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{
"id": "jvasp-120358",
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"structure_string": "Na2 Se1\n1.0\n4.839598 0.000000 -1.209126\n0.000000 4.879754 0.000000\n-1.368477 0.000000 4.796338\nNa Se\n2 1\ndirect\n-0.200015 0.000000 -0.199965 Na\n0.133350 0.000000 0.466614 Na\n0.466665 0.000000 0.133351 Se\n",
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{
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{
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"structure_string": "Na2 Se1\n1.0\n4.989955 0.000000 0.000000\n-2.494977 4.321427 0.000000\n-0.000000 0.000000 4.880693\nNa Se\n2 1\ndirect\n0.333333 0.666667 0.000000 Na\n0.666666 0.333333 0.000000 Na\n0.000000 0.000000 0.000000 Se\n",
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{
"id": "jvasp-11987",
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"structure_string": "Mg3 Al1\n1.0\n4.382168 0.000000 0.000000\n0.000000 4.382168 0.000000\n-0.000000 -0.000000 4.382168\nMg Al\n3 1\ndirect\n0.500000 0.500000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.000000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Al\n",
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{
"id": "jvasp-25087",
"created_at": "2022-09-04T14:37:38.865644Z",
"updated_at": "2022-09-04T14:37:38.865666Z",
"structure_string": "P24\n1.0\n5.432660 0.010771 -0.884853\n-2.172194 10.559686 -0.870171\n0.060478 -0.058874 10.909360\nP\n24\ndirect\n0.084468 -0.008951 0.173026 P\n0.801623 0.490817 0.634275 P\n0.198379 0.509184 0.365726 P\n0.079349 0.365728 0.632999 P\n0.920652 0.634273 0.367002 P\n0.693382 0.300150 0.524266 P\n0.306620 0.699851 0.475735 P\n0.634768 0.679443 0.018078 P\n0.365234 0.320557 0.981923 P\n0.493131 0.679563 0.816273 P\n0.506870 0.320438 0.183727 P\n0.415931 0.822957 0.956556 P\n0.584070 0.177043 0.043445 P\n0.225842 0.621366 0.943396 P\n0.774159 0.378635 0.056604 P\n0.762662 0.987191 0.623851 P\n0.237339 0.012809 0.376149 P\n-0.009136 0.853197 0.699839 P\n0.009138 0.146804 0.300161 P\n0.173038 0.052756 0.691759 P\n0.826964 0.947244 0.308242 P\n0.915533 0.008951 0.826975 P\n0.243566 0.681854 0.268239 P\n0.756435 0.318147 0.731762 P\n",
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{
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"structure_string": "K3 Cd1\n1.0\n5.785204 0.000000 0.000000\n0.000000 5.785204 0.000000\n0.000000 0.000000 5.785204\nK Cd\n3 1\ndirect\n0.000000 0.500000 0.500000 K\n0.500000 0.000000 0.500000 K\n0.500000 0.500000 0.000000 K\n0.000000 0.000000 0.000000 Cd\n",
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{
"id": "jvasp-52831",
"created_at": "2022-09-04T14:36:31.558602Z",
"updated_at": "2022-09-04T14:36:31.558630Z",
"structure_string": "Na2 H6 C4 O10\n1.0\n-5.719917 0.013985 0.016171\n2.216218 5.925045 0.004801\n-0.550811 -1.592369 -6.464231\nNa H C O\n2 6 4 10\ndirect\n0.759066 0.753786 0.972901 Na\n0.240935 0.246216 0.027099 Na\n0.232017 0.799742 0.766040 H\n0.767984 0.200260 0.233960 H\n0.254786 0.776300 -0.003117 H\n0.745214 0.223702 0.003118 H\n0.992726 0.743824 0.393426 H\n0.007274 0.256177 0.606574 H\n0.597780 0.277219 0.642329 C\n0.402221 0.722783 0.357671 C\n0.646995 0.742167 0.458782 C\n0.353006 0.257835 0.541218 C\n0.180639 0.843762 0.911139 O\n0.659596 0.756321 0.644616 O\n0.340404 0.243680 0.355384 O\n0.828655 0.735633 0.325486 O\n0.171346 0.264368 0.674514 O\n0.387083 0.667215 0.163246 O\n0.612917 0.332787 0.836755 O\n0.235233 0.761871 0.483177 O\n0.764767 0.238131 0.516823 O\n0.819362 0.156240 0.088861 O\n",
