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{
"id": "jvasp-111975",
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"structure_string": "V6 O11 F1\n1.0\n10.399233 0.003286 0.000000\n-8.413234 6.112409 0.000000\n0.000000 0.000000 2.868674\nV O F\n6 11 1\ndirect\n0.008907 0.991093 0.000000 V\n0.173038 0.826963 0.499999 V\n0.497209 0.502792 0.499999 V\n0.660747 0.339254 0.000000 V\n0.335340 0.664661 0.000000 V\n0.821868 0.178133 0.499999 V\n0.368038 0.033280 0.000000 O\n0.400230 0.599770 0.499999 O\n0.731233 0.268768 0.499999 O\n0.268318 0.731682 0.499999 O\n0.597365 0.402636 0.499999 O\n0.295369 0.296829 0.000000 O\n0.966721 0.631962 0.000000 O\n0.030811 0.363722 0.000000 O\n0.703172 0.704631 0.000000 O\n0.069699 0.930302 0.499999 O\n0.636278 0.969189 0.000000 O\n0.933935 0.066066 0.499999 F\n",
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{
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{
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"updated_at": "2022-09-04T14:38:51.517945Z",
"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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{
"id": "jvasp-119546",
"created_at": "2022-09-04T14:38:51.607513Z",
"updated_at": "2022-09-04T14:38:51.607541Z",
"structure_string": "Mn5 Sn1 O12\n1.0\n5.091816 -0.008393 0.241884\n-2.555758 4.403948 0.241884\n0.418015 0.724513 8.953601\nMn Sn O\n5 1 12\ndirect\n0.833063 0.166939 0.499999 Mn\n0.333329 0.666672 -0.000000 Mn\n0.666672 0.333330 -0.000000 Mn\n0.166939 0.833062 0.500000 Mn\n0.500001 0.500000 0.499999 Mn\n0.000000 0.000000 0.000000 Sn\n0.962716 0.605595 0.112946 O\n0.680163 0.680162 0.887066 O\n0.394407 0.037285 0.887053 O\n0.201078 0.534211 0.395751 O\n0.868433 0.868433 0.394286 O\n0.798924 0.465790 0.604248 O\n0.465790 0.798923 0.604248 O\n0.319839 0.319839 0.112933 O\n0.605595 0.962715 0.112946 O\n0.037286 0.394405 0.887053 O\n0.534212 0.201078 0.395751 O\n0.131569 0.131568 0.605713 O\n",
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{
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"created_at": "2022-09-04T14:38:52.697890Z",
"updated_at": "2022-09-04T14:38:52.697917Z",
"structure_string": "Fe6 O5 F7\n1.0\n4.608459 0.054811 0.155168\n0.284198 5.478044 0.512425\n0.013277 0.080303 7.503394\nFe O F\n6 5 7\ndirect\n0.570249 0.824864 0.658313 Fe\n0.500606 0.490423 0.017742 Fe\n0.506646 0.167734 0.321396 Fe\n0.972770 0.333532 0.688867 Fe\n0.001730 0.664552 0.328655 Fe\n0.972189 0.014646 0.982089 Fe\n0.287009 0.461376 0.236449 O\n0.708377 0.877982 0.415003 O\n0.693551 0.530709 0.789192 O\n0.696885 0.206157 0.103710 O\n0.796307 0.030297 0.761092 O\n0.800912 0.387822 0.434563 F\n0.788059 0.690247 0.106025 F\n0.296381 0.137499 0.562077 F\n0.293493 0.791470 0.904006 F\n0.189929 0.947029 0.223870 F\n0.195156 0.638869 0.557123 F\n0.229765 0.304782 0.909832 F\n",
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{
"id": "jvasp-111990",
"created_at": "2022-09-04T14:38:52.604304Z",
"updated_at": "2022-09-04T14:38:52.604328Z",
