 ], [ -4.540953483142314, 0, 0 ], [ 0.6634503104843008, 0, -12.81170777932845 ] ]	[ [ -0.5223628734621646, -3.3164049749999998, -7.835972557302921 ], [ -3.355140299195848, -1.105468325, -4.97573522202553 ], [ -2.7051203751377773, -3.3164049749999998, -10.887780924780131 ], [ -1.1723827975202357, -1.105468325, -1.92392685454832 ], [ ...	[ "Sn", "Sn", "Bi", "Bi", "Bi", "Bi", "Se", "Se" ]	0.064574	-31.737091
agm003429225	[ "Bi", "Tb", "Y" ]	6	3	A3B2C	Bi3Tb2Y	[ [ 4.49079059, 0, 0 ], [ 0, 6.34604088, 0 ], [ -2.245395295, -3.17302044, 6.73744112 ] ]	[ [ 2.245395295, 3.1730204399999993, 4.490114408639152 ], [ 1.195232940285961e-17, -2.455087885513194e-16, 2.2473267113608477 ], [ -1.9480025426066308e-16, -5.359023846907007e-16, 6.737441119999999 ], [ 2.245395295, -5.132968241411163e-16, 4.495040758211685 ...	[ "Tb", "Tb", "Y", "Bi", "Bi", "Bi" ]	0.098872	-32.68308
agm005576600	[ "Bi", "Ti", "Zr" ]	16	3	A3B3C2	Bi3Ti2Zr3	[ [ 0, 0, -5.71561762 ], [ -4.253643660972988, -7.367526938098499, 0 ], [ -4.253643660972988, 7.367526938098499, 0 ] ]	[ [ -5.239403332847131, -5.6601411023600585, -1.428904405 ], [ -6.53576797819769, 1.794886717633066e-16, -1.428904405 ], [ -0.9857596718741427, -1.7073858357384404, -1.428904405 ], [ -3.267883989098845, 5.660141102360058, -4.286713215 ], [ -1.9715193...	[ "Zr", "Zr", "Zr", "Zr", "Zr", "Zr", "Ti", "Ti", "Ti", "Ti", "Bi", "Bi", "Bi", "Bi", "Bi", "Bi" ]	0.088467	-110.078941
agm005881346	[ "Br", "Ca", "N" ]	14	3	A3B3C	Br3Ca3N	[ [ 0, -3.89150725, 0 ], [ -8.220121190146982, 0, 0 ], [ 0.5174795943718302, 0, -11.267332420883212 ] ]	[ [ -5.429878058691449, -0.9728768125, -4.2494933516545705 ], [ -2.272763537083703, -2.9186304375, -7.017839069228642 ], [ -0.48882336926034126, -0.9728768125, -4.489773384442901 ], [ -7.213818226514809, -2.9186304375, -6.777559036440311 ], [ -0.5690...	[ "Ca", "Ca", "Ca", "Ca", "Ca", "Ca", "Br", "Br", "Br", "Br", "Br", "Br", "N", "N" ]	0.030025	-61.800461

agm005912441

[ "B", "Si", "Ta" ]

16

3

A5B2C

B2SiTa5

[ [ 6.2420713776242085, 0, 0 ], [ 0, 6.2420713776242085, 0 ], [ -3.1210356888121042, -3.1210356888121042, 5.8152218492283785 ] ]

[ [ 1.0450557671553509, 2.0759799216567525, 4.19864797844807 ], [ 4.166091455967455, 5.197015610468857, 1.6165738707803081 ], [ 0, 0, 0 ], [ 3.1210356888121034, 3.1210356888121034, 0 ], [ -1.0450557671553506, -2.0759799216567534, 4.1986479784...

[ "Ta", "Ta", "Ta", "Ta", "Ta", "Ta", "Ta", "Ta", "Ta", "Ta", "Si", "Si", "B", "B", "B", "B" ]

0

-166.870156

agm002338904

[ "Ba", "Br", "Ge" ]

6

3

A4BC

BaBr4Ge

[ [ 4.9543393861499085, 0, 0 ], [ -2.463519409600393, 6.475147259214868, 0 ], [ -0.0022342970255617212, -1.8243057316839988, 7.55857997027574 ] ]

[ [ 2.092941616956643, 4.646096257228703, 7.539822295878303 ], [ -0.09401223907626592, 5.559548525798846, 3.758977737597947 ], [ 2.8415303856085923, -0.05864758963927902, 6.89126431280697 ], [ -0.13212167001127192, 0.9225258752020952, 2.69591040356028 ], ...

[ "Ge", "Ba", "Br", "Br", "Br", "Br" ]

0.039859

-21.318325

agm002330493

[ "Ba", "C", "Cl" ]

6

3

ABC

BaCCl

[ [ -4.71103616947951, 0, 0 ], [ 2.3353877260063696, -4.619257472759168, 0 ], [ -0.0031226096183971258, -0.01556992895597111, 7.87488306603107 ] ]

[ [ -0.009496913870102233, -3.986571762264038, 0.004830689519196509 ], [ -2.369274139221435, -0.6482556394511004, 7.870052376511874 ], [ -2.369497028110791, -3.129854798207069, 6.1712745691269255 ], [ -0.00927402498074562, -1.50497260350807, 1.70360849690414...

[ "C", "C", "Ba", "Ba", "Cl", "Cl" ]

0.089804

-33.316747

agm005857410

[ "Ba", "Ca", "Ge" ]

12

3

A3B2C

Ba3CaGe2

[ [ 0, 0, 7.375039236769738 ], [ 7.779579964915543, 0, 0 ], [ -3.8897899824577715, 8.093268677169098, -3.687519618384869 ] ]

[ [ 2.340882574167155, 5.053491429722582, -5.44940010295211e-16 ], [ 1.5489074082906178, 3.0397772474465157, 3.6875196183848686 ], [ 6.230672556624926, 3.039777247446516, -1.0384765875924422e-16 ], [ -2.3408825741671544, 5.053491429722582, 3.687519618384868 ...

[ "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ca", "Ca", "Ge", "Ge", "Ge", "Ge" ]

0.038177

-40.025337

agm002913978

[ "Ba", "Ca", "Hg" ]

5

3

A2B2C

BaCa2Hg2

[ [ 5.0949558, 0, 0 ], [ 0, 5.0949558, 0 ], [ -2.5474779, -2.5474779, 6.99309931 ] ]

[ [ 2.220446049250313e-16, 2.5474778999999996, 3.496549655 ], [ 2.5474778999999996, 0, 3.496549655 ], [ 2.5474779, 2.5474779, 1.5037097108459239 ], [ 7.289666917614569e-17, 2.94941274101177e-16, 5.4893895991540775 ], [ 0, 0, 0 ] ]

[ "Ca", "Ca", "Hg", "Hg", "Ba" ]

0.089854

-8.383677

agm005805489

[ "Ba", "Cd", "Ge" ]

5

3

A3BC

BaCd3Ge

[ [ 4.62669117, 0, 0 ], [ 0, 4.62669117, 0 ], [ 0, 0, 6.34418416 ] ]

[ [ 2.313345585, 2.313345585, 5.540436360119361 ], [ 0, 0, 4.019535638608163 ], [ 2.313345585, 0, 2.171258519562148 ], [ 0, 2.313345585, 2.171258519562148 ], [ 0, 0, 0.4590182822966573 ] ]

[ "Ba", "Cd", "Cd", "Cd", "Ge" ]

0.026932

-10.760167

agm003510578

[ "Ba", "Cd", "In" ]

10

3

A7B2C

Ba2Cd7In

[ [ 4.78865921, 0, 0 ], [ 0, 4.78865921, 0 ], [ 0, 0, 12.8239547 ] ]

[ [ 2.394329605, 0, 9.63480041505333 ], [ 0, 2.394329605, 3.189154284946669 ], [ 0, 2.394329605, 11.072556300890174 ], [ 2.394329605, 0, 4.649168195998113 ], [ 2.394329605, 0, 1.7513983991098252 ], [ 0, 2.394329605, 8.17478650...

[ "Ba", "Ba", "Cd", "Cd", "Cd", "Cd", "Cd", "Cd", "Cd", "In" ]

0.000598

-15.8685

agm005953056

[ "Ba", "Cd", "Pd" ]

14

3

A4B2C

BaCd4Pd2

[ [ 0, 0, 4.56857053 ], [ 8.48045505, 0, 0 ], [ 0, 8.48045505, 0 ] ]

[ [ 0, 0, 2.2842852649999994 ], [ 4.240227525, 4.240227525, 0 ], [ 0.759442558683105, 2.9034768863289884, 0 ], [ 7.721012491316895, 5.576978163671011, 0 ], [ 1.3367506386710115, 4.999670083683105, 2.2842852649999994 ], [ 7.14370441132...

