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{
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{
"id": "mp-772294",
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"structure_string": "Na10 Li2 Fe4 P4 C4 O28\n1.0\n6.590290 0.000000 0.000000\n0.000000 8.987466 0.000000\n0.000000 0.208320 10.395721\nNa Li Fe P C O\n10 2 4 4 4 28\ndirect\n0.496802 0.081514 0.880192 Na\n0.503198 0.081514 0.380192 Na\n0.251334 0.260626 0.624855 Na\n0.749096 0.260632 0.624710 Na\n0.250904 0.260632 0.124710 Na\n0.748666 0.260626 0.124855 Na\n0.752092 0.739922 0.875354 Na\n0.247908 0.739922 0.375354 Na\n0.000483 0.915883 0.619790 Na\n0.999517 0.915883 0.119790 Na\n0.246187 0.728903 0.877356 Li\n0.753813 0.728903 0.377356 Li\n0.999521 0.356373 0.892719 Fe\n0.000479 0.356373 0.392719 Fe\n0.502200 0.646978 0.606729 Fe\n0.497800 0.646978 0.106729 Fe\n0.495647 0.417162 0.849068 P\n0.504353 0.417162 0.349068 P\n0.004109 0.588908 0.649576 P\n0.995891 0.588908 0.149576 P\n0.006700 0.054699 0.866071 C\n0.993300 0.054699 0.366071 C\n0.498136 0.939823 0.635566 C\n0.501864 0.939823 0.135566 C\n0.499896 0.083555 0.643135 O\n0.500104 0.083555 0.143135 O\n0.999452 0.119728 0.977245 O\n0.000548 0.119728 0.477245 O\n0.998718 0.137414 0.761528 O\n0.001282 0.137414 0.261528 O\n0.310731 0.318143 0.890149 O\n0.686528 0.326675 0.893782 O\n0.313472 0.326675 0.393782 O\n0.689269 0.318143 0.390149 O\n0.500144 0.434325 0.699709 O\n0.000378 0.433441 0.588815 O\n0.499856 0.434325 0.199709 O\n0.999622 0.433441 0.088815 O\n0.483844 0.572861 0.909594 O\n0.011954 0.572872 0.799789 O\n0.516156 0.572861 0.409594 O\n0.988046 0.572872 0.299789 O\n0.814636 0.682657 0.608148 O\n0.190340 0.681894 0.603308 O\n0.809660 0.681894 0.103308 O\n0.185364 0.682657 0.108148 O\n0.494463 0.856138 0.739545 O\n0.505537 0.856138 0.239545 O\n0.500719 0.877751 0.523325 O\n0.499281 0.877751 0.023325 O\n0.020961 0.911122 0.859943 O\n0.979039 0.911122 0.359943 O\n",
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{
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"structure_string": "Sm4 H4 I4 Cl4 O52\n1.0\n7.268025 0.000000 0.000000\n0.000000 11.111260 0.000000\n0.000000 1.388042 13.192970\nSm H I Cl O\n4 4 4 4 52\ndirect\n0.141114 0.020461 0.180313 Sm\n0.641114 0.979539 0.319687 Sm\n0.858886 0.979539 0.819687 Sm\n0.358886 0.020461 0.680313 Sm\n0.184386 0.713166 0.489244 H\n0.684386 0.286834 0.010756 H\n0.815614 0.286834 0.510756 H\n0.315614 0.713166 0.989244 H\n0.133261 0.927443 0.439637 I\n0.633261 0.072557 0.060363 I\n0.866739 0.072557 0.560363 I\n0.366739 0.927443 0.939637 I\n0.266250 0.450356 0.385842 Cl\n0.766250 0.549644 0.114158 Cl\n0.733750 0.549644 0.614158 Cl\n0.233750 0.450356 0.885842 Cl\n0.304961 0.918421 0.542662 O\n0.804961 0.081579 0.957338 O\n0.695039 0.081579 0.457338 O\n0.195039 0.918421 0.042662 O\n0.077164 0.097799 0.463544 