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{
"id": "jvasp-59744",
"created_at": "2022-09-04T14:38:08.164555Z",
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"structure_string": "Tl1 Cd1 N3 O6\n1.0\n5.788456 0.000000 0.000000\n-0.000000 5.788456 -0.000000\n-0.000000 0.000000 5.788456\nTl Cd N O\n1 1 3 6\ndirect\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Cd\n0.500000 0.500000 0.000000 N\n0.500000 0.000000 0.500000 N\n0.000000 0.500000 0.500000 N\n0.500000 0.000000 0.714878 O\n0.000000 0.714878 0.500000 O\n0.000000 0.285123 0.500000 O\n0.500000 0.000000 0.285123 O\n0.285123 0.500000 0.000000 O\n0.714878 0.500000 0.000000 O\n",
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{
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{
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"structure_string": "V6 O4 F12\n1.0\n0.000000 5.413791 -0.035964\n4.711936 0.000000 0.000000\n0.000000 -1.025213 -9.984340\nV O F\n6 4 12\ndirect\n0.500000 0.500000 -0.000000 V\n0.266942 0.980590 0.755370 V\n0.733058 0.480590 0.744630 V\n0.500000 0.000000 0.500000 V\n0.266942 0.519411 0.255370 V\n0.733058 0.019410 0.244630 V\n0.472141 0.684870 0.822657 O\n0.527860 0.184870 0.677343 O\n0.472141 0.815131 0.322657 O\n0.527859 0.315131 0.177343 O\n0.028214 0.218372 0.194167 F\n0.971786 0.718373 0.305833 F\n0.784299 0.176024 0.426268 F\n0.304995 0.316050 0.424427 F\n0.695006 0.683951 0.575572 F\n0.304995 0.183950 0.924427 F\n0.028214 0.281628 0.694167 F\n0.971786 0.781628 0.805833 F\n0.784299 0.323977 0.926268 F\n0.215701 0.676024 0.073732 F\n0.215701 0.823977 0.573732 F\n0.695005 0.816050 0.075572 F\n",
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{
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"updated_at": "2022-09-04T14:36:43.619673Z",
"structure_string": "Sr2 Zn1 P2\n1.0\n4.231991 0.000000 0.000000\n-2.115996 3.665012 0.000000\n-0.000000 -0.000000 8.320507\nSr Zn P\n2 1 2\ndirect\n0.000000 0.000000 0.705730 Sr\n0.000000 0.000000 0.294271 Sr\n0.666666 0.333333 -0.000000 Zn\n0.666666 0.333333 0.500000 P\n0.333332 0.666666 -0.000000 P\n",
"nsites": 5,
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{
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"created_at": "2022-09-04T14:38:31.497213Z",
"updated_at": "2022-09-04T14:38:31.497236Z",
"structure_string": "Cr2 S4\n1.0\n3.095877 0.053488 0.052636\n1.501302 2.708026 0.052636\n-1.722433 -2.840859 11.871446\nCr S\n2 4\ndirect\n0.000000 0.000000 0.000000 Cr\n-0.000000 0.500001 0.500000 Cr\n0.333741 0.456039 0.122297 S\n0.333772 0.956070 0.622296 S\n0.666229 0.043933 0.377705 S\n0.666260 0.543964 0.877704 S\n",
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{
"id": "jvasp-79450",
"created_at": "2022-09-04T14:37:17.331943Z",
"updated_at": "2022-09-04T14:37:17.331973Z",
"structure_string": "K1 Mn1 O2\n1.0\n2.826254 -0.001237 0.686312\n1.338913 -3.101024 0.643118\n2.819538 -0.016870 -5.448787\nK Mn O\n1 1 2\ndirect\n0.000003 0.499989 0.500002 K\n-0.000014 0.000024 0.000002 Mn\n0.497706 0.820594 0.183987 O\n0.502293 0.179405 0.816008 O\n",
