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{
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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=1265",
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{
"id": "jvasp-2053",
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"structure_string": "Ru1 Cl2 O1\n1.0\n3.421128 -0.000000 -1.016905\n-0.325173 3.495050 -1.093962\n-0.025003 -0.005059 6.179109\nRu Cl O\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Ru\n0.356346 0.856127 0.712690 Cl\n0.643656 0.143873 0.287312 Cl\n0.000000 0.500000 0.000000 O\n",
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{
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"structure_string": "Ru1 C1 Br1\n1.0\n2.816639 0.000000 0.000000\n0.000000 2.816639 0.000000\n0.000000 0.000000 7.913776\nRu C Br\n1 1 1\ndirect\n0.000000 0.000000 -0.024447 Ru\n0.000000 0.000000 0.764426 C\n0.000000 0.000000 0.338922 Br\n",
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{
"id": "jvasp-32393",
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"structure_string": "Ru2 C8 O8 F12\n1.0\n5.221149 0.032605 0.675638\n0.479267 8.743712 0.750646\n0.408832 -0.374453 8.245902\nRu C O F\n2 8 8 12\ndirect\n0.322336 0.536095 0.440133 Ru\n0.677664 0.463905 0.559868 Ru\n0.978068 0.702620 0.098762 C\n0.021932 0.297380 0.901238 C\n0.799906 0.624392 0.241867 C\n0.200095 0.375608 0.758134 C\n0.537419 0.233415 0.361101 C\n0.462582 0.766585 0.638899 C\n0.458514 0.923994 0.715854 C\n0.541487 0.076005 0.284147 C\n0.561031 0.629280 0.241128 O\n0.291021 0.743971 0.554382 O\n0.708979 0.256028 0.445619 O\n0.088760 0.437133 0.643287 O\n0.357141 0.328232 0.331054 O\n0.911240 0.562867 0.356713 O\n0.438970 0.370719 0.758872 O\n0.642859 0.671767 0.668946 O\n0.846917 0.760627 -0.017502 F\n0.153084 0.239372 0.017503 F\n0.645617 0.084114 0.121966 F\n0.314372 0.031720 0.642918 F\n0.170702 0.602061 0.027142 F\n0.829298 0.397939 0.972858 F\n0.090485 0.815625 0.159808 F\n0.299658 0.029989 0.298732 F\n0.700343 0.970011 0.701269 F\n0.685628 0.968279 0.357083 F\n0.354383 0.915886 0.878035 F\n0.909515 0.184375 0.840193 F\n",
"nsites": 30,
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"O",
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],
"chemical_system": "C-F-O-Ru",
"density": 2.894896623182805,
"density_atomic": 0.07994542018780812,
"volume": 375.256017537013,
"volume_molar": 7.532815195483069,
"formula_full": "Ru2 C8 O8 F12",
"formula_reduced": "RuC4(O2F3)2",
"formula_anonymous": "AB4C4D6",
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{
"id": "jvasp-33121",
"created_at": "2022-09-04T14:38:35.509500Z",
"updated_at": "2022-09-04T14:38:35.509516Z",
"structure_string": "Ru2 C6 Br4 O6\n1.0\n6.250716 -0.046306 1.532111\n1.924410 5.947290 1.532111\n0.055275 0.039898 9.329919\nRu C Br O\n2 6 4 6\ndirect\n0.064221 0.064222 0.785849 Ru\n0.935779 0.935778 0.214151 Ru\n0.091445 0.717289 0.358778 C\n0.717289 0.091445 0.358778 C\n0.908555 0.282711 0.641222 C\n0.755453 0.755452 0.208412 C\n0.282711 0.908555 0.641222 C\n0.244547 0.244547 0.791588 C\n0.760288 0.239713 -0.000000 Br\n0.176912 0.176912 0.226386 Br\n0.823088 0.823088 0.773614 Br\n0.239713 0.760287 -0.000000 Br\n0.584431 0.192684 0.443494 O\n0.645105 0.645104 0.213581 O\n0.354895 0.354895 0.786419 O\n0.807316 0.415568 0.556506 O\n0.415569 0.807316 0.556506 O\n0.192684 0.584431 0.443494 O\n",
"nsites": 18,
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"elements": [
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],
"chemical_system": "Br-C-O-Ru",
"density": 3.302034875318025,
"density_atomic": 0.05188853657166129,
"volume": 346.8974303243431,
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"formula_full": "Ru2 C6 Br4 O6",
"formula_reduced": "RuC3Br2O3",
"formula_anonymous": "AB2C3D3",
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"spacegroup": 12
},
{
"id": "jvasp-117912",
"created_at": "2022-09-04T14:38:53.894217Z",
"updated_at": "2022-09-04T14:38:53.894255Z",
"structure_string": "Ru1 C2 N1\n1.0\n2.578082 -0.000000 0.000000\n-0.000000 2.578082 0.000000\n-0.000000 0.000000 4.916711\nRu C N\n1 2 1\ndirect\n0.499999 0.499999 0.500000 Ru\n0.000000 0.499999 0.184912 C\n0.499999 0.000000 -0.184912 C\n0.000000 0.000000 0.000000 N\n",
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"elements": [
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"density": 7.068091456655761,
"density_atomic": 0.12240294201356884,
"volume": 32.678953088861086,