[ "Ba", "Ba", "Cd", "Cd", "Cd", "Cd", "Cd", "Cd", "Cd", "Cd", "Pd", "Pd", "Pd", "Pd" ]

0

-37.991532

agm005783620

[ "Ba", "Cd", "Pt" ]

12

3

A4BC

Ba4CdPt

[ [ 0, 7.751905490856776, 0 ], [ 2.5402476445890723, 0, -8.080809366995249 ], [ -9.067139961339345, -3.875952745428388, 0 ] ]

[ [ -0.5666295432069195, 4.509597027368019, -3.8153847688943068 ], [ -7.230386595837889, 0.6336442819396296, -0.22501991460331663 ], [ -5.960262773543352, -0.6336442819396298, -4.2654245981009415 ], [ 0.7034942790876169, 3.242308463488759, -7.855789452391932...

[ "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Cd", "Cd", "Pt", "Pt" ]

0.083207

-33.591818

agm002187184

[ "Ba", "Cd", "Si" ]

6

3

ABC

BaCdSi

[ [ -2.328690751273994, -4.033410696322297, 0 ], [ -2.328690751273994, 4.033410696322297, 0 ], [ 0, 0, -9.69752786 ] ]

[ [ -2.328690751273994, -1.3444702321074327, -7.273145894999999 ], [ -2.328690751273994, 1.3444702321074327, -2.4243819650000007 ], [ 0, 0, -4.84876393 ], [ 0, 0, 0 ], [ -2.3286907512739945, 1.3444702321074322, -7.273145894999999 ], [ ...

[ "Si", "Si", "Ba", "Ba", "Cd", "Cd" ]

0.036421

-18.534624

agm005790658

[ "Ba", "Cl", "Rh" ]

8

3

A6BC

Ba6ClRh

[ [ 7.89328462935872, 0, 0 ], [ 3.942224152733225, 6.8491015508012625, 0 ], [ 3.9350085449101635, 2.271727448221885, 7.5601421829753495 ] ]

[ [ 9.148133133643427, 6.9361116734553105, 5.773286777331962 ], [ 5.199028842900995, 4.456416858711994, 5.77013858292413 ], [ 6.459546637434344, 6.853290443720417, 1.7948965240720427 ], [ 10.571488484101113, 4.664412140311154, 1.7900036000512198 ], [ ...

[ "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Rh", "Cl" ]

0.053509

-25.126753

agm006089926

[ "Ba", "Cl", "Rh" ]

13

3

A8B4C

Ba8ClRh4

[ [ -4.572191706407677, -7.919268337443139, 0 ], [ -9.144383412815355, 0, 0 ], [ -4.572191706407677, -2.6397561124810465, -7.512209137567731 ] ]

[ [ -13.716575119223032, -7.919268337443139, -5.843318090239637 ], [ -4.5721917064076765, -2.6397561124810465, -1.6688910473280945 ], [ -9.144383412815356, -7.87968382186331, -5.86948596930526 ], [ -6.892568755700149, -6.579598023412702, -1.6427231682624728 ...

[ "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Rh", "Rh", "Rh", "Rh", "Cl" ]

0.051485

-51.746357

agm002919295

[ "Ba", "Cu", "Se" ]

5

3

A2B2C

BaCu2Se2

[ [ 4.08203026, 0, 0 ], [ 0, 4.08203026, 0 ], [ -2.04101513, -2.04101513, 6.59730391 ] ]

[ [ 0, 2.04101513, 3.298651955 ], [ 2.04101513, 0, 3.298651955 ], [ 0, 0, 0 ], [ 2.04101513, 2.04101513, 1.8108791063221013 ], [ 6.424799523394141e-17, 6.424799523394141e-17, 4.786424803677897 ] ]

[ "Cu", "Cu", "Ba", "Se", "Se" ]

0.036538

-21.354196

agm005687956

[ "Ba", "F", "O" ]

9

3

A4B3C2

Ba4F2O3

[ [ 0, -3.932856919287626, 0 ], [ -6.651087795176545, -1.966428459643813, 0 ], [ -1.0720098054304676, -1.966428459643813, -8.372834947084183 ] ]

[ [ -6.278083162061437, -3.932856919287626, -5.903755080805721 ], [ -1.445014438545576, -3.932856919287626, -2.469079866278462 ], [ -4.841083547843911, -3.9328569192876257, -0.9276763696120904 ], [ -2.882014052763101, -3.932856919287626, -7.4451585774720925 ...

[ "Ba", "Ba", "Ba", "Ba", "O", "O", "O", "F", "F" ]

0.047565

-52.383178

agm003527842

[ "Ba", "F", "In" ]

11

3

A8B2C

Ba2F8In

[ [ 4.608321699138872, 0, 0 ], [ -0.555583560141143, 5.468205969162136, 0 ], [ -1.9075820103699836, -2.473891525661918, 7.0647267528796895 ] ]

[ [ -0.1668198417176555, 2.7767543170163833, 2.2728320996660645 ], [ 2.3119759703454013, 0.21756012648383408, 4.791894653213625 ], [ 2.304160849569436, 0, 0 ], [ 2.209287126394179, 3.8818602494068446, 1.2970159398046153 ], [ 0.1925350393169404, 1...

[ "Ba", "Ba", "In", "F", "F", "F", "F", "F", "F", "F", "F" ]

0.068872

-54.500767

agm005745404

[ "Ba", "F", "V" ]

14

3

A5BC

BaF5V

[ [ 4.932201528899455, 3.5644801210895256, 0 ], [ 4.932201528899455, -3.5644801210895256, 0 ], [ 3.414618344305189, 0, -7.498561153743363 ] ]

[ [ 5.7858561149757515, 0.35068424775315155, -1.8746402884358417 ], [ 7.493165287128347, -0.35068424775315077, -5.6239208653075226 ], [ 0, 0, 0 ], [ 6.63951070105205, -3.5644801210895256, -3.7492805768716817 ], [ 8.12821059464561, 0.1413546633427...

[ "Ba", "Ba", "V", "V", "F", "F", "F", "F", "F", "F", "F", "F", "F", "F" ]

0

-84.04097

agm002213408

[ "Ba", "Ga", "Hg" ]

4

3

A2BC

Ba2GaHg

[ [ -4.1537487413778384, -4.1537487413778384, 0 ], [ -4.1537487413778384, 0, -4.1537487413778384 ], [ 0, -4.1537487413778384, -4.1537487413778384 ] ]

[ [ 0, 0, 0 ], [ -4.1537487413778384, -4.1537487413778384, -4.1537487413778384 ], [ -2.0768743706889192, -2.0768743706889197, -2.0768743706889197 ], [ -6.230623112066757, -6.230623112066757, -6.230623112066757 ] ]

[ "Hg", "Ga", "Ba", "Ba" ]

0.036483

-8.867933

agm003312777

[ "Ba", "Ga", "Li" ]

7

3

A3B2C2

Ba2Ga2Li3

[ [ 0, -4.75126562, 0 ], [ -6.1531234347396175, -2.37563281, 0 ], [ -2.0981904631542196, -2.37563281, -6.7615536446852 ] ]

[ [ -3.4183740828755407, -2.37563281, -1.5956601940733806 ], [ -4.832939815018296, -7.12689843, -5.165893450611819 ], [ 0, -2.37563281, 0 ], [ -6.3986892712537555, -4.75126562, -2.919062711789007 ], [ -1.8526246266400797, -4.75126562, -3.8424...

[ "Ba", "Ba", "Li", "Li", "Li", "Ga", "Ga" ]

0.049437

-17.095496

agm001136899

[ "Ba", "Ga", "Mg" ]

4

3

A2BC

Ba2GaMg

[ [ 4.15560397, 0, 0 ], [ 0, 4.15560397, 0 ], [ 0, 0, 8.75563813 ] ]

[ [ 2.077801985, 2.077801985, 4.377819065 ], [ 0, 0, 6.771942806209032 ], [ 0, 0, 1.983695323790967 ], [ 2.077801985, 2.077801985, 0 ] ]

[ "Mg", "Ba", "Ba", "Ga" ]

0.04979

-9.22002

agm005829189

[ "Ba", "Ga", "Mg" ]

10

3

A3BC

BaGa3Mg

[ [ 0, 0, 4.3863239 ], [ 4.722443400173773, 0, 0 ], [ -2.3612217000868867, 12.589011450621866, 0 ] ]

[ [ 5.217007267323272e-16, 2.025088020804896, 1.096580975 ], [ 2.3612217000868867, 10.56392342981697, 3.2897429249999997 ], [ 2.3612217000868867, 7.416708208305743, 1.096580975 ], [ 3.951593155542174e-17, 5.172303242316123, 3.2897429249999997 ], [ 9....

