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{
"id": "mp-774276",
"created_at": "2022-09-04T14:42:16.208986Z",
"structure_string": "Li8 Cr12 Sn4 O32\n1.0\n8.508411 0.000000 0.000000\n0.000000 8.508411 0.000000\n0.000000 0.000000 8.610572\nLi Cr Sn O\n8 12 4 32\ndirect\n0.749773 0.001219 0.626261 Li\n0.998781 0.250227 0.873739 Li\n0.001219 0.749773 0.373739 Li\n0.250227 0.998781 0.126261 Li\n0.249773 0.498781 0.623739 Li\n0.498781 0.249773 0.376261 Li\n0.501219 0.750227 0.876261 Li\n0.750227 0.501219 0.123739 Li\n0.865533 0.134467 0.250000 Cr\n0.872805 0.380018 0.493290 Cr\n0.880018 0.627195 0.743290 Cr\n0.119982 0.372805 0.243290 Cr\n0.127195 0.619982 0.993290 Cr\n0.134467 0.865533 0.750000 Cr\n0.365533 0.365533 0.000000 Cr\n0.372805 0.119982 0.756710 Cr\n0.380018 0.872805 0.506710 Cr\n0.619982 0.127195 0.006710 Cr\n0.627195 0.880018 0.256710 Cr\n0.634467 0.634467 0.500000 Cr\n0.875988 0.875988 0.000000 Sn\n0.124012 0.124012 0.500000 Sn\n0.375988 0.624012 0.250000 Sn\n0.624012 0.375988 0.750000 Sn\n0.857592 0.123190 0.017393 O\n0.865963 0.900902 0.244578 O\n0.856315 0.618874 0.509338 O\n0.876810 0.142408 0.482607 O\n0.868543 0.390169 0.730060 O\n0.881126 0.356315 0.259338 O\n0.890169 0.631457 0.980060 O\n0.900902 0.865963 0.755422 O\n0.099098 0.134037 0.255422 O\n0.109831 0.368543 0.480060 O\n0.118874 0.643685 0.759338 O\n0.131457 0.609831 0.230060 O\n0.123190 0.857592 0.982607 O\n0.143685 0.381126 0.009338 O\n0.134037 0.099098 0.744578 O\n0.142408 0.876810 0.517393 O\n0.357592 0.376810 0.232607 O\n0.365963 0.599098 0.005422 O\n0.356315 0.881126 0.740662 O\n0.376810 0.357592 0.767393 O\n0.368543 0.109831 0.519940 O\n0.381126 0.143685 0.990662 O\n0.390169 0.868543 0.269940 O\n0.400902 0.634037 0.494578 O\n0.599098 0.365963 0.994578 O\n0.609831 0.131457 0.769940 O\n0.618874 0.856315 0.490662 O\n0.631457 0.890169 0.019940 O\n0.623190 0.642408 0.267393 O\n0.643685 0.118874 0.240662 O\n0.634037 0.400902 0.505422 O\n0.642408 0.623190 0.732607 O\n",
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"spacegroup": 96
},
{
"id": "mp-1638691",
"created_at": "2022-09-04T14:42:15.863589Z",
"structure_string": "Ca2 La2 Fe2 W2 O12\n1.0\n-0.074246 5.616222 0.036092\n0.013324 0.050408 8.000819\n5.799723 -0.077536 0.010149\nCa La Fe W O\n2 2 2 2 12\ndirect\n0.525833 0.251762 0.553162 Ca\n0.017999 0.752788 0.947202 Ca\n0.984083 0.246774 0.047587 La\n0.474736 0.747658 0.450787 La\n0.499007 0.500285 0.000784 Fe\n0.997318 0.000474 0.500286 Fe\n0.999595 0.498776 0.502949 W\n0.500989 0.998417 0.996907 W\n0.605915 0.766403 0.031021 O\n0.107301 0.267113 0.470129 O\n0.212165 0.949422 0.192746 O\n0.704964 0.449230 0.299693 O\n0.191749 0.561504 0.218933 O\n0.700481 0.058863 0.288124 O\n0.898625 0.733180 0.536619 O\n0.401945 0.233528 0.962583 O\n0.291714 0.551734 0.708054 O\n0.786585 0.050983 0.799536 O\n0.295765 0.941795 0.710127 O\n0.803231 0.439312 0.782771 O\n",
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"formula_full": "Ca2 La2 Fe2 W2 O12",
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{