"volume_molar": 4.919931384763957,
"formula_full": "Ru1 C2 N1",
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"spacegroup": 115
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{
"id": "jvasp-14265",
"created_at": "2022-09-04T14:36:59.060454Z",
"updated_at": "2022-09-04T14:36:59.060480Z",
"structure_string": "Ru1 C1\n1.0\n1.465048 -2.537536 -0.000000\n1.465048 2.537536 -0.000000\n-0.000000 0.000000 2.686350\nRu C\n1 1\ndirect\n0.000000 0.000000 0.000000 Ru\n0.666668 0.333334 0.500000 C\n",
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"volume": 19.973614216592022,
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"spacegroup": 187
},
{
"id": "jvasp-15850",
"created_at": "2022-09-04T14:38:18.841661Z",
"updated_at": "2022-09-04T14:38:18.841683Z",
"structure_string": "Ru1 C1\n1.0\n1.465048 -2.537536 -0.000000\n1.465048 2.537536 0.000000\n0.000000 0.000000 2.686350\nRu C\n1 1\ndirect\n0.000000 0.000000 0.000000 Ru\n0.666668 0.333334 0.500000 C\n",
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"elements": [
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"volume": 19.973614216592022,
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"formula_full": "Ru1 C1",
"formula_reduced": "RuC",
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"spacegroup": 187
},
{
"id": "jvasp-36401",
"created_at": "2022-09-04T14:37:06.245274Z",
"updated_at": "2022-09-04T14:37:06.245304Z",
"structure_string": "Ru1 C1\n1.0\n2.159306 2.159306 -0.000000\n2.159306 0.000000 -2.159306\n-0.000000 2.159306 -2.159306\nRu C\n1 1\ndirect\n0.000000 0.000000 0.000000 Ru\n0.500001 0.500001 0.500001 C\n",
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"formula_full": "Ru1 C1",
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"spacegroup": 225
},
{
"id": "jvasp-36402",
"created_at": "2022-09-04T14:37:08.192852Z",
"updated_at": "2022-09-04T14:37:08.192879Z",
"structure_string": "Ru1 C1\n1.0\n2.280146 2.280146 -0.000000\n2.280146 0.000000 -2.280146\n0.000000 2.280146 -2.280146\nRu C\n1 1\ndirect\n0.000000 0.000000 0.000000 Ru\n0.750001 0.750001 0.750001 C\n",
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"volume": 23.709258090009097,
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},
{
"id": "jvasp-37108",
"created_at": "2022-09-04T14:38:06.308050Z",
"updated_at": "2022-09-04T14:38:06.308067Z",
"structure_string": "Ru2 C2\n1.0\n-1.391693 -2.410482 -0.000000\n-2.783384 0.000000 0.000000\n-1.391693 -0.803494 -6.279288\nRu C\n2 2\ndirect\n0.228806 0.228806 0.313580 Ru\n0.771192 0.771192 0.686420 Ru\n0.036943 0.036944 0.889169 C\n0.963055 0.963054 0.110831 C\n",
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"formula_full": "Ru2 C2",
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},
{
"id": "jvasp-4234",
"created_at": "2022-09-04T14:37:35.921783Z",
"updated_at": "2022-09-04T14:37:35.921803Z",
"structure_string": "Ru4 Br12\n1.0\n5.885764 0.000000 0.000000\n0.000000 6.451829 0.000000\n0.000000 0.000000 11.174192\nRu Br\n4 12\ndirect\n0.750004 0.250032 0.500000 Ru\n0.250005 0.749969 0.000000 Ru\n0.249995 0.250032 0.500000 Ru\n0.749995 0.749969 0.000000 Ru\n0.000000 0.934095 0.500000 Br\n0.500000 0.065905 0.000000 Br\n0.500000 0.565956 0.500000 Br\n0.000000 0.434045 0.000000 Br\n0.000000 0.407976 0.342021 Br\n0.500000 0.592025 0.157978 Br\n0.000000 0.407976 0.657978 Br\n0.500000 0.592025 0.842021 Br\n0.000000 0.907934 0.157969 Br\n0.500000 0.092066 0.342031 Br\n0.000000 0.907934 0.842031 Br\n0.500000 0.092066 0.657969 Br\n",
"nsites": 16,
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"density": 5.334379562720031,
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"volume": 424.32812854099546,
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"formula_full": "Ru4 Br12",
"formula_reduced": "RuBr3",
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"spacegroup": 193
},
{
"id": "jvasp-14103",
"created_at": "2022-09-04T14:37:29.449930Z",
"updated_at": "2022-09-04T14:37:29.449958Z",
"structure_string": "Ru2 Br6\n1.0\n3.225896 -5.587416 0.000000\n3.225896 5.587416 -0.000000\n-0.000000 -0.000000 5.885558\nRu Br\n2 6\ndirect\n0.000000 0.000000 0.500000 Ru\n0.000000 0.000000 0.000000 Ru\n0.684059 0.000000 0.750000 Br\n0.684060 0.684060 0.250000 Br\n0.315941 0.000000 0.250000 Br\n0.315942 0.315942 0.750000 Br\n0.000000 0.684059 0.750000 Br\n0.000000 0.315941 0.250000 Br\n",
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"formula_full": "Ru2 Br6",
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]
}