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{
"id": "jvasp-106453",
"created_at": "2022-09-04T14:36:46.495837Z",
"updated_at": "2022-09-04T14:36:46.495869Z",
"structure_string": "Na2 Al1 Hg1 Cl6\n1.0\n6.294766 -0.000000 3.634285\n2.098255 5.934762 3.634285\n-0.000000 -0.000000 7.268570\nNa Al Hg Cl\n2 1 1 6\ndirect\n0.750001 0.750000 0.749999 Na\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 Al\n0.500001 0.500000 0.499999 Hg\n0.772860 0.227140 0.227139 Cl\n0.227141 0.227140 0.772859 Cl\n0.227141 0.772859 0.772859 Cl\n0.227141 0.772859 0.227139 Cl\n0.772860 0.227140 0.772859 Cl\n0.772861 0.772859 0.227139 Cl\n",
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{
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{
"id": "jvasp-107216",
"created_at": "2022-09-04T14:36:59.873840Z",
"updated_at": "2022-09-04T14:36:59.873865Z",
"structure_string": "Rb6 Na2\n1.0\n9.308079 0.000000 0.000000\n-4.654040 8.061032 0.000000\n0.000000 -0.000000 7.403040\nRb Na\n6 2\ndirect\n0.827427 0.172573 0.750000 Rb\n0.345147 0.172573 0.750000 Rb\n0.827427 0.654853 0.750000 Rb\n0.172573 0.827426 0.250000 Rb\n0.654853 0.827426 0.250000 Rb\n0.172573 0.345146 0.250000 Rb\n0.666667 0.333333 0.250000 Na\n0.333333 0.666666 0.750000 Na\n",
"nsites": 8,
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"volume": 555.4702472906469,
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"spacegroup": 194
},
{
"id": "jvasp-105166",
"created_at": "2022-09-04T14:36:59.879407Z",
"updated_at": "2022-09-04T14:36:59.879417Z",
"structure_string": "Ga3 Ag1\n1.0\n3.824421 -0.081849 -3.363045\n-0.835467 3.732946 -3.363045\n0.067005 0.081849 5.092325\nGa Ag\n3 1\ndirect\n0.750000 0.250000 0.500001 Ga\n0.250000 0.750001 0.500001 Ga\n0.500000 0.500000 0.000001 Ga\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 4,
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"elements": [
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"formula_full": "Ga3 Ag1",
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},
{
"id": "jvasp-101626",
"created_at": "2022-09-04T14:36:44.816004Z",
"updated_at": "2022-09-04T14:36:44.816029Z",
"structure_string": "Yb2 Zn1 Hg1\n1.0\n4.450743 -0.000000 2.569638\n1.483581 4.196201 2.569638\n-0.000000 -0.000000 5.139276\nYb Zn Hg\n2 1 1\ndirect\n0.250000 0.250000 0.250001 Yb\n0.749999 0.750000 0.750002 Yb\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500001 Hg\n",
"nsites": 4,
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"elements": [
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},
{
"id": "jvasp-100890",
"created_at": "2022-09-04T14:36:41.415510Z",
"updated_at": "2022-09-04T14:36:41.415532Z",
"structure_string": "Na2 Ga1 Cu1 F6\n1.0\n4.956027 -0.000000 2.861364\n1.652009 4.672587 2.861364\n-0.000000 -0.000000 5.722727\nNa Ga Cu F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Na\n0.750000 0.750000 0.749999 Na\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 0.499999 Cu\n0.236927 0.236927 0.763073 F\n0.236927 0.763073 0.763072 F\n0.763073 0.763073 0.236926 F\n0.236927 0.763073 0.236926 F\n0.763073 0.236927 0.763072 F\n0.763073 0.236927 0.236926 F\n",
"nsites": 10,
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"elements": [
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"density": 3.67431745619149,
"density_atomic": 0.07545810793621407,
"volume": 132.5238635515902,
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"formula_full": "Na2 Ga1 Cu1 F6",
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},
{
"id": "jvasp-102536",
"created_at": "2022-09-04T14:36:59.189512Z",
