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{
"id": "jvasp-74535",
"created_at": "2022-09-04T14:36:02.623640Z",
"updated_at": "2022-09-04T14:36:02.623652Z",
"structure_string": "Be1 Cu1 Cl1\n1.0\n1.537135 -2.662396 -0.000000\n1.537135 2.662396 0.000000\n-0.000000 -0.000000 5.528288\nBe Cu Cl\n1 1 1\ndirect\n0.000000 0.000000 0.985708 Be\n0.333331 0.666666 0.262365 Cu\n0.666666 0.333331 0.751926 Cl\n",
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{
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"structure_string": "As8 O12\n1.0\n6.727915 -0.000000 3.884364\n2.242639 6.343140 3.884364\n0.000000 0.000000 7.768728\nAs O\n8 12\ndirect\n0.768688 0.768688 0.768687 As\n0.806063 0.231312 0.231312 As\n0.231313 0.806062 0.231312 As\n0.193938 0.768688 0.768687 As\n0.768688 0.193938 0.768687 As\n0.768688 0.768688 0.193937 As\n0.231312 0.231312 0.231312 As\n0.231312 0.231312 0.806062 As\n0.054172 0.695828 0.695828 O\n0.695828 0.695828 0.054171 O\n0.945828 0.304172 0.304171 O\n0.054172 0.695828 0.054172 O\n0.695828 0.054172 0.695827 O\n0.945828 0.304172 0.945827 O\n0.945829 0.945828 0.304171 O\n0.304172 0.304172 0.945828 O\n0.304173 0.945828 0.304172 O\n0.695828 0.054172 0.054172 O\n0.304173 0.945828 0.945827 O\n0.054172 0.054172 0.695828 O\n",
"nsites": 20,
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{
"id": "jvasp-14531",
"created_at": "2022-09-04T14:38:11.592505Z",
"updated_at": "2022-09-04T14:38:11.592529Z",
"structure_string": "Nd2 Mg4\n1.0\n5.294735 -0.000000 3.056917\n1.764912 4.991923 3.056917\n-0.000000 -0.000000 6.113833\nNd Mg\n2 4\ndirect\n0.875001 0.874999 0.875000 Nd\n0.125000 0.125000 0.125000 Nd\n0.500000 0.500000 0.500000 Mg\n0.500000 0.500000 0.000000 Mg\n-0.000000 0.500000 0.500000 Mg\n0.500000 0.000000 0.500000 Mg\n",
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"elements": [
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{
"id": "jvasp-51662",
"created_at": "2022-09-04T14:38:30.124703Z",
"updated_at": "2022-09-04T14:38:30.124724Z",
"structure_string": "Al4 O6\n1.0\n2.743414 0.003804 0.234716\n-1.365140 -4.541570 -0.120513\n-0.787832 0.003523 -6.927471\nAl O\n4 6\ndirect\n0.034242 0.989779 0.003909 Al\n0.680212 0.489772 0.295911 Al\n0.190152 0.509506 0.795905 Al\n0.044064 0.009498 0.503904 Al\n0.318882 0.749619 0.399916 O\n0.055860 0.214812 0.242110 O\n0.748413 0.284440 0.557713 O\n0.568941 0.249660 0.899916 O\n0.840762 0.784470 0.742095 O\n0.463658 0.714825 0.057708 O\n",
"nsites": 10,
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{
"id": "jvasp-119974",
"created_at": "2022-09-04T14:38:49.480124Z",
"updated_at": "2022-09-04T14:38:49.480151Z",
"structure_string": "Be1 Te1 Br1\n1.0\n3.218181 1.461597 0.000000\n0.211539 7.998379 0.000000\n0.000000 0.000000 3.567079\nBe Te Br\n1 1 1\ndirect\n-0.081010 0.117998 0.000000 Be\n0.190742 0.348462 0.000000 Te\n0.191726 -0.156612 0.000000 Br\n",
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{
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"created_at": "2022-09-04T14:37:49.680994Z",
"updated_at": "2022-09-04T14:37:49.681019Z",
"structure_string": "Ba1\n1.0\n4.154964 0.000000 0.000000\n-2.077482 3.598286 0.000000\n0.000000 0.000000 3.848442\nBa\n1\ndirect\n0.000000 0.000000 0.000000 Ba\n",
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{
"id": "jvasp-100931",
"created_at": "2022-09-04T14:36:33.410366Z",
"updated_at": "2022-09-04T14:36:33.410395Z",
"structure_string": "Rb2 Sc1 In1 I6\n1.0\n7.490767 -0.000000 4.324796\n2.496922 7.062363 4.324796\n-0.000000 -0.000000 8.649592\nRb Sc In I\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Sc\n0.500000 0.500000 0.500000 In\n0.764811 0.235189 0.235190 I\n0.235189 0.235189 0.764811 I\n0.235189 0.764810 0.764811 I\n0.235189 0.764810 0.235190 I\n0.764811 0.235189 0.764811 I\n0.764811 0.764810 0.235190 I\n",
