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{
"id": "jvasp-57868",
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"updated_at": "2022-09-04T14:37:00.461927Z",
"structure_string": "Cr4 Sn8\n1.0\n5.208717 -0.000000 1.530565\n2.604359 4.679320 0.765283\n0.006316 -0.000000 9.606770\nCr Sn\n4 8\ndirect\n0.251715 0.750000 0.496572 Cr\n0.998286 0.750000 0.003428 Cr\n0.748286 0.250000 0.503428 Cr\n0.001715 0.250000 0.996572 Cr\n0.543680 0.750000 0.912641 Sn\n0.706322 0.750000 0.587359 Sn\n0.456321 0.250000 0.087359 Sn\n0.293680 0.250000 0.412641 Sn\n0.290003 0.419997 0.750000 Sn\n0.959999 0.080003 0.750000 Sn\n0.709999 0.580003 0.250000 Sn\n0.040003 0.919997 0.250000 Sn\n",
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{
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{
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"structure_string": "Cr4 Si2 O8\n1.0\n5.607191 -0.209826 -1.287309\n-3.176080 4.625703 -1.287309\n0.020034 0.036390 6.303406\nCr Si O\n4 2 8\ndirect\n0.777931 0.222067 0.750000 Cr\n0.472067 0.527931 0.750000 Cr\n0.222068 0.777931 0.250000 Cr\n0.527931 0.472068 0.250000 Cr\n0.124999 0.874999 0.750000 Si\n0.874999 0.124999 0.250000 Si\n0.269296 0.223854 0.903846 O\n0.320008 0.865451 0.596154 O\n0.776145 0.730701 0.596154 O\n0.134547 0.679991 0.903845 O\n0.730702 0.776145 0.096154 O\n0.679990 0.134547 0.403845 O\n0.865451 0.320008 0.096154 O\n0.223853 0.269297 0.403845 O\n",
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"volume": 159.82812339957707,
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"formula_full": "Cr4 Si2 O8",
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"spacegroup": 70
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{
"id": "jvasp-20809",
"created_at": "2022-09-04T14:38:34.887541Z",
"updated_at": "2022-09-04T14:38:34.887568Z",
"structure_string": "Cr4 Se6\n1.0\n5.619779 0.000610 3.973653\n2.057282 5.229675 3.973653\n0.000896 0.000611 6.882720\nCr Se\n4 6\ndirect\n0.000000 0.000000 0.000000 Cr\n0.500000 0.500000 0.499999 Cr\n0.324792 0.324792 0.324792 Cr\n0.675208 0.675208 0.675207 Cr\n0.593014 0.907485 0.257215 Se\n0.257216 0.593014 0.907483 Se\n0.907484 0.257216 0.593013 Se\n0.406987 0.092516 0.742784 Se\n0.742784 0.406986 0.092515 Se\n0.092516 0.742785 0.406985 Se\n",
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"volume": 202.24460548906043,
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"formula_full": "Cr4 Se6",
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{
"id": "jvasp-49226",
"created_at": "2022-09-04T14:37:29.035402Z",
"updated_at": "2022-09-04T14:37:29.035429Z",
"structure_string": "Cr4 Sb4 Se12\n1.0\n3.834119 -0.000000 0.000000\n0.000000 9.294049 0.000000\n0.000000 0.000000 13.380821\nCr Sb Se\n4 4 12\ndirect\n0.750000 0.657398 0.043334 Cr\n0.250000 0.342602 0.956666 Cr\n0.750000 0.157398 0.456666 Cr\n0.250000 0.842602 0.543334 Cr\n0.250000 0.975181 0.158463 Sb\n0.750000 0.024819 0.841537 Sb\n0.250000 0.475181 0.341537 Sb\n0.750000 0.524819 0.658463 Sb\n0.250000 0.002889 0.393122 Se\n0.750000 0.997111 0.606878 Se\n0.750000 0.786108 0.211973 Se\n0.250000 0.213892 0.788026 Se\n0.750000 0.286108 0.288026 Se\n0.250000 0.325871 0.517771 Se\n0.250000 0.825872 0.982229 Se\n0.750000 0.174129 0.017771 Se\n0.750000 0.497111 0.893122 Se\n0.750000 0.674129 0.482229 Se\n0.250000 0.713892 0.711973 Se\n0.250000 0.502889 0.106878 Se\n",
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"density": 5.720222323483819,
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"formula_full": "Cr4 Sb4 Se12",
