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{
"id": "jvasp-116249",
"created_at": "2022-09-04T14:38:41.782773Z",
"updated_at": "2022-09-04T14:38:41.782807Z",
"structure_string": "Li2 As1\n1.0\n4.359621 0.000000 -1.050516\n0.000000 3.058494 0.000000\n-1.265688 0.000000 4.300415\nLi As\n2 1\ndirect\n-0.200020 0.000000 -0.200063 Li\n0.133340 0.000000 0.466727 Li\n0.466679 0.000000 0.133336 As\n",
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{
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"structure_string": "Mg1 V2 O6\n1.0\n5.101759 0.001942 -0.008902\n2.548690 4.712357 -0.005972\n0.009684 0.002976 5.545429\nMg V O\n1 2 6\ndirect\n0.183112 0.633751 0.499990 Mg\n0.316468 0.366974 0.000013 V\n0.690897 0.618143 0.000035 V\n0.004829 0.501738 0.782111 O\n0.493428 0.501616 0.217932 O\n0.505640 0.988544 0.000023 O\n0.493467 0.501615 0.782103 O\n0.004839 0.501690 0.217929 O\n0.981226 0.038090 0.499871 O\n",
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{
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"structure_string": "Li6 V2 B4 O12\n1.0\n5.094915 0.031469 0.019817\n0.063760 5.833488 -0.270242\n0.072381 1.672385 7.568712\nLi V B O\n6 2 4 12\ndirect\n0.169762 0.812580 0.895780 Li\n0.343790 0.988370 0.241910 Li\n0.339851 0.739677 0.589045 Li\n0.660150 0.260324 0.410956 Li\n0.656211 0.011631 0.758091 Li\n0.830238 0.187421 0.104221 Li\n0.154879 0.507420 0.248418 V\n0.845122 0.492581 0.751583 V\n0.662057 0.655917 0.076063 B\n0.841983 0.826033 0.415418 B\n0.158018 0.173968 0.584583 B\n0.337944 0.344084 0.923937 B\n0.781960 0.496130 0.208078 O\n0.105478 0.763738 0.391515 O\n0.218041 0.503871 0.791923 O\n0.199848 0.246832 0.070848 O\n0.285474 0.275480 0.428405 O\n0.287666 0.011801 0.698938 O\n0.395114 0.702864 0.095536 O\n0.604886 0.297137 0.904465 O\n0.712335 0.988200 0.301063 O\n0.714526 0.724521 0.571596 O\n0.800152 0.753169 0.929153 O\n0.894522 0.236263 0.608486 O\n",
"nsites": 24,
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],
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"volume": 227.2312231882678,
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"formula_full": "Li6 V2 B4 O12",
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{
"id": "jvasp-8570",
"created_at": "2022-09-04T14:37:07.203130Z",
"updated_at": "2022-09-04T14:37:07.203152Z",
"structure_string": "Li2 Co1 Cl4\n1.0\n3.532959 0.000000 0.000000\n0.000000 5.858232 -2.095750\n0.000000 -0.001617 6.221821\nLi Co Cl\n2 1 4\ndirect\n0.500000 0.500000 -0.000000 Li\n0.500000 -0.000000 0.500000 Li\n0.000000 0.000000 0.000000 Co\n0.500000 0.234829 0.234829 Cl\n0.000000 0.240274 0.759725 Cl\n0.500000 0.765171 0.765171 Cl\n0.000000 0.759725 0.240275 Cl\n",
"nsites": 7,
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"elements": [
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{
"id": "jvasp-71129",
"created_at": "2022-09-04T14:36:13.095069Z",
"updated_at": "2022-09-04T14:36:13.095094Z",
"structure_string": "Li4 Be1 Sn1\n1.0\n0.000000 3.599600 3.599600\n3.599600 0.000000 3.599600\n3.599600 3.599600 0.000000\nLi Be Sn\n4 1 1\ndirect\n0.124437 0.625187 0.625187 Li\n0.625187 0.625187 0.625187 Li\n0.625187 0.124437 0.625187 Li\n0.625187 0.625187 0.124437 Li\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Sn\n",
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{
