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{
"id": "jvasp-101761",
"created_at": "2022-09-04T14:36:40.021950Z",
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"structure_string": "Fe4 Se3 N2\n1.0\n4.875413 -0.023642 4.264936\n1.125014 3.091598 -0.000000\n0.078723 -0.028647 8.718593\nFe Se N\n4 3 2\ndirect\n0.390793 0.804603 0.635425 Fe\n0.609205 0.195397 0.364577 Fe\n0.552072 0.723964 0.151719 Fe\n0.447926 0.276036 0.848282 Fe\n0.000000 0.000000 0.000000 Se\n0.770124 0.614937 0.785820 Se\n0.229874 0.385063 0.214181 Se\n0.434543 0.782728 0.406863 N\n0.565455 0.217272 0.593138 N\n",
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"structure_string": "Li2 V2 O6\n1.0\n5.072553 -0.037534 0.553545\n-2.943672 4.131223 0.553545\n-0.016776 -0.032259 4.887661\nLi V O\n2 2 6\ndirect\n0.151372 0.848628 0.000001 Li\n0.848628 0.151373 0.000001 Li\n0.345187 0.654812 0.500001 V\n0.654811 0.345188 0.500001 V\n0.705668 0.705669 0.289962 O\n0.294331 0.294331 0.710040 O\n0.458568 0.057248 0.269546 O\n0.942752 0.541432 0.730455 O\n0.541431 0.942752 0.730456 O\n0.057247 0.458568 0.269546 O\n",
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{
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"updated_at": "2022-09-04T14:36:39.860746Z",
"structure_string": "Li3 Ti1 Ni3 O8\n1.0\n-1.550777 5.622896 -0.049138\n-1.628040 2.496289 4.874544\n3.444507 4.137209 2.380058\nLi Ti Ni O\n3 1 3 8\ndirect\n0.500001 0.499999 0.500000 Li\n0.000000 0.500000 0.500000 Li\n-0.000000 -0.000000 0.500000 Li\n0.000000 0.000000 0.000000 Ti\n0.500001 0.500000 -0.000000 Ni\n0.000000 0.500000 -0.000000 Ni\n0.500001 -0.000000 -0.000000 Ni\n0.772955 0.740475 0.229472 O\n0.250147 0.762473 0.224906 O\n0.772954 0.257098 0.229472 O\n0.249241 0.274896 0.200966 O\n0.750760 0.725103 0.799034 O\n0.227047 0.742901 0.770529 O\n0.749854 0.237526 0.775094 O\n0.227047 0.259524 0.770529 O\n",
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{
"id": "jvasp-1642",
"created_at": "2022-09-04T14:36:39.883515Z",
"updated_at": "2022-09-04T14:36:39.883522Z",
"structure_string": "Li1 Cu1 O2\n1.0\n2.633620 -0.000000 0.740124\n1.305698 2.864693 0.409602\n0.011616 0.061814 5.014404\nLi Cu O\n1 1 2\ndirect\n0.000002 0.499999 0.499999 Li\n0.000000 0.000000 0.000000 Cu\n0.579141 0.096089 0.745630 O\n0.420863 0.903908 0.254367 O\n",
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{
"id": "jvasp-48360",
"created_at": "2022-09-04T14:36:40.178225Z",
"updated_at": "2022-09-04T14:36:40.178238Z",
"structure_string": "Li2 Fe1 Co3 O8\n1.0\n5.610984 0.031944 -0.017683\n2.833155 4.907169 0.000000\n-0.033124 -3.252322 4.736071\nLi Fe Co O\n2 1 3 8\ndirect\n0.500000 -0.000000 0.500000 Li\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Fe\n0.000000 0.500000 -0.000000 Co\n0.500000 -0.000000 0.000000 Co\n0.500000 0.500000 0.000000 Co\n0.237168 0.023950 0.788020 O\n0.271170 0.465925 0.203019 O\n0.237169 0.526902 0.788020 O\n0.733390 0.030255 0.793899 O\n0.266611 0.969745 0.206101 O\n0.762832 0.473098 0.211980 O\n0.728831 0.534075 0.796981 O\n0.762832 0.976050 0.211980 O\n",
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{
"id": "jvasp-10144",
"created_at": "2022-09-04T14:36:40.205857Z",
"updated_at": "2022-09-04T14:36:40.205884Z",
"structure_string": "Nb2 Ga2 O8\n1.0\n3.838277 0.000000 0.000000\n-1.919138 6.022192 -1.964160\n0.000000 0.012255 6.716261\nNb Ga O\n2 2 8\ndirect\n0.101612 0.207039 0.232201 Nb\n0.894573 0.792960 0.767798 Nb\n0.195126 0.394064 0.816105 Ga\n0.801063 0.605934 0.183894 Ga\n0.861319 0.726451 0.482671 O\n0.134867 0.273548 0.517329 O\n0.943219 0.890254 0.132943 O\n0.052964 0.109744 0.867057 O\n0.257000 0.517811 0.145377 O\n0.739189 0.482188 0.854623 O\n0.358992 0.721798 0.797348 O\n0.637194 0.278201 0.202651 O\n",
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"spacegroup": 12
