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{
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{
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"structure_string": "Sb4 Ir2 C6 O6 F26\n1.0\n-8.661461 0.000000 0.000000\n-0.239179 -8.930832 0.000000\n2.433779 3.784051 9.942800\nSb Ir C O F\n4 2 6 6 26\ndirect\n0.321399 0.248308 0.639243 Sb\n0.678601 0.751692 0.360757 Sb\n0.680330 0.794434 0.838756 Sb\n0.319670 0.205566 0.161244 Sb\n0.218656 0.697829 0.703506 Ir\n0.781344 0.302171 0.296494 Ir\n0.117481 0.891724 0.751459 C\n0.882519 0.108276 0.248541 C\n0.198583 0.701406 0.518180 C\n0.801417 0.298594 0.481820 C\n0.233796 0.685322 0.884521 C\n0.766204 0.314678 0.115479 C\n0.052960 0.008000 0.778982 O\n0.947040 0.992000 0.221018 O\n0.190057 0.705886 0.414167 O\n0.809943 0.294114 0.585833 O\n0.237906 0.674129 0.985594 O\n0.762094 0.325871 0.014406 O\n0.019271 0.569938 0.645230 F\n0.980729 0.430062 0.354770 F\n0.333229 0.483669 0.644733 F\n0.666771 0.516331 0.355267 F\n0.136303 0.213102 0.497218 F\n0.863697 0.786898 0.502782 F\n0.454599 0.201289 0.515755 F\n0.545401 0.798711 0.484245 F\n0.191843 0.330000 0.765921 F\n0.808157 0.670000 0.234079 F\n0.297950 0.033698 0.632311 F\n0.702050 0.966302 0.367689 F\n0.503928 0.302554 0.782714 F\n0.496072 0.697446 0.217286 F\n0.442553 0.818942 0.761790 F\n0.557447 0.181058 0.238210 F\n0.671998 0.976673 0.995953 F\n0.328002 0.023327 0.004047 F\n0.668892 0.615624 0.677235 F\n0.331108 0.384376 0.322765 F\n0.598873 0.664089 0.917415 F\n0.401127 0.335911 0.082585 F\n0.726933 0.939548 0.758679 F\n0.273067 0.060452 0.241321 F\n0.899100 0.773092 0.907370 F\n0.100900 0.226908 0.092630 F\n",
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"formula_full": "Sb4 Ir2 C6 O6 F26",
"formula_reduced": "Sb2IrC3O3F13",
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"updated_at": "2021-11-28T01:34:54.327000Z",
"spacegroup": 2
},
{
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"created_at": "2022-09-04T14:39:59.798265Z",
"structure_string": "Na4 Ag2 As2\n1.0\n3.707806 -4.453001 0.000000\n3.707806 4.453001 0.000000\n0.000000 0.000000 5.706198\nNa Ag As\n4 2 2\ndirect\n0.030805 0.674998 0.250000 Na\n0.969195 0.325002 0.750000 Na\n0.674998 0.030805 0.250000 Na\n0.325002 0.969195 0.750000 Na\n0.500000 0.500000 0.500000 Ag\n0.500000 0.500000 0.000000 Ag\n0.787979 0.787979 0.750000 As\n0.212021 0.212021 0.250000 As\n",
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],
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"density": 4.032090592384096,
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"volume": 188.4285162821731,
"volume_molar": 14.18428810311498,
"formula_full": "Na4 Ag2 As2",
"formula_reduced": "Na2AgAs",
"formula_anonymous": "ABC2",
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"updated_at": "2021-11-28T01:34:44.970000Z",
"spacegroup": 63
},
{
"id": "mp-1194912",
"created_at": "2022-09-04T14:39:59.807191Z",
"structure_string": "Y4 V4 Te8 O32\n1.0\n3.698270 -4.100790 0.000000\n3.698270 4.100790 0.000000\n0.000000 0.000000 21.625604\nY V Te O\n4 4 8 32\ndirect\n0.751433 0.751433 0.000000 Y\n0.248567 0.248567 0.000000 Y\n0.748567 0.748567 0.500000 Y\n0.251433 0.251433 0.500000 Y\n0.755349 0.744651 0.750000 V\n0.255349 0.244651 0.750000 V\n0.244651 0.255349 0.250000 V\n0.744651 0.755349 0.250000 V\n0.311402 0.688598 0.888573 Te\n0.688598 0.311402 0.111427 Te\n0.821800 0.178200 0.866394 Te\n0.178200 0.821800 0.133606 Te\n0.321800 0.678200 0.633606 Te\n0.678200 0.321800 0.366394 Te\n0.811402 0.188598 0.611427 Te\n0.188598 0.811402 0.388573 Te\n0.047179 0.559626 0.940375 O\n0.440374 0.952821 0.940375 O\n0.952821 0.440374 0.059625 O\n0.559626 0.047179 0.059625 O\n0.515773 0.484227 0.932477 O\n0.484227 0.515773 0.067523 O\n0.935077 0.064923 0.942019 O\n0.064923 0.935077 0.057981 O\n0.759129 0.844317 0.836152 O\n0.155683 0.240871 0.836152 O\n0.240871 0.155683 0.163848 O\n0.844317 0.759129 0.163848 O\n0.435077 0.564923 0.557981 O\n0.564923 0.435077 0.442019 O\n0.655683 0.740871 0.663848 O\n0.259129 0.344317 0.663848 O\n0.344317 0.259129 0.336152 O\n0.740871 0.655683 0.336152 O\n0.547179 0.059626 0.559625 O\n0.940374 0.452821 0.559625 O\n0.452821 0.940374 0.440375 O\n0.059626 0.547179 0.440375 O\n0.015773 0.984227 0.567523 O\n0.984227 0.015773 0.432477 O\n0.470556 0.529444 0.766320 O\n0.529444 0.470556 0.233680 O\n0.456919 0.043081 0.750000 O\n0.956919 0.543081 0.750000 O\n0.543081 0.956919 0.250000 O\n0.043081 0.456919 0.250000 O\n0.970556 0.029444 0.733680 O\n0.029444 0.970556 0.266320 O\n",
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],
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"volume": 655.940408711214,
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"formula_full": "Y4 V4 Te8 O32",
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}
]
}