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{
"id": "mp-772882",
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{
"id": "mp-999264",
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"spacegroup": 131
},
{
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"created_at": "2022-09-04T14:40:15.912779Z",
"structure_string": "Sm1 Cu2 Ge2\n1.0\n-2.054226 2.054226 5.164868\n2.054226 -2.054226 5.164868\n2.054226 2.054226 -5.164868\nSm Cu Ge\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sm\n0.750000 0.250000 0.500000 Cu\n0.250000 0.750000 0.500000 Cu\n0.620969 0.620969 0.000000 Ge\n0.379031 0.379031 0.000000 Ge\n",
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{
"id": "mp-1203019",
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"structure_string": "Ca6 Mn1 Si6 Pb2 S2 O32\n1.0\n6.405176 4.099848 -1.750244\n6.405176 -4.099848 -1.750244\n-0.271473 0.000000 -13.004132\nCa Mn Si Pb S O\n6 1 6 2 2 32\ndirect\n0.445390 0.445390 0.231747 Ca\n0.554610 0.554610 0.768253 Ca\n0.931246 0.466123 0.323818 Ca\n0.466123 0.931246 0.323818 Ca\n0.068754 0.533877 0.676182 Ca\n0.533877 0.068754 0.676182 Ca\n0.500000 0.500000 0.500000 Mn\n0.238673 0.238673 0.485006 Si\n0.761327 0.761327 0.514994 Si\n0.114631 0.761939 0.372230 Si\n0.761939 0.114631 0.372230 Si\n0.885369 0.238061 0.627770 Si\n0.238061 0.885369 0.627770 Si\n0.892552 0.892552 0.130429 Pb\n0.107448 0.107448 0.869571 Pb\n0.232761 0.232761 0.108458 S\n0.767239 0.767239 0.891542 S\n0.275071 0.275071 0.358126 O\n0.724929 0.724929 0.641874 O\n0.674355 0.674355 0.447291 O\n0.325645 0.325645 0.552709 O\n0.001188 0.682153 0.480130 O\n0.682153 0.001188 0.480130 O\n0.998812 0.317847 0.519870 O\n0.317847 0.998812 0.519870 O\n0.097714 0.684160 0.269952 O\n0.684160 0.097714 0.269952 O\n0.902286 0.315840 0.730048 O\n0.315840 0.902286 0.730048 O\n0.679867 0.342887 0.385816 O\n0.342887 0.679867 0.385816 O\n0.320133 0.657113 0.614184 O\n0.657113 0.320133 0.614184 O\n0.002398 0.002398 0.362683 O\n0.997602 0.997602 0.637317 O\n0.219560 0.219560 0.000320 O\n0.780440 0.780440 0.999680 O\n0.345248 0.345248 0.108368 O\n0.654752 0.654752 0.891632 O\n0.034732 0.331869 0.167461 O\n0.331869 0.034732 0.167461 O\n0.965268 0.668131 0.832539 O\n0.668131 0.965268 0.832539 O\n0.729669 0.729669 0.224809 O\n0.270331 0.270331 0.775191 O\n0.736970 0.360893 0.098997 O\n0.360893 0.736970 0.098997 O\n0.263030 0.639107 0.901003 O\n0.639107 0.263030 0.901003 O\n",
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"elements": [
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"formula_full": "Ca6 Mn1 Si6 Pb2 S2 O32",
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{
"id": "mp-1009601",
"created_at": "2022-09-04T14:40:15.916502Z",
"structure_string": "Pd1 N1\n1.0\n1.508369 -2.612571 0.000000\n1.508369 2.612571 0.000000\n0.000000 0.000000 2.879205\nPd N\n1 1\ndirect\n0.666667 0.333333 0.000000 Pd\n0.000000 0.000000 0.500000 N\n",
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"volume": 22.69228782802659,
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{
"id": "mp-1217569",
"created_at": "2022-09-04T14:40:15.922723Z",
