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{
"id": "mp-1043209",
"created_at": "2022-09-04T14:41:10.517391Z",
"structure_string": "Zn4 Ni8 P8 O36\n1.0\n6.234569 0.000000 0.000000\n0.000000 6.954378 0.000000\n0.000000 0.000000 14.441246\nZn Ni P O\n4 8 8 36\ndirect\n0.250000 0.386010 0.773188 Zn\n0.250000 0.113990 0.273188 Zn\n0.750000 0.613990 0.226812 Zn\n0.750000 0.886010 0.726812 Zn\n0.250000 0.860476 0.874132 Ni\n0.750000 0.139524 0.125868 Ni\n0.750000 0.360476 0.625868 Ni\n0.250000 0.639524 0.374132 Ni\n0.000000 0.500000 0.000000 Ni\n0.000000 0.000000 0.500000 Ni\n0.500000 0.000000 0.500000 Ni\n0.500000 0.500000 0.000000 Ni\n0.750000 0.868832 0.927517 P\n0.250000 0.131168 0.072483 P\n0.250000 0.368832 0.572483 P\n0.750000 0.631168 0.427517 P\n0.250000 0.883846 0.697093 P\n0.750000 0.116154 0.302907 P\n0.750000 0.383846 0.802907 P\n0.250000 0.616154 0.197093 P\n0.538590 0.104510 0.359904 O\n0.038590 0.895490 0.640096 O\n0.461410 0.604510 0.140096 O\n0.961410 0.395490 0.859904 O\n0.461410 0.895490 0.640096 O\n0.961410 0.104510 0.359904 O\n0.538590 0.395490 0.859904 O\n0.038590 0.604510 0.140096 O\n0.750000 0.823016 0.482330 O\n0.250000 0.176984 0.517670 O\n0.250000 0.323016 0.017670 O\n0.750000 0.676984 0.982330 O\n0.250000 0.653541 0.954335 O\n0.750000 0.346459 0.045665 O\n0.750000 0.153541 0.545665 O\n0.250000 0.846459 0.454335 O\n0.250000 0.698056 0.757645 O\n0.750000 0.301944 0.242355 O\n0.750000 0.198056 0.742355 O\n0.250000 0.801944 0.257645 O\n0.938055 0.628319 0.357533 O\n0.438055 0.371681 0.642467 O\n0.061945 0.128319 0.142467 O\n0.561945 0.871681 0.857533 O\n0.061945 0.371681 0.642467 O\n0.561945 0.628319 0.357533 O\n0.938055 0.871681 0.857533 O\n0.438055 0.128319 0.142467 O\n0.250000 0.451741 0.273291 O\n0.750000 0.548259 0.726709 O\n0.750000 0.951741 0.226709 O\n0.250000 0.048259 0.773291 O\n0.250000 0.527177 0.500574 O\n0.750000 0.472823 0.499426 O\n0.750000 0.027177 0.999426 O\n0.250000 0.972823 0.000574 O\n",
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"spacegroup": 62
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{
"id": "mp-1097664",
"created_at": "2022-09-04T14:41:10.522623Z",
"structure_string": "Mn1 Nb2 Os1\n1.0\n-4.901596 5.174598 7.413623\n4.901596 -5.174598 7.413623\n4.901596 5.174598 -7.413623\nMn Nb Os\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Mn\n0.000000 0.263192 0.263192 Nb\n0.000000 0.736808 0.736808 Nb\n0.000000 0.500000 0.500000 Os\n",
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{
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"structure_string": "Na4 Li8 Mn4 P4 C4 O28\n1.0\n6.652213 0.000000 0.000000\n0.017203 8.718719 0.000000\n0.008307 0.175282 10.078820\nNa Li Mn P C O\n4 8 4 4 4 28\ndirect\n0.745867 0.084159 0.877931 Na\n0.747905 0.084277 0.378604 Na\n0.002961 0.251580 0.124445 Na\n0.499579 0.748454 0.376342 Na\n0.979535 0.265075 0.616904 Li\n0.522155 0.266928 0.613884 Li\n0.518029 0.268049 0.115305 Li\n0.482151 0.736475 0.882055 Li\n0.019711 0.734690 0.885620 Li\n0.015917 0.733846 0.384437 Li\n0.245877 0.917806 0.628005 Li\n0.250881 0.912663 0.123413 Li\n0.252807 0.357822 0.884346 Mn\n0.252286 0.359809 0.391735 Mn\n0.753420 0.644641 0.615896 Mn\n0.751525 0.641968 0.108919 Mn\n0.749919 0.412513 0.849479 P\n0.751697 0.412768 0.355525 P\n0.250196 0.593391 0.651247 P\n0.250578 0.592942 0.145412 P\n0.250184 0.041461 0.865799 C\n0.243009 0.046028 0.365866 C\n0.750859 0.950471 0.633394 C\n0.742696 0.945822 0.132277 C\n0.751394 0.100198 0.640344 O\n0.723744 0.094350 0.141574 O\n0.247104 0.088400 0.987878 O\n0.250527 0.089820 0.488444 O\n0.252754 0.140814 0.767626 O\n0.258132 0.147708 0.269454 O\n0.938088 0.322928 0.898068 O\n0.566978 0.320625 0.904404 O\n0.937034 0.314346 0.398939 O\n0.566700 0.325910 0.414000 O\n0.746453 0.413428 0.693861 O\n0.247495 0.423402 0.603054 O\n0.734798 0.418182 0.200515 O\n0.267955 0.426274 0.093880 O\n0.747160 0.582180 0.895085 O\n0.245817 0.586465 0.806774 O\n0.768133 0.579106 0.404528 O\n0.234104 0.581861 0.300124 O\n0.437262 0.684466 0.604579 O\n0.069305 0.688631 0.597768 O\n0.433513 0.694286 0.103761 O\n0.066859 0.681855 0.088092 O\n0.753018 0.865323 0.740112 O\n0.755793 0.860001 0.238371 O\n0.748263 0.884759 0.518827 O\n0.749339 0.882227 0.017066 O\n0.250962 0.895914 0.839917 O\n0.221569 0.902902 0.336114 O\n",
