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{
"id": "jvasp-121353",
"created_at": "2022-09-04T14:38:54.026311Z",
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"structure_string": "Cr8 Se6 N4\n1.0\n6.431853 -0.000000 0.000000\n0.000000 13.072720 0.000000\n-0.000000 -0.000000 3.353242\nCr Se N\n8 6 4\ndirect\n0.687284 0.938249 0.500000 Cr\n0.312715 0.061751 0.500000 Cr\n0.187285 0.561751 -0.000000 Cr\n0.812715 0.438249 -0.000000 Cr\n0.803779 0.642750 0.500000 Cr\n0.196221 0.357250 0.500000 Cr\n0.303779 0.857250 -0.000000 Cr\n0.696221 0.142750 -0.000000 Cr\n0.665512 0.782704 -0.000000 Se\n0.334487 0.217296 -0.000000 Se\n0.165512 0.717296 0.500000 Se\n0.500000 0.500000 0.500000 Se\n0.000000 0.000000 0.000000 Se\n0.834487 0.282704 0.500000 Se\n0.114308 0.420911 -0.000000 N\n0.614308 0.079089 0.500000 N\n0.385692 0.920911 0.500000 N\n0.885691 0.579089 -0.000000 N\n",
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{
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"structure_string": "Fe6 O4 F8\n1.0\n4.721665 -0.045941 0.033429\n-0.327964 4.710485 0.033429\n0.005066 0.005378 9.242891\nFe O F\n6 4 8\ndirect\n0.000000 0.000000 0.000000 Fe\n0.030095 0.030095 0.336233 Fe\n0.969906 0.969905 0.663767 Fe\n0.485608 0.485607 0.152376 Fe\n0.514393 0.514392 0.847624 Fe\n0.500000 0.500000 0.500000 Fe\n0.321192 0.321192 0.333786 O\n0.293027 0.293026 0.996668 O\n0.706974 0.706973 0.003332 O\n0.678809 0.678808 0.666214 O\n0.796309 0.191252 0.833072 F\n0.203692 0.808748 0.166928 F\n0.202028 0.797972 0.500000 F\n0.191253 0.796308 0.833072 F\n0.718464 0.718464 0.333166 F\n0.281536 0.281536 0.666834 F\n0.808748 0.203692 0.166928 F\n0.797973 0.202027 0.500000 F\n",
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{
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"structure_string": "Sr6 Al4 P8\n1.0\n6.667216 -0.014015 0.085882\n0.074598 8.085080 2.097549\n-0.022967 0.004432 8.353038\nSr Al P\n6 4 8\ndirect\n0.750001 0.598516 0.401485 Sr\n0.039959 0.748299 0.008663 Sr\n0.460041 0.991337 0.251701 Sr\n0.960041 0.251701 0.991337 Sr\n0.539959 0.008663 0.748299 Sr\n0.250000 0.401485 0.598515 Sr\n0.418458 0.418076 0.172261 Al\n0.918458 0.172262 0.418076 Al\n0.581543 0.581924 0.827739 Al\n0.081543 0.827738 0.581924 Al\n0.575590 0.259295 0.420765 P\n0.024160 0.058646 0.705814 P\n0.424411 0.740705 0.579235 P\n0.975840 0.941354 0.294186 P\n0.524161 0.705814 0.058646 P\n0.475840 0.294186 0.941354 P\n0.924411 0.579235 0.740705 P\n0.075590 0.420765 0.259295 P\n",
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{
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"structure_string": "Sb4 S3 N2\n1.0\n5.461811 0.333301 4.646100\n1.051598 3.572512 -0.000000\n-0.909784 0.267802 9.124413\nSb S N\n4 3 2\ndirect\n0.241178 0.879410 0.594335 Sb\n0.758823 0.120588 0.405664 Sb\n0.625204 0.687397 0.121867 Sb\n0.374797 0.312601 0.878132 Sb\n0.000000 0.000000 0.000000 S\n0.706569 0.646715 0.705792 S\n0.293432 0.353283 0.294207 S\n0.615692 0.692153 0.359129 N\n0.384309 0.307845 0.640870 N\n",
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{
"id": "jvasp-85247",
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"updated_at": "2022-09-04T14:37:11.464793Z",