"structure_string": "Tb2 Al2 Cu2\n1.0\n-2.722528 2.726038 3.754726\n2.722528 -2.726038 3.754726\n2.722528 2.726038 -3.754726\nTb Al Cu\n2 2 2\ndirect\n0.124012 0.874012 0.250000 Tb\n0.875988 0.125988 0.750000 Tb\n0.500000 0.500000 0.500000 Al\n0.500000 0.000000 0.000000 Al\n0.500000 0.500000 0.000000 Cu\n0.000000 0.500000 0.500000 Cu\n",
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{
"id": "mp-772543",
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"structure_string": "Li4 Ti3 Mn2 V3 O16\n1.0\n2.928094 5.100690 0.000000\n-2.928094 5.100690 0.000000\n0.000000 0.055596 9.776821\nLi Ti Mn V O\n4 3 2 3 16\ndirect\n0.328664 0.328664 0.894554 Li\n0.003420 0.003420 0.995473 Li\n0.001213 0.001213 0.498470 Li\n0.665810 0.665810 0.393299 Li\n0.661671 0.165139 0.218393 Ti\n0.165139 0.661671 0.218393 Ti\n0.831391 0.831391 0.720511 Ti\n0.329212 0.329212 0.495492 Mn\n0.667061 0.667061 0.992085 Mn\n0.169058 0.169058 0.207966 V\n0.345630 0.813587 0.711748 V\n0.813587 0.345630 0.711748 V\n0.676840 0.162607 0.604239 O\n0.482729 0.482729 0.330553 O\n0.337252 0.337252 0.103986 O\n0.000541 0.000541 0.314487 O\n0.999671 0.999671 0.811325 O\n0.162607 0.676840 0.604239 O\n0.481050 0.035425 0.330457 O\n0.035425 0.481050 0.330457 O\n0.843183 0.843183 0.104130 O\n0.155788 0.155788 0.609766 O\n0.958166 0.513302 0.831489 O\n0.513302 0.958166 0.831489 O\n0.667616 0.667616 0.601733 O\n0.847131 0.322320 0.104783 O\n0.512405 0.512405 0.830625 O\n0.322320 0.847131 0.104783 O\n",
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{
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"structure_string": "Na2 Li2 Ti6 O14\n1.0\n0.000000 0.000000 5.770372\n5.667686 0.000000 2.885186\n0.000000 8.320150 2.885186\nNa Li Ti O\n2 2 6 14\ndirect\n0.130673 0.738653 0.500000 Na\n0.869327 0.261347 0.500000 Na\n0.183470 0.000000 0.133060 Li\n0.816530 0.000000 0.866940 Li\n0.750000 0.500000 0.000000 Ti\n0.250000 0.500000 0.000000 Ti\n0.481810 0.254099 0.282282 Ti\n0.735909 0.745901 0.282282 Ti\n0.518190 0.745901 0.717718 Ti\n0.264091 0.254099 0.717718 Ti\n0.397860 0.732188 0.972091 O\n0.130048 0.267812 0.972091 O\n0.602140 0.267812 0.027909 O\n0.869952 0.732188 0.027909 O\n0.631670 0.500000 0.236661 O\n0.131670 0.500000 0.236661 O\n0.368330 0.500000 0.763339 O\n0.868330 0.500000 0.763339 O\n0.829714 0.000000 0.288183 O\n0.382103 0.000000 0.288183 O\n0.170286 0.000000 0.711817 O\n0.617897 0.000000 0.711817 O\n0.334167 0.331666 0.500000 O\n0.665833 0.668334 0.500000 O\n",
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{
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{
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{
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"formula_reduced": "CuAgTe2",
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},
{
"id": "mp-1206633",
"created_at": "2022-09-04T14:40:15.935239Z",
"structure_string": "Co1 Cl6\n1.0\n5.030051 -6.425303 0.000000\n5.030051 6.425303 0.000000\n0.000000 0.000000 43.411698\nCo Cl\n1 6\ndirect\n0.000000 0.000000 0.000000 Co\n0.000000 0.000000 0.249980 Cl\n0.000000 0.000000 0.750020 Cl\n0.267684 0.035593 0.000000 Cl\n0.732316 0.964407 0.000000 Cl\n0.035593 0.267684 0.000000 Cl\n0.964407 0.732316 0.000000 Cl\n",
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"elements": [
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],
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}
]
}