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{
"id": "jvasp-90417",
"created_at": "2022-09-04T14:35:59.620371Z",
"updated_at": "2022-09-04T14:35:59.620411Z",
"structure_string": "I2 Cl6\n1.0\n-0.004216 0.067171 -5.434991\n-5.653570 0.000633 -0.905449\n-2.341389 7.829684 -1.717122\nI Cl\n2 6\ndirect\n0.817795 -0.000658 0.812417 I\n0.182204 0.000660 0.187582 I\n0.129668 0.293682 0.860915 Cl\n0.870332 0.706319 0.139084 Cl\n0.783550 0.277982 0.534972 Cl\n0.216450 0.722019 0.465027 Cl\n0.460588 0.277050 0.206182 Cl\n0.539412 0.722951 0.793817 Cl\n",
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{
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"updated_at": "2022-09-04T14:38:38.123460Z",
"structure_string": "Ga2 Te2 Cl2\n1.0\n7.112578 -2.074867 0.551151\n7.112578 2.074867 0.551151\n-3.129213 0.000000 5.857408\nGa Te Cl\n2 2 2\ndirect\n0.318653 0.318653 0.409096 Ga\n0.681347 0.681347 0.590904 Ga\n0.884343 0.884343 0.688439 Te\n0.115657 0.115657 0.311561 Te\n0.372546 0.372546 0.141305 Cl\n0.627455 0.627455 0.858695 Cl\n",
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{
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"updated_at": "2022-09-04T14:37:09.942898Z",
"structure_string": "Ce1 Bi1\n1.0\n4.155594 0.000000 -0.000000\n0.000000 4.155594 -0.000000\n-0.000000 -0.000000 3.475219\nCe Bi\n1 1\ndirect\n0.499999 0.499999 0.500000 Ce\n0.000000 0.000000 0.000000 Bi\n",
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{
"id": "jvasp-14888",
"created_at": "2022-09-04T14:36:21.655780Z",
"updated_at": "2022-09-04T14:36:21.655809Z",
"structure_string": "Th2 Sb4\n1.0\n4.420824 0.000000 -0.000000\n0.000000 4.420824 0.000000\n-0.000000 0.000000 9.212310\nTh Sb\n2 4\ndirect\n0.000000 0.500000 0.276097 Th\n0.500000 0.000000 0.723903 Th\n0.000000 0.000000 0.000000 Sb\n0.500000 0.500000 0.000000 Sb\n0.000000 0.500000 0.633695 Sb\n0.500000 0.000000 0.366305 Sb\n",
"nsites": 6,
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"density": 8.772182239266495,
"density_atomic": 0.03332546791583608,
"volume": 180.04248327894695,
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"formula_full": "Th2 Sb4",
"formula_reduced": "ThSb2",
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"spacegroup": 129
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{
"id": "jvasp-17594",
"created_at": "2022-09-04T14:38:19.227090Z",
"updated_at": "2022-09-04T14:38:19.227116Z",
"structure_string": "Sr2 In4\n1.0\n2.531862 -4.385314 0.000000\n2.531862 4.385314 -0.000000\n-0.000000 -0.000000 8.107932\nSr In\n2 4\ndirect\n0.000000 0.000000 0.750000 Sr\n0.000000 0.000000 0.250000 Sr\n0.333333 0.666666 0.953445 In\n0.666666 0.333333 0.453445 In\n0.333333 0.666666 0.546554 In\n0.666666 0.333333 0.046555 In\n",
"nsites": 6,
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{
"id": "jvasp-122884",
"created_at": "2022-09-04T14:38:54.888438Z",
"updated_at": "2022-09-04T14:38:54.888476Z",
"structure_string": "Sm3 Ru1\n1.0\n1.957276 -3.390101 0.000000\n1.957276 3.390101 -0.000000\n-0.000000 -0.000000 9.045126\nSm Ru\n3 1\ndirect\n0.000000 0.000000 0.500000 Sm\n0.333334 0.666668 0.176007 Sm\n0.666668 0.333334 0.823993 Sm\n0.000000 0.000000 0.000000 Ru\n",
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{
"id": "jvasp-8665",
"created_at": "2022-09-04T14:37:08.575838Z",
"updated_at": "2022-09-04T14:37:08.575864Z",
"structure_string": "I2 Cl6\n1.0\n5.422061 0.234330 0.301442\n0.667147 5.687186 -0.026921\n1.275125 2.489880 7.868380\nI Cl\n2 6\ndirect\n0.817802 -0.000632 0.812405 I\n0.182199 0.000632 0.187595 I\n0.460649 0.276972 0.206171 Cl\n0.539352 0.723028 0.793829 Cl\n0.870349 0.706311 0.139080 Cl\n0.129652 0.293690 0.860920 Cl\n0.216449 0.721984 0.465029 Cl\n0.783552 0.278016 0.534971 Cl\n",
