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{
"id": "mp-1185237",
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{
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"structure_string": "La14 Mn16 O48\n1.0\n7.850382 0.000000 0.000000\n-3.804676 8.721705 0.000000\n-3.889332 -1.853990 14.032224\nLa Mn O\n14 16 48\ndirect\n0.877206 0.380436 0.876342 La\n0.122810 0.118372 0.628288 La\n0.372908 0.373867 0.875672 La\n0.499694 0.750889 0.748624 La\n0.379472 0.876345 0.373688 La\n0.620528 0.123655 0.626312 La\n0.748245 0.502422 0.500980 La\n0.627092 0.626133 0.124328 La\n0.877190 0.881628 0.371712 La\n0.251755 0.497578 0.499020 La\n0.122794 0.619564 0.123658 La\n0.243563 0.992946 0.996063 La\n0.500306 0.249111 0.251376 La\n0.756437 0.007054 0.003937 La\n0.812684 0.689432 0.935207 Mn\n0.936751 0.059433 0.812412 Mn\n0.060657 0.440061 0.687951 Mn\n0.433326 0.059874 0.812569 Mn\n0.184508 0.810495 0.563538 Mn\n0.310167 0.187847 0.435873 Mn\n0.566463 0.440558 0.688244 Mn\n0.689833 0.812153 0.564127 Mn\n0.433537 0.559442 0.311756 Mn\n0.566674 0.940126 0.187431 Mn\n0.815492 0.189505 0.436462 Mn\n0.939343 0.559939 0.312049 Mn\n0.690062 0.312069 0.065063 Mn\n0.063249 0.940567 0.187588 Mn\n0.187316 0.310568 0.064793 Mn\n0.309938 0.687931 0.934937 Mn\n0.041981 0.265776 0.766231 O\n0.204302 0.072480 0.836373 O\n0.056496 0.685000 0.928975 O\n0.425799 0.893868 0.893291 O\n0.303316 0.928874 0.691152 O\n0.241118 0.576638 0.808089 O\n0.288353 0.012921 0.514066 O\n0.646461 0.538877 0.820724 O\n0.442314 0.805280 0.580319 O\n0.601784 0.212315 0.931838 O\n0.301008 0.436960 0.665452 O\n0.455635 0.236863 0.738488 O\n0.635453 0.629665 0.629477 O\n0.807835 0.412151 0.706185 O\n0.527288 0.671261 0.442532 O\n0.684232 0.075884 0.794778 O\n0.472712 0.328739 0.557468 O\n0.821130 0.868587 0.867906 O\n0.544365 0.763137 0.261512 O\n0.903787 0.287256 0.573202 O\n0.698992 0.563040 0.334548 O\n0.833502 0.969853 0.676977 O\n0.557686 0.194720 0.419681 O\n0.711647 0.987079 0.485934 O\n0.909419 0.398173 0.398945 O\n0.071525 0.179467 0.462449 O\n0.758882 0.423362 0.191911 O\n0.928475 0.820533 0.537551 O\n0.696684 0.071126 0.308848 O\n0.090581 0.601827 0.601055 O\n0.784948 0.515189 0.015827 O\n0.166498 0.030147 0.323023 O\n0.943504 0.315000 0.071025 O\n0.096213 0.712744 0.426798 O\n0.795698 0.927520 0.163627 O\n0.958019 0.734224 0.233769 O\n0.178870 0.131413 0.132094 O\n0.315768 0.924116 0.205222 O\n0.029433 0.166115 0.945184 O\n0.192165 0.587849 0.293815 O\n0.970567 0.833885 0.054816 O\n0.364547 0.370335 0.370523 O\n0.398216 0.787685 0.068162 O\n0.353539 0.461123 0.179276 O\n0.215052 0.484811 0.984173 O\n0.570943 0.683079 0.959715 O\n0.429057 0.316921 0.040285 O\n0.574201 0.106132 0.106709 O\n",
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"formula_full": "La14 Mn16 O48",
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{
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{
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"structure_string": "Th2 Ni1 C2\n1.0\n-1.884757 1.884757 6.154295\n1.884757 -1.884757 6.154295\n1.884757 1.884757 -6.154295\nTh Ni C\n2 1 2\ndirect\n0.353890 0.353890 0.000000 Th\n0.646110 0.646110 0.000000 Th\n0.000000 0.000000 0.000000 Ni\n0.156233 0.156233 0.000000 C\n0.843767 0.843767 0.000000 C\n",
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{
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"created_at": "2022-09-04T14:41:45.407202Z",
"structure_string": "Hf2 Br2 N2\n1.0\n10.347978 -1.816824 0.000000\n10.347978 1.816824 0.000000\n10.028993 0.000000 3.130623\nHf Br N\n2 2 2\ndirect\n0.791579 0.791579 0.791579 Hf\n0.208421 0.208421 0.208421 Hf\n0.606088 0.606088 0.606088 Br\n0.393912 0.393912 0.393912 Br\n0.861449 0.861449 0.861449 N\n0.138551 0.138551 0.138551 N\n",
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{
"id": "mp-1210244",
"created_at": "2022-09-04T14:41:45.447442Z",
