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{
"id": "jvasp-18822",
"created_at": "2022-09-04T14:35:49.489862Z",
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{
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{
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"structure_string": "Rb2 Hg2 Pd1 Cl8\n1.0\n6.368097 0.039047 1.932409\n2.754388 5.741736 1.932409\n-0.037039 -0.023470 9.834079\nRb Hg Pd Cl\n2 2 1 8\ndirect\n0.397295 0.397295 0.829109 Rb\n0.602705 0.602706 0.170891 Rb\n0.866074 0.866075 0.400908 Hg\n0.133926 0.133926 0.599092 Hg\n0.000000 0.000000 0.000000 Pd\n0.085111 0.085111 0.305976 Cl\n0.106719 0.623961 0.134386 Cl\n0.647880 0.647881 0.503489 Cl\n0.376039 0.893282 0.865614 Cl\n0.352119 0.352120 0.496511 Cl\n0.623961 0.106720 0.134386 Cl\n0.893281 0.376040 0.865614 Cl\n0.914889 0.914890 0.694024 Cl\n",
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"spacegroup": 12
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{
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"created_at": "2022-09-04T14:37:05.081789Z",
"updated_at": "2022-09-04T14:37:05.081814Z",
"structure_string": "In4 O4 F4\n1.0\n5.156855 -0.008544 -2.024998\n-1.818604 4.825547 -2.024998\n0.002163 0.003120 6.270921\nIn O F\n4 4 4\ndirect\n0.075333 0.924668 0.250000 In\n0.674667 0.325333 0.250000 In\n0.924667 0.075333 0.749999 In\n0.325333 0.674668 0.750000 In\n0.011591 0.261590 0.523181 O\n0.261590 0.011591 0.023181 O\n0.988409 0.738410 0.476818 O\n0.738409 0.988410 0.976818 O\n0.499999 0.000000 0.500000 F\n0.500000 0.500001 0.500000 F\n0.000000 0.500000 0.000000 F\n0.500000 0.500001 -0.000000 F\n",
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"elements": [
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"volume": 156.0174563137715,
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"spacegroup": 70
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{
"id": "jvasp-93173",
"created_at": "2022-09-04T14:36:12.315243Z",
"updated_at": "2022-09-04T14:36:12.315266Z",
"structure_string": "Rb1 Li1 Mg6\n1.0\n8.742649 -1.414950 0.000000\n-5.596707 6.863880 0.000000\n0.000000 0.000000 5.013435\nRb Li Mg\n1 1 6\ndirect\n0.286273 0.213727 0.749999 Rb\n0.109143 0.390857 0.250000 Li\n0.213573 0.800827 0.250000 Mg\n0.699172 0.286426 0.250000 Mg\n0.634368 0.865632 0.250000 Mg\n0.326669 0.682050 0.749999 Mg\n0.817950 0.173331 0.749999 Mg\n0.912851 0.587149 0.749999 Mg\n",
"nsites": 8,
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{
"id": "jvasp-104615",
"created_at": "2022-09-04T14:37:06.731501Z",
"updated_at": "2022-09-04T14:37:06.731521Z",
"structure_string": "Sr2 Hg1 Ge1\n1.0\n4.771843 -0.000000 2.755025\n1.590614 4.498937 2.755025\n-0.000000 -0.000000 5.510049\nSr Hg Ge\n2 1 1\ndirect\n0.749999 0.750001 0.749999 Sr\n0.250000 0.250000 0.250000 Sr\n0.000000 0.000000 0.000000 Hg\n0.499999 0.500000 0.499999 Ge\n",
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{
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"created_at": "2022-09-04T14:35:42.318327Z",
"updated_at": "2022-09-04T14:35:42.318358Z",
"structure_string": "K1 Ba1 Cd2\n1.0\n4.202187 -0.000000 0.000000\n0.000000 4.202187 -0.000000\n-0.000000 -0.000000 8.555293\nK Ba Cd\n1 1 2\ndirect\n0.500000 0.500000 0.000000 K\n0.500000 0.500000 0.500000 Ba\n0.000000 0.000000 0.736642 Cd\n0.000000 0.000000 0.263358 Cd\n",
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{
"id": "jvasp-69255",
"created_at": "2022-09-04T14:36:02.286350Z",
"updated_at": "2022-09-04T14:36:02.286378Z",
"structure_string": "Ba1 Ga1 Cl2\n1.0\n5.034887 0.000000 0.000000\n0.000000 5.034887 0.000000\n0.000000 0.000000 4.239948\nBa Ga Cl\n1 1 2\ndirect\n0.000000 0.000000 0.500000 Ba\n0.500000 0.500000 0.500000 Ga\n0.500000 0.000000 0.000000 Cl\n0.000000 0.500000 0.000000 Cl\n",
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{
"id": "jvasp-105673",
"created_at": "2022-09-04T14:35:52.746716Z",
"updated_at": "2022-09-04T14:35:52.746735Z",
"structure_string": "K1 Na2 Ga1 F6\n1.0\n5.311104 -0.000000 3.066367\n1.770368 5.007356 3.066367\n0.000000 0.000000 6.132735\nK Na Ga F\n1 2 1 6\ndirect\n0.500000 0.500000 0.500000 K\n0.250000 0.250000 0.250000 Na\n0.750000 0.750001 0.750000 Na\n0.000000 0.000000 0.000000 Ga\n0.220034 0.220034 0.779965 F\n0.220034 0.779966 0.779965 F\n0.779965 0.779966 0.220035 F\n0.220034 0.779966 0.220034 F\n0.779965 0.220034 0.779966 F\n0.779965 0.220034 0.220035 F\n",
"nsites": 10,
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"formula_anonymous": "ABC2D6",
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{
"id": "jvasp-69019",
"created_at": "2022-09-04T14:36:09.374016Z",
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"structure_string": "Ba2 Sn1 Te1\n1.0\n-0.000000 4.253634 4.253634\n4.253634 -0.000000 4.253634\n4.253634 4.253634 -0.000000\nBa Sn Te\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.749999 0.749999 0.749999 Ba\n0.000000 0.000000 0.000000 Sn\n0.500000 0.500000 0.500000 Te\n",
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{
"id": "jvasp-78665",
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"structure_string": "Cd1 Cu1 Sb1\n1.0\n4.029601 0.000000 2.326492\n1.343201 3.799145 2.326492\n0.000000 0.000000 4.652982\nCd Cu Sb\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Cd\n0.500000 0.499999 0.500000 Cu\n0.250000 0.250000 0.250000 Sb\n",
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{
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"created_at": "2022-09-04T14:37:55.072423Z",
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"structure_string": "Zn6 Hg2\n1.0\n3.101529 -5.372007 0.000000\n3.101529 5.372007 -0.000000\n0.000000 -0.000000 4.295919\nZn Hg\n6 2\ndirect\n0.689597 0.844799 0.750000 Zn\n0.155201 0.310403 0.750000 Zn\n0.155201 0.844799 0.750000 Zn\n0.310403 0.155201 0.250000 Zn\n0.844799 0.689597 0.250000 Zn\n0.844799 0.155201 0.250000 Zn\n0.333333 0.666667 0.250000 Hg\n0.666667 0.333333 0.750000 Hg\n",
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