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{
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{
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"structure_string": "S8 O20 F8\n1.0\n7.428912 -0.000000 -0.000000\n-0.000000 7.428912 0.000000\n0.000000 -0.000000 9.029232\nS O F\n8 20 8\ndirect\n0.677445 0.079956 0.137417 S\n0.920044 0.677445 0.862583 S\n0.177445 0.420044 0.362583 S\n0.822555 0.579956 0.362583 S\n0.322555 0.920044 0.137417 S\n0.420044 0.822555 0.637416 S\n0.579956 0.177445 0.637416 S\n0.079956 0.322555 0.862583 S\n0.615239 0.301538 0.752435 O\n0.976190 0.288095 0.991082 O\n0.788095 0.476191 0.491082 O\n0.211905 0.523809 0.491082 O\n0.023809 0.711904 0.991082 O\n0.523809 0.788095 0.508918 O\n0.711904 0.976190 0.008918 O\n0.384760 0.698462 0.752435 O\n0.198462 0.884760 0.252435 O\n0.698462 0.615239 0.247565 O\n0.301538 0.384760 0.247565 O\n0.884760 0.801538 0.747565 O\n0.115239 0.198462 0.747565 O\n0.476191 0.211905 0.508918 O\n0.288095 0.023809 0.008918 O\n0.801538 0.115239 0.252435 O\n0.500000 0.000000 0.224335 O\n0.000000 0.500000 0.775664 O\n0.000000 0.500000 0.275664 O\n0.500000 0.000000 0.724335 O\n0.095161 0.235703 0.414578 F\n0.264297 0.404839 0.914578 F\n0.404839 0.735703 0.085421 F\n0.235703 0.904839 0.585421 F\n0.764297 0.095161 0.585421 F\n0.595160 0.264297 0.085421 F\n0.735703 0.595160 0.914578 F\n0.904839 0.764297 0.414578 F\n",
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{
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"structure_string": "V2 H2 O5\n1.0\n-0.000000 2.883415 0.000000\n0.126411 0.000000 4.861144\n5.986034 -1.441708 -0.737470\nV H O\n2 2 5\ndirect\n0.861873 0.600577 0.723744 V\n0.138127 0.399422 0.276255 V\n0.648186 0.936646 0.296371 H\n0.351814 0.063353 0.703629 H\n-0.000000 0.500000 -0.000000 O\n0.692096 0.649613 0.384191 O\n0.307904 0.350386 0.615808 O\n0.379426 0.869871 0.758851 O\n0.620574 0.130128 0.241148 O\n",
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{
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"created_at": "2022-09-04T14:36:08.310065Z",
"updated_at": "2022-09-04T14:36:08.310081Z",
"structure_string": "Ce4 Zn4 Cu10\n1.0\n5.071037 -0.024000 11.957633\n2.411350 4.461096 11.957633\n-0.040471 -0.024000 12.988410\nCe Zn Cu\n4 4 10\ndirect\n0.945238 0.945238 0.945236 Ce\n0.152983 0.152983 0.152983 Ce\n0.847017 0.847017 0.847015 Ce\n0.054762 0.054762 0.054762 Ce\n0.500000 -0.000000 0.500000 Zn\n0.500000 0.500000 0.499999 Zn\n0.500000 0.500000 -0.000001 Zn\n-0.000000 0.500000 0.500000 Zn\n0.388439 0.388439 0.388438 Cu\n0.110589 0.608469 0.608468 Cu\n0.391531 0.889412 0.391530 Cu\n0.391531 0.391531 0.889411 Cu\n0.608469 0.110589 0.608468 Cu\n0.608469 0.608469 0.110588 Cu\n0.889412 0.391531 0.391530 Cu\n0.722725 0.722725 0.722723 Cu\n0.277276 0.277276 0.277275 Cu\n0.611561 0.611561 0.611560 Cu\n",
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{
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"created_at": "2022-09-04T14:36:07.949898Z",
"updated_at": "2022-09-04T14:36:07.949922Z",
"structure_string": "Ba2 Sc2 O5\n1.0\n4.166246 -0.000000 0.000000\n0.000000 4.166246 0.000000\n-0.000000 -0.000000 8.264804\nBa Sc O\n2 2 5\ndirect\n0.000000 0.000000 0.000000 Ba\n0.000000 0.000000 0.500000 Ba\n0.500000 0.500000 0.261114 Sc\n0.500000 0.500000 0.738886 Sc\n0.500000 0.000000 0.221457 O\n0.500000 0.000000 0.778543 O\n-0.000000 0.500000 0.221457 O\n-0.000000 0.500000 0.778543 O\n0.500000 0.500000 0.500000 O\n",