O\n0.577164 0.902201 0.036456 O\n0.922836 0.902201 0.536456 O\n0.422836 0.097799 0.963544 O\n0.966436 0.943036 0.328776 O\n0.466436 0.056964 0.171224 O\n0.033564 0.056964 0.671224 O\n0.533564 0.943036 0.828776 O\n0.134630 0.759236 0.427088 O\n0.634630 0.240764 0.072912 O\n0.865370 0.240764 0.572912 O\n0.365370 0.759236 0.927088 O\n0.111066 0.222535 0.085724 O\n0.611066 0.777465 0.414276 O\n0.888934 0.777465 0.914276 O\n0.388934 0.222535 0.585724 O\n0.225086 0.711059 0.197380 O\n0.725086 0.288941 0.302620 O\n0.774914 0.288941 0.802620 O\n0.274914 0.711059 0.697380 O\n0.809512 0.025154 0.160978 O\n0.309512 0.974846 0.339022 O\n0.190488 0.974846 0.839022 O\n0.690488 0.025154 0.660978 O\n0.101916 0.236162 0.181187 O\n0.601916 0.763838 0.318813 O\n0.898084 0.763838 0.818813 O\n0.398084 0.236162 0.681187 O\n0.233147 0.645217 0.632085 O\n0.733147 0.354783 0.867915 O\n0.766853 0.354783 0.367915 O\n0.266853 0.645217 0.132085 O\n0.326354 0.348103 0.334719 O\n0.826354 0.651897 0.165281 O\n0.673646 0.651897 0.665281 O\n0.173646 0.348103 0.834719 O\n0.214617 0.405775 0.491750 O\n0.714617 0.594225 0.008250 O\n0.785383 0.594225 0.508250 O\n0.285383 0.405775 0.991750 O\n0.097331 0.503314 0.340423 O\n0.597331 0.496686 0.159577 O\n0.902669 0.496686 0.659577 O\n0.402669 0.503314 0.840423 O\n0.408503 0.541208 0.385317 O\n0.908503 0.458792 0.114683 O\n0.591497 0.458792 0.614683 O\n0.091497 0.541208 0.885317 O\n",
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{
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"structure_string": "Ce18 C18 Cl11\n1.0\n6.653262 0.000000 0.000000\n-1.873386 -7.380539 0.000000\n-3.042434 0.485449 -18.491588\nCe C Cl\n18 18 11\ndirect\n0.908768 0.853165 0.060461 Ce\n0.091232 0.146835 0.939539 Ce\n0.129096 0.813880 0.490368 Ce\n0.870904 0.186120 0.509632 Ce\n0.569978 0.879063 0.386131 Ce\n0.430022 0.120937 0.613869 Ce\n0.308546 0.248182 0.400392 Ce\n0.691454 0.751818 0.599608 Ce\n0.001753 0.942928 0.273345 Ce\n0.998247 0.057072 0.726655 Ce\n0.632752 0.221038 0.045493 Ce\n0.367248 0.778962 0.954507 Ce\n0.451380 0.933034 0.173222 Ce\n0.548620 0.066966 0.826778 Ce\n0.174086 0.301459 0.153949 Ce\n0.825914 0.698541 0.846051 Ce\n0.740861 0.311855 0.290884 Ce\n0.259139 0.688145 0.709116 Ce\n0.461719 0.065724 0.479285 C\n0.538281 0.934276 0.520715 C\n0.256862 0.107260 0.076379 C\n0.743138 0.892740 0.923621 C\n0.412391 0.057904 0.303253 C\n0.587609 0.942096 0.696747 C\n0.707546 0.028757 0.965192 C\n0.292454 0.971243 0.034808 C\n0.900832 0.131730 0.370293 C\n0.099168 0.868270 0.629707 C\n0.806440 0.165560 0.193186 C\n0.193560 0.834440 0.806814 C\n0.978223 0.001695 0.411793 C\n0.021777 0.998305 0.588207 C\n0.833708 0.044442 0.143118 C\n0.166292 0.955558 0.856882 C\n0.335578 0.171032 0.252596 C\n0.664422 0.828968 0.747404 C\n0.061198 0.654563 0.181744 Cl\n0.938802 0.345437 0.818256 Cl\n0.521423 0.591551 0.087194 Cl\n0.478577 0.408449 0.912806 Cl\n0.156288 0.608464 0.361573 Cl\n0.843712 0.391536 0.638427 Cl\n0.000000 0.500000 0.000000 Cl\n0.603472 0.660346 0.267100 Cl\n0.396528 0.339654 0.732900 Cl\n0.717468 0.539079 0.454490 Cl\n0.282532 0.460921 0.545510 Cl\n",