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"spacegroup": 62
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{
"id": "jvasp-33853",
"created_at": "2022-09-04T14:38:07.684205Z",
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"structure_string": "Cr4 Sb4 S12\n1.0\n3.657658 0.000000 0.000000\n-0.000000 8.793071 0.000000\n0.000000 0.000000 12.778733\nCr Sb S\n4 4 12\ndirect\n0.250000 0.657474 0.455777 Cr\n0.750000 0.342526 0.544222 Cr\n0.250000 0.157474 0.044223 Cr\n0.750000 0.842526 0.955777 Cr\n0.250000 0.021053 0.662203 Sb\n0.250000 0.521053 0.837797 Sb\n0.750000 0.478947 0.162203 Sb\n0.750000 0.978947 0.337797 Sb\n0.750000 0.327140 0.986976 S\n0.750000 0.502178 0.394877 S\n0.750000 0.711753 0.788944 S\n0.250000 0.288247 0.211055 S\n0.250000 0.497822 0.605123 S\n0.750000 0.002178 0.105123 S\n0.250000 0.997822 0.894876 S\n0.250000 0.172860 0.486976 S\n0.750000 0.827140 0.513024 S\n0.250000 0.672860 0.013024 S\n0.750000 0.211753 0.711055 S\n0.250000 0.788247 0.288945 S\n",
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{
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"created_at": "2022-09-04T14:37:04.505659Z",
"updated_at": "2022-09-04T14:37:04.505674Z",
"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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{
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"created_at": "2022-09-04T14:37:19.588438Z",
"updated_at": "2022-09-04T14:37:19.588455Z",
"structure_string": "Cr4 S8\n1.0\n6.702893 0.145730 0.103782\n3.223655 5.878228 0.104665\n3.223972 1.955144 5.544088\nCr S\n4 8\ndirect\n0.493352 0.519802 0.493466 Cr\n0.493417 0.993474 0.019775 Cr\n0.493450 0.993382 0.493331 Cr\n0.019780 0.993354 0.493413 Cr\n0.248344 0.748420 0.754948 S\n0.248277 0.254940 0.248424 S\n0.754952 0.748276 0.248346 S\n0.248419 0.748350 0.248284 S\n0.743452 0.769711 0.743384 S\n0.743405 0.243377 0.269740 S\n0.743419 0.243460 0.743490 S\n0.269732 0.243450 0.743409 S\n",
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{
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"created_at": "2022-09-04T14:37:19.990792Z",
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"structure_string": "Cr4 S6\n1.0\n5.223180 -0.083927 3.639550\n1.855118 4.883357 3.639550\n-0.123776 -0.083927 6.364951\nCr S\n4 6\ndirect\n0.328981 0.328980 0.328981 Cr\n0.500000 0.500000 0.500000 Cr\n0.000000 0.000000 0.000000 Cr\n0.671019 0.671019 0.671019 Cr\n0.743129 0.409949 0.092101 S\n0.092101 0.743129 0.409949 S\n0.590051 0.907899 0.256871 S\n0.409949 0.092101 0.743129 S\n0.907899 0.256870 0.590051 S\n0.256871 0.590050 0.907899 S\n",
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{
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"created_at": "2022-09-04T14:36:52.772472Z",
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"structure_string": "Cr4 S6\n1.0\n3.293457 -4.857257 -0.000000\n1.935061 4.857256 -2.665033\n1.961308 4.875053 3.847884\nCr S\n4 6\ndirect\n0.323534 0.676467 0.970600 Cr\n0.500001 0.500000 0.500002 Cr\n-0.000002 0.000002 -0.000005 Cr\n0.676471 0.323530 0.029411 Cr\n0.092917 0.596412 0.242247 S\n0.596415 0.745747 0.757750 S\n0.403589 0.254258 0.242247 S\n0.907085 0.403586 0.757750 S\n0.254254 0.092916 0.757750 S\n0.745742 0.907083 0.242248 S\n",
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{
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{
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"formula_full": "Cr4 S10",
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]
}