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{
"id": "jvasp-99715",
"created_at": "2022-09-04T14:36:20.758556Z",
"updated_at": "2022-09-04T14:36:20.758592Z",
"structure_string": "Rb2 Sb1 Au1 Cl6\n1.0\n6.504546 -0.000000 3.755401\n2.168182 6.132545 3.755401\n0.000000 0.000000 7.510802\nRb Sb Au Cl\n2 1 1 6\ndirect\n0.750000 0.749999 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Sb\n0.500000 0.500000 0.500000 Au\n0.750145 0.249855 0.249855 Cl\n0.249855 0.249855 0.750145 Cl\n0.249855 0.750144 0.750145 Cl\n0.249855 0.750144 0.249855 Cl\n0.750145 0.249855 0.750145 Cl\n0.750145 0.750144 0.249855 Cl\n",
"nsites": 10,
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{
"id": "jvasp-120037",
"created_at": "2022-09-04T14:38:52.902936Z",
"updated_at": "2022-09-04T14:38:52.902971Z",
"structure_string": "Y1 Br1 O1\n1.0\n4.636120 0.000000 0.000000\n-2.318060 4.014997 0.000000\n0.000000 -0.000000 4.235119\nY Br O\n1 1 1\ndirect\n0.666668 0.333334 0.000000 Y\n0.000000 0.000000 0.000000 Br\n0.333334 0.666667 0.000000 O\n",
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},
{
"id": "jvasp-11380",
"created_at": "2022-09-04T14:37:00.755357Z",
"updated_at": "2022-09-04T14:37:00.755374Z",
"structure_string": "K4 V2 Cu2 Se8\n1.0\n5.483468 0.000000 1.315771\n2.741734 6.604754 0.657885\n0.023759 0.000000 11.985033\nK V Cu Se\n4 2 2 8\ndirect\n0.944385 0.750000 0.111230 K\n0.305615 0.750000 0.388769 K\n0.055615 0.250000 0.888769 K\n0.694385 0.250000 0.611230 K\n0.125000 0.750000 0.750000 V\n0.875000 0.250000 0.250000 V\n0.625000 0.750000 0.749999 Cu\n0.375000 0.250000 0.250000 Cu\n0.267015 0.045297 0.134617 Se\n0.946930 0.454703 0.365382 Se\n0.687689 0.045297 0.365382 Se\n0.598368 0.454703 0.134617 Se\n0.732985 0.954703 0.865382 Se\n0.053071 0.545296 0.634617 Se\n0.312312 0.954703 0.634617 Se\n0.401633 0.545296 0.865382 Se\n",
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"volume": 433.8549534061906,
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{
"id": "jvasp-25020",
"created_at": "2022-09-04T14:37:50.913912Z",
"updated_at": "2022-09-04T14:37:50.913928Z",
"structure_string": "I8 Cl8 O8 F8\n1.0\n0.000000 7.517596 0.058837\n7.042502 0.000000 0.000000\n0.000000 -1.070086 -12.730549\nI Cl O F\n8 8 8 8\ndirect\n0.309561 0.397783 0.414282 I\n0.643915 0.457845 0.218162 I\n0.356085 0.542155 0.781838 I\n0.143914 0.042155 0.218162 I\n0.190438 0.897783 0.585718 I\n0.856086 0.957845 0.781838 I\n0.690439 0.602217 0.585718 I\n0.809562 0.102217 0.414282 I\n0.715755 0.874902 0.936022 Cl\n0.539182 0.761188 0.155010 Cl\n0.460818 0.238812 0.844990 Cl\n0.039182 0.738812 0.155010 Cl\n0.784246 0.374902 0.063978 Cl\n0.284245 0.125097 0.063978 Cl\n0.960818 0.261188 0.844990 Cl\n0.215754 0.625097 0.936022 Cl\n0.770598 0.649015 0.722430 O\n0.270598 0.850985 0.722430 O\n0.039757 0.025655 0.395251 O\n0.460242 0.525654 0.604749 O\n0.229402 0.350985 0.277570 O\n0.539758 0.474345 0.395251 O\n0.960243 0.974345 0.604749 O\n0.729402 0.149015 0.277569 O\n0.417317 0.132681 0.424200 F\n0.582683 0.867319 0.575800 F\n0.082683 0.632680 0.575800 F\n0.741372 0.833034 0.392074 F\n0.258628 0.166966 0.607926 F\n0.917317 0.367319 0.424200 F\n0.758628 0.333034 0.607926 F\n0.241372 0.666966 0.392074 F\n",
