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{
"id": "mp-707467",
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"structure_string": "Th4 H80 C16 S8 N32 O60\n1.0\n8.077277 4.129267 -0.519444\n-8.077277 4.129267 0.519444\n-0.070060 0.000000 32.362140\nTh H C S N O\n4 80 16 8 32 60\ndirect\n0.155880 0.686315 0.621139 Th\n0.686315 0.155880 0.878861 Th\n0.844120 0.313685 0.378861 Th\n0.313685 0.844120 0.121139 Th\n0.388338 0.182533 0.733974 H\n0.182533 0.388338 0.766026 H\n0.611662 0.817467 0.266026 H\n0.817467 0.611662 0.233974 H\n0.370870 0.989049 0.720517 H\n0.989049 0.370870 0.779483 H\n0.629130 0.010951 0.279483 H\n0.010951 0.629130 0.220517 H\n0.274199 0.305498 0.683375 H\n0.305498 0.274199 0.816625 H\n0.725801 0.694502 0.316625 H\n0.694502 0.725801 0.183375 H\n0.202672 0.208282 0.634561 H\n0.208282 0.202672 0.865439 H\n0.797328 0.791718 0.365439 H\n0.791718 0.797328 0.134561 H\n0.656640 0.334055 0.576827 H\n0.334055 0.656640 0.923173 H\n0.343360 0.665945 0.423173 H\n0.665945 0.343360 0.076827 H\n0.466615 0.181700 0.607299 H\n0.181700 0.466615 0.892701 H\n0.533385 0.818300 0.392701 H\n0.818300 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"elements": [
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"formula_full": "Th4 H80 C16 S8 N32 O60",
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"updated_at": "2021-11-28T01:36:37.689000Z",
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},
{
"id": "mp-652793",
"created_at": "2022-09-04T14:41:07.336927Z",
"structure_string": "Fe8 Co16 Ge8 C84 O84\n1.0\n9.099093 0.000000 -2.182472\n-1.359970 18.380510 -5.669943\n0.001979 -0.048290 20.067308\nFe Co Ge C O\n8 16 8 84 84\ndirect\n0.511510 0.442572 0.317169 Fe\n0.488490 0.557428 0.682831 Fe\n0.521641 0.680914 0.792780 Fe\n0.271140 0.180914 0.792780 Fe\n0.478359 0.319086 0.207220 Fe\n0.805659 0.942572 0.317169 Fe\n0.728860 0.819086 0.207220 Fe\n0.194341 0.057428 0.682831 Fe\n0.620506 0.503186 0.888969 Co\n0.140460 0.472915 0.146560 Co\n0.859540 0.527085 0.853440 Co\n0.019174 0.243984 0.610419 Co\n0.006100 0.972915 0.146560 Co\n0.379494 0.496814 0.111031 Co\n0.268463 0.003186 0.888969 Co\n0.824848 0.208719 0.668462 Co\n0.156387 0.291281 0.331538 Co\n0.843613 0.708719 0.668462 Co\n0.980826 0.756016 0.389581 Co\n0.993900 0.027085 0.853440 Co\n0.591246 0.743984 0.610419 Co\n0.175152 0.791281 0.331538 Co\n0.408754 0.256016 0.389581 Co\n0.731537 0.996814 0.111031 Co\n0.367784 0.334665 0.310335 Ge\n0.633271 0.571992 0.807459 Ge\n0.366729 0.428008 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"elements": [
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"volume_molar": 10.097989164923366,
"formula_full": "Fe8 Co16 Ge8 C84 O84",
"formula_reduced": "Fe2Co4Ge2(CO)21",
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"updated_at": "2021-11-28T01:35:09.254000Z",
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{
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{
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{
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}