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{
"id": "jvasp-30781",
"created_at": "2022-09-04T14:38:37.414548Z",
"updated_at": "2022-09-04T14:38:37.414580Z",
"structure_string": "Zn4 Sn12 O28\n1.0\n5.233426 0.000000 -0.000000\n0.000000 10.291181 0.000000\n0.000000 0.000000 10.253908\nZn Sn O\n4 12 28\ndirect\n0.662281 0.750000 0.869587 Zn\n0.162280 0.250000 0.630413 Zn\n0.337720 0.250000 0.130413 Zn\n0.837720 0.750000 0.369587 Zn\n0.640838 0.015294 0.640336 Sn\n0.359163 0.515294 0.359664 Sn\n0.859163 0.484706 0.140336 Sn\n0.176388 0.750000 0.644233 Sn\n0.676388 0.250000 0.855767 Sn\n0.140838 0.984706 0.859664 Sn\n0.323613 0.750000 0.144233 Sn\n0.140838 0.515294 0.859664 Sn\n0.640838 0.484706 0.640336 Sn\n0.859163 0.015294 0.140336 Sn\n0.359163 0.984706 0.359664 Sn\n0.823613 0.250000 0.355767 Sn\n0.919370 0.620750 0.717271 O\n0.204693 0.750000 0.454822 O\n0.704693 0.250000 0.045178 O\n0.795308 0.250000 0.545178 O\n0.295308 0.750000 0.954822 O\n0.816129 0.917091 0.966940 O\n0.683872 0.582908 0.466940 O\n0.316128 0.082908 0.533060 O\n0.816129 0.582908 0.966940 O\n0.316128 0.417092 0.533060 O\n0.419369 0.379250 0.782729 O\n0.183872 0.417092 0.033060 O\n0.080631 0.120750 0.282729 O\n0.585574 0.121253 0.257903 O\n0.080631 0.379250 0.282729 O\n0.580631 0.620750 0.217271 O\n0.919370 0.879250 0.717271 O\n0.419369 0.120750 0.782729 O\n0.414427 0.621253 0.742097 O\n0.914427 0.378747 0.757903 O\n0.183872 0.082908 0.033060 O\n0.085574 0.878747 0.242097 O\n0.585574 0.378747 0.257903 O\n0.085574 0.621253 0.242097 O\n0.414427 0.878747 0.742097 O\n0.914427 0.121253 0.757903 O\n0.580631 0.879250 0.217271 O\n0.683872 0.917091 0.466940 O\n",
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{
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"structure_string": "Y6 Ni1 I10\n1.0\n7.524430 -0.023530 -0.933395\n-2.834599 8.633038 -2.854712\n-0.009466 -0.026503 9.534660\nY Ni I\n6 1 10\ndirect\n0.888311 0.962301 0.240913 Y\n0.111688 0.037700 0.759087 Y\n0.027310 0.714717 0.913995 Y\n0.972689 0.285284 0.086005 Y\n0.651673 0.874977 0.835531 Y\n0.348326 0.125023 0.164469 Y\n0.000000 0.000000 0.000000 Ni\n0.548818 0.190167 0.905006 I\n0.451181 0.809833 0.094994 I\n0.912250 0.626784 0.186552 I\n0.087750 0.373217 0.813447 I\n0.365078 0.462466 0.277357 I\n0.729425 0.909536 0.531678 I\n0.213566 0.732432 0.642433 I\n0.634921 0.537534 0.722643 I\n0.270575 0.090464 0.468322 I\n0.786434 0.267569 0.357567 I\n",
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],
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{
"id": "jvasp-110701",
"created_at": "2022-09-04T14:38:37.417871Z",
"updated_at": "2022-09-04T14:38:37.417885Z",
"structure_string": "Rb2 Sb1 Au1 Br6\n1.0\n6.832795 -0.000000 3.944916\n2.277598 6.442021 3.944916\n-0.000000 -0.000000 7.889832\nRb Sb Au Br\n2 1 1 6\ndirect\n0.750001 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Sb\n0.500001 0.500000 0.500000 Au\n0.748290 0.251710 0.251711 Br\n0.251711 0.251710 0.748290 Br\n0.251711 0.748290 0.748290 Br\n0.251711 0.748290 0.251711 Br\n0.748290 0.251710 0.748290 Br\n0.748290 0.748290 0.251711 Br\n",
"nsites": 10,
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"elements": [
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{
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"created_at": "2022-09-04T14:38:37.418207Z",
"updated_at": "2022-09-04T14:38:37.418223Z",
"structure_string": "Yb1 Ga1 Cu4\n1.0\n5.080148 -0.000000 0.000000\n-2.540074 4.399537 0.000000\n0.000000 -0.000000 4.054274\nYb Ga Cu\n1 1 4\ndirect\n0.333334 0.666667 -0.000000 Yb\n0.666667 0.333334 -0.000000 Ga\n0.000000 0.000000 0.000000 Cu\n0.330007 0.165004 0.500000 Cu\n0.834997 0.165004 0.500000 Cu\n0.834998 0.669993 0.500000 Cu\n",
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{
"id": "jvasp-110704",
"created_at": "2022-09-04T14:38:37.418580Z",
"updated_at": "2022-09-04T14:38:37.418608Z",