"nsites": 10,
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"volume": 457.58517659953515,
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{
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"created_at": "2022-09-04T14:36:01.557976Z",
"updated_at": "2022-09-04T14:36:01.557994Z",
"structure_string": "Hf1 Mg6 Co1\n1.0\n6.325435 -0.147964 0.000000\n-3.290858 5.404005 0.000000\n0.000000 0.000000 4.765763\nHf Mg Co\n1 6 1\ndirect\n0.306390 0.193610 0.749999 Hf\n0.176048 0.839131 0.250000 Mg\n0.660868 0.323952 0.250000 Mg\n0.673222 0.826777 0.250000 Mg\n0.317747 0.669506 0.749999 Mg\n0.830493 0.182252 0.749999 Mg\n0.833445 0.666554 0.749999 Mg\n0.201782 0.298217 0.250000 Co\n",
"nsites": 8,
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{
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"created_at": "2022-09-04T14:38:03.485224Z",
"updated_at": "2022-09-04T14:38:03.485248Z",
"structure_string": "Rb8 As8 Se16\n1.0\n9.269175 0.037429 -1.769985\n-0.781205 9.131123 -3.897980\n0.077229 -0.042560 12.607045\nRb As Se\n8 8 16\ndirect\n0.336614 0.279091 0.404782 Rb\n0.663385 0.720909 0.595217 Rb\n0.836614 0.125693 0.404782 Rb\n0.749999 0.977005 -0.000000 Rb\n0.250000 0.022994 -0.000000 Rb\n0.749999 0.533314 -0.000000 Rb\n0.250000 0.466686 -0.000000 Rb\n0.163386 0.874307 0.595217 Rb\n0.048736 0.507181 0.300990 As\n0.151552 0.814422 0.213696 As\n0.348447 0.600726 0.786303 As\n0.848447 0.185578 0.786303 As\n0.651552 0.399274 0.213696 As\n0.451264 0.206190 0.699009 As\n0.548735 0.793810 0.300990 As\n0.951264 0.492819 0.699009 As\n0.939583 0.968998 0.792071 Se\n0.957802 0.743439 0.296491 Se\n0.542196 0.446949 0.703508 Se\n0.042197 0.256560 0.703508 Se\n0.457803 0.553051 0.296491 Se\n0.991567 0.328914 0.108025 Se\n0.508432 0.220888 0.891974 Se\n0.008432 0.671086 0.891974 Se\n0.491567 0.779112 0.108025 Se\n0.652590 0.081375 0.606471 Se\n0.847409 0.474903 0.393528 Se\n0.060416 0.031002 0.207928 Se\n0.347409 0.918625 0.393528 Se\n0.439584 0.823073 0.792071 Se\n0.560416 0.176927 0.207928 Se\n0.152590 0.525097 0.606471 Se\n",
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{
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"created_at": "2022-09-04T14:36:47.280964Z",
"updated_at": "2022-09-04T14:36:47.280987Z",
"structure_string": "Rb2 Na1 Nd1 I6\n1.0\n7.508271 -0.000000 4.334902\n2.502757 7.078866 4.334902\n-0.000000 -0.000000 8.669805\nRb Na Nd I\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.499999 Na\n0.000000 0.000000 0.000000 Nd\n0.748807 0.251193 0.251193 I\n0.251193 0.251193 0.748806 I\n0.251193 0.748807 0.748806 I\n0.251193 0.748807 0.251192 I\n0.748807 0.251193 0.748806 I\n0.748807 0.748807 0.251192 I\n",
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{
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"created_at": "2022-09-04T14:38:26.453387Z",
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"structure_string": "Mn4 O2 F8\n1.0\n4.907713 0.102273 0.000000\n-4.046537 2.778784 0.000000\n-0.000000 -0.000000 12.041278\nMn O F\n4 2 8\ndirect\n0.928103 0.071894 0.195989 Mn\n0.742492 0.257505 0.907933 Mn\n0.257505 0.742492 0.407933 Mn\n0.071894 0.928103 0.695989 Mn\n0.667189 0.332808 0.763404 O\n0.332807 0.667190 0.263403 O\n0.820921 0.179076 0.051646 F\n0.882307 0.117691 0.446299 F\n0.546015 0.453983 0.145101 F\n0.629699 0.370298 0.366952 F\n0.370297 0.629700 0.866952 F\n0.453982 0.546015 0.645101 F\n0.179076 0.820921 0.551646 F\n0.117690 0.882307 0.946300 F\n",
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