[ "Ba", "Ba", "Mg", "Mg", "Ga", "Ga", "Ga", "Ga", "Ga", "Ga" ]

0.095494

-28.216902

agm002151085

[ "Ba", "Ga", "Se" ]

7

3

A4B2C

BaGa2Se4

[ [ 0, 0, -6.335341530046646 ], [ -4.078211710329198, -4.078211710329198, -3.167670765023323 ], [ -4.078211710329198, 4.078211710329198, -3.167670765023323 ] ]

[ [ -4.078211710329198, 0, -6.335341530046646 ], [ -4.078211710329198, 0, -3.167670765023323 ], [ 0, 0, 0 ], [ -2.7550643460485102, -1.3231473642806884, -4.751506147534985 ], [ -5.401359074609886, -1.3231473642806884, -7.919176912558308 ], ...

[ "Ga", "Ga", "Ba", "Se", "Se", "Se", "Se" ]

0.011593

-29.530925

agm003066821

[ "Ba", "Ge", "Hg" ]

6

3

ABC

BaGeHg

[ [ 4.247809055761527, 0, 0 ], [ 0.00015585433095617967, 4.7807805426073005, 0 ], [ 2.1186581929035064, 0.00835485352769082, 9.875287312012924 ] ]

[ [ 4.245081918262894, 3.738493756957328, 4.7123792671551215 ], [ 2.1207740531300203, 3.7387877538956364, 3.2159668092198705 ], [ 2.1209820120987333, 1.3473307746095087, 5.905552758893487 ], [ 4.245659641577565, 1.3477577480570124, 2.0232879706229645 ], ...

[ "Ge", "Ge", "Ba", "Ba", "Hg", "Hg" ]

0.099039

-16.200192

agm003484772

[ "Ba", "Ge", "N" ]

18

3

A6B2C

Ba6Ge2N

[ [ 7.70928294616994, 0, 0 ], [ 0, 8.21840203, 0 ], [ 0.013054678241011253, 0, 11.140488572900432 ] ]

[ [ 3.0958880474385158, 3.861055816866486, 8.508848160909974 ], [ 2.4895623042404833, 1.7055237990917296, 0.5715212122102817 ], [ 2.2506282357058236, 1.4557915453422015, 4.961121808613568 ], [ 1.6105405764996523, 5.564992560342201, 0.609122477836648 ], [...

[ "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ge", "Ge", "Ge", "Ge", "N", "N" ]

0.006675

-66.390851

agm003628645

[ "Ba", "Ge", "Sn" ]

8

3

A2BC

Ba2GeSn

[ [ 0, -4.52869114, 0 ], [ -6.794776193622831, 0, 0 ], [ 2.7384952423404036, 0, -9.654624103003393 ] ]

[ [ -3.8846939381705505, -1.1321727849999996, -5.545266297733899 ], [ -0.17158701311187655, -3.3965183550000004, -4.109357805269495 ], [ -2.281613601657267, -3.3965183550000004, -9.046262101712891 ], [ -1.7746673496251604, -1.1321727849999996, -0.60836200129...

[ "Ba", "Ba", "Ba", "Ba", "Sn", "Sn", "Ge", "Ge" ]

0.011858

-30.044238

agm002153562

[ "Ba", "H", "Ir" ]

9

3

A6B2C

Ba2H6Ir

[ [ -4.039437380196922, -4.039437380196922, 0 ], [ -4.039437380196922, 0, -4.039437380196922 ], [ 0, -4.039437380196922, -4.039437380196922 ] ]

[ [ -4.039437380196922, -1.7187491784509716, -4.039437380196922 ], [ -1.7187491784509712, -4.039437380196923, -4.039437380196922 ], [ -4.039437380196922, -4.039437380196922, -1.7187491784509716 ], [ -4.039437380196922, -6.360125581942874, -4.039437380196922 ...

[ "H", "H", "H", "H", "H", "H", "Ir", "Ba", "Ba" ]

0

-38.031045

agm003463259

[ "Ba", "H", "N" ]

7

3

A4B2C

Ba4H2N

[ [ 6.86727651, 0, 0 ], [ 0, 6.86727651, 0 ], [ -3.433638255, -3.433638255, 5.40936871 ] ]

[ [ 1.9445656573595527, 1.9445656573595522, 1.42899255346489 ], [ 4.922710852640447, 4.922710852640447, 1.428992553464889 ], [ 1.4890725976404466, -1.4890725976404466, 3.9803761565351095 ], [ -1.4890725976404466, 1.4890725976404466, 3.9803761565351095 ], ...

[ "Ba", "Ba", "Ba", "Ba", "H", "H", "N" ]

0.080912

-24.920422

agm006048716

[ "Ba", "Hg", "In" ]

11

3

A6B4C

BaHg6In4

[ [ 0, 0, -4.78328349 ], [ -4.336973311962608, -7.5118581273895035, 0 ], [ -4.336973311962608, 7.5118581273895035, 0 ] ]

[ [ -4.336973311962609, 2.503952709129835, 0 ], [ -1.8465899479377372, 0.5498545186198056, -2.391641745 ], [ -3.889866319504156, 5.637737062792537, -2.391641745 ], [ -4.336973311962608, -2.5039527091298344, 0 ], [ -7.274463668445931, 1.3242665459...

[ "Ba", "In", "In", "In", "In", "Hg", "Hg", "Hg", "Hg", "Hg", "Hg" ]

0.029427

-16.430593

agm003507157

[ "Ba", "Hg", "Pb" ]

9

3

A6B2C

Ba2Hg6Pb

[ [ 0.0016837005530398142, 0, -6.5857249040215 ], [ 0, 6.992775066464034, 0 ], [ 6.057002117137977, -3.496387533232017, 0 ] ]

[ [ 2.0222212847909122, 3.496387533232017, -1.1458511980521875 ], [ 4.036464532900106, 2.1033145938919855e-16, -5.439873705969313 ], [ 1.1045785814716393, 5.085108756841542, -4.362325761043944 ], [ 3.8389822984633333, 3.4963875332320176, -4.370035405760085 ...

[ "Ba", "Ba", "Hg", "Hg", "Hg", "Hg", "Hg", "Hg", "Pb" ]

0

-12.969545

agm005727053

[ "Ba", "Hg", "Pb" ]

12

3

A3B2C

Ba3Hg2Pb

[ [ 5.99181669688031, 0, 0 ], [ 0.006863582617884925, 0, -8.519420560919839 ], [ 2.995908348440155, 9.024753300000015, 0 ] ]

[ [ 5.9918028206450025, 3.011652860426399, -2.1250650960195827 ], [ 5.996672626748868, 9.024753300000015, -6.38724055601301 ], [ 3.002785807293348, 6.013100439573616, -6.394355464900256 ], [ 5.998694155733503, 3.0116528604263975, -6.394355464900256 ], [ ...

[ "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Hg", "Hg", "Hg", "Hg", "Pb", "Pb" ]

0.033802

-26.631823

agm003679496

[ "Ba", "Hg", "Sn" ]

13

3

A7B5C

BaHg7Sn5

[ [ 3.448774387403774, 0, -5.602033596931078 ], [ 6.0939289653066355, 5.434696063063444, 0 ], [ 6.0939289653066355, -5.434696063063444, 0 ] ]

[ [ 12.106226595355823, -1.2125260404964423e-15, -0.04421416220445087 ], [ 4.820001262507248, -2.6609756140253453, -2.7557775201331864 ], [ 6.549820470711858, -2.680172373541062, -5.570448603247212 ], [ 4.8200012625072475, 2.6609756140253435, -2.755777520133...

[ "Ba", "Sn", "Sn", "Sn", "Sn", "Sn", "Hg", "Hg", "Hg", "Hg", "Hg", "Hg", "Hg" ]

0.075166

-25.115898

agm005799904

[ "Ba", "Hg", "Sr" ]

14

3

A5BC

BaHgSr5

[ [ 0, -4.22719793, 0 ], [ -10.279549854494638, 0, 0 ], [ 1.4039869158455391, 0, -16.294859016477126 ] ]

[ [ -4.844931772806393, -1.0567994825, -10.089496268478962 ], [ -4.030631165842706, -3.1703984475, -6.205362747998164 ], [ -8.49722511480988, -1.0567994825, -11.623235696877527 ], [ -8.891758002455289, -3.1703984475, -1.0818531682796555 ], [ -7.82615...

