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{
"id": "jvasp-85706",
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"updated_at": "2022-09-04T14:35:49.007867Z",
"structure_string": "Eu2 Mg1 H6\n1.0\n5.487057 -0.000239 -0.000659\n-2.743735 4.752289 0.000000\n0.000434 0.000250 3.682426\nEu Mg H\n2 1 6\ndirect\n0.666668 0.333333 0.737090 Eu\n0.333331 0.666666 0.262911 Eu\n0.000000 0.000000 0.000000 Mg\n0.628782 0.814392 0.759333 H\n0.185573 0.371207 0.759269 H\n0.185573 0.814367 0.759269 H\n0.371217 0.185608 0.240668 H\n0.814426 0.628793 0.240732 H\n0.814426 0.185633 0.240732 H\n",
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{
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"updated_at": "2022-09-04T14:35:49.009071Z",
"structure_string": "Hg2 Br4\n1.0\n4.149853 -0.121358 0.000000\n-1.632661 3.817122 0.000000\n0.000000 0.000000 12.469954\nHg Br\n2 4\ndirect\n0.660966 0.339033 0.500213 Hg\n0.339034 0.660966 0.000213 Hg\n0.607454 0.392545 0.134364 Br\n0.392545 0.607454 0.634364 Br\n0.071343 0.928656 0.865422 Br\n0.928656 0.071343 0.365422 Br\n",
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"elements": [
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{
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"updated_at": "2022-09-04T14:35:49.009542Z",
"structure_string": "As1 Ru2 Pt1\n1.0\n-0.000000 3.126166 3.126166\n3.126166 0.000000 3.126166\n3.126166 3.126166 0.000000\nAs Ru Pt\n1 2 1\ndirect\n0.500001 0.500001 0.500001 As\n0.000000 0.000000 0.000000 Ru\n0.250000 0.250000 0.250000 Ru\n0.750001 0.750001 0.750001 Pt\n",
"nsites": 4,
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"elements": [
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"volume": 61.10350205734549,
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"formula_full": "As1 Ru2 Pt1",
"formula_reduced": "AsRu2Pt",
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"spacegroup": 216
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{
"id": "jvasp-66454",
"created_at": "2022-09-04T14:35:49.014400Z",
"updated_at": "2022-09-04T14:35:49.014434Z",
"structure_string": "Ba4 Fe1 W1\n1.0\n0.000000 4.779272 4.779272\n4.779272 0.000000 4.779272\n4.779272 4.779272 0.000000\nBa Fe W\n4 1 1\ndirect\n0.124825 0.625058 0.625058 Ba\n0.625058 0.625058 0.625058 Ba\n0.625058 0.124825 0.625058 Ba\n0.625058 0.625058 0.124825 Ba\n0.250000 0.250000 0.250000 Fe\n0.000000 0.000000 0.000000 W\n",
"nsites": 6,
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"elements": [
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"density_atomic": 0.027481220121189375,
"volume": 218.3309173879694,
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"formula_full": "Ba4 Fe1 W1",
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"formula_anonymous": "ABC4",
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"spacegroup": 216
},
{
"id": "jvasp-14970",
"created_at": "2022-09-04T14:35:49.016503Z",
"updated_at": "2022-09-04T14:35:49.016518Z",
"structure_string": "Si2 Mo1\n1.0\n3.031530 0.000000 -1.142981\n-0.430939 3.000744 -1.142981\n-0.007486 -0.008638 4.571900\nSi Mo\n2 1\ndirect\n0.664192 0.664192 0.328385 Si\n0.335806 0.335806 0.671614 Si\n0.000000 0.000000 0.000000 Mo\n",
"nsites": 3,
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"elements": [
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"volume": 41.53000711927911,
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"formula_full": "Si2 Mo1",
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{
"id": "jvasp-92307",
"created_at": "2022-09-04T14:35:49.017655Z",
"updated_at": "2022-09-04T14:35:49.017678Z",
"structure_string": "Ga2 Cu4\n1.0\n-4.227599 -0.000000 0.000000\n-2.113800 -2.586982 3.664974\n-2.113800 2.586982 3.664974\nGa Cu\n2 4\ndirect\n0.499964 0.750036 0.250036 Ga\n0.500037 0.249963 0.749963 Ga\n0.166572 0.333432 0.333423 Cu\n0.833429 0.666567 0.666576 Cu\n0.833429 0.166577 0.166567 Cu\n0.166573 0.833422 0.833431 Cu\n",
