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{
"id": "jvasp-59746",
"created_at": "2022-09-04T14:38:31.031123Z",
"updated_at": "2022-09-04T14:38:31.031149Z",
"structure_string": "Sb8 O16\n1.0\n6.447878 -0.000000 3.722684\n2.149292 6.079117 3.722684\n-0.000000 -0.000000 7.445369\nSb O\n8 16\ndirect\n0.751194 0.751194 0.751193 Sb\n0.753582 0.248806 0.248805 Sb\n0.248806 0.753582 0.248805 Sb\n0.246418 0.751194 0.751194 Sb\n0.751194 0.246418 0.751193 Sb\n0.751194 0.751194 0.246417 Sb\n0.248806 0.248806 0.248806 Sb\n0.248806 0.248806 0.753582 Sb\n0.179632 0.179632 0.570368 O\n0.179631 0.570369 0.179631 O\n0.429631 0.820369 0.429631 O\n0.820368 0.429632 0.820368 O\n-0.000000 0.500000 -0.000000 O\n0.820368 0.820369 0.429631 O\n0.570368 0.179632 0.179631 O\n0.570368 0.570369 0.179631 O\n0.570368 0.179632 0.570368 O\n0.429631 0.820369 0.820368 O\n0.179631 0.570369 0.570368 O\n0.000000 0.000000 0.000000 O\n0.000000 0.000000 0.500000 O\n0.500000 0.000000 -0.000000 O\n0.429632 0.429632 0.820368 O\n0.820368 0.429632 0.429631 O\n",
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{
"id": "jvasp-117863",
"created_at": "2022-09-04T14:38:26.044453Z",
"updated_at": "2022-09-04T14:38:26.044479Z",
"structure_string": "Pb1 Br2\n1.0\n5.570105 -0.000000 0.000000\n-2.785052 4.823852 -0.000000\n-0.000000 0.000000 3.549395\nPb Br\n1 2\ndirect\n0.000000 0.000000 0.000000 Pb\n0.333334 0.666667 0.000000 Br\n0.666667 0.333334 0.000000 Br\n",
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{
"id": "jvasp-15937",
"created_at": "2022-09-04T14:38:29.049742Z",
"updated_at": "2022-09-04T14:38:29.049762Z",
"structure_string": "Nb1 Se2\n1.0\n1.752654 -3.035685 -0.000000\n1.752654 3.035685 0.000000\n-0.000000 0.000000 6.315867\nNb Se\n1 2\ndirect\n0.000000 0.000000 0.000000 Nb\n0.666666 0.333332 0.264822 Se\n0.333332 0.666666 0.735178 Se\n",
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"density": 6.197355980699048,
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"volume": 67.20720969087785,
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"formula_full": "Nb1 Se2",
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},
{
"id": "jvasp-15851",
"created_at": "2022-09-04T14:38:19.920653Z",
"updated_at": "2022-09-04T14:38:19.920681Z",
"structure_string": "Ge4 Os2\n1.0\n3.078366 0.000000 0.705271\n1.425512 4.528846 0.848789\n0.013895 0.003763 7.010219\nGe Os\n4 2\ndirect\n0.855560 0.755534 0.533347 Ge\n0.144439 0.244466 0.466653 Ge\n0.600248 0.688247 0.111259 Ge\n0.399751 0.311753 0.888742 Ge\n0.154331 0.892461 0.798875 Os\n0.845668 0.107539 0.201125 Os\n",
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"elements": [
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"density": 11.406944436492962,
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"volume": 97.68215587210372,
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"formula_full": "Ge4 Os2",
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},
{
"id": "jvasp-111370",
"created_at": "2022-09-04T14:38:26.103630Z",
"updated_at": "2022-09-04T14:38:26.103657Z",
"structure_string": "Ga1 Fe2\n1.0\n5.876538 0.007438 1.658170\n5.376036 2.431723 0.921912\n-0.022975 0.111286 2.580082\nGa Fe\n1 2\ndirect\n0.000000 0.000000 0.000000 Ga\n0.331231 0.331234 0.668767 Fe\n0.668768 0.668768 0.331231 Fe\n",
"nsites": 3,
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"elements": [
