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{
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"structure_string": "Ca12 Sc8 Ge12 O48\n1.0\n-6.325217 6.325217 6.325217\n6.325217 -6.325217 6.325217\n6.325217 6.325217 -6.325217\nCa Sc Ge O\n12 8 12 48\ndirect\n0.375000 0.125000 0.250000 Ca\n0.750000 0.125000 0.375000 Ca\n0.250000 0.375000 0.125000 Ca\n0.125000 0.250000 0.375000 Ca\n0.375000 0.750000 0.125000 Ca\n0.125000 0.375000 0.750000 Ca\n0.625000 0.875000 0.750000 Ca\n0.250000 0.875000 0.625000 Ca\n0.750000 0.625000 0.875000 Ca\n0.875000 0.750000 0.625000 Ca\n0.625000 0.250000 0.875000 Ca\n0.875000 0.625000 0.250000 Ca\n0.000000 0.000000 0.000000 Sc\n0.500000 0.000000 0.000000 Sc\n0.000000 0.500000 0.000000 Sc\n0.000000 0.000000 0.500000 Sc\n0.500000 0.500000 0.000000 Sc\n0.000000 0.500000 0.500000 Sc\n0.500000 0.000000 0.500000 Sc\n0.500000 0.500000 0.500000 Sc\n0.625000 0.375000 0.250000 Ge\n0.750000 0.375000 0.625000 Ge\n0.250000 0.125000 0.875000 Ge\n0.875000 0.250000 0.125000 Ge\n0.625000 0.750000 0.375000 Ge\n0.375000 0.625000 0.750000 Ge\n0.125000 0.750000 0.875000 Ge\n0.750000 0.875000 0.125000 Ge\n0.375000 0.250000 0.625000 Ge\n0.250000 0.625000 0.375000 Ge\n0.875000 0.125000 0.750000 Ge\n0.125000 0.875000 0.250000 Ge\n0.413304 0.810475 0.792600 O\n0.879296 0.397171 0.086696 O\n0.102829 0.982125 0.689525 O\n0.517875 0.620704 0.707400 O\n0.689525 0.086696 0.707400 O\n0.620704 0.707400 0.517875 O\n0.620704 0.413304 0.102829 O\n0.707400 0.517875 0.620704 O\n0.810475 0.517875 0.397171 O\n0.982125 0.792600 0.879296 O\n0.792600 0.879296 0.982125 O\n0.707400 0.689525 0.086696 O\n0.413304 0.102829 0.620704 O\n0.397171 0.810475 0.517875 O\n0.086696 0.707400 0.689525 O\n0.102829 0.620704 0.413304 O\n0.517875 0.397171 0.810475 O\n0.086696 0.879296 0.397171 O\n0.982125 0.689525 0.102829 O\n0.189525 0.482125 0.602829 O\n0.689525 0.102829 0.982125 O\n0.792600 0.413304 0.810475 O\n0.397171 0.086696 0.879296 O\n0.879296 0.982125 0.792600 O\n0.586696 0.189525 0.207400 O\n0.120704 0.602829 0.913304 O\n0.897171 0.017875 0.310475 O\n0.482125 0.379296 0.292600 O\n0.310475 0.913304 0.292600 O\n0.379296 0.292600 0.482125 O\n0.379296 0.586696 0.897171 O\n0.292600 0.482125 0.379296 O\n0.120704 0.017875 0.207400 O\n0.602829 0.913304 0.120704 O\n0.207400 0.586696 0.189525 O\n0.189525 0.207400 0.586696 O\n0.310475 0.897171 0.017875 O\n0.017875 0.310475 0.897171 O\n0.913304 0.120704 0.602829 O\n0.482125 0.602829 0.189525 O\n0.897171 0.379296 0.586696 O\n0.913304 0.292600 0.310475 O\n0.602829 0.189525 0.482125 O\n0.586696 0.897171 0.379296 O\n0.292600 0.310475 0.913304 O\n0.207400 0.120704 0.017875 O\n0.017875 0.207400 0.120704 O\n0.810475 0.792600 0.413304 O\n",
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{
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{
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{
"id": "mp-556831",
"created_at": "2022-09-04T14:40:52.956068Z",
