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{
"id": "jvasp-1339",
"created_at": "2022-09-04T14:36:10.332390Z",
"updated_at": "2022-09-04T14:36:10.332401Z",
"structure_string": "K2 Te1\n1.0\n4.975485 0.000000 2.872597\n1.658495 4.690933 2.872597\n0.000000 0.000000 5.745195\nK Te\n2 1\ndirect\n0.250001 0.250000 0.250000 K\n0.750002 0.750000 0.750001 K\n0.000000 0.000000 0.000000 Te\n",
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{
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"structure_string": "Os4 N8\n1.0\n4.934389 0.000000 0.000000\n0.000000 4.570926 -1.898545\n0.000000 0.037094 4.985573\nOs N\n4 8\ndirect\n0.497246 0.231632 0.720468 Os\n0.502755 0.768368 0.279530 Os\n0.997246 0.768367 0.779530 Os\n0.002754 0.231633 0.220469 Os\n0.401605 0.806329 0.694100 N\n0.098395 0.806329 0.194101 N\n0.089933 0.323335 0.673075 N\n0.410067 0.323336 0.173076 N\n0.910067 0.676665 0.326923 N\n0.589933 0.676664 0.826923 N\n0.901605 0.193671 0.805897 N\n0.598395 0.193671 0.305898 N\n",
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{
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"structure_string": "Ce2 Mg4\n1.0\n3.130048 -0.000000 -0.000000\n-1.565024 2.710701 -0.000000\n0.000000 0.000000 17.115040\nCe Mg\n2 4\ndirect\n0.333334 0.666667 0.174977 Ce\n0.333334 0.666667 0.825022 Ce\n0.333334 0.666667 0.500000 Mg\n0.000000 0.000000 0.346143 Mg\n0.000000 0.000000 0.000000 Mg\n0.000000 0.000000 0.653857 Mg\n",
"nsites": 6,
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"elements": [
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{
"id": "jvasp-93691",
"created_at": "2022-09-04T14:36:00.957018Z",
"updated_at": "2022-09-04T14:36:00.957050Z",
"structure_string": "Ir2 C4\n1.0\n0.000000 2.855649 -0.000000\n-2.517904 1.427824 2.950717\n1.050590 1.427824 7.332107\nIr C\n2 4\ndirect\n0.262407 -0.275768 0.750952 Ir\n0.737592 0.275768 0.249048 Ir\n0.914525 0.224838 0.946110 C\n0.085473 0.775161 0.053891 C\n0.588247 0.312026 0.511479 C\n0.411750 0.687974 0.488522 C\n",
"nsites": 6,
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"elements": [
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"density": 11.663460015879402,
"density_atomic": 0.09744661168672726,
"volume": 61.57217676576467,
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{
"id": "jvasp-93530",
"created_at": "2022-09-04T14:36:11.573425Z",
"updated_at": "2022-09-04T14:36:11.573451Z",
"structure_string": "Ca2 Mg4\n1.0\n3.556336 -0.000000 -0.000000\n-1.778168 3.079877 0.000000\n0.000000 -0.000000 16.037357\nCa Mg\n2 4\ndirect\n0.666668 0.333333 0.250000 Ca\n0.333333 0.666668 0.750000 Ca\n0.333333 0.666668 0.077028 Mg\n0.333333 0.666668 0.422972 Mg\n0.666668 0.333333 0.577028 Mg\n0.666668 0.333333 0.922972 Mg\n",
"nsites": 6,
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"elements": [
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"density": 1.6767758053931685,
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"volume": 175.65841332507674,
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{
"id": "jvasp-5509",
"created_at": "2022-09-04T14:36:10.192765Z",
"updated_at": "2022-09-04T14:36:10.192790Z",
"structure_string": "Ga8 Br16\n1.0\n7.544973 0.000000 0.000000\n0.000000 9.914748 0.000000\n0.000000 0.000000 10.011802\nGa Br\n8 16\ndirect\n0.750000 0.000000 0.679309 Ga\n0.750000 0.500000 0.820690 Ga\n0.250000 0.000000 0.320690 Ga\n0.250000 0.500000 0.179310 Ga\n0.157125 0.250000 0.750000 Ga\n0.342875 0.750000 0.750000 Ga\n0.842875 0.750000 0.250000 Ga\n0.657125 0.250000 0.250000 Ga\n0.498489 0.545384 0.316752 Br\n0.498489 0.954617 0.183248 Br\n-0.001511 0.954617 0.816752 Br\n-0.001511 0.545384 0.683248 Br\n0.501511 0.454617 0.683248 Br\n0.501511 0.045384 0.816752 Br\n0.337390 0.185942 0.452619 Br\n0.662610 0.814058 0.547381 Br\n0.162610 0.685943 0.047381 Br\n0.162610 0.814058 0.452619 Br\n0.001511 0.454617 0.316752 Br\n0.662610 0.685943 0.952619 Br\n0.837390 0.314058 0.952619 Br\n0.837390 0.185942 0.547381 Br\n0.337390 0.314058 0.047381 Br\n0.001511 0.045384 0.183248 Br\n",
"nsites": 24,
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"elements": [
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"volume": 748.9479260014011,
