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{
"id": "jvasp-13063",
"created_at": "2022-09-04T14:36:50.823399Z",
"updated_at": "2022-09-04T14:36:50.823418Z",
"structure_string": "Sm4 S2 Cl8\n1.0\n5.904069 -0.000000 -2.484037\n-0.381614 6.957323 -0.907022\n-0.003197 0.000683 8.250828\nSm S Cl\n4 2 8\ndirect\n0.685288 0.422009 0.785301 Sm\n0.899986 0.077990 0.214699 Sm\n0.314712 0.577990 0.214699 Sm\n0.100014 0.922009 0.785301 Sm\n0.932077 0.750000 -0.000000 S\n0.067923 0.250000 0.000000 S\n0.303651 0.572901 0.823300 Cl\n0.480351 0.927098 0.176700 Cl\n0.696350 0.427098 0.176700 Cl\n0.519649 0.072901 0.823300 Cl\n0.698724 0.681795 0.558621 Cl\n0.140103 0.818204 0.441379 Cl\n0.301277 0.318204 0.441379 Cl\n0.859898 0.181795 0.558621 Cl\n",
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{
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"structure_string": "Lu4 Cd2 S8\n1.0\n6.777088 -0.000000 3.912753\n2.259030 6.389500 3.912753\n0.000000 0.000000 7.825507\nLu Cd S\n4 2 8\ndirect\n0.500000 0.500000 -0.000000 Lu\n0.500000 0.500000 0.500000 Lu\n0.000000 0.500000 0.500000 Lu\n0.500000 -0.000000 0.500000 Lu\n0.875000 0.875000 0.874999 Cd\n0.125000 0.125000 0.125000 Cd\n0.741452 0.741452 0.741452 S\n0.258548 0.258548 0.724355 S\n0.258548 0.724355 0.258548 S\n0.724356 0.258548 0.258547 S\n0.741452 0.275645 0.741452 S\n0.275645 0.741452 0.741452 S\n0.258548 0.258548 0.258548 S\n0.741452 0.741452 0.275644 S\n",
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{
"id": "jvasp-74813",
"created_at": "2022-09-04T14:36:08.892198Z",
"updated_at": "2022-09-04T14:36:08.892219Z",
"structure_string": "Be1 Tl1 Cl2\n1.0\n5.174938 0.000000 0.000000\n0.000000 5.174938 0.000000\n0.000000 -0.000000 3.615231\nBe Tl Cl\n1 1 2\ndirect\n0.000000 0.000000 0.500000 Be\n0.500000 0.500000 0.500000 Tl\n0.500000 0.000000 0.000000 Cl\n0.000000 0.500000 0.000000 Cl\n",
"nsites": 4,
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"elements": [
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"formula_full": "Be1 Tl1 Cl2",
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"spacegroup": 123
},
{
"id": "jvasp-21880",
"created_at": "2022-09-04T14:37:34.134359Z",
"updated_at": "2022-09-04T14:37:34.134386Z",
"structure_string": "Rb2 U2 Cu2 S6\n1.0\n3.936696 0.000000 -0.000000\n-1.968348 7.229971 -0.000000\n-0.000000 0.000000 10.204110\nRb U Cu S\n2 2 2 6\ndirect\n0.259253 0.518505 0.250000 Rb\n0.740747 0.481495 0.750000 Rb\n0.000000 0.000000 0.500000 U\n0.000000 0.000000 0.000000 U\n0.463200 0.926399 0.750000 Cu\n0.536801 0.073601 0.250000 Cu\n0.378452 0.756905 0.556971 S\n0.621548 0.243095 0.443029 S\n0.621548 0.243095 0.056971 S\n0.057293 0.114588 0.750000 S\n0.942707 0.885412 0.250000 S\n0.378452 0.756905 0.943029 S\n",
"nsites": 12,
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"volume": 290.4313983747572,
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{
"id": "jvasp-93321",
"created_at": "2022-09-04T14:36:10.253742Z",
"updated_at": "2022-09-04T14:36:10.253766Z",
"structure_string": "Ce2 Mg4\n1.0\n3.130048 -0.000000 -0.000000\n-1.565024 2.710701 -0.000000\n0.000000 0.000000 17.115040\nCe Mg\n2 4\ndirect\n0.333334 0.666667 0.174977 Ce\n0.333334 0.666667 0.825022 Ce\n0.333334 0.666667 0.500000 Mg\n0.000000 0.000000 0.346143 Mg\n0.000000 0.000000 0.000000 Mg\n0.000000 0.000000 0.653857 Mg\n",
"nsites": 6,
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{
"id": "jvasp-94320",
"created_at": "2022-09-04T14:36:31.412426Z",
"updated_at": "2022-09-04T14:36:31.412448Z",
"structure_string": "Ce2 Se4\n1.0\n-4.171752 -4.171752 0.000000\n-4.171752 0.000000 -4.171752\n0.000000 -4.171752 -4.171752\nCe Se\n2 4\ndirect\n0.750000 0.750000 0.750000 Ce\n0.000000 0.000000 0.000000 Ce\n0.875000 0.375000 0.375000 Se\n0.375000 0.875000 0.375000 Se\n0.375000 0.375000 0.875000 Se\n0.375000 0.375000 0.375000 Se\n",
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{
"id": "jvasp-116320",
"created_at": "2022-09-04T14:38:42.484261Z",
