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{
"id": "jvasp-69774",
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"structure_string": "Ti1 Be1 Hg1\n1.0\n0.000000 3.048937 3.048937\n3.048937 0.000000 3.048937\n3.048937 3.048937 -0.000000\nTi Be Hg\n1 1 1\ndirect\n0.750001 0.750001 0.750001 Ti\n0.000000 0.000000 0.000000 Be\n0.500001 0.500001 0.500001 Hg\n",
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{
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{
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"structure_string": "Ti1 Re2 As1\n1.0\n-0.000000 3.142119 3.142119\n3.142119 0.000000 3.142119\n3.142119 3.142119 0.000000\nTi Re As\n1 2 1\ndirect\n0.250000 0.250000 0.250000 Ti\n0.000000 0.000000 0.000000 Re\n0.750000 0.750000 0.750000 Re\n0.500000 0.500000 0.500000 As\n",
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{
"id": "jvasp-64726",
"created_at": "2022-09-04T14:35:54.214745Z",
"updated_at": "2022-09-04T14:35:54.214770Z",
"structure_string": "Ba4 Mg1 Zr1\n1.0\n-0.000000 5.051452 5.051452\n5.051452 0.000000 5.051452\n5.051452 5.051452 -0.000000\nBa Mg Zr\n4 1 1\ndirect\n0.123922 0.625359 0.625359 Ba\n0.625359 0.625359 0.625359 Ba\n0.625359 0.123922 0.625359 Ba\n0.625359 0.625359 0.123922 Ba\n0.250000 0.250000 0.250000 Mg\n0.000000 0.000000 0.000000 Zr\n",
"nsites": 6,
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],
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"density_atomic": 0.0232740821533407,
"volume": 257.79749166773377,
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"formula_full": "Ba4 Mg1 Zr1",
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"formula_anonymous": "ABC4",
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{
"id": "jvasp-66040",
"created_at": "2022-09-04T14:35:54.230788Z",
"updated_at": "2022-09-04T14:35:54.230812Z",
"structure_string": "Ba1 Li1 Br1\n1.0\n0.000000 4.009272 4.009272\n4.009272 0.000000 4.009272\n4.009272 4.009272 -0.000000\nBa Li Br\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Br\n",
"nsites": 3,
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"volume": 128.8921768738434,
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"spacegroup": 216
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{
"id": "jvasp-74485",
"created_at": "2022-09-04T14:35:54.339595Z",
"updated_at": "2022-09-04T14:35:54.339605Z",
"structure_string": "Sr1 Be2 Zn1\n1.0\n-2.341518 2.341518 3.311727\n2.341518 -2.341518 3.311727\n2.341518 2.341518 -3.311727\nSr Be Zn\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Sr\n0.000000 0.000000 0.000000 Be\n0.250000 0.750001 0.500000 Be\n0.750001 0.250000 0.500000 Zn\n",
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{
"id": "jvasp-65067",
"created_at": "2022-09-04T14:35:55.333394Z",
"updated_at": "2022-09-04T14:35:55.333425Z",
"structure_string": "Be1 Tc1 Bi4\n1.0\n-0.000000 4.522577 4.522577\n4.522577 -0.000000 4.522577\n4.522577 4.522577 0.000000\nBe Tc Bi\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Tc\n0.123989 0.625338 0.625338 Bi\n0.625338 0.625338 0.625338 Bi\n0.625338 0.123989 0.625338 Bi\n0.625338 0.625338 0.123989 Bi\n",
"nsites": 6,
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{
"id": "jvasp-67704",
"created_at": "2022-09-04T14:35:54.427086Z",
"updated_at": "2022-09-04T14:35:54.427114Z",
"structure_string": "Sc1 Be1 Ga4\n1.0\n0.000000 3.735406 3.735406\n3.735406 0.000000 3.735406\n3.735406 3.735406 0.000000\nSc Be Ga\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Sc\n0.000000 0.000000 0.000000 Be\n0.123710 0.625430 0.625430 Ga\n0.625430 0.625430 0.625430 Ga\n0.625430 0.123710 0.625430 Ga\n0.625430 0.625430 0.123710 Ga\n",
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{
"id": "jvasp-65061",
"created_at": "2022-09-04T14:35:54.486024Z",
"updated_at": "2022-09-04T14:35:54.486040Z",
"structure_string": "Zr1 Be1 Te4\n1.0\n0.000000 4.433332 4.433332\n4.433332 0.000000 4.433332\n4.433332 4.433332 -0.000000\nZr Be Te\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Zr\n0.000000 0.000000 0.000000 Be\n0.125605 0.624798 0.624798 Te\n0.624798 0.624798 0.624798 Te\n0.624798 0.125605 0.624798 Te\n0.624798 0.624798 0.125605 Te\n",
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{
"id": "jvasp-64912",
"created_at": "2022-09-04T14:35:54.456882Z",
"updated_at": "2022-09-04T14:35:54.456904Z",
"structure_string": "Ta1 Be1 Br4\n1.0\n-0.000000 4.250390 4.250390\n4.250390 -0.000000 4.250390\n4.250390 4.250390 0.000000\nTa Be Br\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Ta\n0.000000 0.000000 0.000000 Be\n0.624059 0.127824 0.624059 Br\n0.127824 0.624059 0.624059 Br\n0.624059 0.624059 0.624059 Br\n0.624059 0.624059 0.127824 Br\n",
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{
"id": "jvasp-63959",
"created_at": "2022-09-04T14:35:54.480647Z",
"updated_at": "2022-09-04T14:35:54.480666Z",
"structure_string": "Ba4 Ga1 Ge1\n1.0\n0.000000 4.938316 4.938316\n4.938316 -0.000000 4.938316\n4.938316 4.938316 -0.000000\nBa Ga Ge\n4 1 1\ndirect\n0.123103 0.625633 0.625633 Ba\n0.625633 0.625633 0.625633 Ba\n0.625633 0.123103 0.625633 Ba\n0.625633 0.625633 0.123103 Ba\n0.250000 0.250000 0.250000 Ga\n0.000000 0.000000 0.000000 Ge\n",
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{
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"created_at": "2022-09-04T14:35:54.514177Z",
"updated_at": "2022-09-04T14:35:54.514197Z",
"structure_string": "Ba4 Ga1 P1\n1.0\n0.000000 4.871201 4.871201\n4.871201 0.000000 4.871201\n4.871201 4.871201 0.000000\nBa Ga P\n4 1 1\ndirect\n0.121613 0.626129 0.626129 Ba\n0.626129 0.626129 0.626129 Ba\n0.626129 0.121613 0.626129 Ba\n0.626129 0.626129 0.121613 Ba\n0.250000 0.250000 0.250000 Ga\n0.000000 0.000000 0.000000 P\n",
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