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{
"id": "jvasp-112090",
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{
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"structure_string": "Li4 Cr2 Si2 O8\n1.0\n0.000000 4.830007 0.034648\n5.620423 0.000000 0.000000\n0.000000 -4.719458 -6.265924\nLi Cr Si O\n4 2 2 8\ndirect\n0.505928 0.815234 0.001693 Li\n0.250125 0.346590 0.744779 Li\n0.505927 0.184765 0.501693 Li\n0.250126 0.653409 0.244779 Li\n0.010391 0.152653 -0.011103 Cr\n0.010390 0.847347 0.488896 Cr\n0.739082 0.666155 0.746533 Si\n0.739082 0.333844 0.246533 Si\n0.064956 0.801813 0.966832 O\n0.847496 0.389441 0.743225 O\n0.399749 0.663396 0.749125 O\n0.619271 0.821851 0.528912 O\n0.064956 0.198187 0.466832 O\n0.847496 0.610559 0.243226 O\n0.399749 0.336603 0.249126 O\n0.619272 0.178148 0.028913 O\n",
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{
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"updated_at": "2022-09-04T14:38:02.725557Z",
"structure_string": "Mg2 Cr4 O8\n1.0\n5.142326 -0.000000 2.968923\n1.714109 4.848231 2.968923\n-0.000000 -0.000000 5.937846\nMg Cr O\n2 4 8\ndirect\n0.125000 0.125000 0.125000 Mg\n0.875001 0.875000 0.874999 Mg\n0.500001 0.500000 -0.000001 Cr\n0.500001 0.500000 0.500000 Cr\n0.000000 0.500000 0.500000 Cr\n0.500000 0.000000 0.500000 Cr\n0.738467 0.738466 0.738466 O\n0.261534 0.261534 0.715399 O\n0.261534 0.715399 0.261533 O\n0.715400 0.261534 0.261533 O\n0.738467 0.284601 0.738466 O\n0.284601 0.738466 0.738466 O\n0.261534 0.261534 0.261533 O\n0.738467 0.738466 0.284600 O\n",
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{
"id": "jvasp-29868",
"created_at": "2022-09-04T14:36:44.209589Z",
"updated_at": "2022-09-04T14:36:44.209615Z",
"structure_string": "U2 H4 O8\n1.0\n2.110322 5.120867 0.000000\n-2.110322 5.120867 0.000000\n0.000000 0.000000 6.849480\nU H O\n2 4 8\ndirect\n0.499930 0.499930 0.502634 U\n0.000071 0.000071 0.002634 U\n0.831112 0.831112 0.359113 H\n0.668889 0.668889 0.859113 H\n0.168759 0.168759 0.645988 H\n0.331241 0.331241 0.145988 H\n0.334963 0.334963 0.604069 O\n0.664895 0.664895 0.401210 O\n0.165037 0.165037 0.104069 O\n0.835106 0.835106 0.901210 O\n0.071224 0.071224 0.652640 O\n0.928650 0.928650 0.352579 O\n0.428777 0.428777 0.152640 O\n0.571351 0.571351 0.852579 O\n",
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{
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"structure_string": "Ca4 Ga8 O16\n1.0\n3.021634 -0.000000 0.000000\n0.000000 9.193529 0.000000\n0.000000 0.000000 10.658604\nCa Ga O\n4 8 16\ndirect\n0.749999 0.757419 0.654541 Ca\n0.250000 0.242581 0.345459 Ca\n0.749999 0.257419 0.845459 Ca\n0.250000 0.742581 0.154541 Ca\n0.250000 0.082382 0.604362 Ga\n0.749999 0.917618 0.395638 Ga\n0.749999 0.417618 0.104362 Ga\n0.250000 0.582382 0.895638 Ga\n0.250000 0.564869 0.388360 Ga\n0.749999 0.935131 0.888359 Ga\n0.250000 0.064869 0.111640 Ga\n0.749999 0.435131 0.611640 Ga\n0.250000 0.381870 0.977191 O\n0.250000 0.795633 0.837657 O\n0.749999 0.204367 0.162343 O\n0.749999 0.118130 0.477191 O\n0.250000 0.881870 0.522808 O\n0.749999 0.618130 0.022808 O\n0.749999 0.527037 0.783417 O\n0.749999 0.917290 0.072173 O\n0.749999 0.027037 0.716582 O\n0.250000 0.972963 0.283417 O\n0.749999 0.417290 0.427827 O\n0.250000 0.582710 0.572172 O\n0.749999 0.704367 0.337657 O\n0.250000 0.082710 0.927827 O\n0.250000 0.472963 0.216583 O\n0.250000 0.295633 0.662343 O\n",