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{
"id": "jvasp-30351",
"created_at": "2022-09-04T14:36:40.249643Z",
"updated_at": "2022-09-04T14:36:40.249661Z",
"structure_string": "Ti1 Mn5 O12\n1.0\n2.423885 4.210393 0.459609\n-2.454592 4.215986 0.229804\n0.416125 0.722827 9.105253\nTi Mn O\n1 5 12\ndirect\n0.000000 0.000000 0.000000 Ti\n0.145070 0.709862 0.499999 Mn\n0.666729 0.666542 -0.000000 Mn\n0.333271 0.333459 -0.000000 Mn\n0.854929 0.290140 0.500000 Mn\n0.499999 0.000001 0.500000 Mn\n0.038058 0.351983 0.889888 O\n0.313927 0.000000 0.110266 O\n0.609959 0.351983 0.110112 O\n0.801921 0.658926 0.601340 O\n0.125768 0.000001 0.625942 O\n0.198078 0.341076 0.398659 O\n0.539154 0.658925 0.398659 O\n0.686071 0.000002 0.889734 O\n0.390040 0.648019 0.889888 O\n-0.038058 0.648018 0.110111 O\n0.460845 0.341077 0.601340 O\n0.874230 0.000001 0.374058 O\n",
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"formula_full": "Ti1 Mn5 O12",
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{
"id": "jvasp-2931",
"created_at": "2022-09-04T14:36:40.361004Z",
"updated_at": "2022-09-04T14:36:40.361033Z",
"structure_string": "Al2 Te5\n1.0\n4.074493 0.000000 1.069536\n1.839201 6.819316 1.289237\n-0.009891 0.006121 8.333524\nAl Te\n2 5\ndirect\n0.374323 0.849305 0.402049 Al\n0.625676 0.150695 0.597952 Al\n0.591193 0.694692 0.122922 Te\n0.408807 0.305308 0.877079 Te\n0.000000 0.000000 0.000000 Te\n0.181889 0.244036 0.392185 Te\n0.818110 0.755965 0.607815 Te\n",
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{
"id": "jvasp-11428",
"created_at": "2022-09-04T14:36:40.607081Z",
"updated_at": "2022-09-04T14:36:40.607107Z",
"structure_string": "Y6 Si6 Rh2\n1.0\n4.177424 -0.000000 0.694316\n2.055423 5.292740 0.547447\n-0.001275 -0.006451 12.921782\nY Si Rh\n6 6 2\ndirect\n0.602413 0.716262 0.078911 Y\n0.397584 0.283738 0.921090 Y\n0.522431 0.331138 0.623999 Y\n0.477566 0.668862 0.376002 Y\n0.256871 0.258240 0.228017 Y\n0.743126 0.741760 0.771983 Y\n0.955011 0.853571 0.236404 Si\n0.044986 0.146429 0.763597 Si\n0.868705 0.718308 0.544278 Si\n0.131293 0.281692 0.455722 Si\n0.114417 0.846392 0.924773 Si\n0.885581 0.153608 0.075228 Si\n0.753763 0.078632 0.413839 Rh\n0.246234 0.921368 0.586161 Rh\n",
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{
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"structure_string": "Pr4 Co1 I5\n1.0\n9.757345 0.085674 2.239675\n8.830980 4.150532 2.239675\n0.065142 0.014846 9.066558\nPr Co I\n4 1 5\ndirect\n0.853849 0.853846 0.077639 Pr\n0.146165 0.146167 0.922360 Pr\n0.499752 0.499751 0.205660 Pr\n0.500261 0.500262 0.794338 Pr\n0.000007 0.000007 0.000000 Co\n0.673312 0.673310 0.181950 I\n0.326702 0.326703 0.818049 I\n0.669578 0.669577 0.644013 I\n0.330436 0.330436 0.355986 I\n0.000006 0.000007 0.500000 I\n",
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{
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"created_at": "2022-09-04T14:36:40.924240Z",
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"structure_string": "Li1 H1 F2\n1.0\n2.575374 -0.007995 1.456994\n0.863951 2.426150 1.456994\n0.036670 0.025782 5.371707\nLi H F\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 -0.000000 0.500000 H\n0.812522 0.812525 0.758860 F\n0.187476 0.187476 0.241139 F\n",
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"structure_string": "Sb4 As2 S4\n1.0\n5.366925 -0.018170 2.267781\n3.884997 3.702838 2.267781\n0.029750 0.011848 12.600490\nSb As S\n4 2 4\ndirect\n0.277695 0.277696 0.671102 Sb\n0.722304 0.722305 0.328897 Sb\n0.910828 0.910830 0.897837 Sb\n0.089171 0.089171 0.102163 Sb\n0.117750 0.117750 0.489430 As\n0.882249 0.882251 0.510570 As\n0.673740 0.673742 0.923995 S\n0.326259 0.326259 0.076005 S\n0.530738 0.530739 0.265007 S\n0.469261 0.469262 0.734993 S\n",
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