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{
"id": "jvasp-4267",
"created_at": "2022-09-04T14:36:58.462359Z",
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"structure_string": "Sm2 Te6\n1.0\n4.316910 0.000000 -0.728614\n0.000000 4.379216 0.000000\n0.017507 0.000000 13.256490\nSm Te\n2 6\ndirect\n0.830314 0.250000 0.660629 Sm\n0.169687 0.750001 0.339372 Sm\n0.705653 0.250000 0.411306 Te\n0.294348 0.750001 0.588695 Te\n0.072487 0.250000 0.144976 Te\n0.927513 0.750001 0.855025 Te\n0.572579 0.750001 0.145157 Te\n0.427422 0.250000 0.854843 Te\n",
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{
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"structure_string": "Ti2 In1 Co1\n1.0\n3.164022 3.164022 0.000000\n3.164022 0.000000 -3.164022\n0.000000 3.164022 -3.164022\nTi In Co\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.750000 0.750000 0.750000 Ti\n0.250000 0.250000 0.250000 In\n0.500000 0.500000 0.500000 Co\n",
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{
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{
"id": "jvasp-15465",
"created_at": "2022-09-04T14:36:39.530675Z",
"updated_at": "2022-09-04T14:36:39.530701Z",
"structure_string": "Ce2 Te1 O2\n1.0\n3.866263 0.000000 -1.162485\n-0.349529 3.850431 -1.162485\n-0.016310 -0.017858 6.956322\nCe Te O\n2 1 2\ndirect\n0.654997 0.654997 0.309995 Ce\n0.345003 0.345003 0.690006 Ce\n0.000000 0.000000 0.000000 Te\n0.250000 0.750000 0.500000 O\n0.749999 0.250000 0.500000 O\n",
"nsites": 5,
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"density": 7.063631565033577,
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"volume": 103.3967045661532,
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"formula_full": "Ce2 Te1 O2",
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"formula_anonymous": "AB2C2",
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{
"id": "jvasp-119674",
"created_at": "2022-09-04T14:38:50.312895Z",
"updated_at": "2022-09-04T14:38:50.312922Z",
"structure_string": "Sr8 Ir4 N12\n1.0\n6.277851 -0.006036 -0.265573\n-10.168749 4.932735 -0.000000\n-0.009123 -0.018806 12.460999\nSr Ir N\n8 4 12\ndirect\n0.440080 0.020176 0.855744 Sr\n0.559916 0.580094 0.644256 Sr\n0.559916 0.979821 0.144256 Sr\n0.440080 0.419903 0.355744 Sr\n0.533123 0.874790 0.575517 Sr\n0.466872 0.341665 0.924483 Sr\n0.466873 0.125207 0.424483 Sr\n0.533124 0.658333 0.075517 Sr\n0.408866 0.709669 0.332172 Ir\n0.591130 0.300802 0.167829 Ir\n0.591130 0.290328 0.667829 Ir\n0.408866 0.699196 0.832172 Ir\n-0.000001 0.000514 0.750000 N\n-0.000002 0.619506 0.750000 N\n-0.000001 0.380493 0.250000 N\n0.585485 0.123484 0.632909 N\n0.414512 0.537997 0.867091 N\n0.414511 0.876513 0.367091 N\n0.585485 0.462000 0.132909 N\n0.506212 0.158022 0.041940 N\n0.493785 0.651808 0.458060 N\n0.493784 0.841976 0.958060 N\n0.506211 0.348190 0.541940 N\n-0.000002 0.999484 0.250000 N\n",
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],
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{
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"created_at": "2022-09-04T14:36:04.915408Z",
"updated_at": "2022-09-04T14:36:04.915431Z",
