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{
"id": "jvasp-17346",
"created_at": "2022-09-04T14:36:21.927797Z",
"updated_at": "2022-09-04T14:36:21.927821Z",
"structure_string": "Mo1 O2\n1.0\n2.804541 0.000556 4.255722\n1.276587 2.497153 4.255722\n0.000909 0.000556 5.096726\nMo O\n1 2\ndirect\n0.500002 0.500000 0.499999 Mo\n0.753122 0.753121 0.753119 O\n0.246881 0.246878 0.246878 O\n",
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{
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{
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{
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"created_at": "2022-09-04T14:37:01.824056Z",
"updated_at": "2022-09-04T14:37:01.824067Z",
"structure_string": "Mo1 O2\n1.0\n2.701935 -0.073717 4.315593\n1.183928 2.429856 4.315593\n-0.121578 -0.073717 5.090187\nMo O\n1 2\ndirect\n0.000000 0.000000 0.000000 Mo\n0.253078 0.253077 0.253077 O\n0.746921 0.746920 0.746925 O\n",
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{
"id": "jvasp-119136",
"created_at": "2022-09-04T14:38:35.359496Z",
"updated_at": "2022-09-04T14:38:35.359528Z",
"structure_string": "Ti2 Al2 Cr1 Cu1 S8\n1.0\n6.061794 0.000416 3.492797\n-4.058256 5.920420 0.000000\n-0.000000 0.000000 6.985593\nTi Al Cr Cu S\n2 2 1 1 8\ndirect\n0.024464 0.006740 0.464397 Ti\n0.024464 0.006740 0.011138 Ti\n0.237243 0.608703 0.631378 Al\n0.494979 0.497241 0.002511 Al\n0.474701 0.002863 0.012650 Cr\n0.749703 0.376445 0.375149 Cu\n0.006648 0.754093 0.246676 S\n0.013373 0.249507 0.243314 S\n0.498071 0.252516 0.768812 S\n0.498071 0.252516 0.233116 S\n0.973972 0.221735 0.763014 S\n0.987270 0.756085 0.756365 S\n0.508518 0.757410 0.229417 S\n0.508518 0.757410 0.762065 S\n",
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"volume": 250.71331465823047,
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{
"id": "jvasp-8621",
"created_at": "2022-09-04T14:37:04.348692Z",
"updated_at": "2022-09-04T14:37:04.348708Z",
"structure_string": "Cr1 H1 O2\n1.0\n2.862219 -0.000191 3.890785\n1.276819 2.561646 3.890785\n-0.000309 -0.000191 4.830166\nCr H O\n1 1 2\ndirect\n0.002329 0.002329 0.002329 Cr\n0.513904 0.513906 0.513905 H\n0.405357 0.405358 0.405357 O\n0.591810 0.591812 0.591811 O\n",
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"formula_full": "Cr1 H1 O2",
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"spacegroup": 160
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{
"id": "jvasp-101116",
"created_at": "2022-09-04T14:36:59.891655Z",
"updated_at": "2022-09-04T14:36:59.891680Z",
"structure_string": "Sr2 Ta1 Mn1 O6\n1.0\n4.874027 -0.000000 2.814021\n1.624676 4.595277 2.814021\n-0.000000 -0.000000 5.628041\nSr Ta Mn O\n2 1 1 6\ndirect\n0.750001 0.750001 0.749999 Sr\n0.250000 0.250000 0.250000 Sr\n0.000000 0.000000 0.000000 Ta\n0.500001 0.500000 0.499999 Mn\n0.750218 0.750218 0.249782 O\n0.249783 0.750218 0.249782 O\n0.750218 0.249783 0.249782 O\n0.249783 0.249783 0.750217 O\n0.750218 0.249783 0.750216 O\n0.249783 0.750218 0.750216 O\n",
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"density_atomic": 0.07933103516334966,
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"formula_full": "Sr2 Ta1 Mn1 O6",
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{
"id": "jvasp-24638",
"created_at": "2022-09-04T14:37:14.641117Z",
"updated_at": "2022-09-04T14:37:14.641136Z",
