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{
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{
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"structure_string": "Fe4 As4\n1.0\n3.409694 -0.000000 0.000000\n-0.000000 5.329112 0.000000\n0.000000 0.000000 5.969976\nFe As\n4 4\ndirect\n0.749999 0.999647 0.202061 Fe\n0.250000 0.000353 0.797939 Fe\n0.749999 0.499647 0.297939 Fe\n0.250000 0.500353 0.702062 Fe\n0.749999 0.797691 0.581526 As\n0.250000 0.202309 0.418475 As\n0.749999 0.297691 0.918475 As\n0.250000 0.702308 0.081526 As\n",
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{
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"structure_string": "Sc12 P8\n1.0\n3.723256 0.000000 0.000000\n0.000000 10.175488 0.000000\n0.000000 0.000000 10.030300\nSc P\n12 8\ndirect\n0.250000 0.224088 0.799042 Sc\n0.750001 0.451966 0.633191 Sc\n0.250000 0.548034 0.366809 Sc\n0.750001 0.626141 0.938078 Sc\n0.250000 0.373859 0.061922 Sc\n0.750001 0.126141 0.561922 Sc\n0.250000 0.873859 0.438078 Sc\n0.250000 0.724088 0.700958 Sc\n0.750001 0.275912 0.299042 Sc\n0.750001 0.951966 0.866809 Sc\n0.750001 0.775913 0.200958 Sc\n0.250000 0.048034 0.133191 Sc\n0.750001 0.685443 0.504028 P\n0.250000 0.314557 0.495972 P\n0.750001 0.185443 0.995972 P\n0.250000 0.814558 0.004028 P\n0.750001 0.510358 0.180320 P\n0.250000 0.489642 0.819680 P\n0.750001 0.010358 0.319680 P\n0.250000 0.989642 0.680321 P\n",
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{
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"structure_string": "Ti8 O16\n1.0\n3.023061 -0.000962 -0.004386\n0.003765 9.744306 0.000079\n0.013361 0.000224 9.373368\nTi O\n8 16\ndirect\n0.250133 -0.025219 0.152136 Ti\n0.750101 0.201217 0.401296 Ti\n0.250131 0.298111 0.901292 Ti\n0.750122 0.524548 0.652136 Ti\n0.250137 0.474782 0.345488 Ti\n0.750109 0.701220 0.096325 Ti\n0.250145 0.798112 0.596326 Ti\n0.750126 0.024551 0.845481 Ti\n0.250150 0.801381 0.220932 O\n0.750116 0.859648 0.503906 O\n0.250136 0.639693 0.003900 O\n0.750113 0.697947 0.720929 O\n0.750120 0.559425 0.251721 O\n0.250122 0.603953 0.521605 O\n0.750135 0.395378 0.476018 O\n0.250134 0.139679 0.493715 O\n0.250150 0.301385 0.276695 O\n0.750111 0.359637 -0.006279 O\n0.250137 0.939908 0.751720 O\n0.750115 0.197953 0.776685 O\n0.750120 0.059425 0.245898 O\n0.250119 0.103949 0.976007 O\n0.250136 0.439908 0.745901 O\n0.750137 0.895383 0.021612 O\n",
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{
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"created_at": "2022-09-04T14:36:18.268302Z",
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"structure_string": "Tb4 Pd4\n1.0\n0.000000 4.580386 0.000000\n0.000000 -0.000000 5.568000\n6.997422 0.000000 0.000000\nTb Pd\n4 4\ndirect\n0.250000 0.355670 0.683150 Tb\n0.250000 0.144330 0.183150 Tb\n0.750001 0.644330 0.316850 Tb\n0.750001 0.855670 0.816849 Tb\n0.250000 0.843754 0.542849 Pd\n0.250000 0.656246 0.042849 Pd\n0.750001 0.156246 0.457151 Pd\n0.750001 0.343754 0.957151 Pd\n",
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{
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"structure_string": "Bi4 Rh4 O12\n1.0\n5.402207 0.000000 0.000000\n-0.000000 5.901203 0.000000\n0.000000 0.000000 7.788911\nBi Rh O\n4 4 12\ndirect\n0.017362 0.933811 0.750000 Bi\n0.482638 0.433812 0.750000 Bi\n0.982638 0.066188 0.250000 Bi\n0.517362 0.566188 0.250000 Bi\n0.000000 0.500000 0.500000 Rh\n0.000000 0.500000 0.000000 Rh\n0.500000 0.000000 0.500000 Rh\n0.500000 0.000000 0.000000 Rh\n0.173855 0.187760 0.957121 O\n0.326145 0.687760 0.542879 O\n0.616485 0.042970 0.750000 O\n0.383515 0.957029 0.250000 O\n0.826145 0.812240 0.457121 O\n0.673855 0.312240 0.457121 O\n0.883516 0.542970 0.750000 O\n0.326145 0.687760 0.957121 O\n0.173855 0.187760 0.542879 O\n0.673855 0.312240 0.042879 O\n0.826145 0.812240 0.042879 O\n0.116485 0.457030 0.250000 O\n",
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{
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"structure_string": "Li4 Mn4 Si4 O16\n1.0\n4.778685 0.000000 0.000000\n0.000000 6.201839 0.000000\n0.000000 0.000000 9.991484\nLi Mn Si O\n4 4 4 16\ndirect\n0.056126 0.006586 0.219081 Li\n0.443873 0.006586 0.719081 Li\n0.556126 0.506586 0.280919 Li\n0.943873 0.506586 0.780919 Li\n0.000002 0.256522 0.499996 Mn\n0.499997 0.256522 -0.000004 Mn\n0.500002 0.756522 0.000004 Mn\n-0.000002 0.756522 0.500004 Mn\n0.906305 0.006521 0.905884 Si\n0.593694 0.006521 0.405884 Si\n0.406305 0.506521 0.594115 Si\n0.093694 0.506521 0.094116 Si\n0.754978 0.229428 0.850288 O\n0.742905 0.506520 0.594594 O\n0.757094 0.506520 0.094594 O\n0.745021 0.229428 0.350288 O\n0.745004 0.783600 0.350304 O\n0.759655 0.006526 0.558870 O\n0.240344 0.506526 0.441129 O\n0.245004 0.283599 0.149696 O\n0.254978 0.729428 0.649711 O\n0.242905 0.006519 0.905406 O\n0.257094 0.006519 0.405406 O\n0.245021 0.729428 0.149712 O\n0.754995 0.783600 0.850304 O\n0.259655 0.506526 0.941129 O\n0.254995 0.283599 0.649696 O\n0.740344 0.006526 0.058871 O\n",
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}