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{
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"structure_string": "Er10 Ni4 Te4\n1.0\n3.949934 0.000000 0.000000\n-1.974967 7.421005 -0.000000\n0.000000 -0.000000 14.794136\nEr Ni Te\n10 4 4\ndirect\n0.961026 0.922056 0.873347 Er\n0.961026 0.922056 0.626654 Er\n0.260623 0.521247 0.869397 Er\n0.739376 0.478754 0.130603 Er\n0.739376 0.478754 0.369397 Er\n0.392143 0.784288 0.250000 Er\n0.038972 0.077945 0.373347 Er\n0.260623 0.521247 0.630603 Er\n0.038972 0.077945 0.126654 Er\n0.607856 0.215713 0.750000 Er\n0.582811 0.165622 0.250000 Ni\n0.812296 0.624595 0.750000 Ni\n0.417188 0.834379 0.750000 Ni\n0.187702 0.375405 0.250000 Ni\n0.617132 0.234266 0.960769 Te\n0.617132 0.234266 0.539231 Te\n0.382867 0.765734 0.460769 Te\n0.382867 0.765734 0.039231 Te\n",
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{
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"created_at": "2022-09-04T14:36:04.240772Z",
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"structure_string": "Sm2 Fe2 O5\n1.0\n7.135911 -0.020068 0.004384\n0.010686 3.895643 0.002693\n-0.002246 -0.002855 3.833283\nSm Fe O\n2 2 5\ndirect\n-0.000009 0.984634 0.000032 Sm\n0.499976 0.111897 0.999911 Sm\n0.206100 0.495173 0.500007 Fe\n0.793904 0.495128 0.500005 Fe\n0.216656 0.483339 0.000006 O\n0.783369 0.483257 0.000002 O\n0.500006 0.462438 0.499940 O\n0.218110 0.992080 0.500035 O\n0.781887 0.992041 0.500042 O\n",
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{
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"structure_string": "Zn4 Bi4 O10\n1.0\n3.544295 0.012593 -0.428465\n-0.008327 6.258888 0.116294\n-2.137726 -0.225992 12.018447\nZn Bi O\n4 4 10\ndirect\n0.896798 0.263370 0.146817 Zn\n0.634073 0.633754 0.883935 Zn\n0.133967 0.866242 0.383930 Zn\n0.396888 0.236649 0.646817 Zn\n0.641088 0.359307 0.391276 Bi\n-0.117511 0.761481 0.632363 Bi\n0.141217 0.140681 0.891274 Bi\n0.382426 0.738528 0.132368 Bi\n0.067001 0.151599 0.317120 O\n0.597881 0.728642 0.347795 O\n0.800981 0.576712 0.050890 O\n0.567137 0.348394 0.817128 O\n-0.715423 0.467567 0.534878 O\n0.097997 0.771349 0.847791 O\n-0.055095 0.100453 0.694924 O\n0.784673 0.032432 0.034888 O\n0.444832 0.399550 0.194924 O\n0.301038 0.923294 0.550884 O\n",
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{
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{
"id": "jvasp-13078",
"created_at": "2022-09-04T14:37:01.134096Z",
"updated_at": "2022-09-04T14:37:01.134132Z",
"structure_string": "Li4 B4 Se10\n1.0\n5.155472 -0.000000 1.172849\n2.462074 5.341732 1.094837\n-0.040563 0.056532 12.095642\nLi B Se\n4 4 10\ndirect\n0.856541 0.315707 0.931702 Li\n0.103951 0.184292 0.568298 Li\n0.143458 0.684292 0.068298 Li\n0.896048 0.815707 0.431703 Li\n0.307414 0.574117 0.707381 B\n0.588913 0.925882 0.792619 B\n0.692586 0.425882 0.292619 B\n0.411087 0.074118 0.207381 B\n0.733471 0.928889 0.939009 Se\n0.601369 0.571110 0.560991 Se\n0.076010 0.149080 0.340686 Se\n0.565775 0.350920 0.159314 Se\n0.758818 0.750000 0.250000 Se\n0.434224 0.649079 0.840686 Se\n0.241182 0.250000 0.750000 Se\n0.398630 0.428889 0.439009 Se\n0.923990 0.850919 0.659314 Se\n0.266529 0.071110 0.060991 Se\n",
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}