"structure_string": "Nb2 Al2 O8\n1.0\n3.804572 0.000000 0.000000\n-1.902286 5.858815 -1.852397\n0.000000 -0.033356 6.565952\nNb Al O\n2 2 8\ndirect\n0.104661 0.209321 0.237300 Nb\n0.895337 0.790678 0.762699 Nb\n0.798203 0.596407 0.175849 Al\n0.201795 0.403591 0.824150 Al\n0.355953 0.711907 0.796099 O\n0.644045 0.288091 0.203900 O\n0.736543 0.473088 0.858744 O\n0.263454 0.526910 0.141255 O\n0.859768 0.719537 0.471497 O\n0.140230 0.280461 0.528501 O\n0.942096 0.884195 0.136454 O\n0.057902 0.115803 0.863544 O\n",
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{
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"created_at": "2022-09-04T14:36:31.220811Z",
"updated_at": "2022-09-04T14:36:31.220844Z",
"structure_string": "Ti4 Si4 Rh4\n1.0\n3.838498 -0.000000 0.000000\n-0.000000 6.284155 0.000000\n0.000000 0.000000 7.279247\nTi Si Rh\n4 4 4\ndirect\n0.750000 0.524265 0.316742 Ti\n0.750000 0.024265 0.183258 Ti\n0.250000 0.975734 0.816742 Ti\n0.250000 0.475734 0.683259 Ti\n0.250000 0.732136 0.120516 Si\n0.750000 0.267863 0.879484 Si\n0.250000 0.232136 0.379484 Si\n0.750000 0.767863 0.620516 Si\n0.750000 0.652663 0.935622 Rh\n0.250000 0.847336 0.435622 Rh\n0.750000 0.152663 0.564379 Rh\n0.250000 0.347337 0.064378 Rh\n",
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{
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"created_at": "2022-09-04T14:36:05.481361Z",
"updated_at": "2022-09-04T14:36:05.481388Z",
"structure_string": "Fe2 Sb4 O12\n1.0\n4.730398 0.000000 0.000000\n-0.000000 4.730398 0.000000\n0.000000 0.000000 9.546157\nFe Sb O\n2 4 12\ndirect\n0.000000 0.000000 0.000000 Fe\n0.500000 0.500000 0.500000 Fe\n0.000000 0.000000 0.332763 Sb\n0.500000 0.500000 0.832764 Sb\n0.500000 0.500000 0.167237 Sb\n0.000000 0.000000 0.667237 Sb\n0.694991 0.694991 0.331892 O\n0.194990 0.805010 0.168108 O\n0.805010 0.194990 0.168108 O\n0.805010 0.194990 0.831892 O\n0.194990 0.805010 0.831892 O\n0.806573 0.193428 0.500000 O\n0.693428 0.693428 0.000000 O\n0.305010 0.305010 0.668108 O\n0.193428 0.806573 0.500000 O\n0.306572 0.306572 0.000000 O\n0.305010 0.305010 0.331892 O\n0.694991 0.694991 0.668108 O\n",
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{
"id": "jvasp-81711",
"created_at": "2022-09-04T14:37:14.085767Z",
"updated_at": "2022-09-04T14:37:14.085799Z",
"structure_string": "Y1 Sb1 Rh2\n1.0\n-9.253467 0.000001 -5.342491\n-6.054602 -0.494522 -0.198105\n-4.869570 2.857258 -2.250641\nY Sb Rh\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Y\n0.500000 0.000000 -0.000000 Sb\n0.743528 0.000001 -0.000000 Rh\n0.256471 0.000000 -0.000000 Rh\n",
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{
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"updated_at": "2022-09-04T14:37:29.298456Z",
"structure_string": "Al6 Cr2 O12\n1.0\n0.000000 5.222227 -0.002195\n4.858534 0.000000 0.000000\n0.000000 -0.707719 -7.108771\nAl Cr O\n6 2 12\ndirect\n0.294587 0.998216 0.853031 Al\n0.800038 0.497931 0.850134 Al\n0.205058 0.497655 0.646483 Al\n0.294587 0.001783 0.353031 Al\n0.800039 0.502068 0.350134 Al\n0.205058 0.502344 0.146483 Al\n0.699951 0.998015 0.649800 Cr\n0.699951 0.001984 0.149800 Cr\n0.153502 0.343726 0.402970 O\n0.851929 0.361284 0.095693 O\n0.646556 0.163686 0.398291 O\n0.499596 0.690316 0.253601 O\n0.009515 0.199046 0.755120 O\n0.851929 0.638715 0.595693 O\n0.339270 0.846116 0.594878 O\n0.153502 0.656273 0.902970 O\n0.009515 0.800953 0.255120 O\n0.646556 0.836313 0.898291 O\n0.499596 0.309683 0.753601 O\n0.339270 0.153883 0.094878 O\n",
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"formula_full": "Al6 Cr2 O12",
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}
]
}