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{
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"created_at": "2022-09-04T14:38:12.093401Z",
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"structure_string": "Ca4 V8 O16\n1.0\n2.971468 -0.000000 0.000000\n0.000000 9.261880 0.000000\n0.000000 0.000000 10.758675\nCa V O\n4 8 16\ndirect\n0.250000 0.242010 0.345057 Ca\n0.250000 0.742010 0.154943 Ca\n0.750000 0.257990 0.845057 Ca\n0.750000 0.757990 0.654943 Ca\n0.250000 0.583470 0.894692 V\n0.750000 0.416530 0.105308 V\n0.750000 0.936446 0.886524 V\n0.750000 0.916530 0.394692 V\n0.250000 0.563554 0.386524 V\n0.750000 0.436446 0.613476 V\n0.250000 0.063554 0.113476 V\n0.250000 0.083470 0.605308 V\n0.750000 0.523811 0.783331 O\n0.250000 0.083231 0.926894 O\n0.750000 0.916769 0.073107 O\n0.250000 0.976189 0.283330 O\n0.750000 0.023811 0.716670 O\n0.250000 0.476189 0.216670 O\n0.250000 0.883050 0.523645 O\n0.250000 0.293259 0.664664 O\n0.250000 0.383050 0.976356 O\n0.750000 0.616950 0.023644 O\n0.250000 0.793259 0.835337 O\n0.750000 0.206741 0.164664 O\n0.750000 0.416769 0.426894 O\n0.750000 0.706741 0.335336 O\n0.750000 0.116950 0.476356 O\n0.250000 0.583231 0.573107 O\n",
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{
"id": "jvasp-11808",
"created_at": "2022-09-04T14:37:50.554672Z",
"updated_at": "2022-09-04T14:37:50.554689Z",
"structure_string": "Mg2 Cr4 O8\n1.0\n5.142466 -0.000000 2.969004\n1.714156 4.848364 2.969004\n0.000000 0.000000 5.938009\nMg Cr O\n2 4 8\ndirect\n0.125000 0.125000 0.125000 Mg\n0.875002 0.874999 0.874998 Mg\n0.500001 0.500000 -0.000001 Cr\n0.500001 0.500000 0.499999 Cr\n0.000001 0.500000 0.500000 Cr\n0.500000 0.000000 0.500000 Cr\n0.738465 0.738463 0.738463 O\n0.261537 0.261536 0.715391 O\n0.261537 0.715391 0.261535 O\n0.715393 0.261536 0.261535 O\n0.738465 0.284608 0.738463 O\n0.284609 0.738463 0.738463 O\n0.261537 0.261536 0.261536 O\n0.738465 0.738463 0.284607 O\n",
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{
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"structure_string": "Ca2 B4 C4\n1.0\n4.615687 0.005564 -2.574621\n-3.025241 4.331594 -0.135946\n0.003886 -0.005564 5.285189\nCa B C\n2 4 4\ndirect\n0.000001 0.750000 0.750000 Ca\n0.000000 0.250000 0.250000 Ca\n0.221870 0.360935 0.860936 B\n0.500001 0.860934 0.639065 B\n0.500001 0.139065 0.360935 B\n0.778131 0.639064 0.139065 B\n0.500001 0.659412 0.840588 C\n0.818825 0.159412 0.659413 C\n0.500000 0.340587 0.159412 C\n0.181177 0.840587 0.340587 C\n",
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{
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"created_at": "2022-09-04T14:36:40.943658Z",
"updated_at": "2022-09-04T14:36:40.943675Z",