"updated_at": "2022-09-04T14:36:59.189529Z",
"structure_string": "Nd1 Ho1 Zn2\n1.0\n4.409577 -0.000000 2.545871\n1.469859 4.157389 2.545871\n-0.000000 -0.000000 5.091741\nNd Ho Zn\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Nd\n0.500000 0.500000 0.500000 Ho\n0.250000 0.250000 0.250000 Zn\n0.750001 0.750000 0.749999 Zn\n",
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"elements": [
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],
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"spacegroup": 225
},
{
"id": "jvasp-106898",
"created_at": "2022-09-04T14:36:51.876954Z",
"updated_at": "2022-09-04T14:36:51.876974Z",
"structure_string": "Na2 Ga1 Hg1 Br6\n1.0\n6.664411 -0.000000 3.847699\n2.221470 6.283267 3.847699\n-0.000000 -0.000000 7.695399\nNa Ga Hg Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 0.500000 Hg\n0.761100 0.238900 0.238900 Br\n0.238900 0.238900 0.761100 Br\n0.238900 0.761101 0.761100 Br\n0.238900 0.761101 0.238900 Br\n0.761100 0.238900 0.761100 Br\n0.761100 0.761101 0.238900 Br\n",
"nsites": 10,
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"elements": [
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"density_atomic": 0.031032843407426253,
"volume": 322.2392440393319,
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"formula_full": "Na2 Ga1 Hg1 Br6",
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"formula_anonymous": "ABC2D6",
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"spacegroup": 225
},
{
"id": "jvasp-101769",
"created_at": "2022-09-04T14:37:04.443077Z",
"updated_at": "2022-09-04T14:37:04.443101Z",
"structure_string": "K2 Mn1 F4\n1.0\n4.000953 0.006836 -6.052399\n-0.355969 3.985092 -6.052399\n-0.006242 -0.006836 7.255282\nK Mn F\n2 1 4\ndirect\n0.354276 0.354277 -0.000000 K\n0.645723 0.645724 -0.000000 K\n0.000000 0.000000 0.000000 Mn\n0.160047 0.160047 -0.000000 F\n0.839952 0.839954 -0.000001 F\n0.500000 -0.000000 0.500000 F\n0.000000 0.499999 0.499999 F\n",
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},
{
"id": "jvasp-99674",
"created_at": "2022-09-04T14:36:41.338630Z",
"updated_at": "2022-09-04T14:36:41.338649Z",
"structure_string": "K3 Ga1 Br6\n1.0\n6.810269 -0.000000 3.931911\n2.270090 6.420784 3.931911\n-0.000000 0.000000 7.863822\nK Ga Br\n3 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Ga\n0.771508 0.228492 0.228492 Br\n0.228492 0.228492 0.771508 Br\n0.228492 0.771508 0.771508 Br\n0.228492 0.771508 0.228492 Br\n0.771508 0.228492 0.771508 Br\n0.771508 0.771508 0.228492 Br\n",
"nsites": 10,
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},
{
"id": "jvasp-79905",
"created_at": "2022-09-04T14:36:46.333031Z",
"updated_at": "2022-09-04T14:36:46.333056Z",
"structure_string": "Li1 Yb2 Hg1\n1.0\n0.000031 3.706941 3.706944\n3.706936 0.000027 3.706948\n3.706953 3.706962 0.000011\nYb Li Hg\n2 1 1\ndirect\n-0.000000 -0.000000 0.000001 Yb\n0.499999 0.500001 0.499999 Yb\n0.750000 0.749999 0.750000 Li\n0.250001 0.250000 0.250000 Hg\n",
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},
{
"id": "jvasp-18632",
"created_at": "2022-09-04T14:36:46.328100Z",
"updated_at": "2022-09-04T14:36:46.328124Z",
"structure_string": "Sr2 Cu2 Bi2\n1.0\n2.340392 -4.053677 0.000000\n2.340392 4.053677 0.000000\n0.000000 0.000000 8.830851\nSr Cu Bi\n2 2 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.000000 0.000000 0.500000 Sr\n0.666667 0.333333 0.750000 Cu\n0.333333 0.666667 0.250000 Cu\n0.666667 0.333333 0.250000 Bi\n0.333333 0.666667 0.750000 Bi\n",
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}