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{
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{
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{
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"structure_string": "Cr2 S4\n1.0\n4.706275 -0.000000 -2.140464\n-0.973505 4.604487 -2.140464\n-0.046610 -0.057495 6.141634\nCr S\n2 4\ndirect\n0.250001 0.750001 0.500001 Cr\n0.000000 0.000000 0.000000 Cr\n0.883454 0.875001 0.250001 S\n0.625000 0.116547 0.750000 S\n0.366547 0.375001 0.250001 S\n0.125001 0.633455 0.750001 S\n",
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"elements": [
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"formula_full": "Cr2 S4",
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"spacegroup": 122
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{
"id": "jvasp-30601",
"created_at": "2022-09-04T14:37:29.761160Z",
"updated_at": "2022-09-04T14:37:29.761171Z",
"structure_string": "Cr1 S2\n1.0\n6.719408 -0.246445 -0.145965\n6.124226 2.775792 -0.145965\n6.124226 1.206068 2.504341\nCr S\n1 2\ndirect\n0.000000 0.000000 0.000000 Cr\n0.591218 0.591219 0.591215 S\n0.408784 0.408784 0.408781 S\n",
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"elements": [
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"volume": 53.29635251627362,
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"spacegroup": 166
},
{
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"created_at": "2022-09-04T14:37:44.418218Z",
"updated_at": "2022-09-04T14:37:44.418234Z",
"structure_string": "Cr1 S2\n1.0\n3.339578 0.000000 0.000000\n-1.669789 2.892172 -0.000017\n0.000000 -0.000435 5.383111\nCr S\n1 2\ndirect\n0.999963 0.000000 0.000000 Cr\n0.333316 0.666694 0.250280 S\n0.666622 0.333307 0.749719 S\n",
"nsites": 3,
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"elements": [
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{
"id": "jvasp-8285",
"created_at": "2022-09-04T14:37:05.016056Z",
"updated_at": "2022-09-04T14:37:05.016074Z",
"structure_string": "Cr1 S2\n1.0\n6.719959 -0.246229 -0.145837\n6.124818 2.775801 -0.145837\n6.124818 1.206185 2.504287\nCr S\n1 2\ndirect\n0.000000 0.000000 0.000000 Cr\n0.591219 0.591216 0.591216 S\n0.408784 0.408782 0.408782 S\n",
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{
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"created_at": "2022-09-04T14:37:04.505659Z",
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"structure_string": "Cr4 S8\n1.0\n6.702895 0.145737 0.103784\n3.223661 5.878230 0.104670\n3.223977 1.955151 5.544086\nCr S\n4 8\ndirect\n0.493352 0.519803 0.493465 Cr\n0.493415 0.993473 0.019775 Cr\n0.493450 0.993382 0.493330 Cr\n0.019780 0.993354 0.493411 Cr\n0.248343 0.748420 0.754947 S\n0.248277 0.254940 0.248423 S\n0.754951 0.748277 0.248345 S\n0.248419 0.748350 0.248284 S\n0.743452 0.769712 0.743383 S\n0.743405 0.243378 0.269739 S\n0.743419 0.243462 0.743490 S\n0.269731 0.243451 0.743410 S\n",
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"volume": 213.20350809896146,
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{
"id": "jvasp-19789",
"created_at": "2022-09-04T14:38:19.187159Z",
"updated_at": "2022-09-04T14:38:19.187187Z",
"structure_string": "Cr2 Sb2\n1.0\n2.004540 -3.471964 -0.000000\n2.004540 3.471964 0.000000\n0.000000 0.000000 5.894456\nCr Sb\n2 2\ndirect\n0.000000 0.000000 0.000000 Cr\n0.000000 0.000000 0.500000 Cr\n0.333333 0.666667 0.250000 Sb\n0.666667 0.333333 0.750000 Sb\n",
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"spacegroup": 194
},
{
"id": "jvasp-4367",
"created_at": "2022-09-04T14:37:09.202375Z",
"updated_at": "2022-09-04T14:37:09.202391Z",
"structure_string": "Cr2 Sb2\n1.0\n2.004540 -3.471964 0.000000\n2.004540 3.471964 0.000000\n0.000000 0.000000 5.894456\nCr Sb\n2 2\ndirect\n0.000000 0.000000 0.000000 Cr\n0.000000 0.000000 0.500000 Cr\n0.333333 0.666667 0.250000 Sb\n0.666667 0.333333 0.750000 Sb\n",
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{
"id": "jvasp-18230",
"created_at": "2022-09-04T14:38:07.578491Z",
"updated_at": "2022-09-04T14:38:07.578514Z",
"structure_string": "Cr2 Sb4\n1.0\n3.478650 0.000000 0.000000\n0.000000 5.952304 0.000000\n0.000000 0.000000 6.893285\nCr Sb\n2 4\ndirect\n0.000000 0.000000 0.000000 Cr\n0.500000 0.500000 0.500000 Cr\n0.000000 0.183805 0.362476 Sb\n0.000000 0.816194 0.637523 Sb\n0.500000 0.683805 0.137524 Sb\n0.500000 0.316195 0.862476 Sb\n",
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{
"id": "jvasp-15006",
"created_at": "2022-09-04T14:35:41.525659Z",
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"structure_string": "Cr2 Sb4\n1.0\n5.246895 0.004454 -1.540834\n-2.939035 4.346493 -1.540834\n-0.002362 -0.004454 5.468462\nCr Sb\n2 4\ndirect\n0.250000 0.250000 0.000000 Cr\n0.749999 0.749999 0.000001 Cr\n0.659364 0.159363 0.818727 Sb\n0.159363 0.340637 0.500000 Sb\n0.840637 0.659362 0.500001 Sb\n0.340636 0.840636 0.181274 Sb\n",
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{
"id": "jvasp-30340",
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"structure_string": "Cr1 Sb1 O4\n1.0\n4.700234 -0.211728 -0.129390\n7.668783 5.510453 -0.291439\n7.668753 3.884032 2.371795\nCr Sb O\n1 1 4\ndirect\n0.500002 0.999999 0.499999 Cr\n0.499999 0.500000 0.500001 Sb\n0.241062 -0.000009 0.244110 O\n0.239629 0.499993 0.236041 O\n0.758938 0.000009 0.755888 O\n0.760373 0.500008 0.763955 O\n",
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"spacegroup": 10
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}