[ "Ba", "Ba", "Sr", "Sr", "Sr", "Sr", "Sr", "Sr", "Sr", "Sr", "Sr", "Sr", "Hg", "Hg" ]

0.051984

-22.833925

agm003511182

[ "Ba", "Hg", "Tl" ]

10

3

A7B2C

Ba2HgTl7

[ [ 5.24416591, 0, 0 ], [ 0, 5.24416591, 0 ], [ 0, 0, 12.54414609 ] ]

[ [ 2.622082955, 0, 9.483275094402966 ], [ 0, 2.622082955, 3.0608709955970332 ], [ 0, 2.622082955, 10.933765996521151 ], [ 2.622082955, 0, 4.5707269436446785 ], [ 2.622082955, 0, 1.6103800934788484 ], [ 0, 2.622082955, 7.97341...

[ "Ba", "Ba", "Tl", "Tl", "Tl", "Tl", "Tl", "Tl", "Tl", "Hg" ]

0.042423

-23.001624

agm002926216

[ "Ba", "In", "Ir" ]

5

3

A2B2C

BaIn2Ir2

[ [ 4.63216042, 0, 0 ], [ 0, 4.63216042, 0 ], [ -2.31608021, -2.31608021, 5.60857083 ] ]

[ [ 2.31608021, 2.31608021, 1.233655462938845 ], [ 4.8330753521696555e-18, 4.8330753521696555e-18, 4.3749153670611545 ], [ 0, 0, 0 ], [ -9.347632612399792e-17, 2.31608021, 2.8042854149999994 ], [ 2.31608021, -9.347632612399792e-17, 2.80428541...

[ "Ir", "Ir", "Ba", "In", "In" ]

0.02159

-26.494189

agm003747322

[ "Ba", "In", "Rh" ]

12

3

A4BC

BaIn4Rh

[ [ -5.09164066, 0, 0 ], [ 0, 0, -7.00840549 ], [ 2.54582033, -9.57260209, 0 ] ]

[ [ -2.54582033, -1.9485611653881647, -5.2563041175 ], [ -9.205213224892076e-17, -7.624040924611835, -1.7521013725 ], [ -2.5458203300000006, -5.6193021780503365, -3.452313562012863 ], [ -1.0206017840962998e-16, -3.953299911949664, -3.556091927987137 ], [...

[ "Ba", "Ba", "In", "In", "In", "In", "In", "In", "In", "In", "Rh", "Rh" ]

0.090401

-44.390966

agm005753809

[ "Ba", "Ir", "O" ]

12

3

A4BC

BaIrO4

[ [ -3.7074594509700463, -5.018090713497907, 0 ], [ -3.7074594509700463, 5.018090713497907, 0 ], [ 2.461291348321518, 0, -5.769205879983173 ] ]

[ [ -1.8614909397289083, -1.4789433370525578, -4.32690440998738 ], [ -3.0921366138896667, 1.4789433370525589, -1.4423014699957926 ], [ -3.0921366138896667, -5.002732345060177, -1.4423014699957926 ], [ -1.861490939728908, 5.002732345060178, -4.32690440998738 ...

[ "Ba", "Ba", "Ir", "Ir", "O", "O", "O", "O", "O", "O", "O", "O" ]

0.036187

-78.073554

agm005810082

[ "Ba", "K", "Pd" ]

9

3

A6B2C

Ba6K2Pd

[ [ 2.64155995610834, 4.587416515959404, 7.489142192316971 ], [ -2.64155995610834, 4.587416515959404, -7.489142192316971 ], [ -7.941918619074473, -4.587416515959404, 0 ] ]

[ [ -2.648196159095585, 4.587416515959404, -1.8700647927449556 ], [ -5.293722459978886, 2.0970293115387002e-15, 1.8700647927449552 ], [ -7.88114463661791, 1.646371662770364e-16, -5.57104578612159 ], [ -6.585468060294446, -2.240453260765086, -1.91462496411497...

[ "K", "K", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Pd" ]

0.0463

-19.930629

agm003172138

[ "Ba", "K", "Sr" ]

4

3

A2BC

BaKSr2

[ [ 4.243858243197234, 0, 0 ], [ 0, 7.0335933, 0 ], [ -1.4016635025494222, 0, 8.096405001244449 ] ]

[ [ 2.283239966527863, 0, 6.109157776858501 ], [ 0.5589547741199493, 0, 1.987247224385948 ], [ -0.7008317512747111, 3.51679665, 4.048202500622224 ], [ 2.121929121598617, 3.51679665, 0 ] ]

[ "Sr", "Sr", "K", "Ba" ]

0.082837

-6.069336

agm003041281

[ "Ba", "La", "Tl" ]

6

3

ABC

BaLaTl

[ [ 0, -4.219533922693473, 0 ], [ -0.006861260870143139, 0, 5.9209974611985 ], [ -9.464451444927771, 2.1097669613467365, 0 ] ]

[ [ -7.632608676612456, 4.724633395062882e-17, 1.4872198003508468 ], [ -1.8387040291854617, -2.109766961346737, 4.433777660847653 ], [ -8.099089176788105, -2.1097669613467365, 4.444919024140467 ], [ -1.3722235290098077, 1.97506946414817e-18, 1.47607843705803...

[ "Tl", "Tl", "Ba", "Ba", "La", "La" ]

0.066962

-19.938736

agm003620357

[ "Ba", "Li", "Na" ]

8

3

A2BC

BaLiNa2

[ [ -6.158093416184427, 0, 0 ], [ 2.914682776605583, 0, -5.447735979491549 ], [ 0, -9.76696324, 0 ] ]

[ [ -1.5407433063520617, -2.44174081, -2.779043313474382 ], [ -1.7026673332267828, -7.32522243, -2.668692666017167 ], [ 1.3815867098480876, -5.51782419977961, -4.526136327899307 ], [ -4.624997349426932, -4.249139040220391, -0.9215996515922419 ], [ 1....

[ "Ba", "Ba", "Na", "Na", "Na", "Na", "Li", "Li" ]

0.094545

-12.312716

agm003302730

[ "Ba", "Li", "Na" ]

19

3

A15B2C2

Ba2Li15Na2

[ [ 5.338272672930458, 3.082053164724023, 5.220829487600787 ], [ -5.338272672930458, 3.082053164724023, 5.220829487600787 ], [ 0, -6.164106329448046, 5.220829487600787 ] ]

[ [ 8.807479558340819e-17, -9.099535415316633e-16, 5.454276476557291 ], [ -4.578749486977685e-16, 4.658643316816006e-16, 10.208211986245068 ], [ 2.559310941693784e-16, -5.552953913226841e-16, 1.5414028143321525 ], [ -1.5506429127106773e-15, 8.137789213357038e-16...

[ "Ba", "Ba", "Na", "Na", "Li", "Li", "Li", "Li", "Li", "Li", "Li", "Li", "Li", "Li", "Li", "Li", "Li", "Li", "Li" ]

0.035468

-34.598088

agm003586986

[ "Ba", "Na", "Pb" ]

12

3

A8B3C

Ba3NaPb8

[ [ -3.388903289952948, -5.869752680135827, 0 ], [ -6.777806579905896, 0, 0 ], [ -3.388903289952948, -1.9565842267119424, -10.76105265 ] ]

[ [ -6.777806579905895, -3.9131684534238844, -1.3554260346570968 ], [ -3.388903289952948, -1.9565842267119427, -10.609204189329533 ], [ -6.777806579905896, -3.9131684534238853, -5.489256861859813 ], [ -3.388903289952948, -1.9565842267119427, -6.6223821469784...

[ "Ba", "Ba", "Ba", "Na", "Pb", "Pb", "Pb", "Pb", "Pb", "Pb", "Pb", "Pb" ]

0.003286

-41.339231

agm006009633

[ "Ba", "O", "Sr" ]

8

3

A4B3C

Ba3O4Sr

[ [ 0, 0, -3.8977427 ], [ -3.9013457643775, -5.522746193106696, 0 ], [ -3.9013457643775, 5.522746193106696, 0 ] ]

[ [ 0, 0, -1.94887135 ], [ -5.8520186465662505, 2.761373096553348, 0 ], [ -3.9013457643775, 0, -1.94887135 ], [ -5.8520186465662505, -2.761373096553348, 0 ], [ -1.8751482900744738, 1.0650983279666165e-16, 0 ], [ -3.9013457643775, ...