"id": "jvasp-115866",
"created_at": "2022-09-04T14:38:40.461669Z",
"updated_at": "2022-09-04T14:38:40.461692Z",
"structure_string": "Na1 I1 Cl1\n1.0\n3.540067 0.000000 0.000000\n-0.000000 3.540067 0.000000\n-0.000000 0.000000 8.873038\nNa I Cl\n1 1 1\ndirect\n0.000000 0.000000 0.005116 Na\n0.000000 0.000000 0.676892 I\n0.000000 0.000000 0.276504 Cl\n",
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{
"id": "jvasp-43384",
"created_at": "2022-09-04T14:38:10.869424Z",
"updated_at": "2022-09-04T14:38:10.869452Z",
"structure_string": "Mg6 O6\n1.0\n3.276951 -0.000066 0.000037\n-1.638533 2.837889 -0.000037\n-0.000166 0.000095 15.601688\nMg O\n6 6\ndirect\n0.333261 0.666739 0.352039 Mg\n0.333307 0.666694 0.020746 Mg\n0.999931 0.000067 0.186394 Mg\n0.999983 0.000013 0.518265 Mg\n0.000066 0.999932 0.852624 Mg\n0.666745 0.333250 0.686385 Mg\n0.333260 0.666740 0.148157 O\n0.333306 0.666692 0.479484 O\n0.999981 0.000013 0.981304 O\n0.999932 0.000065 0.313800 O\n0.000070 0.999927 0.646938 O\n0.666742 0.333253 0.813835 O\n",
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"elements": [
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},
{
"id": "jvasp-117878",
"created_at": "2022-09-04T14:38:29.230078Z",
"updated_at": "2022-09-04T14:38:29.230113Z",
"structure_string": "C1 Cl1 O1\n1.0\n3.844481 -0.000000 -0.000000\n-1.922240 3.329418 0.000000\n0.000000 0.000000 2.974723\nC Cl O\n1 1 1\ndirect\n0.000000 0.000000 0.000000 C\n0.333334 0.666667 0.000000 Cl\n0.666666 0.333334 0.000000 O\n",
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},
{
"id": "jvasp-93102",
"created_at": "2022-09-04T14:35:58.234631Z",
"updated_at": "2022-09-04T14:35:58.234660Z",
"structure_string": "Mg6 Nb1 Si1\n1.0\n6.170380 0.034352 0.000000\n-3.055440 5.360880 0.000000\n0.000000 0.000000 4.824320\nMg Nb Si\n6 1 1\ndirect\n0.168409 0.840370 0.250000 Mg\n0.659629 0.331591 0.250000 Mg\n0.667145 0.832855 0.250000 Mg\n0.328280 0.669400 0.750000 Mg\n0.830600 0.171720 0.750000 Mg\n0.831403 0.668596 0.750000 Mg\n0.320367 0.179633 0.750000 Nb\n0.194165 0.305835 0.250000 Si\n",
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},
{
"id": "jvasp-118809",
"created_at": "2022-09-04T14:38:29.246905Z",
"updated_at": "2022-09-04T14:38:29.246921Z",
"structure_string": "Na1 Zn1\n1.0\n3.023399 0.000000 -0.000000\n0.000000 3.023399 -0.000000\n0.000000 -0.000000 5.802379\nNa Zn\n1 1\ndirect\n0.000000 0.000000 0.750030 Na\n0.000000 0.000000 0.249970 Zn\n",
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{
"id": "jvasp-78526",
"created_at": "2022-09-04T14:37:12.140293Z",
"updated_at": "2022-09-04T14:37:12.140302Z",
"structure_string": "Si2 O1\n1.0\n-2.304434 -2.989415 0.889980\n-1.436692 2.488423 -0.000000\n0.834756 0.481948 -4.563646\nSi O\n2 1\ndirect\n0.703510 0.351754 0.932809 Si\n0.426913 0.713455 0.214135 Si\n0.536175 0.268087 0.513057 O\n",
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{
"id": "jvasp-121179",
"created_at": "2022-09-04T14:38:55.062536Z",
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"structure_string": "Al1 P1 N1\n1.0\n4.025042 0.000000 0.000000\n-2.012521 3.485789 -0.000000\n0.000000 -0.000000 3.077620\nAl P N\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Al\n0.666666 0.333334 0.000000 P\n0.333333 0.666668 0.000000 N\n",
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