"structure_string": "Li4 V2 F12\n1.0\n5.283648 0.154351 -0.000000\n-2.629020 4.585740 0.000000\n-0.000000 -0.000000 8.309261\nLi V F\n4 2 12\ndirect\n0.544839 0.455161 0.022308 Li\n0.773805 0.226195 0.570621 Li\n0.226196 0.773804 0.070621 Li\n0.455161 0.544839 0.522307 Li\n0.879341 0.120658 0.235067 V\n0.120659 0.879341 0.735067 V\n0.374934 0.146650 0.585458 F\n0.902752 0.634522 0.902529 F\n0.146650 0.374934 0.085458 F\n0.918685 0.081314 0.735275 F\n0.081315 0.918685 0.235275 F\n0.625066 0.853350 0.085458 F\n0.097248 0.365478 0.402529 F\n0.365478 0.097248 0.902529 F\n0.634522 0.902752 0.402529 F\n0.676707 0.323293 0.208615 F\n0.853350 0.625066 0.585458 F\n0.323294 0.676706 0.708615 F\n",
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{
"id": "jvasp-116922",
"created_at": "2022-09-04T14:38:52.154407Z",
"updated_at": "2022-09-04T14:38:52.154430Z",
"structure_string": "Tb4 Al6 Ge8\n1.0\n7.961909 0.029630 0.000000\n-5.685633 5.573728 0.000000\n0.000000 0.000000 7.923222\nTb Al Ge\n4 6 8\ndirect\n0.114828 0.885172 0.419533 Tb\n0.885172 0.114828 0.580467 Tb\n0.385173 0.614828 0.919533 Tb\n0.614828 0.385172 0.080467 Tb\n0.534753 0.965248 0.250000 Al\n0.465248 0.034752 0.750000 Al\n0.965248 0.534753 0.750000 Al\n0.500000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.034753 0.465248 0.250000 Al\n0.313831 0.686170 0.555847 Ge\n0.206148 0.293852 0.250000 Ge\n0.293852 0.206148 0.750000 Ge\n0.793852 0.706148 0.750000 Ge\n0.706149 0.793852 0.250000 Ge\n0.186170 0.813830 0.055847 Ge\n0.813830 0.186170 0.944152 Ge\n0.686170 0.313830 0.444153 Ge\n",
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{
"id": "jvasp-111728",
"created_at": "2022-09-04T14:38:52.179970Z",
"updated_at": "2022-09-04T14:38:52.179979Z",
"structure_string": "Ti3 Mn3 Sn12\n1.0\n5.637991 0.000000 0.000000\n-2.818995 4.882644 -0.000000\n0.000000 0.000000 14.137960\nTi Mn Sn\n3 3 12\ndirect\n0.500000 -0.000000 0.500000 Ti\n0.000000 0.500000 0.166667 Ti\n0.500000 0.500000 0.833333 Ti\n0.000000 0.000000 0.500000 Mn\n0.000000 0.000000 0.166667 Mn\n0.000000 0.000000 0.833333 Mn\n0.500000 0.500000 0.217586 Sn\n0.000000 0.500000 0.782414 Sn\n0.000000 0.500000 0.550919 Sn\n0.500000 -0.000000 0.884252 Sn\n0.832989 0.167011 0.333333 Sn\n0.832989 0.665977 0.000000 Sn\n0.334022 0.167011 0.666667 Sn\n0.500000 -0.000000 0.115748 Sn\n0.665978 0.832988 0.666667 Sn\n0.167011 0.334022 0.000000 Sn\n0.167012 0.832988 0.333333 Sn\n0.500000 0.500000 0.449081 Sn\n",
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},
{
"id": "jvasp-111787",
"created_at": "2022-09-04T14:38:53.034869Z",
"updated_at": "2022-09-04T14:38:53.034903Z",
"structure_string": "Rb2 Sb2 W2 O12\n1.0\n6.395292 -0.026651 -3.573809\n-2.148307 5.919981 -3.743152\n0.068839 0.026651 7.325785\nRb Sb W O\n2 2 2 12\ndirect\n0.659510 0.382327 0.777182 Rb\n0.394855 0.617673 0.277182 Rb\n-0.003731 0.500000 0.496269 Sb\n-0.003731 -0.000000 -0.003731 Sb\n0.515497 0.991197 0.024302 W\n0.033105 0.008803 0.524302 W\n0.316656 0.688792 0.752840 O\n0.934674 0.066754 0.743406 O\n0.317505 0.063209 0.754296 O\n0.916100 0.672183 0.743917 O\n0.064048 0.311207 0.627863 O\n0.064048 0.936184 0.252841 O\n0.676653 0.308733 0.243406 O\n0.316656 0.063816 0.127863 O\n0.691089 0.936791 0.254297 O\n0.071735 0.327817 0.243917 O\n0.676652 0.933246 0.867921 O\n0.934674 0.691267 0.367921 O\n",