"structure_string": "Pr46 Mg8 Pt14\n1.0\n5.113846 -8.857442 0.000000\n5.113846 8.857442 0.000000\n0.000000 0.000000 23.107710\nPr Mg Pt\n46 8 14\ndirect\n0.206009 0.412018 0.720235 Pr\n0.206009 0.793991 0.720235 Pr\n0.793991 0.587982 0.220235 Pr\n0.587982 0.793991 0.720235 Pr\n0.793991 0.206009 0.220235 Pr\n0.412018 0.206009 0.220235 Pr\n0.793634 0.587268 0.946035 Pr\n0.793634 0.206366 0.946035 Pr\n0.206366 0.412732 0.446035 Pr\n0.412732 0.206366 0.946035 Pr\n0.206366 0.793634 0.446035 Pr\n0.587268 0.793634 0.446035 Pr\n0.211828 0.423657 0.990265 Pr\n0.211828 0.788172 0.990265 Pr\n0.788172 0.576343 0.490265 Pr\n0.576343 0.788172 0.990265 Pr\n0.788172 0.211828 0.490265 Pr\n0.423657 0.211828 0.490265 Pr\n0.870758 0.741515 0.635233 Pr\n0.870758 0.129242 0.635233 Pr\n0.129242 0.258485 0.135233 Pr\n0.258485 0.129242 0.635233 Pr\n0.129242 0.870758 0.135233 Pr\n0.741515 0.870758 0.135233 Pr\n0.456369 0.912739 0.856466 Pr\n0.456369 0.543631 0.856466 Pr\n0.543631 0.087261 0.356466 Pr\n0.087261 0.543631 0.856466 Pr\n0.543631 0.456369 0.356466 Pr\n0.912739 0.456369 0.356466 Pr\n0.000000 0.000000 0.998634 Pr\n0.000000 0.000000 0.498634 Pr\n0.461478 0.922955 0.585245 Pr\n0.461478 0.538522 0.585245 Pr\n0.538522 0.077045 0.085245 Pr\n0.077045 0.538522 0.585245 Pr\n0.538522 0.461478 0.085245 Pr\n0.922955 0.461478 0.085245 Pr\n0.797989 0.595977 0.782820 Pr\n0.797989 0.202011 0.782820 Pr\n0.202011 0.404023 0.282820 Pr\n0.404023 0.202011 0.782820 Pr\n0.202011 0.797989 0.282820 Pr\n0.595977 0.797989 0.282820 Pr\n0.666667 0.333333 0.642955 Pr\n0.333333 0.666667 0.142955 Pr\n0.000000 0.000000 0.749814 Mg\n0.000000 0.000000 0.249814 Mg\n0.105993 0.211985 0.863093 Mg\n0.105993 0.894007 0.863093 Mg\n0.894007 0.788015 0.363093 Mg\n0.788015 0.894007 0.863093 Mg\n0.894007 0.105993 0.363093 Mg\n0.211985 0.105993 0.363093 Mg\n0.522341 0.044682 0.710234 Pt\n0.522341 0.477659 0.710234 Pt\n0.477659 0.955318 0.210234 Pt\n0.955318 0.477659 0.710234 Pt\n0.477659 0.522341 0.210234 Pt\n0.044682 0.522341 0.210234 Pt\n0.666667 0.333333 0.861957 Pt\n0.333333 0.666667 0.361957 Pt\n0.143393 0.286786 0.564827 Pt\n0.143393 0.856607 0.564827 Pt\n0.856607 0.713214 0.064827 Pt\n0.713214 0.856607 0.564827 Pt\n0.856607 0.143393 0.064827 Pt\n0.286786 0.143393 0.064827 Pt\n",
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{
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{
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"structure_string": "Ti1 Ga1 Co2\n1.0\n0.000000 2.918416 2.918416\n2.918416 0.000000 2.918416\n2.918416 2.918416 0.000000\nTi Ga Co\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Ti\n0.000000 0.000000 0.000000 Ga\n0.750000 0.750000 0.750000 Co\n0.250000 0.250000 0.250000 Co\n",
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{
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{
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"formula_reduced": "Li9Mn2Co5O16",
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{
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"formula_full": "Sm3 In3 Ni3",
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},
{
"id": "mp-780303",
"created_at": "2022-09-04T14:41:35.257572Z",
"structure_string": "Li4 Fe3 Sb1 O8\n1.0\n3.056264 5.234087 0.000000\n-3.056264 5.234087 0.000000\n0.000000 3.423471 5.049990\nLi Fe Sb O\n4 3 1 8\ndirect\n0.500000 0.500000 0.000000 Li\n0.000000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Li\n0.500000 0.000000 0.500000 Li\n0.500000 0.000000 0.000000 Fe\n0.500000 0.500000 0.500000 Fe\n0.000000 0.500000 0.000000 Fe\n0.000000 0.000000 0.500000 Sb\n0.267272 0.267272 0.749587 O\n0.754104 0.238323 0.272727 O\n0.769068 0.769068 0.728306 O\n0.732728 0.732728 0.250413 O\n0.238323 0.754104 0.272727 O\n0.245896 0.761677 0.727273 O\n0.230932 0.230932 0.271694 O\n0.761677 0.245896 0.727273 O\n",
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"formula_full": "Li4 Fe3 Sb1 O8",
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]
}