"structure_string": "Cu4 Mo6 Se8\n1.0\n6.602197 -0.036484 1.913783\n-0.049857 6.571924 2.094753\n-0.158853 -0.228898 8.051405\nCu Mo Se\n4 6 8\ndirect\n0.269755 0.142951 0.014440 Cu\n0.730245 0.857049 0.985559 Cu\n0.642490 0.231034 0.918968 Cu\n0.357510 0.768966 0.081031 Cu\n0.222824 0.925962 0.579760 Mo\n0.777176 0.074037 0.420239 Mo\n0.425214 0.277800 0.455543 Mo\n0.501279 0.001895 0.264402 Mo\n0.574786 0.722199 0.544456 Mo\n0.498721 0.998105 0.735597 Mo\n0.149347 0.197179 0.753272 Se\n0.838879 0.787704 0.700956 Se\n0.696764 0.352987 0.154576 Se\n0.290691 0.662460 0.398661 Se\n0.303237 0.647013 0.845423 Se\n0.850653 0.802821 0.246727 Se\n0.161121 0.212296 0.299043 Se\n0.709309 0.337539 0.601338 Se\n",
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{
"id": "jvasp-42302",
"created_at": "2022-09-04T14:38:11.795065Z",
"updated_at": "2022-09-04T14:38:11.795080Z",
"structure_string": "Mn6 O4 F8\n1.0\n-4.504529 4.504529 3.078931\n0.236722 4.773722 -3.126489\n-4.773722 -0.236722 -3.126489\nMn O F\n6 4 8\ndirect\n0.836838 0.668563 0.668563 Mn\n0.670829 0.350795 0.350795 Mn\n0.329170 0.649206 0.649206 Mn\n0.163162 0.331437 0.331437 Mn\n0.500000 0.000000 0.000000 Mn\n0.000000 0.000000 0.000000 Mn\n0.371908 0.428141 0.428141 O\n0.040627 0.761687 0.761687 O\n0.628092 0.571860 0.571860 O\n0.959373 0.238314 0.238314 O\n-0.000000 0.302302 0.697698 F\n0.674009 0.028315 0.642570 F\n0.325991 0.357431 0.971685 F\n0.310109 0.879688 0.879688 F\n0.689891 0.120313 0.120313 F\n0.325991 0.971685 0.357431 F\n0.674009 0.642570 0.028315 F\n-0.000000 0.697698 0.302302 F\n",
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"structure_string": "W3 Se4 S2\n1.0\n3.280352 0.000000 0.000000\n-1.640176 2.840870 0.000000\n-0.000000 -0.000000 27.886958\nW Se S\n3 4 2\ndirect\n0.333316 0.666634 0.116708 W\n0.333316 0.666634 0.577257 W\n0.666677 0.333355 0.346982 W\n0.666649 0.333300 0.055813 Se\n0.666650 0.333301 0.516299 Se\n0.666650 0.333301 0.177666 Se\n0.666649 0.333300 0.638151 Se\n0.333342 0.666687 0.402427 S\n0.333342 0.666687 0.291538 S\n",
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"structure_string": "Rb12 Fe8 Se16\n1.0\n7.611369 0.000000 0.000000\n-0.000000 11.199298 0.000000\n0.000000 0.000000 12.552353\nRb Fe Se\n12 8 16\ndirect\n0.093521 0.250000 0.763467 Rb\n0.593521 0.250000 0.736533 Rb\n0.906479 0.750000 0.236533 Rb\n0.406479 0.750000 0.263467 Rb\n0.081915 0.435754 0.133891 Rb\n0.581915 0.064246 0.366109 Rb\n0.918085 0.935754 0.866108 Rb\n0.418085 0.564246 0.633891 Rb\n0.918085 0.564246 0.866108 Rb\n0.418085 0.935754 0.633891 Rb\n0.081915 0.064246 0.133891 Rb\n0.581915 0.435754 0.366109 Rb\n0.555621 0.366091 0.029439 Fe\n0.055621 0.133909 0.470561 Fe\n0.944380 0.633909 0.529439 Fe\n0.444379 0.866091 0.970560 Fe\n0.944380 0.866091 0.529439 Fe\n0.555621 0.133909 0.029439 Fe\n0.055621 0.366091 0.470561 Fe\n0.444379 0.633909 0.970560 Fe\n0.354750 0.055329 0.893961 Se\n0.854750 0.444672 0.606038 Se\n0.354750 0.444672 0.893961 Se\n0.854750 0.055329 0.606038 Se\n0.645250 0.944672 0.106039 Se\n0.145250 0.555329 0.393961 Se\n0.074780 0.750000 0.667897 Se\n0.925220 0.250000 0.332103 Se\n0.425220 0.250000 0.167897 Se\n0.191707 0.750000 0.030126 Se\n0.691707 0.750000 0.469874 Se\n0.808294 0.250000 0.969874 Se\n0.308293 0.250000 0.530126 Se\n0.145250 0.944672 0.393961 Se\n0.574780 0.750000 0.832102 Se\n0.645250 0.555329 0.106039 Se\n",
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