"structure_string": "Li4 Mn3 Ni1 P4 O16\n1.0\n0.000000 4.731199 -0.001772\n6.060749 0.000000 0.000000\n0.000000 -0.014548 -10.326680\nLi Mn Ni P O\n4 3 1 4 16\ndirect\n0.998430 0.250802 0.005243 Li\n0.998430 0.749198 0.005243 Li\n0.501829 0.747113 0.494139 Li\n0.501829 0.252887 0.494139 Li\n0.029999 0.000000 0.718006 Mn\n0.471539 0.000000 0.221665 Mn\n0.524666 0.500000 0.779367 Mn\n0.973932 0.500000 0.278477 Ni\n0.915570 0.000000 0.407475 P\n0.587699 0.000000 0.909279 P\n0.412063 0.500000 0.097181 P\n0.084473 0.500000 0.586097 P\n0.782003 0.795209 0.337184 O\n0.760882 0.500000 0.591403 O\n0.737066 0.500000 0.101474 O\n0.721860 0.203742 0.838922 O\n0.721860 0.796259 0.838922 O\n0.712267 0.000000 0.048604 O\n0.292174 0.500000 0.956878 O\n0.221007 0.297633 0.657708 O\n0.274000 0.296476 0.166174 O\n0.263704 0.000000 0.906265 O\n0.239821 0.000000 0.406190 O\n0.221007 0.702367 0.657708 O\n0.782003 0.204792 0.337184 O\n0.207853 0.500000 0.446623 O\n0.274000 0.703524 0.166174 O\n0.788029 0.000000 0.546274 O\n",
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{
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"structure_string": "Li4 Mn4 Si4 O16\n1.0\n4.778685 0.000000 0.000000\n0.000000 6.201839 0.000000\n0.000000 0.000000 9.991484\nLi Mn Si O\n4 4 4 16\ndirect\n0.056126 0.006586 0.219081 Li\n0.443873 0.006586 0.719081 Li\n0.556126 0.506586 0.280919 Li\n0.943873 0.506586 0.780919 Li\n0.000002 0.256522 0.499996 Mn\n0.499997 0.256522 -0.000004 Mn\n0.500002 0.756522 0.000004 Mn\n-0.000002 0.756522 0.500004 Mn\n0.906305 0.006521 0.905884 Si\n0.593694 0.006521 0.405884 Si\n0.406305 0.506521 0.594115 Si\n0.093694 0.506521 0.094116 Si\n0.754978 0.229428 0.850288 O\n0.742905 0.506520 0.594594 O\n0.757094 0.506520 0.094594 O\n0.745021 0.229428 0.350288 O\n0.745004 0.783600 0.350304 O\n0.759655 0.006526 0.558870 O\n0.240344 0.506526 0.441129 O\n0.245004 0.283599 0.149696 O\n0.254978 0.729428 0.649711 O\n0.242905 0.006519 0.905406 O\n0.257094 0.006519 0.405406 O\n0.245021 0.729428 0.149712 O\n0.754995 0.783600 0.850304 O\n0.259655 0.506526 0.941129 O\n0.254995 0.283599 0.649696 O\n0.740344 0.006526 0.058871 O\n",
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"formula_full": "Li4 Mn4 Si4 O16",
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{
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"structure_string": "Yb1 Co3 B2\n1.0\n2.566628 -4.445530 0.000000\n2.566628 4.445530 -0.000000\n-0.000000 -0.000000 2.780591\nYb Co B\n1 3 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500000 0.500000 0.500000 Co\n0.000000 0.500000 0.500000 Co\n0.500000 0.000000 0.500000 Co\n0.666667 0.333333 0.000000 B\n0.333333 0.666667 0.000000 B\n",
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{
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"created_at": "2022-09-04T14:37:30.574329Z",
"updated_at": "2022-09-04T14:37:30.574359Z",
"structure_string": "Ta1 Ti2 N3\n1.0\n2.527338 -4.377479 0.000000\n2.527338 4.377479 -0.000000\n0.000000 -0.000000 2.867761\nTa Ti N\n1 2 3\ndirect\n0.000000 0.000000 0.000000 Ta\n0.333333 0.666667 0.500000 Ti\n0.666667 0.333333 0.500000 Ti\n0.000000 0.500000 0.000000 N\n0.500000 0.500000 0.000000 N\n0.500000 0.000000 0.000000 N\n",
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]
}