[ "Sr", "Ba", "Ba", "Ba", "O", "O", "O", "O" ]

0.027895

-47.378927

agm005758333

[ "Ba", "P", "Rh" ]

9

3

A6B2C

Ba6P2Rh

[ [ 0, 4.645645660894461, 0 ], [ 2.541197322316746, 0, -9.188797013336455 ], [ -10.363105657815264, -2.3228228304472305, 0 ] ]

[ [ -2.9142606868864274, 2.3228228304472305, -0.9583423684269723 ], [ -8.2269846666985, 2.322822830447231, -7.096306147417332 ], [ -5.6577520162496295, -5.440986780616624e-17, -3.9639785750155982 ], [ 0.40507633119998016, 2.8721590574569514e-18, -2.092490865...

[ "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "P", "P", "Rh" ]

0.024697

-35.164624

agm005933005

[ "Ba", "Pb", "Tl" ]

16

3

A5B2C

Ba5PbTl2

[ [ 8.982561278391964, 0, 0 ], [ 0, 8.982561278391964, 0 ], [ -4.491280639195982, -4.491280639195982, 9.003819796453374 ] ]

[ [ -2.918265556674355, -1.5730150825216274, 6.35783584953853 ], [ 1.5730150825216267, 2.918265556674355, 2.645983946914845 ], [ 4.491280639195982, 4.491280639195982, 0 ], [ 0, 0, 0 ], [ 2.9182655566743545, 1.573015082521627, 6.35783584953853...

[ "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Ba", "Tl", "Tl", "Tl", "Tl", "Pb", "Pb" ]

0.03797

-42.227051

agm003346697

[ "Ba", "Pd", "Tl" ]

20

3

A5B3C2

Ba2Pd5Tl3

[ [ 0, 0, 6.50530033 ], [ 5.686803653827525, 6.769825368313961, 3.252650165 ], [ -5.686803653827525, 6.769825368313961, 3.252650165 ] ]

[ [ 2.6802878063913926, 8.48101205703198, 9.757950495 ], [ -2.680287806391392, 8.48101205703198, 6.50530033 ], [ -2.6802878063913926, 5.058638679595941, 3.252650165 ], [ 2.680287806391392, 5.058638679595941, 6.50530033 ], [ -1.113761519226777, 4....

[ "Ba", "Ba", "Ba", "Ba", "Tl", "Tl", "Tl", "Tl", "Tl", "Tl", "Pd", "Pd", "Pd", "Pd", "Pd", "Pd", "Pd", "Pd", "Pd", "Pd" ]

0.026109

-81.900086

agm003391993

[ "Ba", "Pd", "Zn" ]

10

3

A2B2C

Ba2Pd2Zn

[ [ 5.267650029947263, 3.138708112869834, 0 ], [ 5.267650029947263, -3.138708112869834, 0 ], [ 1.928987218572927, 0, -8.270566442438154 ] ]

[ [ 3.9649220464788506, 0.827804572590671, -1.2402404972733958 ], [ 7.534871622702139, 0.8278045725906712, -2.8950427239456813 ], [ 8.499365231988602, -0.8278045725906701, -7.030325945164758 ], [ 4.929415655765315, -0.8278045725906702, -5.375523718492472 ]...

[ "Ba", "Ba", "Ba", "Ba", "Zn", "Zn", "Pd", "Pd", "Pd", "Pd" ]

0.075387

-35.994147

agm002182941

[ "Ba", "S", "Ta" ]

12

3

A7B3C2

Ba3S7Ta2

[ [ 4.8608455984665175, 0, 0 ], [ 0, 4.8608455984665175, 0 ], [ -2.4304227992332588, -2.4304227992332588, 12.760351185227103 ] ]

[ [ 2.4304227992332588, 2.4304227992332588, 0 ], [ 2.4304227992332588, 2.4304227992332588, 4.977007691593792 ], [ -7.431583688258367e-17, -7.431583688258367e-17, 7.783343493633311 ], [ 2.4304227992332588, 1.9881712752055285e-17, 2.442887312957118 ], [ ...

[ "S", "S", "S", "S", "S", "S", "S", "Ba", "Ba", "Ba", "Ta", "Ta" ]

0.032878

-77.022178

agm002628553

[ "Ba", "Sr", "Zn" ]

5

3

A3BC

BaSr3Zn

[ [ 6.332690239999999, 0, 0 ], [ 0, 6.332690239999999, 0 ], [ 0, 0, 6.332690239999999 ] ]

[ [ 0, 3.1663451199999995, 0 ], [ 0, 0, 3.1663451199999995 ], [ 3.1663451199999995, 0, 0 ], [ 0, 0, 0 ], [ 3.1663451199999995, 3.1663451199999995, 3.1663451199999995 ] ]

[ "Sr", "Sr", "Sr", "Zn", "Ba" ]

0.057343

-8.376186

agm006039189

[ "Ba", "Te", "Tl" ]

14

3

A4B2C

Ba2Te4Tl

[ [ 0, -6.645132, 0 ], [ -8.626788800015014, 0, 0 ], [ 2.9853014782756504, 0, -9.678204567806292 ] ]

[ [ 0.6591445535336417, -1.661283, -9.011219776516576 ], [ -6.300631875273004, -4.983849, -0.6669847912897165 ], [ -4.7862941431844845, -4.983849, -5.397159076346292 ], [ -0.8551931785548786, -1.661283, -4.2810454914600005 ], [ -4.311567580689025, ...

[ "Ba", "Ba", "Ba", "Ba", "Tl", "Tl", "Te", "Te", "Te", "Te", "Te", "Te", "Te", "Te" ]

0.085711

-51.740048

agm005859114

[ "Be", "Br", "Cs" ]

14

3

A4B2C

BeBr4Cs2

[ [ 0, -7.4872836699999965, 0 ], [ -7.518231458233174, 0, 0 ], [ 1.9771913943931867, 0, -9.99667611298282 ] ]

[ [ -3.237431856103272, -5.615462752499997, -9.651144701907736 ], [ -2.303608207736715, -1.8718209174999991, -0.34553141107508367 ], [ -5.18208659141394, -1.8718209174999991, -6.1107317864430915 ], [ -0.3589534724260466, -5.615462752499997, -3.88594432653972...

[ "Cs", "Cs", "Cs", "Cs", "Be", "Be", "Br", "Br", "Br", "Br", "Br", "Br", "Br", "Br" ]

0

-45.594652

agm2000102806

[ "Be", "Cl", "Rb" ]

10

3

A3BC

BeCl3Rb

[ [ 0, 6.800487900000113, 0 ], [ 0, 0, 11.99114667000297 ], [ 16.23936387, 0, 0 ] ]

[ [ 8.119681935, 3.4002439500000565, 9.27580474727201 ], [ 8.119681935, 0, 3.280231412270525 ], [ 8.119681935, 3.4002439500000565, 5.279443109857168 ], [ 8.119681935, 0, 11.275016444858654 ], [ 8.73936339357538, 4.949650179921211, 6.223499492...

[ "Rb", "Rb", "Be", "Be", "Cl", "Cl", "Cl", "Cl", "Cl", "Cl" ]

0.081351

-36.601621

agm006107605

[ "Be", "Co", "Er" ]

8

3

A4B3C

BeCo3Er4

[ [ 3.84775955, 0, 0 ], [ 0, 3.946426750000001, 0 ], [ 0, 0, 10.24356311 ] ]

[ [ 1.923879775, 1.9732133750000005, 9.701940037211566 ], [ 1.923879775, 0, 4.490921170000647 ], [ 0, 0, 5.756462379296857 ], [ 0, 1.9732133750000005, 0.5318388310482839 ], [ 1.923879775, 1.9732133750000005, 6.550161204244424 ], [ 1.9...

[ "Be", "Co", "Co", "Co", "Er", "Er", "Er", "Er" ]

0.04187

-44.894421

agm005789368

[ "Be", "Co", "Pd" ]

6

3

A3B2C

Be3CoPd2

[ [ 2.75192463, 0, 0 ], [ 0, 2.75192463, 0 ], [ 0, 0, 8.26174703 ] ]

[ [ 0, 0, 0 ], [ 0, 0, 5.277044765107539 ], [ 0, 0, 2.9847022648924613 ], [ 1.375962315, 1.375962315, 4.130873515 ], [ 1.375962315, 1.375962315, 6.827049218631836 ], [ 1.375962315, 1.375962315, 1.4346978113681648 ] ]

[ "Be", "Be", "Be", "Co", "Pd", "Pd" ]

0

-31.764895

agm005980963

[ "Be", "Co", "Ti" ]

8

3

A4B3C

Be3CoTi4

[ [ 2.9823738099999995, 0, 0 ], [ 0, 4.141900930000001, 0 ], [ 0, 0, 8.27271753 ] ]

[ [ 1.4911869049999997, 0, 2.06387194393648 ], [ 1.4911869049999997, 2.0709504650000006, 4.136358765 ], [ 1.4911869049999997, 0, 6.20884558606352 ], [ 1.4911869049999997, 2.0709504650000006, 0 ], [ 0, 0, 4.136358765 ], [ 0, 2.0709...