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"formula_full": "Na4 Li8 Mn4 P4 C4 O28",
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{
"id": "mp-1194892",
"created_at": "2022-09-04T14:41:10.543389Z",
"structure_string": "Si2 P8 Pd2 Pb2 O28\n1.0\n17.408236 0.000000 0.000000\n0.000000 4.657489 0.000000\n0.000000 1.364743 6.390872\nSi P Pd Pb O\n2 8 2 2 28\ndirect\n0.000000 0.000000 0.000000 Si\n0.500000 0.000000 0.000000 Si\n0.122807 0.116523 0.647000 P\n0.622807 0.883477 0.353000 P\n0.877193 0.883477 0.353000 P\n0.377193 0.116523 0.647000 P\n0.086325 0.431675 0.222394 P\n0.586325 0.568325 0.777606 P\n0.913675 0.568325 0.777606 P\n0.413675 0.431675 0.222394 P\n0.250000 0.618860 0.642580 Pd\n0.750000 0.381140 0.357420 Pd\n0.250000 0.102863 0.139602 Pb\n0.750000 0.897137 0.860398 Pb\n0.071351 0.322265 0.471962 O\n0.571351 0.677735 0.528038 O\n0.928649 0.677735 0.528038 O\n0.428649 0.322265 0.471962 O\n0.067652 0.932815 0.804195 O\n0.567652 0.067185 0.195805 O\n0.932348 0.067185 0.195805 O\n0.432348 0.932815 0.804195 O\n0.169700 0.927368 0.524278 O\n0.669700 0.072632 0.475722 O\n0.830300 0.072632 0.475722 O\n0.330300 0.927368 0.524278 O\n0.171385 0.309173 0.763183 O\n0.671385 0.690827 0.236817 O\n0.828615 0.690827 0.236817 O\n0.328615 0.309173 0.763183 O\n0.074578 0.159441 0.125442 O\n0.574578 0.840559 0.874558 O\n0.925422 0.840559 0.874558 O\n0.425422 0.159441 0.125442 O\n0.022464 0.655833 0.159428 O\n0.522464 0.344167 0.840572 O\n0.977536 0.344167 0.840572 O\n0.477536 0.655833 0.159428 O\n0.168879 0.534193 0.187828 O\n0.668879 0.465807 0.812172 O\n0.831121 0.465807 0.812172 O\n0.331121 0.534193 0.187828 O\n",
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"formula_full": "Si2 P8 Pd2 Pb2 O28",
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{
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{
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{
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{
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{
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},
{
"id": "mp-1214580",
"created_at": "2022-09-04T14:41:10.581916Z",
"structure_string": "Ba3 Cd1 Si2 O8\n1.0\n2.906478 -5.034167 0.000000\n2.906478 5.034167 0.000000\n0.000000 0.000000 7.465579\nBa Cd Si O\n3 1 2 8\ndirect\n0.333333 0.666667 0.672920 Ba\n0.666667 0.333333 0.327080 Ba\n0.000000 0.000000 0.000000 Ba\n0.000000 0.000000 0.500000 Cd\n0.333333 0.666667 0.223512 Si\n0.666667 0.333333 0.776488 Si\n0.333333 0.666667 0.007089 O\n0.666667 0.333333 0.992911 O\n0.179608 0.820392 0.305723 O\n0.820392 0.179608 0.694277 O\n0.179608 0.359216 0.305723 O\n0.820392 0.640784 0.694277 O\n0.640784 0.820392 0.305723 O\n0.359216 0.179608 0.694277 O\n",
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"volume": 218.46815931656616,
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"formula_full": "Ba3 Cd1 Si2 O8",
"formula_reduced": "Ba3Cd(SiO4)2",
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},
{
"id": "mp-540872",
"created_at": "2022-09-04T14:41:08.632143Z",
"structure_string": "Ag4 Sb4 O12\n1.0\n0.000000 5.211863 5.211863\n5.211863 0.000000 5.211863\n5.211863 5.211863 0.000000\nAg Sb O\n4 4 12\ndirect\n0.625000 0.125000 0.125000 Ag\n0.125000 0.625000 0.125000 Ag\n0.125000 0.125000 0.625000 Ag\n0.125000 0.125000 0.125000 Ag\n0.125000 0.625000 0.625000 Sb\n0.625000 0.125000 0.625000 Sb\n0.625000 0.625000 0.125000 Sb\n0.625000 0.625000 0.625000 Sb\n0.700650 0.700650 0.299350 O\n0.299350 0.299350 0.700650 O\n0.700650 0.299350 0.700650 O\n0.299350 0.700650 0.299350 O\n0.299350 0.700650 0.700650 O\n0.700650 0.299350 0.299350 O\n0.549350 0.549350 0.950650 O\n0.950650 0.950650 0.549350 O\n0.549350 0.950650 0.549350 O\n0.950650 0.549350 0.950650 O\n0.950650 0.549350 0.549350 O\n0.549350 0.950650 0.950650 O\n",
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}
]
}