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{
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"created_at": "2022-09-04T14:36:01.468602Z",
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"structure_string": "Sb4 Xe4 O4 F36\n1.0\n8.539581 -0.040166 -0.369741\n-2.599516 8.780000 -3.334725\n0.016140 -0.068660 10.055199\nSb Xe O F\n4 4 4 36\ndirect\n0.925504 0.747057 0.251630 Sb\n0.433577 0.775896 0.585864 Sb\n0.074496 0.252943 0.748370 Sb\n0.566422 0.224103 0.414136 Sb\n0.560832 0.228757 0.878765 Xe\n0.925846 0.795198 0.723374 Xe\n0.439167 0.771243 0.121234 Xe\n0.074153 0.204802 0.276625 Xe\n0.102766 0.884668 0.864669 O\n0.266480 0.786834 0.019821 O\n0.733519 0.213165 0.980178 O\n0.897233 0.115332 0.135330 O\n0.746781 0.139784 0.401565 F\n0.685879 0.427771 0.865870 F\n0.869166 0.531052 0.166841 F\n0.778942 0.650169 0.795025 F\n0.064407 0.228475 0.927369 F\n0.412841 0.748371 0.762665 F\n0.253218 0.860216 0.598435 F\n0.587158 0.251629 0.237335 F\n0.695050 0.741635 0.235200 F\n0.479098 0.368515 0.039770 F\n0.221057 0.349831 0.204975 F\n0.153740 0.770733 0.285201 F\n0.363252 0.281209 0.421688 F\n0.314120 0.572228 0.134130 F\n0.023442 0.028557 0.656121 F\n0.846259 0.229266 0.714798 F\n0.691247 0.427760 0.521946 F\n0.976558 0.971442 0.343879 F\n0.522735 0.185728 0.585654 F\n0.426385 0.013292 0.306793 F\n0.520901 0.631485 0.960230 F\n0.304949 0.258364 0.764800 F\n0.130833 0.468948 0.833159 F\n0.935592 0.771524 0.072630 F\n0.009887 0.615236 0.629051 F\n0.096510 0.260765 0.561441 F\n0.477264 0.814271 0.414345 F\n0.806992 0.939145 0.839807 F\n0.193007 0.060854 0.160192 F\n0.606089 0.932995 0.078882 F\n0.636748 0.718790 0.578312 F\n0.308752 0.572240 0.478053 F\n-0.009887 0.384764 0.370949 F\n0.393910 0.067005 0.921118 F\n0.903490 0.739235 0.438558 F\n0.573614 0.986708 0.693207 F\n",
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{
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"created_at": "2022-09-04T14:37:38.856893Z",
"updated_at": "2022-09-04T14:37:38.856908Z",
"structure_string": "Rb2 Ge1 F6\n1.0\n5.194025 0.000000 2.998772\n1.731341 4.896974 2.998772\n0.000000 -0.000000 5.997544\nRb Ge F\n2 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.749999 0.749999 0.750000 Rb\n0.000000 0.000000 0.000000 Ge\n0.216686 0.783314 0.783314 F\n0.216686 0.783314 0.216686 F\n0.783314 0.216686 0.783314 F\n0.783314 0.216686 0.216686 F\n0.783314 0.783314 0.216686 F\n0.216686 0.216686 0.783314 F\n",
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}
]
}