[ "Be", "Be", "Be", "Co", "Ti", "Ti", "Ti", "Ti" ]

0.025282

-51.447831

agm005634197

[ "Be", "Cu", "Pd" ]

9

3

A4B3C2

Be4Cu2Pd3

[ [ -1.9864042141037799, -3.4405530231966726, 0 ], [ -1.9864042141037799, 3.4405530231966726, 0 ], [ 0, 0, -7.438311577518478 ] ]

[ [ -1.98640421410378, 1.1468510077322243, -0.7356011122900195 ], [ 0, 0, -4.964757667965814 ], [ 0, 0, -2.4735539095526655 ], [ -1.9864042141037799, -1.1468510077322238, -6.702710465228459 ], [ -1.9864042141037799, -1.1468510077322245, -1.57...

[ "Be", "Be", "Be", "Be", "Cu", "Cu", "Pd", "Pd", "Pd" ]

0.092296

-41.630116

agm006136481

[ "Be", "Cu", "Tm" ]

12

3

A6B5C

BeCu5Tm6

[ [ -4.827566225127029, 0, 0 ], [ 0, -6.7959635911852985, 0 ], [ 2.4088814234645386, 0, 7.23632553187606 ] ]

[ [ 0, 0, 0 ], [ -2.414730866905353, -1.6925012962438302, 4.831939941432433 ], [ -2.414730866905353, -5.103462294941468, 4.831939941432433 ], [ -2.4137831125635145, -5.1038086172460755, 0 ], [ -2.4137831125635145, -1.692154973939223, 0 ], ...

[ "Be", "Tm", "Tm", "Tm", "Tm", "Tm", "Tm", "Cu", "Cu", "Cu", "Cu", "Cu" ]

0.031886

-53.795172

agm001270333

[ "Be", "Er", "Ir" ]

3

ABC

BeErIr

[ [ -1.9542186202301166, -3.3848059393357106, 0 ], [ -1.9542186202301166, 3.3848059393357106, 0 ], [ 0, 0, -3.93964681 ] ]

[ [ -1.954218620230117, 1.1282686464452365, 0 ], [ 0, 0, 0 ], [ -1.9542186202301166, -1.1282686464452372, -1.969823405 ] ]

[ "Be", "Ir", "Er" ]

0.026253

-19.21168

agm005838364

[ "Be", "I", "Sn" ]

6

3

A4BC

BeI4Sn

[ [ 7.0205749846461085, 0, 0 ], [ 0, 7.0205749846461085, 0 ], [ -3.5102874923230543, -3.5102874923230543, 5.684071079068492 ] ]

[ [ 3.510287492323054, 0, 2.842035539534246 ], [ 3.5102874923230543, 3.5102874923230543, 0 ], [ 5.087519723642796, 1.2863901693733109, 1.513596906945321 ], [ 1.9330552610033123, 5.7341848152727986, 1.513596906945321 ], [ 2.223897322949744, 1.5772...

[ "Be", "Sn", "I", "I", "I", "I" ]

0.083853

-16.656147

agm003302089

[ "Be", "Mn", "Ni" ]

19

3

A15B2C2

Be15Mn2Ni2

[ [ 3.6413244348394698, 2.10231964266133, 3.579186294500718 ], [ -3.6413244348394698, 2.10231964266133, 3.579186294500718 ], [ 0, -4.20463928532266, 3.579186294500718 ] ]

[ [ 4.075959854849894e-16, -4.618847503247901e-16, 3.7550841164368896 ], [ -2.054618741005412e-16, 9.28693484805658e-16, 6.982474767065264 ], [ -1.8206622174197349, 3.153479463991995, 5.368779441751077 ], [ -1.3475607425629883e-16, -2.10231964266133, 1.78959...

[ "Mn", "Mn", "Be", "Be", "Be", "Be", "Be", "Be", "Be", "Be", "Be", "Be", "Be", "Be", "Be", "Be", "Be", "Ni", "Ni" ]

0.092695

-88.614096

agm005597360

[ "Be", "Nb", "Ti" ]

9

3

A6B2C

Be6Nb2Ti

[ [ 0, 0, -2.97844875 ], [ -3.184170983425116, -5.515145923278858, 0 ], [ -3.184170983425116, 5.515145923278858, 0 ] ]

[ [ 0, 0, 0 ], [ -2.117490771134174, -5.109619759071659e-16, -1.489224375 ], [ -4.250851195716058, -8.213056536430219e-16, -1.489224375 ], [ -2.125425597858029, -3.681345123197563, -1.489224375 ], [ -5.309596581283144, -1.8338008000812942, -1...

[ "Ti", "Be", "Be", "Be", "Be", "Be", "Be", "Nb", "Nb" ]

0.039132

-52.081691

agm005826926

[ "Be", "Nb", "Zr" ]

6

3

A4BC

Be4NbZr

[ [ 3.1241475742744456, 0, 0 ], [ 0, 3.7308627961190886, 0 ], [ 0, 0, 6.496778977149185 ] ]

[ [ 1.5620737871372228, 1.8654313980595443, 0 ], [ 0, 1.8654313980595443, 4.29116396385691 ], [ 0, 1.8654313980595443, 2.2056150132922743 ], [ 0, 0, 1.1376123108536786 ], [ 0, 0, 5.359166666295506 ], [ 1.5620737871372228, 0, 3...

[ "Zr", "Be", "Be", "Be", "Be", "Nb" ]

0.059533

-34.562195

agm005844632

[ "Be", "Os", "Sc" ]

6

3

A3B2C

BeOs3Sc2

[ [ 4.268323964970967, 2.6008257554476137, 0 ], [ 4.268323964970967, -2.6008257554476137, 0 ], [ 2.665556500379993, 0, -4.232111132495101 ] ]

[ [ 6.994053225833947, -1.039740147920297e-16, -2.6402986835719995 ], [ 4.208151204487979, -7.048287670485955e-18, -1.5918124489231011 ], [ 0, 0, 0 ], [ 6.40248594745645, 1.3004128777238069, 0 ], [ 6.40248594745645, -1.3004128777238069, 0 ]...

[ "Sc", "Sc", "Be", "Os", "Os", "Os" ]

0.025529

-52.285871

agm002646562

[ "Be", "Os", "V" ]

4

3

A2BC

BeOs2V

[ [ -2.93296458, -2.93296458, 0 ], [ -2.93296458, 0, -2.93296458 ], [ 0, -2.93296458, -2.93296458 ] ]

[ [ 0, 0, 0 ], [ -4.39944687, -4.39944687, -4.39944687 ], [ -1.46648229, -1.4664822900000003, -1.4664822900000003 ], [ -2.93296458, -2.93296458, -2.93296458 ] ]

[ "Be", "Os", "Os", "V" ]

0.034912

-36.330562

agm001272303

[ "Be", "Rh", "Sm" ]

3

ABC

BeRhSm

[ [ -1.9710328570088376, -3.4139290517269485, 0 ], [ -1.9710328570088376, 3.4139290517269485, 0 ], [ 0, 0, -4.11502666 ] ]

[ [ -1.9710328570088378, 1.1379763505756495, -2.05751333 ], [ 0, 0, -2.05751333 ], [ -1.9710328570088378, -1.13797635057565, 0 ] ]

[ "Be", "Rh", "Sm" ]

0.039126

-17.448332

agm005010117

[ "In", "O", "Pr", "S" ]

10

4

A2BCD

InO2PrS

[ [ 0, -4.19697817, 0 ], [ -7.123899285757164, 0, 0 ], [ 3.198625476163547, 0, -6.694387609336596 ] ]

[ [ -5.0944839439441285, -3.1477336275, -0.30698995505531335 ], [ 1.1692101343505121, -1.0492445425000005, -6.3873976542812825 ], [ 0.2995529796151825, -3.1477336275, -3.602534149338039 ], [ -4.224826789208799, -1.0492445425000005, -3.091853459998557 ], ...