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"density": 8.087480264867242,
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"volume": 37.2481123691559,
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},
{
"id": "jvasp-109063",
"created_at": "2022-09-04T14:38:17.496416Z",
"updated_at": "2022-09-04T14:38:17.496438Z",
"structure_string": "Nd2 Mg1\n1.0\n3.734732 0.195954 -6.239937\n-0.118347 3.737996 -6.239937\n-0.180136 -0.195954 7.269979\nNd Mg\n2 1\ndirect\n0.658626 0.658627 -0.000001 Nd\n0.341372 0.341373 -0.000001 Nd\n0.000000 0.000000 0.000000 Mg\n",
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{
"id": "jvasp-55118",
"created_at": "2022-09-04T14:38:19.528734Z",
"updated_at": "2022-09-04T14:38:19.528753Z",
"structure_string": "Th2 Ru4\n1.0\n4.709406 0.000000 2.718977\n1.569802 4.440070 2.718977\n-0.000000 -0.000000 5.437954\nTh Ru\n2 4\ndirect\n0.125000 0.125000 0.125000 Th\n0.875000 0.875000 0.875000 Th\n0.500000 0.500000 0.000001 Ru\n-0.000000 0.500000 0.500000 Ru\n0.500000 -0.000000 0.500000 Ru\n0.500000 0.500000 0.500000 Ru\n",
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{
"id": "jvasp-16869",
"created_at": "2022-09-04T14:38:33.150751Z",
"updated_at": "2022-09-04T14:38:33.150767Z",
"structure_string": "Ca1 Si2\n1.0\n2.057943 -3.564463 -0.000000\n2.057943 3.564463 0.000000\n0.000000 0.000000 4.246217\nCa Si\n1 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.333332 0.666666 0.500000 Si\n0.666666 0.333332 0.500000 Si\n",
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},
{
"id": "jvasp-17427",
"created_at": "2022-09-04T14:38:32.879540Z",
"updated_at": "2022-09-04T14:38:32.879579Z",
"structure_string": "Al2 Pd1\n1.0\n3.643069 0.000000 2.103326\n1.214357 3.434718 2.103326\n-0.000000 -0.000000 4.206654\nAl Pd\n2 1\ndirect\n0.250000 0.250000 0.250000 Al\n0.750001 0.750000 0.750000 Al\n0.000000 0.000000 0.000000 Pd\n",
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"volume": 52.63750254628754,
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"spacegroup": 225
},
{
"id": "jvasp-111388",
"created_at": "2022-09-04T14:38:26.301541Z",
"updated_at": "2022-09-04T14:38:26.301567Z",
"structure_string": "Y2 Se4\n1.0\n4.080641 0.000000 0.000000\n0.000000 4.080641 0.000000\n-0.000000 -0.000000 8.318592\nY Se\n2 4\ndirect\n-0.000000 0.500000 0.726369 Y\n0.500000 -0.000000 0.273631 Y\n0.500000 0.500000 -0.000000 Se\n0.000000 0.000000 0.000000 Se\n0.500000 -0.000000 0.630155 Se\n-0.000000 0.500000 0.369844 Se\n",
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},
{
"id": "jvasp-29602",
"created_at": "2022-09-04T14:38:27.661975Z",
"updated_at": "2022-09-04T14:38:27.662003Z",
"structure_string": "Zn1 Br2\n1.0\n3.666504 0.036456 5.474116\n1.690858 3.253548 5.474116\n0.059364 0.036456 6.588298\nZn Br\n1 2\ndirect\n0.000000 0.000000 0.000000 Zn\n0.746528 0.746533 0.746532 Br\n0.253469 0.253470 0.253470 Br\n",
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{
"id": "jvasp-20207",
"created_at": "2022-09-04T14:38:29.129477Z",
"updated_at": "2022-09-04T14:38:29.129502Z",
"structure_string": "Th2 Os4\n1.0\n4.751457 -0.000000 2.743255\n1.583819 4.479717 2.743255\n-0.000000 0.000000 5.486511\nTh Os\n2 4\ndirect\n0.875001 0.875001 0.875001 Th\n0.125000 0.125000 0.125000 Th\n0.500000 0.000000 0.500000 Os\n0.000000 0.500000 0.500000 Os\n0.500000 0.500000 0.500000 Os\n0.500000 0.500000 0.000001 Os\n",
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}
]
}