"updated_at": "2022-09-04T14:38:42.484288Z",
"structure_string": "Mg1 Te1 O1\n1.0\n3.217206 -0.000000 -0.000000\n-0.000000 3.217206 -0.000000\n0.000000 0.000000 7.014346\nMg Te O\n1 1 1\ndirect\n0.000000 0.000000 0.440243 Mg\n0.000000 0.000000 -0.021477 Te\n0.000000 0.000000 0.705687 O\n",
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"density_atomic": 0.04132152394863845,
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"formula_anonymous": "ABC",
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"spacegroup": 99
},
{
"id": "jvasp-56496",
"created_at": "2022-09-04T14:37:44.439762Z",
"updated_at": "2022-09-04T14:37:44.439772Z",
"structure_string": "Ho16 Cd4 Co4\n1.0\n8.110459 0.000000 4.682575\n2.703486 7.646614 4.682575\n0.000000 0.000000 9.365150\nHo Cd Co\n16 4 4\ndirect\n0.062296 0.437704 0.437704 Ho\n0.039784 0.653405 0.653405 Ho\n0.811700 0.188300 0.811699 Ho\n0.437704 0.062296 0.062295 Ho\n0.188301 0.811699 0.188300 Ho\n0.653406 0.653405 0.039782 Ho\n0.811700 0.188300 0.188300 Ho\n0.811700 0.811699 0.188299 Ho\n0.653406 0.653405 0.653404 Ho\n0.437705 0.437704 0.062295 Ho\n0.653405 0.039783 0.653405 Ho\n0.188301 0.811699 0.811699 Ho\n0.062296 0.437704 0.062295 Ho\n0.062296 0.062296 0.437704 Ho\n0.188300 0.188300 0.811700 Ho\n0.437704 0.062296 0.437704 Ho\n0.418787 0.418787 0.743638 Cd\n0.743639 0.418787 0.418786 Cd\n0.418788 0.743638 0.418786 Cd\n0.418787 0.418787 0.418786 Cd\n0.859065 0.859064 0.859063 Co\n0.422807 0.859064 0.859063 Co\n0.859065 0.422806 0.859063 Co\n0.859065 0.859064 0.422805 Co\n",
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{
"id": "jvasp-90282",
"created_at": "2022-09-04T14:35:42.920353Z",
"updated_at": "2022-09-04T14:35:42.920377Z",
"structure_string": "Pr3 Cd3 Ga3\n1.0\n0.000000 0.000000 -4.489187\n-3.742205 -6.481689 0.000000\n-3.742212 6.481693 0.000000\nPr Cd Ga\n3 3 3\ndirect\n0.500000 0.582798 -0.000000 Pr\n0.500000 0.417180 0.417192 Pr\n0.500000 0.999987 0.582807 Pr\n0.000000 0.248567 -0.000000 Cd\n0.000000 0.751411 0.751419 Cd\n0.000000 -0.000010 0.248580 Cd\n0.000000 0.333321 0.666667 Ga\n0.000000 0.666654 0.333331 Ga\n0.500000 -0.000010 0.000000 Ga\n",
"nsites": 9,
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{
"id": "jvasp-53450",
"created_at": "2022-09-04T14:36:48.083814Z",
"updated_at": "2022-09-04T14:36:48.083840Z",
"structure_string": "In4 Sn1 S8\n1.0\n6.608990 0.001191 3.817648\n2.204120 6.234193 3.817648\n0.000000 -0.000000 7.635295\nIn Sn S\n4 1 8\ndirect\n0.491578 0.489885 0.028650 In\n0.491578 0.489885 0.489886 In\n0.491578 0.028650 0.489886 In\n0.888868 0.870377 0.870378 In\n0.027774 0.490741 0.490742 Sn\n0.240572 0.256502 0.256503 S\n0.240572 0.256502 0.746423 S\n0.240572 0.746422 0.256503 S\n0.742671 0.252442 0.252443 S\n0.288831 0.737056 0.737057 S\n0.743469 0.276643 0.739945 S\n0.743469 0.739943 0.276644 S\n0.743469 0.739943 0.739945 S\n",
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"volume": 314.5672370957813,
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"formula_full": "In4 Sn1 S8",
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{
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"created_at": "2022-09-04T14:38:01.761441Z",
"updated_at": "2022-09-04T14:38:01.761470Z",
"structure_string": "Zr1 Sc1 Cd2\n1.0\n-10.561837 0.000000 -6.097880\n-6.800484 0.330202 -0.416976\n-5.943099 2.755254 -1.902010\nZr Sc Cd\n1 1 2\ndirect\n0.500000 0.000000 -0.000000 Zr\n0.000000 0.000000 0.000000 Sc\n0.751299 0.000000 -0.000000 Cd\n0.248701 0.000000 -0.000000 Cd\n",
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{
"id": "jvasp-80762",
"created_at": "2022-09-04T14:37:06.066299Z",
"updated_at": "2022-09-04T14:37:06.066326Z",
"structure_string": "Mg2 Hg1 Pb1\n1.0\n-11.457151 2.480397 -2.564892\n-8.349989 1.444979 1.078537\n-7.328116 4.335425 -0.691569\nMg Hg Pb\n2 1 1\ndirect\n0.715038 0.029439 0.029443 Mg\n0.284962 -0.029439 -0.029441 Mg\n0.000000 0.000000 0.000000 Hg\n0.500000 0.000000 0.000001 Pb\n",
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}