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"structure_string": "Fe16 W8 N4\n1.0\n-5.463656 -0.021431 -5.489720\n5.442225 -5.442225 0.000000\n-5.448184 -5.448184 -0.036687\nFe W N\n16 8 4\ndirect\n0.751934 0.375967 0.877989 Fe\n0.250711 0.372574 0.378202 Fe\n0.250711 0.878137 0.378202 Fe\n0.744485 0.372243 0.376204 Fe\n0.347136 0.173568 0.483071 Fe\n0.661135 0.170152 0.169774 Fe\n0.661135 0.490983 0.169774 Fe\n0.336829 0.168414 0.165059 Fe\n0.157302 0.578651 0.261417 Fe\n0.840979 0.579030 0.576352 Fe\n0.840979 0.261949 0.576352 Fe\n0.159197 0.579599 0.581516 Fe\n0.895321 0.947661 0.547924 Fe\n0.502719 0.554357 0.549370 Fe\n0.502719 0.948363 0.549370 Fe\n0.099019 0.549509 0.949477 Fe\n0.500410 0.948640 0.943741 W\n0.500410 0.551770 0.943741 W\n0.594575 0.797288 0.214033 W\n0.988594 0.197089 0.209399 W\n0.988594 0.791506 0.209399 W\n0.403677 0.201838 0.787623 W\n0.009432 0.804547 0.797058 W\n0.009432 0.204886 0.797058 W\n0.741643 0.870822 0.392931 N\n0.253030 0.870195 0.872606 N\n0.253030 0.382835 0.872606 N\n0.754861 0.877431 0.869751 N\n",
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{
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"created_at": "2022-09-04T14:42:16.159129Z",
"structure_string": "Tl4 Fe4 I12\n1.0\n4.009761 0.000000 0.000000\n0.000000 9.824469 0.000000\n0.000000 0.000000 16.127104\nTl Fe I\n4 4 12\ndirect\n0.750000 0.556920 0.172738 Tl\n0.750000 0.056920 0.327262 Tl\n0.250000 0.443080 0.827262 Tl\n0.250000 0.943080 0.672738 Tl\n0.250000 0.649175 0.451018 Fe\n0.750000 0.350825 0.548982 Fe\n0.750000 0.850825 0.951018 Fe\n0.250000 0.149175 0.048982 Fe\n0.250000 0.688958 0.999761 I\n0.750000 0.733118 0.800693 I\n0.750000 0.487092 0.410171 I\n0.750000 0.233118 0.699307 I\n0.250000 0.012908 0.910171 I\n0.250000 0.188958 0.500239 I\n0.250000 0.512908 0.589829 I\n0.750000 0.311042 0.000239 I\n0.750000 0.811042 0.499761 I\n0.750000 0.987092 0.089829 I\n0.250000 0.266882 0.199307 I\n0.250000 0.766882 0.300693 I\n",
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{
"id": "mp-504714",
"created_at": "2022-09-04T14:42:15.986473Z",
"structure_string": "Ni6 B14 I2 O26\n1.0\n0.000000 6.078832 6.078832\n6.078832 0.000000 6.078832\n6.078832 6.078832 0.000000\nNi B I O\n6 14 2 26\ndirect\n0.500000 0.000000 0.000000 Ni\n0.000000 0.500000 0.000000 Ni\n0.500000 0.000000 0.500000 Ni\n0.500000 0.500000 0.000000 Ni\n0.000000 0.000000 0.500000 Ni\n0.000000 0.500000 0.500000 Ni\n0.250000 0.750000 0.250000 B\n0.250000 0.750000 0.750000 B\n0.750000 0.250000 0.250000 B\n0.750000 0.750000 0.250000 B\n0.250000 0.250000 0.750000 B\n0.750000 0.250000 0.750000 B\n0.080270 0.080270 0.080270 B\n0.259189 0.580270 0.580270 B\n0.580270 0.259189 0.580270 B\n0.580270 0.580270 0.259189 B\n0.080270 0.759189 0.080270 B\n0.080270 0.080270 0.759189 B\n0.759189 0.080270 0.080270 B\n0.580270 0.580270 0.580270 B\n0.250000 0.250000 0.250000 I\n0.750000 0.750000 0.750000 I\n0.000000 0.000000 0.000000 O\n0.500000 0.500000 0.500000 O\n0.101495 0.936178 0.258814 O\n0.203513 0.758814 0.601495 O\n0.758814 0.203513 0.436178 O\n0.436178 0.758814 0.203513 O\n0.203513 0.601495 0.436178 O\n0.758814 0.601495 0.203513 O\n0.436178 0.203513 0.601495 O\n0.258814 0.101495 0.936178 O\n0.936178 0.258814 0.101495 O\n0.101495 0.703513 0.936178 O\n0.101495 0.258814 0.703513 O\n0.936178 0.703513 0.258814 O\n0.703513 0.101495 0.258814 O\n0.703513 0.936178 0.101495 O\n0.258814 0.936178 0.703513 O\n0.936178 0.101495 0.703513 O\n0.258814 0.703513 0.101495 O\n0.703513 0.258814 0.936178 O\n0.601495 0.203513 0.758814 O\n0.601495 0.436178 0.203513 O\n0.203513 0.436178 0.758814 O\n0.601495 0.758814 0.436178 O\n0.436178 0.601495 0.758814 O\n0.758814 0.436178 0.601495 O\n",