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{
"id": "jvasp-120428",
"created_at": "2022-09-04T14:38:52.048462Z",
"updated_at": "2022-09-04T14:38:52.048491Z",
"structure_string": "Pr6 C2 Br10\n1.0\n7.535108 -0.022437 -1.008719\n-2.941333 8.114280 -2.868236\n-0.005585 0.015391 9.160583\nPr C Br\n6 2 10\ndirect\n0.888373 0.959048 0.237200 Pr\n0.111626 0.040952 0.762799 Pr\n0.023282 0.712383 0.915081 Pr\n0.976718 0.287617 0.084918 Pr\n0.599224 0.841222 0.796164 Pr\n0.400776 0.158777 0.203835 Pr\n0.906827 0.965659 0.954339 C\n0.093172 0.034341 0.045660 C\n0.097011 0.374335 0.817187 Br\n0.902989 0.625664 0.182812 Br\n0.165607 0.719196 0.628514 Br\n0.834393 0.280803 0.371485 Br\n0.734176 0.914453 0.530087 Br\n0.452904 0.814220 0.089331 Br\n0.265824 0.085547 0.469912 Br\n0.635932 0.517554 0.714749 Br\n0.547096 0.185779 0.910668 Br\n0.364068 0.482445 0.285250 Br\n",
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{
"id": "jvasp-120435",
"created_at": "2022-09-04T14:38:52.052426Z",
"updated_at": "2022-09-04T14:38:52.052444Z",
"structure_string": "Y6 Mn2 Au10\n1.0\n7.136131 -0.008472 3.145037\n2.047575 6.836072 3.145037\n-0.011396 -0.008472 7.798429\nY Mn Au\n6 2 10\ndirect\n0.891704 0.191351 0.620761 Y\n0.620760 0.891704 0.191352 Y\n0.191350 0.620761 0.891705 Y\n0.108295 0.808649 0.379240 Y\n0.379239 0.108296 0.808650 Y\n0.808649 0.379240 0.108296 Y\n0.654119 0.654120 0.654121 Mn\n0.345880 0.345880 0.345881 Mn\n0.060985 0.446436 0.682862 Au\n0.553563 0.317139 0.939015 Au\n0.317138 0.939014 0.553565 Au\n0.939013 0.553565 0.317140 Au\n0.000000 0.000000 0.000000 Au\n0.801750 0.801751 0.801752 Au\n0.499999 0.500000 0.500001 Au\n0.682861 0.060986 0.446436 Au\n0.198248 0.198249 0.198249 Au\n0.446435 0.682861 0.060987 Au\n",
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},
{
"id": "jvasp-120467",
"created_at": "2022-09-04T14:38:52.073244Z",
"updated_at": "2022-09-04T14:38:52.073267Z",
"structure_string": "Tb12 Co4 Sn2\n1.0\n7.881395 0.002854 -2.768125\n-3.681920 6.800744 -3.157890\n0.000134 -0.002854 8.353377\nTb Co Sn\n12 4 2\ndirect\n0.442771 0.235857 0.206914 Tb\n0.676117 0.989358 0.313240 Tb\n0.323882 0.010642 0.686759 Tb\n0.676118 0.362877 0.686759 Tb\n0.815706 0.285029 0.100735 Tb\n0.184294 0.714971 0.899265 Tb\n0.323882 0.637123 0.313241 Tb\n0.184294 0.285030 0.469324 Tb\n0.971057 0.764142 0.206913 Tb\n0.028943 0.235857 0.793086 Tb\n0.557229 0.764143 0.793086 Tb\n0.815706 0.714970 0.530676 Tb\n0.342831 -0.000000 0.342831 Co\n0.657169 -0.000000 0.657169 Co\n0.113075 0.613075 0.500000 Co\n0.886925 0.386924 0.500000 Co\n0.500000 0.499999 -0.000001 Sn\n0.000000 0.000000 0.000000 Sn\n",
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"formula_full": "Tb12 Co4 Sn2",
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"spacegroup": 71
}
]
}