[ "Pr", "Pr", "In", "In", "S", "S", "O", "O", "O", "O" ]

0.062509

-63.932753

agm003584053

[ "Bi", "Br", "S" ]

11

3

A7B3C

Bi3Br7S

[ [ 0, 0, -7.15343627 ], [ -4.171090371342065, -7.224540446125792, 0 ], [ -4.171090371342065, 7.224540446125792, 0 ] ]

[ [ -2.1601740426187606, -3.5691832324148116, -1.6119818683303608 ], [ -4.171090371342065, -0.0861739812961708, -1.6119818683303608 ], [ -6.1820067000653705, -3.569183232414811, -1.6119818683303608 ], [ -4.171090371342065, -2.408180148708598, -3.054280794686...

[ "Bi", "Bi", "Bi", "S", "Br", "Br", "Br", "Br", "Br", "Br", "Br" ]

0.010628

-34.979788

agm002203826

[ "Bi", "Ca", "Ni" ]

8

3

A2BC

Bi2CaNi

[ [ 4.5693178, 0, 0 ], [ 0, 4.5693178, 0 ], [ 0, 0, 9.77318083 ] ]

[ [ 2.2846589, 2.2846589, 0 ], [ 0, 0, 0 ], [ 0, 2.2846589, 2.2641427365098448 ], [ 2.2846589, 0, 7.509038093490155 ], [ 2.2846589, 0, 1.3806669313031215 ], [ 0, 2.2846589, 8.392513898696878 ], [ 0, 0, 4.886590...

[ "Ni", "Ni", "Ca", "Ca", "Bi", "Bi", "Bi", "Bi" ]

0.043731

-34.137805

agm005887212

[ "Bi", "Ca", "Pd" ]

12

3

A9B2C

BiCa2Pd9

[ [ 4.12937188, 0, 0 ], [ 0, 4.12937188, 0 ], [ 0, 0, 12.3865546 ] ]

[ [ 0, 0, 4.143884310169562 ], [ 0, 0, 8.242670289830437 ], [ 0, 0, 0 ], [ 2.06468594, 2.06468594, 0 ], [ 2.06468594, 2.06468594, 4.084820882542652 ], [ 2.06468594, 2.06468594, 8.301733717457347 ], [ 2.06468594, 0,...

[ "Ca", "Ca", "Bi", "Pd", "Pd", "Pd", "Pd", "Pd", "Pd", "Pd", "Pd", "Pd" ]

0.035583

-59.777145

agm002967720

[ "Bi", "Cd", "In" ]

10

3

A2B2C

BiCd2In2

[ [ 0, 0, 3.47078066 ], [ 8.80694014, 0, 0 ], [ 0, 8.80694014, 0 ] ]

[ [ 3.329829912498021, 7.733299982498021, 0 ], [ 7.733299982498021, 5.477110227501979, 0 ], [ 5.477110227501979, 1.073640157501979, 0 ], [ 1.073640157501979, 3.329829912498021, 0 ], [ 0, 0, 0 ], [ 4.40347007, 4.40347007, 0 ]...

[ "Cd", "Cd", "Cd", "Cd", "Bi", "Bi", "In", "In", "In", "In" ]

0.084785

-21.676127

agm005907065

[ "Bi", "Cd", "Sb" ]

10

3

A3BC

BiCd3Sb

[ [ 0, -6.229214470000105, 0 ], [ -6.480417155949016, 0, 0 ], [ 0.6416705719360094, 0, -6.838787433388369 ] ]

[ [ -4.7756621719943215, -1.5573036175000263, -4.409460565861167 ], [ -1.9027589090381705, -1.5573036175000263, -5.66598770528613 ], [ 0, 0, 0 ], [ -1.063084412018685, -4.671910852500079, -2.429326867527201 ], [ -3.935987674974836, -4.67191085250...

[ "Cd", "Cd", "Cd", "Cd", "Cd", "Cd", "Bi", "Bi", "Sb", "Sb" ]

0.084127

-20.93923

agm006006689

[ "Bi", "Ce", "Rh" ]

16

3

A5B2C

Bi2Ce5Rh

[ [ 0, 0, 4.67044975 ], [ 7.98707587, 0, 0 ], [ 0, 12.58651529, 0 ] ]

[ [ 0, 6.293257644999999, 0 ], [ 3.9935379349999995, 0, 0 ], [ 7.021551094957526, 2.4591999274667713, 0 ], [ 0.9655247750424728, 10.127315362533228, 0 ], [ 4.959062710042473, 8.752457572466772, 0 ], [ 3.0280131599575264, 3.8340577...

[ "Ce", "Ce", "Ce", "Ce", "Ce", "Ce", "Ce", "Ce", "Ce", "Ce", "Bi", "Bi", "Bi", "Bi", "Rh", "Rh" ]

0.022546

-98.919788

agm001268766

[ "Bi", "Cs", "Rb" ]

3

ABC

BiCsRb

[ [ 0, 0, -3.80666902 ], [ -3.1770264951690432, -5.502771306625261, 0 ], [ -3.1770264951690432, 5.502771306625261, 0 ] ]

[ [ 0, 0, -3.0973418139511697 ], [ -3.1770264951690432, -1.8342571022084204, -1.2556053754985816 ], [ -3.1770264951690437, 1.8342571022084206, -3.260390850550249 ] ]

[ "Cs", "Bi", "Rb" ]

0.095889

-6.489352

agm005804565

[ "Bi", "Ga", "La" ]

18

3

A6B2C

BiGa2La6

[ [ 4.993592880060746, 5.173084595228141, 5.640177528178624 ], [ 4.993592880060746, -5.173084595228141, -5.640177528178624 ], [ -4.993592880060746, 5.173084595228141, -5.640177528178624 ] ]

[ [ -2.1790415412180506, 3.2076966023034887, -5.640177528178624 ], [ 7.172634421278796, 1.9653879929246518, 5.749554626671167e-16 ], [ 2.1790415412180515, 3.2076966023034887, -5.640177528178624 ], [ 2.814551338842694, 1.965387992924652, 4.1840908879818396e-1...

[ "La", "La", "La", "La", "La", "La", "La", "La", "La", "La", "La", "La", "Ga", "Ga", "Ga", "Ga", "Bi", "Bi" ]

0.056521

-87.556542

agm003529767

[ "Bi", "H", "K" ]

11

3

A8B2C

Bi2HK8

[ [ 0, 6.14077232, 0 ], [ 1.9563527289558749, 0, -7.653814612813946 ], [ -10.521914144061029, -3.07038616, 0 ] ]

[ [ -8.285483073532978, 1.5677119513632988e-15, -1.399757705891044 ], [ -2.822279965030704, 3.0703861600000004, -3.121021624946096 ], [ -4.158345821340694, 3.0703861600000004, -6.626268264210175 ], [ -8.60000615435526, 3.0703861599999995, -5.587672868831343 ...

[ "K", "K", "K", "K", "K", "K", "K", "K", "Bi", "Bi", "H" ]

0.087373

-22.413508

agm005751751

[ "Bi", "Hg", "La" ]

8

3

A6BC

BiHg6La

[ [ 5.43958805, 0, 0 ], [ 0, 6.633382893031533, 0 ], [ 0, -3.3166914465157666, 6.140588672670048 ] ]

[ [ 2.719794025, 3.316691446515767, 4.1579436487462385 ], [ 2.719794025, 1.702145187661536, 1.050010758359743 ], [ 2.719794025, 4.931237705369996, 1.050010758359743 ], [ 0, -1.6346328719264487, 5.104214565199252 ], [ 0, 1.634632871926449, 5.1...

[ "La", "Hg", "Hg", "Hg", "Hg", "Hg", "Hg", "Bi" ]

0.08071

-12.29493

agm006051704

[ "Bi", "Hg", "Na" ]

9

3

A4B4C

BiHg4Na4

[ [ 0, 0, -4.811217594287242 ], [ -4.949808635078753, -4.949808635078753, -2.405608797143621 ], [ -4.949808635078753, 4.949808635078753, -2.405608797143621 ] ]

[ [ -6.602683828647472, -3.2969334415100344, -4.811217594287242 ], [ -3.296933441510036, 3.296933441510035, -4.811217594287243 ], [ -8.246742076588788, 1.6528751935687183, -7.216826391430864 ], [ -6.602683828647471, 3.296933441510035, -4.811217594287242 ],...