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{
"id": "jvasp-78776",
"created_at": "2022-09-04T14:37:10.835957Z",
"updated_at": "2022-09-04T14:37:10.835979Z",
"structure_string": "La1 Cd1\n1.0\n3.915318 0.000000 0.000000\n0.000000 3.915318 -0.000000\n0.000000 0.000000 3.915318\nLa Cd\n1 1\ndirect\n0.500000 0.500000 0.500000 La\n0.000000 0.000000 0.000000 Cd\n",
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"density": 6.952947104946687,
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"volume": 60.02070923538354,
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"formula_full": "La1 Cd1",
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{
"id": "jvasp-28511",
"created_at": "2022-09-04T14:36:59.744399Z",
"updated_at": "2022-09-04T14:36:59.744418Z",
"structure_string": "Te2 Mo2 W1 Se4\n1.0\n3.404714 -0.000004 -0.000433\n-1.702360 2.948630 0.003847\n-0.003434 0.033172 26.903967\nTe Mo W Se\n2 2 1 4\ndirect\n0.667301 0.335054 0.529559 Te\n0.666432 0.332651 0.668823 Te\n0.332964 0.665740 0.099782 Mo\n0.333546 0.667199 0.599261 Mo\n0.666806 0.333685 0.341909 W\n0.332838 0.665482 0.403450 Se\n0.667042 0.334148 0.038608 Se\n0.665560 0.330682 0.161046 Se\n0.334112 0.668562 0.280404 Se\n",
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"volume": 270.0948335991807,
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"formula_full": "Te2 Mo2 W1 Se4",
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"formula_anonymous": "AB2C2D4",
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"spacegroup": 156
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{
"id": "jvasp-9087",
"created_at": "2022-09-04T14:37:32.847301Z",
"updated_at": "2022-09-04T14:37:32.847320Z",
"structure_string": "Cd8 Sb8\n1.0\n6.618534 -0.000000 0.000000\n0.000000 8.371657 0.000000\n0.000000 0.000000 8.666078\nCd Sb\n8 8\ndirect\n0.450024 0.122808 0.866656 Cd\n0.950024 0.377192 0.133344 Cd\n0.549975 0.622808 0.633344 Cd\n0.049976 0.877192 0.366656 Cd\n0.549975 0.877192 0.133344 Cd\n0.049976 0.622808 0.866656 Cd\n0.450024 0.377192 0.366656 Cd\n0.950024 0.122808 0.633344 Cd\n0.139408 0.074156 0.104181 Sb\n0.639408 0.425844 0.895820 Sb\n0.860592 0.574156 0.395820 Sb\n0.360592 0.925844 0.604181 Sb\n0.860592 0.925844 0.895820 Sb\n0.360592 0.574156 0.104181 Sb\n0.139408 0.425844 0.604181 Sb\n0.639408 0.074156 0.395820 Sb\n",
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{
"id": "jvasp-90730",
"created_at": "2022-09-04T14:36:15.291578Z",
"updated_at": "2022-09-04T14:36:15.291602Z",
"structure_string": "Tm2 Te6\n1.0\n-4.329882 0.000000 -0.000000\n0.000000 0.000000 -4.331280\n2.164941 -12.802009 0.000000\nTm Te\n2 6\ndirect\n0.170959 0.750000 0.341918 Tm\n0.829040 0.250000 0.658082 Tm\n0.925954 0.750000 0.851907 Te\n0.074046 0.250000 0.148093 Te\n0.574092 0.750000 0.148183 Te\n0.425908 0.250000 0.851817 Te\n0.293715 0.750000 0.587430 Te\n0.706285 0.250000 0.412570 Te\n",
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"formula_full": "Tm2 Te6",
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{
"id": "jvasp-18468",
"created_at": "2022-09-04T14:36:19.035074Z",
"updated_at": "2022-09-04T14:36:19.035107Z",
"structure_string": "K2 Os1 Br6\n1.0\n6.283662 -0.000000 3.627873\n2.094554 5.924293 3.627873\n0.000000 0.000000 7.255747\nK Os Br\n2 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.749999 0.750000 0.750000 K\n0.000000 0.000000 0.000000 Os\n0.755862 0.244137 0.244137 Br\n0.755862 0.755862 0.244137 Br\n0.755862 0.244137 0.755863 Br\n0.244137 0.244137 0.755863 Br\n0.244137 0.755862 0.244137 Br\n0.244137 0.755862 0.755863 Br\n",
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