"structure_string": "Rb2 Ag1 Bi1 I6\n1.0\n7.381539 -0.000000 4.261733\n2.460513 6.959381 4.261733\n-0.000000 -0.000000 8.523467\nRb Ag Bi I\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 Bi\n0.745277 0.254723 0.254722 I\n0.254723 0.254723 0.745277 I\n0.254723 0.745277 0.745277 I\n0.254723 0.745277 0.254723 I\n0.745277 0.254723 0.745277 I\n0.745277 0.745277 0.254722 I\n",
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{
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"created_at": "2022-09-04T14:38:37.419012Z",
"updated_at": "2022-09-04T14:38:37.419040Z",
"structure_string": "Nd2 Si2 Os4 C2\n1.0\n5.926886 -0.002504 0.000000\n-4.589529 3.750227 0.000000\n-0.000000 -0.000000 7.204064\nNd Si Os C\n2 2 4 2\ndirect\n0.549163 0.450839 0.250000 Nd\n0.450839 0.549163 0.750000 Nd\n0.270434 0.729568 0.250000 Si\n0.729568 0.270434 0.750000 Si\n0.834049 0.165953 0.058796 Os\n0.165953 0.834049 0.941204 Os\n0.165953 0.834049 0.558795 Os\n0.834049 0.165953 0.441204 Os\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
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{
"id": "jvasp-110826",
"created_at": "2022-09-04T14:38:37.419194Z",
"updated_at": "2022-09-04T14:38:37.419222Z",
"structure_string": "Mg1 S2\n1.0\n3.649914 0.009476 3.595515\n1.511206 3.322381 3.595515\n0.014678 0.009476 5.123416\nMg S\n1 2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.423297 0.423298 0.423297 S\n0.576703 0.576705 0.576704 S\n",
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{
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"created_at": "2022-09-04T14:38:37.447342Z",
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"structure_string": "Li3 Mn1 F6\n1.0\n4.938507 0.002462 0.073774\n-2.529876 4.241296 0.073774\n0.004807 0.008469 4.906199\nLi Mn F\n3 1 6\ndirect\n0.320842 0.679159 0.499999 Li\n0.000000 0.000000 0.500000 Li\n0.679159 0.320842 0.499999 Li\n0.000000 0.000000 0.000000 Mn\n0.681013 0.987826 0.275374 F\n0.318988 0.012174 0.724624 F\n0.987826 0.681013 0.275374 F\n0.704049 0.704049 0.772561 F\n0.012175 0.318988 0.724624 F\n0.295952 0.295952 0.227438 F\n",
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"structure_string": "Cu1 F3\n1.0\n5.956960 0.982130 0.534512\n-3.591227 -2.798331 -0.317753\n-0.578067 -1.229114 -3.522043\nCu F\n1 3\ndirect\n0.908274 0.930730 -0.018655 Cu\n0.539079 0.862705 0.837769 F\n0.908232 0.930616 0.481359 F\n0.277504 -0.001225 0.124851 F\n",
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"created_at": "2022-09-04T14:38:37.450779Z",
"updated_at": "2022-09-04T14:38:37.450806Z",
"structure_string": "Na3 Pr1 Cl6\n1.0\n6.573416 -0.000000 3.795163\n2.191139 6.197476 3.795163\n-0.000000 -0.000000 7.590327\nNa Pr Cl\n3 1 6\ndirect\n0.750000 0.750000 0.749999 Na\n0.250000 0.250000 0.250000 Na\n0.500000 0.500000 0.499999 Na\n0.000000 0.000000 0.000000 Pr\n0.746612 0.253389 0.253388 Cl\n0.253389 0.253389 0.746611 Cl\n0.253389 0.746612 0.746611 Cl\n0.253389 0.746612 0.253388 Cl\n0.746612 0.253389 0.746611 Cl\n0.746612 0.746612 0.253388 Cl\n",
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"created_at": "2022-09-04T14:38:37.455154Z",
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"structure_string": "Ba4 Bi2 O1\n1.0\n5.134973 0.007349 -8.736709\n-0.373905 5.121348 -8.736709\n-0.006823 -0.007349 10.134002\nBa Bi O\n4 2 1\ndirect\n0.997661 0.497661 0.500000 Ba\n0.497662 0.997661 0.500001 Ba\n0.833649 0.833649 0.000000 Ba\n0.177196 0.177196 0.000000 Ba\n0.636588 0.636588 0.000000 Bi\n0.361386 0.361386 0.000000 Bi\n0.978660 0.978661 0.000001 O\n",
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"structure_string": "Sb4 Te3 Se3\n1.0\n10.238774 -0.015413 1.210117\n9.378576 4.107920 1.210117\n0.015239 0.003179 7.287659\nSb Te Se\n4 3 3\ndirect\n0.908399 0.908400 0.702471 Sb\n0.406540 0.406541 0.191742 Sb\n0.588662 0.588663 0.803076 Sb\n0.091551 0.091552 0.302696 Sb\n0.819609 0.819610 0.393205 Te\n0.178005 0.178005 0.610583 Te\n0.678901 0.678902 0.103137 Te\n0.497501 0.497502 0.501298 Se\n0.999031 0.999032 0.000719 Se\n0.331798 0.331799 0.891079 Se\n",
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}