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{
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{
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"structure_string": "Li8 Ni4 Ge12 O32\n1.0\n8.305329 0.000000 0.000000\n0.000000 8.305329 0.000000\n0.000000 0.000000 8.305329\nLi Ni Ge O\n8 4 12 32\ndirect\n0.503211 0.503211 0.503211 Li\n0.253211 0.246789 0.753211 Li\n0.753211 0.253211 0.246789 Li\n0.246789 0.753211 0.253211 Li\n0.996789 0.496789 0.003211 Li\n0.003211 0.996789 0.496789 Li\n0.496789 0.003211 0.996789 Li\n0.746789 0.746789 0.746789 Li\n0.125000 0.125000 0.125000 Ni\n0.375000 0.875000 0.625000 Ni\n0.625000 0.375000 0.875000 Ni\n0.875000 0.625000 0.375000 Ni\n0.877445 0.372555 0.625000 Ge\n0.372555 0.625000 0.877445 Ge\n0.627445 0.125000 0.622555 Ge\n0.872555 0.875000 0.122555 Ge\n0.122555 0.872555 0.875000 Ge\n0.622555 0.627445 0.125000 Ge\n0.875000 0.122555 0.872555 Ge\n0.375000 0.377445 0.127445 Ge\n0.625000 0.877445 0.372555 Ge\n0.127445 0.375000 0.377445 Ge\n0.125000 0.622555 0.627445 Ge\n0.377445 0.127445 0.375000 Ge\n0.615870 0.115870 0.384130 O\n0.649544 0.356705 0.623830 O\n0.149544 0.143295 0.376170 O\n0.356705 0.623830 0.649544 O\n0.643295 0.123830 0.850456 O\n0.623830 0.649544 0.356705 O\n0.876170 0.350456 0.856705 O\n0.899544 0.373830 0.393295 O\n0.399544 0.126170 0.606705 O\n0.100456 0.873830 0.106705 O\n0.126170 0.606705 0.399544 O\n0.106705 0.100456 0.873830 O\n0.606705 0.399544 0.126170 O\n0.373830 0.393295 0.899544 O\n0.393295 0.899544 0.373830 O\n0.873830 0.106705 0.100456 O\n0.884130 0.884130 0.884130 O\n0.634130 0.865870 0.134130 O\n0.134130 0.634130 0.865870 O\n0.865870 0.134130 0.634130 O\n0.626170 0.893295 0.600456 O\n0.384130 0.615870 0.115870 O\n0.115870 0.384130 0.615870 O\n0.365870 0.365870 0.365870 O\n0.893295 0.600456 0.626170 O\n0.350456 0.856705 0.876170 O\n0.850456 0.643295 0.123830 O\n0.143295 0.376170 0.149544 O\n0.856705 0.876170 0.350456 O\n0.123830 0.850456 0.643295 O\n0.376170 0.149544 0.143295 O\n0.600456 0.626170 0.893295 O\n",
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"elements": [
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"formula_full": "Li8 Ni4 Ge12 O32",
"formula_reduced": "Li2NiGe3O8",
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"updated_at": "2021-11-28T01:38:30.695000Z",
"spacegroup": 212
},
{
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"created_at": "2022-09-04T14:40:15.268219Z",
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"updated_at": "2021-11-28T01:34:52.623000Z",
"spacegroup": 6
}
]
}