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"formula_full": "Ga8 Br16",
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"spacegroup": 52
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{
"id": "jvasp-3906",
"created_at": "2022-09-04T14:36:00.947163Z",
"updated_at": "2022-09-04T14:36:00.947186Z",
"structure_string": "Cd2 Br4\n1.0\n2.011894 -3.484702 0.000000\n2.011894 3.484702 0.000000\n0.000000 0.000000 12.547449\nCd Br\n2 4\ndirect\n0.666666 0.333332 0.124967 Cd\n0.333332 0.666666 0.624967 Cd\n0.000000 0.000000 0.250846 Br\n0.000000 0.000000 0.750846 Br\n0.333332 0.666666 -0.000813 Br\n0.666666 0.333332 0.499187 Br\n",
"nsites": 6,
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"elements": [
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"Br"
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"density": 5.138559060793724,
"density_atomic": 0.03410319556500521,
"volume": 175.9365918822242,
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"formula_full": "Cd2 Br4",
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"formula_anonymous": "AB2",
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"spacegroup": 186
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{
"id": "jvasp-94363",
"created_at": "2022-09-04T14:36:10.168375Z",
"updated_at": "2022-09-04T14:36:10.168412Z",
"structure_string": "Sr2 Mg4\n1.0\n3.809970 0.000000 -0.000000\n-1.904985 3.299531 0.000000\n-0.000000 0.000000 16.047557\nSr Mg\n2 4\ndirect\n0.333332 0.666667 0.611000 Sr\n0.666667 0.333333 0.389000 Sr\n0.333332 0.666667 0.929956 Mg\n0.666667 0.333333 0.787848 Mg\n0.333332 0.666667 0.212152 Mg\n0.666667 0.333333 0.070044 Mg\n",
"nsites": 6,
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"elements": [
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"Mg"
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"density": 2.2426895206746478,
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"formula_full": "Sr2 Mg4",
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{
"id": "jvasp-93736",
"created_at": "2022-09-04T14:36:10.451602Z",
"updated_at": "2022-09-04T14:36:10.451630Z",
"structure_string": "Ho2 Co4\n1.0\n-3.548289 -3.548289 -0.000000\n-3.548289 0.000000 -3.548289\n0.000000 -3.548289 -3.548289\nHo Co\n2 4\ndirect\n0.750000 0.750000 0.750000 Ho\n0.000000 0.000000 0.000000 Ho\n0.875000 0.375000 0.375000 Co\n0.375000 0.875000 0.375000 Co\n0.375000 0.375000 0.875000 Co\n0.375000 0.375000 0.375000 Co\n",
"nsites": 6,
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"elements": [
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"density": 10.51154358628197,
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"volume": 89.34843508117933,
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{
"id": "jvasp-93439",
"created_at": "2022-09-04T14:36:10.140226Z",
"updated_at": "2022-09-04T14:36:10.140248Z",
"structure_string": "Bi2 Au4\n1.0\n4.945721 -0.000000 2.855413\n1.648574 4.662870 2.855413\n0.000000 0.000000 5.710827\nBi Au\n2 4\ndirect\n0.874999 0.875000 0.875000 Bi\n0.125000 0.125000 0.125000 Bi\n0.500000 -0.000000 0.500000 Au\n-0.000000 0.500000 0.500000 Au\n0.499999 0.500000 0.500000 Au\n0.499999 0.500000 -0.000000 Au\n",
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{
"id": "jvasp-93529",
"created_at": "2022-09-04T14:36:10.120503Z",
"updated_at": "2022-09-04T14:36:10.120538Z",
"structure_string": "Mg2 Al4\n1.0\n5.615038 0.000000 0.000000\n0.000000 5.615038 0.000000\n0.000000 0.000000 5.162931\nMg Al\n2 4\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.337059 0.337059 0.000000 Al\n0.662942 0.662942 0.000000 Al\n0.837059 0.162942 0.500000 Al\n0.162942 0.837059 0.500000 Al\n",
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{
"id": "jvasp-93777",
"created_at": "2022-09-04T14:36:10.230842Z",
"updated_at": "2022-09-04T14:36:10.230867Z",
"structure_string": "Sm4 Sb2\n1.0\n4.493711 -0.000000 0.000000\n-0.000000 4.493711 0.000000\n-2.246855 -2.246855 8.731531\nSm Sb\n4 2\ndirect\n0.500000 0.000000 0.000000 Sm\n0.000000 0.500000 0.000000 Sm\n0.821505 0.821505 0.643010 Sm\n0.178494 0.178494 0.356990 Sm\n0.639384 0.639384 0.278769 Sb\n0.360615 0.360615 0.721230 Sb\n",
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