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"elements": [
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{
"id": "jvasp-92295",
"created_at": "2022-09-04T14:35:49.017683Z",
"updated_at": "2022-09-04T14:35:49.017709Z",
"structure_string": "Y1 Si2 Pd2\n1.0\n4.169641 -0.000000 -0.000000\n-0.000000 4.169641 -0.000000\n-2.084820 -2.084820 4.982960\nY Si Pd\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Y\n0.617121 0.617121 0.234243 Si\n0.382879 0.382879 0.765757 Si\n0.250000 0.750000 0.500000 Pd\n0.750000 0.250000 0.500000 Pd\n",
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"formula_full": "Y1 Si2 Pd2",
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{
"id": "jvasp-67738",
"created_at": "2022-09-04T14:35:49.022455Z",
"updated_at": "2022-09-04T14:35:49.022482Z",
"structure_string": "Sr1 Be1 Pd1\n1.0\n-1.652314 1.652314 5.391135\n1.652314 -1.652314 5.391135\n1.652314 1.652314 -5.391135\nSr Be Pd\n1 1 1\ndirect\n0.667248 0.667248 0.000000 Sr\n0.944593 0.944593 0.000000 Be\n0.388161 0.388161 0.000000 Pd\n",
"nsites": 3,
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"formula_full": "Sr1 Be1 Pd1",
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"spacegroup": 107
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{
"id": "jvasp-86727",
"created_at": "2022-09-04T14:35:49.026336Z",
"updated_at": "2022-09-04T14:35:49.026362Z",
"structure_string": "Sm1 Si2 Rh3\n1.0\n5.568349 -0.000000 0.000000\n-2.784175 4.822332 -0.000000\n0.000000 0.000000 3.679124\nSm Si Rh\n1 2 3\ndirect\n0.000000 0.000000 0.000000 Sm\n0.666667 0.333333 0.000000 Si\n0.333333 0.666667 0.000000 Si\n0.500000 0.500000 0.499999 Rh\n0.500000 0.000000 0.499999 Rh\n0.000000 0.500000 0.499999 Rh\n",
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"volume": 98.79341073056304,
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"formula_full": "Sm1 Si2 Rh3",
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"spacegroup": 191
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{
"id": "jvasp-73833",
"created_at": "2022-09-04T14:35:49.026440Z",
"updated_at": "2022-09-04T14:35:49.026474Z",
"structure_string": "Be2 Co1 Pt1\n1.0\n2.758139 0.000000 0.000000\n0.000000 2.758139 0.000000\n0.000000 0.000000 5.447072\nBe Co Pt\n2 1 1\ndirect\n0.000000 0.000000 0.029743 Be\n0.500000 0.500000 0.246123 Be\n0.000000 0.000000 0.439674 Co\n0.500000 0.500000 0.784459 Pt\n",
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{
"id": "jvasp-71709",
"created_at": "2022-09-04T14:35:49.033528Z",
"updated_at": "2022-09-04T14:35:49.033547Z",
"structure_string": "Be1 Ru1 Rh2\n1.0\n-1.840108 1.840108 3.808548\n1.840108 -1.840108 3.808548\n1.840108 1.840108 -3.808548\nBe Ru Rh\n1 1 2\ndirect\n0.750001 0.250000 0.500001 Be\n0.500000 0.500000 0.000000 Ru\n0.000000 0.000000 0.000000 Rh\n0.250000 0.750001 0.500001 Rh\n",
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{
"id": "jvasp-98702",
"created_at": "2022-09-04T14:35:49.037973Z",
"updated_at": "2022-09-04T14:35:49.037998Z",
"structure_string": "Ce4 Si4 Ir4\n1.0\n6.330838 0.000000 -0.000000\n-0.000000 6.330838 -0.000000\n0.000000 -0.000000 6.330838\nCe Si Ir\n4 4 4\ndirect\n0.123322 0.876678 0.376678 Ce\n0.876678 0.376678 0.123322 Ce\n0.623323 0.623323 0.623323 Ce\n0.376678 0.123322 0.876678 Ce\n0.084449 0.415551 0.584449 Si\n0.584449 0.084449 0.415551 Si\n0.415551 0.584449 0.084449 Si\n0.915551 0.915551 0.915551 Si\n0.687818 0.812182 0.187818 Ir\n0.187818 0.687818 0.812182 Ir\n0.312182 0.312182 0.312182 Ir\n0.812182 0.187818 0.687818 Ir\n",
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"formula_full": "Ce4 Si4 Ir4",
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