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{
"id": "mp-755424",
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"structure_string": "Mn6 O7 F5\n1.0\n5.550697 0.000000 0.000000\n1.793944 5.284419 0.000000\n2.188877 1.419757 6.874933\nMn O F\n6 7 5\ndirect\n0.302098 0.320842 0.161867 Mn\n0.653062 0.674108 0.324023 Mn\n0.370388 0.337454 0.682312 Mn\n0.645813 0.691708 0.835827 Mn\n0.002318 0.023595 0.496158 Mn\n0.009465 0.970743 0.002943 Mn\n0.347188 0.981656 0.329477 O\n0.765097 0.763728 0.037147 O\n0.226379 0.208744 0.971736 O\n0.573514 0.578248 0.624023 O\n0.663179 0.047062 0.664012 O\n0.961626 0.374036 0.323120 O\n0.300581 0.667094 0.005059 O\n0.048545 0.638990 0.668862 F\n0.129684 0.117006 0.693167 F\n0.417653 0.425773 0.363048 F\n0.892869 0.899733 0.308533 F\n0.690538 0.279476 0.008686 F\n",
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{
"id": "mp-1046302",
"created_at": "2022-09-04T14:42:16.214281Z",
"structure_string": "Ca4 Mn4 O8\n1.0\n3.334495 0.000000 0.000000\n1.100751 8.526051 0.000000\n0.474816 1.179082 8.702560\nCa Mn O\n4 4 8\ndirect\n0.194040 0.197559 0.949476 Ca\n0.805960 0.802441 0.050524 Ca\n0.080227 0.378206 0.265207 Ca\n0.919773 0.621794 0.734793 Ca\n0.321521 0.926833 0.728215 Mn\n0.713928 0.268132 0.633376 Mn\n0.286072 0.731868 0.366624 Mn\n0.678479 0.073167 0.271785 Mn\n0.232448 0.950469 0.191325 O\n0.390741 0.761365 0.581466 O\n0.609259 0.238635 0.418534 O\n0.767552 0.049531 0.808675 O\n0.354207 0.725816 0.899085 O\n0.161709 0.367896 0.724495 O\n0.645793 0.274184 0.100915 O\n0.838291 0.632104 0.275505 O\n",
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"formula_full": "Ca4 Mn4 O8",
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{
"id": "mp-1190273",
"created_at": "2022-09-04T14:42:16.098776Z",
"structure_string": "Pr2 Cr2 Te2 O12\n1.0\n-2.612774 -4.525089 0.000124\n-2.612455 4.524904 -0.000248\n0.000018 -0.000032 -10.342319\nPr Cr Te O\n2 2 2 12\ndirect\n0.000000 0.000000 0.000000 Pr\n0.000000 0.000000 0.500000 Pr\n0.333860 0.666930 0.250000 Cr\n0.666140 0.333070 0.750000 Cr\n0.333282 0.666641 0.750000 Te\n0.666718 0.333359 0.250000 Te\n0.373902 0.363908 0.143851 O\n0.636089 0.009950 0.143848 O\n0.990031 0.626102 0.143847 O\n0.626098 0.636092 0.856149 O\n0.363911 0.990050 0.856152 O\n0.009969 0.373898 0.856153 O\n0.636089 0.626139 0.356152 O\n0.373902 0.009994 0.356149 O\n0.990031 0.363929 0.356153 O\n0.363911 0.373861 0.643848 O\n0.626098 0.990006 0.643851 O\n0.009969 0.636071 0.643847 O\n",
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{
"id": "mp-1021211",
"created_at": "2022-09-04T14:42:15.909369Z",
"structure_string": "Ce2 Mg12 W2\n1.0\n5.169437 0.000000 0.000000\n0.000000 5.790837 0.000000\n0.000000 0.000000 11.805888\nCe Mg W\n2 12 2\ndirect\n0.500000 0.000000 0.177624 Ce\n0.500000 0.500000 0.677624 Ce\n0.500000 0.250141 0.425722 Mg\n0.500000 0.749859 0.425722 Mg\n0.000000 0.739852 0.081626 Mg\n0.000000 0.260148 0.081626 Mg\n0.000000 0.000000 0.336304 Mg\n0.000000 0.500000 0.303105 Mg\n0.500000 0.750141 0.925722 Mg\n0.500000 0.249859 0.925722 Mg\n0.000000 0.239852 0.581626 Mg\n0.000000 0.760148 0.581626 Mg\n0.000000 0.500000 0.836304 Mg\n0.000000 0.000000 0.803105 Mg\n0.500000 0.500000 0.168269 W\n0.500000 0.000000 0.668269 W\n",
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