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{
"id": "jvasp-10675",
"created_at": "2022-09-04T14:37:27.796191Z",
"updated_at": "2022-09-04T14:37:27.796222Z",
"structure_string": "Ag1 B1 C4 N4\n1.0\n5.726406 -0.000000 -0.000000\n-0.000000 5.726406 0.000000\n0.000000 0.000000 5.726406\nAg B C N\n1 1 4 4\ndirect\n0.500000 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 B\n0.840265 0.840265 0.840265 C\n0.159736 0.840265 0.159736 C\n0.159736 0.159736 0.840265 C\n0.840265 0.159736 0.159736 C\n0.723426 0.723426 0.723426 N\n0.276574 0.723426 0.276574 N\n0.276574 0.276574 0.723426 N\n0.723426 0.276574 0.276574 N\n",
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{
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"created_at": "2022-09-04T14:36:40.363133Z",
"updated_at": "2022-09-04T14:36:40.363151Z",
"structure_string": "H2 C6 S4 N2 O2\n1.0\n4.127794 -0.002097 0.356320\n0.113596 4.425245 0.046546\n-0.027881 -0.066929 12.106913\nH C S N O\n2 6 4 2 2\ndirect\n0.921696 0.730591 0.361114 H\n0.421681 0.730600 0.861114 H\n0.857660 0.688396 0.197195 C\n0.357649 0.688405 0.697195 C\n0.389645 0.165489 0.806716 C\n0.889657 0.165480 0.306717 C\n0.734356 0.372850 0.225102 C\n0.234346 0.372859 0.725101 C\n0.464072 0.296460 0.930161 S\n0.964076 0.296451 0.430162 S\n0.916792 0.793562 0.067931 S\n0.416790 0.793569 0.567931 S\n0.895441 0.860450 0.289915 N\n0.395423 0.860459 0.789915 N\n0.482864 0.293576 0.188113 O\n0.982852 0.293583 0.688111 O\n",
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"structure_string": "Cd1 H20 C12 O4\n1.0\n3.795651 0.153081 0.216247\n1.251092 4.397336 0.208573\n0.412355 0.080386 17.439716\nCd H C O\n1 20 12 4\ndirect\n0.772725 0.948129 0.851185 Cd\n0.330312 0.186147 0.509887 H\n0.087126 0.658970 0.589688 H\n0.436286 0.758831 0.052427 H\n0.766322 0.764529 0.164726 H\n0.216695 0.710420 0.192479 H\n0.543837 0.731957 0.305740 H\n-0.004059 0.674905 0.333073 H\n0.317788 0.699856 0.447404 H\n0.769824 0.643510 0.474813 H\n-0.011536 0.817019 0.025741 H\n0.537218 0.607212 0.617728 H\n0.008774 0.289388 0.084793 H\n0.459103 0.237474 0.112707 H\n0.776882 0.253358 0.227710 H\n0.229076 0.196893 0.255038 H\n0.551403 0.221825 0.369381 H\n0.003375 0.164988 0.396763 H\n0.110000 0.137468 0.649871 H\n0.557626 0.079398 0.676662 H\n0.780454 0.132274 0.537745 H\n0.412727 0.489084 0.960492 C\n0.248535 0.634364 0.036572 C\n0.192939 0.413934 0.102086 C\n0.030777 0.585439 0.176054 C\n0.965362 0.376654 0.243647 C\n0.807049 0.551735 0.317260 C\n0.353300 0.482599 0.600347 C\n0.581506 0.520154 0.458826 C\n0.515963 0.311251 0.526381 C\n0.297547 0.261993 0.665805 C\n0.132920 0.407080 0.741883 C\n0.740124 0.345116 0.385220 C\n0.367819 0.663216 0.899046 O\n0.177734 0.232813 0.803306 O\n0.949798 0.691623 0.741629 O\n0.595630 0.204484 0.960761 O\n",
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{
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{
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"created_at": "2022-09-04T14:38:52.624349Z",
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]
}