"structure_string": "Al4 Se4 S8 N8 Cl20\n1.0\n11.068221 0.000000 0.000000\n0.000000 9.594147 0.000000\n0.000000 9.183972 11.715818\nAl Se S N Cl\n4 4 8 8 20\ndirect\n0.639842 0.716572 0.808691 Al\n0.139842 0.283428 0.691309 Al\n0.860158 0.716572 0.308691 Al\n0.360158 0.283428 0.191309 Al\n0.282420 0.825844 0.611126 Se\n0.782420 0.174156 0.888874 Se\n0.217580 0.825844 0.111126 Se\n0.717580 0.174156 0.388874 Se\n0.461712 0.821477 0.186806 S\n0.248438 0.651960 0.809091 S\n0.751562 0.348040 0.190909 S\n0.538288 0.178523 0.813194 S\n0.748438 0.348040 0.690909 S\n0.251562 0.651960 0.309091 S\n0.038288 0.821477 0.686806 S\n0.961712 0.178523 0.313194 S\n0.125753 0.875930 0.584640 N\n0.609233 0.298510 0.697720 N\n0.109233 0.701490 0.802280 N\n0.374247 0.875930 0.084640 N\n0.890767 0.298510 0.197720 N\n0.625753 0.124070 0.915360 N\n0.390767 0.701490 0.302280 N\n0.874247 0.124070 0.415360 N\n0.633667 0.930354 0.424575 Cl\n0.286928 0.470270 0.602696 Cl\n0.478420 0.383726 0.257729 Cl\n0.287476 0.029894 0.331695 Cl\n0.787476 0.970106 0.168305 Cl\n0.021580 0.383726 0.757729 Cl\n0.978420 0.616274 0.242271 Cl\n0.039117 0.254671 0.580662 Cl\n0.213072 0.470270 0.102696 Cl\n0.133667 0.069646 0.075425 Cl\n0.712524 0.970106 0.668305 Cl\n0.960883 0.745329 0.419338 Cl\n0.866333 0.930354 0.924575 Cl\n0.521580 0.616274 0.742271 Cl\n0.366333 0.069646 0.575425 Cl\n0.539117 0.745329 0.919338 Cl\n0.713072 0.529730 0.397304 Cl\n0.460883 0.254671 0.080662 Cl\n0.212524 0.029894 0.831695 Cl\n0.786928 0.529730 0.897304 Cl\n",
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{
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{
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{
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"structure_string": "Li5 Mn8 B8 O24\n1.0\n5.294764 0.000000 0.000000\n-0.010137 9.154206 0.000000\n-0.154303 -0.346770 10.361674\nLi Mn B O\n5 8 8 24\ndirect\n0.938471 0.923619 0.320451 Li\n0.900877 0.928371 0.854872 Li\n0.585735 0.579811 0.599163 Li\n0.441077 0.412251 0.338777 Li\n0.413038 0.429378 0.827767 Li\n0.928854 0.265218 0.372905 Mn\n0.931245 0.588361 0.866289 Mn\n0.549872 0.912354 0.119168 Mn\n0.569471 0.231876 0.617508 Mn\n0.424117 0.742551 0.364255 Mn\n0.405551 0.093628 0.872390 Mn\n0.098392 0.405897 0.111008 Mn\n0.080539 0.772208 0.616697 Mn\n0.919698 0.585271 0.380826 B\n0.910773 0.253157 0.865066 B\n0.610088 0.243192 0.137970 B\n0.566681 0.911620 0.637496 B\n0.416945 0.084011 0.362375 B\n0.418739 0.750532 0.876389 B\n0.076690 0.741337 0.115406 B\n0.075921 0.426518 0.622253 B\n0.923990 0.855721 0.141163 O\n0.929419 0.317545 0.559762 O\n0.986281 0.611896 0.051598 O\n0.939495 0.548960 0.673898 O\n0.861449 0.243117 0.187028 O\n0.814671 0.912173 0.669868 O\n0.665245 0.565441 0.397172 O\n0.659758 0.269246 0.823949 O\n0.552245 0.961222 0.312151 O\n0.539161 0.877822 0.928267 O\n0.559501 0.205246 0.408467 O\n0.549862 0.624490 0.854859 O\n0.462374 0.360960 0.155093 O\n0.456780 0.787846 0.574616 O\n0.525957 0.117846 0.070555 O\n0.415926 0.031780 0.670298 O\n0.331853 0.740747 0.156223 O\n0.331420 0.420315 0.633562 O\n0.162046 0.084881 0.368234 O\n0.162988 0.763327 0.841687 O\n0.074351 0.468128 0.339072 O\n0.054656 0.381805 0.895847 O\n0.033509 0.720374 0.409290 O\n0.023415 0.123241 0.881024 O\n",
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{
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