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{
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{
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{
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{
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{
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{
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"structure_string": "Sb18 O48\n1.0\n8.985676 0.000000 0.000000\n0.000000 9.564820 0.000000\n0.000000 9.495622 10.028193\nSb O\n18 48\ndirect\n0.307262 0.500000 0.250000 Sb\n0.692738 0.500000 0.750000 Sb\n0.992320 0.753911 0.746419 Sb\n0.007680 0.246089 0.253581 Sb\n0.992320 0.246089 0.753581 Sb\n0.007680 0.753911 0.246419 Sb\n0.352768 0.742782 0.749524 Sb\n0.647232 0.257218 0.250476 Sb\n0.352768 0.257218 0.750476 Sb\n0.647232 0.742782 0.249524 Sb\n0.848271 0.745868 0.001265 Sb\n0.151729 0.254132 0.998735 Sb\n0.848271 0.254132 0.498735 Sb\n0.151729 0.745868 0.501265 Sb\n0.494561 0.768076 0.981642 Sb\n0.505439 0.231924 0.018358 Sb\n0.494561 0.231924 0.518358 Sb\n0.505439 0.768076 0.481642 Sb\n0.163262 0.441311 0.174014 O\n0.836738 0.558689 0.825986 O\n0.163262 0.558689 0.325986 O\n0.836738 0.441311 0.674014 O\n0.489416 0.466357 0.164763 O\n0.510584 0.533643 0.835237 O\n0.489416 0.533643 0.335237 O\n0.510584 0.466357 0.664763 O\n0.339227 0.234518 0.417536 O\n0.660773 0.765482 0.582464 O\n0.339227 0.765482 0.082464 O\n0.660773 0.234518 0.917536 O\n0.174517 0.915687 0.676676 O\n0.825483 0.084313 0.323324 O\n0.174517 0.084313 0.823324 O\n0.825483 0.915687 0.176676 O\n0.000077 0.769483 0.592630 O\n0.999923 0.230517 0.407370 O\n0.000077 0.230517 0.907370 O\n0.999923 0.769483 0.092630 O\n0.993547 0.713643 0.909270 O\n0.006453 0.286357 0.090730 O\n0.993547 0.286357 0.590730 O\n0.006453 0.713643 0.409270 O\n0.350652 0.707825 0.907519 O\n0.649348 0.292175 0.092481 O\n0.350652 0.292175 0.592481 O\n0.649348 0.707825 0.407519 O\n0.333176 0.767559 0.589812 O\n0.666824 0.232441 0.410188 O\n0.333176 0.232441 0.910188 O\n0.666824 0.767559 0.089812 O\n0.674152 0.727870 0.923488 O\n0.325848 0.272130 0.076512 O\n0.674152 0.272130 0.576512 O\n0.325848 0.727870 0.423488 O\n0.834516 0.452151 0.162508 O\n0.165484 0.547849 0.837492 O\n0.834516 0.547849 0.337492 O\n0.165484 0.452151 0.662508 O\n0.851624 0.029927 0.849446 O\n0.148376 0.970073 0.150554 O\n0.851624 0.970073 0.650554 O\n0.148376 0.029927 0.349446 O\n0.499301 0.049846 0.840857 O\n0.500699 0.950154 0.159143 O\n0.499301 0.950154 0.659143 O\n0.500699 0.049846 0.340857 O\n",
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{
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"updated_at": "2021-11-28T01:36:55.768000Z",
"spacegroup": 221
},
{
"id": "mp-1195860",
"created_at": "2022-09-04T14:45:35.107134Z",
"structure_string": "Er20 Ge16\n1.0\n7.541947 0.000000 0.000000\n0.000000 7.680132 0.000000\n0.000000 0.000000 14.574704\nEr Ge\n20 16\ndirect\n0.631551 0.161768 0.619355 Er\n0.131551 0.338232 0.880645 Er\n0.368449 0.838232 0.119355 Er\n0.868449 0.661768 0.380645 Er\n0.368449 0.838232 0.380645 Er\n0.868449 0.661768 0.119355 Er\n0.631551 0.161768 0.880645 Er\n0.131551 0.338232 0.619355 Er\n0.483104 0.682561 0.596640 Er\n0.983104 0.817439 0.903360 Er\n0.516896 0.317439 0.096640 Er\n0.016896 0.182561 0.403360 Er\n0.516896 0.317439 0.403360 Er\n0.016896 0.182561 0.096640 Er\n0.483104 0.682561 0.903360 Er\n0.983104 0.817439 0.596640 Er\n0.793695 0.501025 0.750000 Er\n0.293695 0.998975 0.750000 Er\n0.206305 0.498975 0.250000 Er\n0.706305 0.001025 0.250000 Er\n0.712372 0.964746 0.456347 Ge\n0.212372 0.535254 0.043653 Ge\n0.287628 0.035254 0.956347 Ge\n0.787628 0.464746 0.543653 Ge\n0.287628 0.035254 0.543653 Ge\n0.787628 0.464746 0.956347 Ge\n0.712372 0.964746 0.043653 Ge\n0.212372 0.535254 0.456347 Ge\n0.428392 0.382663 0.750000 Ge\n0.928392 0.117337 0.750000 Ge\n0.571608 0.617337 0.250000 Ge\n0.071608 0.882663 0.250000 Ge\n0.675424 0.859921 0.750000 Ge\n0.175424 0.640079 0.750000 Ge\n0.324576 0.140079 0.250000 Ge\n0.824576 0.359921 0.250000 Ge\n",
"nsites": 36,
"nelements": 2,
"elements": [
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],
"chemical_system": "Er-Ge",
"density": 8.86594884044961,
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"volume": 844.2127440918783,
"volume_molar": 14.12213326751986,
"formula_full": "Er20 Ge16",
"formula_reduced": "Er5Ge4",
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"updated_at": "2021-11-28T01:37:11.985000Z",
"spacegroup": 62
}
]
}