[ "Na", "Na", "Na", "Na", "Hg", "Hg", "Hg", "Hg", "Bi" ]

0.063535

-12.288469

agm001208710

[ "Bi", "Hg", "Pb" ]

4

3

A2BC

BiHgPb2

[ [ 0, 0, 4.59346132 ], [ 5.14945868, 0, 0 ], [ 0, 5.14945868, 0 ] ]

[ [ 0, 2.57472934, 0 ], [ 2.57472934, 0, 0 ], [ 0, 0, 2.29673066 ], [ 2.57472934, 2.57472934, 2.29673066 ] ]

[ "Pb", "Pb", "Bi", "Hg" ]

0.047412

-11.491799

agm006077843

[ "Bi", "Hg", "Pb" ]

12

3

A7B4C

Bi4HgPb7

[ [ -2.3653098159962083, -4.096836776946825, 0 ], [ -2.3653098159962083, 4.096836776946825, 0 ], [ 0, 0, -21.200249820000046 ] ]

[ [ 0, 0, -10.600124910000023 ], [ -2.3653098159962083, -1.3656122589822752, -1.8545393415641012 ], [ -2.3653098159962087, 1.3656122589822752, -19.345710478435944 ], [ -2.3653098159962083, -1.3656122589822752, -7.2141045377339035 ], [ -2.365309815996...

[ "Hg", "Bi", "Bi", "Bi", "Bi", "Pb", "Pb", "Pb", "Pb", "Pb", "Pb", "Pb" ]

0.093027

-40.763231

agm006043434

[ "Bi", "Hg", "Tl" ]

11

3

A6B4C

BiHg4Tl6

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[ "Tl", "Tl", "Tl", "Tl", "Tl", "Tl", "Hg", "Hg", "Hg", "Hg", "Bi" ]

0.049765

-19.096138

agm003636868

[ "Bi", "Ho", "P" ]

4

3

A2BC

BiHo2P

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[ "Ho", "Ho", "Bi", "P" ]

0.091398

-23.18318

agm004479922

[ "Bi", "I", "Rb" ]

10

3

A6B3C

BiI6Rb3

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[ "I", "I", "I", "I", "I", "I", "Bi", "Rb", "Rb", "Rb" ]

0.082928

-26.202869

agm005701284

[ "Bi", "K", "Rb" ]

14

3

A7B4C3

Bi4K7Rb3

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[ "K", "K", "K", "K", "K", "K", "K", "Rb", "Rb", "Rb", "Bi", "Bi", "Bi", "Bi" ]

0.077948

-30.185639

agm003484188

[ "Bi", "K", "Tl" ]

9

3

A6B2C

Bi2KTl6

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[ "K", "Tl", "Tl", "Tl", "Tl", "Tl", "Tl", "Bi", "Bi" ]

0.041412

-23.71828

agm003531983

[ "Bi", "Li", "Sb" ]

11

3

A8B2C

BiLi8Sb2

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[ "Li", "Li", "Li", "Li", "Li", "Li", "Li", "Li", "Bi", "Sb", "Sb" ]

0.023211

-33.666034

agm002222721

[ "Bi", "Mn", "Tm" ]

9

3

A6B2C

Bi2MnTm6

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[ "Tm", "Tm", "Tm", "Tm", "Tm", "Tm", "Bi", "Bi", "Mn" ]

0.022804

-47.277599

agm003678589

[ "Bi", "Nd", "Sm" ]

12

3

A6B5C

Bi6NdSm5

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[ "Nd", "Sm", "Sm", "Sm", "Sm", "Sm", "Bi", "Bi", "Bi", "Bi", "Bi", "Bi" ]

0.098947

-62.806037

agm003215408

[ "Bi", "Ni", "Se" ]

14

3

A3B2C2

Bi2Ni3Se2

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[ "Ni", "Ni", "Ni", "Ni", "Ni", "Ni", "Bi", "Bi", "Bi", "Bi", "Se", "Se", "Se", "Se" ]

0

-67.424836

agm003368342

[ "Bi", "O", "Ti" ]

19

3

A12B5C2

Bi5O12Ti2

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[ "Ti", "Ti", "Bi", "Bi", "Bi", "Bi", "Bi", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O", "O" ]

0.033924

-128.15243

agm005899834

[ "Bi", "Pb", "Tl" ]

7

3

A4B2C

BiPb4Tl2

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[ "Tl", "Tl", "Bi", "Pb", "Pb", "Pb", "Pb" ]

0.044495

-23.291462

agm003411222

[ "Bi", "Pb", "Tl" ]

12

3

A3B2C

Bi2PbTl3

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[ "Tl", "Tl", "Tl", "Tl", "Tl", "Tl", "Bi", "Bi", "Bi", "Bi", "Pb", "Pb" ]

0.047062

-37.038314

agm003578410

[ "Bi", "Pr", "S" ]

20

3

A6B3C

Bi3PrS6

[ [ 0, 4.04715648, 0 ], [ 3.3714615498446485, 0, -11.232387388127528 ], [ -11.72731646164261, 0, 0 ] ]

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[ "Pr", "Pr", "Bi", "Bi", "Bi", "Bi", "Bi", "Bi", "S", "S", "S", "S", "S", "S", "S", "S", "S", "S", "S", "S" ]

0.048604

-98.18111

agm003578160

[ "Bi", "Pr", "Se" ]

20

3

A6B3C

Bi3PrSe6

[ [ 0, -4.19221498, 0 ], [ -12.298686902641398, 0, 0 ], [ 3.8898642118878177, 0, -11.730253227502164 ] ]

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[ "Pr", "Pr", "Bi", "Bi", "Bi", "Bi", "Bi", "Bi", "Se", "Se", "Se", "Se", "Se", "Se", "Se", "Se", "Se", "Se", "Se", "Se" ]

0.008307

-89.959073

agm003484546

[ "Bi", "Rb", "Tl" ]

9

3

A6B2C

Bi2Rb6Tl

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[ "Rb", "Rb", "Rb", "Rb", "Rb", "Rb", "Tl", "Bi", "Bi" ]

0.083804

-17.88101

agm003653156

[ "Bi", "Sb", "Sm" ]

10

3

A5B4C

BiSb4Sm5

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[ "Sm", "Sm", "Sm", "Sm", "Sm", "Bi", "Sb", "Sb", "Sb", "Sb" ]

0.020805

-55.225944

agm003772327

[ "Bi", "Sb", "Tl" ]

8

3

A6BC

BiSbTl6

[ [ 4.99052717, 0, 0 ], [ 0, 4.99052717, 0 ], [ 0, 0, 9.9903589 ] ]

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[ "Tl", "Tl", "Tl", "Tl", "Tl", "Tl", "Bi", "Sb" ]

0.012181

-22.314661

agm006109971

[ "Bi", "Sc", "Tl" ]

12

3

A6B5C

BiSc6Tl5

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[ "Sc", "Sc", "Sc", "Sc", "Sc", "Sc", "Tl", "Tl", "Tl", "Tl", "Tl", "Bi" ]

0.049753

-57.04264

agm005705961

[ "Bi", "Se", "Sn" ]

8

3

A2BC

Bi2SeSn

[ [ 0, -4.4218733, 0 ], [ -4.540953483142314, 0, 0 ], [ 0.6634503104843008, 0, -12.81170777932845 ] ]

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[ "Sn", "Sn", "Bi", "Bi", "Bi", "Bi", "Se", "Se" ]

0.064574

-31.737091

agm003429225

[ "Bi", "Tb", "Y" ]

6

3

A3B2C

Bi3Tb2Y

[ [ 4.49079059, 0, 0 ], [ 0, 6.34604088, 0 ], [ -2.245395295, -3.17302044, 6.73744112 ] ]

[ [ 2.245395295, 3.1730204399999993, 4.490114408639152 ], [ 1.195232940285961e-17, -2.455087885513194e-16, 2.2473267113608477 ], [ -1.9480025426066308e-16, -5.359023846907007e-16, 6.737441119999999 ], [ 2.245395295, -5.132968241411163e-16, 4.495040758211685 ...

[ "Tb", "Tb", "Y", "Bi", "Bi", "Bi" ]

0.098872

-32.68308

agm005576600

[ "Bi", "Ti", "Zr" ]

16

3

A3B3C2

Bi3Ti2Zr3

[ [ 0, 0, -5.71561762 ], [ -4.253643660972988, -7.367526938098499, 0 ], [ -4.253643660972988, 7.367526938098499, 0 ] ]

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[ "Zr", "Zr", "Zr", "Zr", "Zr", "Zr", "Ti", "Ti", "Ti", "Ti", "Bi", "Bi", "Bi", "Bi", "Bi", "Bi" ]

0.088467

-110.078941

agm005881346

[ "Br", "Ca", "N" ]

14

3

A3B3C

Br3Ca3N

[ [ 0, -3.89150725, 0 ], [ -8.220121190146982, 0, 0 ], [ 0.5174795943718302, 0, -11.267332420883212 ] ]

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[ "Ca", "Ca", "Ca", "Ca", "Ca", "Ca", "Br", "Br", "Br", "Br", "Br", "Br", "N", "N" ]

0.030025

-61.800461