"structure_string": "Ta2 Pb2 F14\n1.0\n4.908956 -0.002774 0.000000\n-0.469895 6.795164 0.000000\n0.000000 0.000000 7.345875\nTa Pb F\n2 2 14\ndirect\n0.463623 0.785708 0.750000 Ta\n0.536379 0.214292 0.250000 Ta\n0.980435 0.683056 0.250000 Pb\n0.019567 0.316944 0.750000 Pb\n0.679637 0.794370 0.530240 F\n0.802059 0.358823 0.075344 F\n0.845437 0.050965 0.250000 F\n0.802059 0.358823 0.424656 F\n0.197943 0.641178 0.924657 F\n0.632439 0.060148 0.750000 F\n0.594083 0.512145 0.750000 F\n0.154565 0.949035 0.750000 F\n0.197943 0.641178 0.575344 F\n0.679637 0.794370 0.969761 F\n0.320365 0.205630 0.469761 F\n0.367562 0.939852 0.250000 F\n0.405918 0.487855 0.250000 F\n0.320365 0.205630 0.030240 F\n",
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"density": 7.063421266640832,
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"volume": 245.02796044779666,
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"formula_full": "Ta2 Pb2 F14",
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"spacegroup": 11
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{
"id": "jvasp-93574",
"created_at": "2022-09-04T14:36:22.452857Z",
"updated_at": "2022-09-04T14:36:22.452885Z",
"structure_string": "Tb1 Ge5\n1.0\n3.989546 0.000000 -0.000000\n-0.000000 6.145826 -0.000000\n-1.994773 -3.072913 5.006441\nTb Ge\n1 5\ndirect\n0.000000 0.000000 0.000000 Tb\n0.667356 0.456511 0.334709 Ge\n0.332646 0.543490 0.665291 Ge\n0.332646 0.121803 0.665291 Ge\n0.667356 0.878198 0.334709 Ge\n0.000000 0.500000 0.000000 Ge\n",
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"volume": 122.75320491168088,
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"formula_full": "Tb1 Ge5",
"formula_reduced": "TbGe5",
"formula_anonymous": "AB5",
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"spacegroup": 71
},
{
"id": "jvasp-110604",
"created_at": "2022-09-04T14:38:38.655401Z",
"updated_at": "2022-09-04T14:38:38.655428Z",
"structure_string": "Cd1 Sb1\n1.0\n3.086100 0.000000 0.000000\n0.000000 3.255881 0.000000\n0.000000 0.000000 5.479362\nCd Sb\n1 1\ndirect\n0.000000 0.000000 0.000000 Cd\n0.000000 0.500000 0.500000 Sb\n",
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{
"id": "jvasp-78874",
"created_at": "2022-09-04T14:37:12.224979Z",
"updated_at": "2022-09-04T14:37:12.225002Z",
"structure_string": "Ga1 Ag1 O2\n1.0\n-2.920973 0.000000 0.766303\n-1.561004 2.585066 -0.000000\n-3.059114 -0.083416 -5.710451\nGa Ag O\n1 1 2\ndirect\n0.499998 0.500000 0.500000 Ga\n0.000000 0.000000 0.000000 Ag\n0.887519 0.887523 0.337435 O\n0.112478 0.112477 0.662565 O\n",
"nsites": 4,
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"spacegroup": 166
},
{
"id": "jvasp-89391",
"created_at": "2022-09-04T14:36:03.871328Z",
"updated_at": "2022-09-04T14:36:03.871356Z",
"structure_string": "La4 Ga4 O12\n1.0\n5.520754 -0.000000 0.000000\n0.000000 5.589182 0.000000\n0.000000 0.000000 7.821904\nLa Ga O\n4 4 12\ndirect\n0.999782 0.992601 0.750000 La\n0.500217 0.492601 0.250000 La\n0.000217 0.007398 0.250000 La\n0.499782 0.507398 0.750000 La\n0.000000 0.500000 0.500000 Ga\n0.500000 0.000000 0.500000 Ga\n0.500000 0.000000 0.000000 Ga\n0.000000 0.500000 0.000000 Ga\n0.749500 0.749494 0.543256 O\n0.750499 0.249494 0.456744 O\n0.499744 0.921380 0.250000 O\n0.999743 0.578620 0.250000 O\n0.500256 0.078620 0.750000 O\n0.249501 0.750505 0.543256 O\n0.750499 0.249494 0.043256 O\n0.749500 0.749494 0.956744 O\n0.250499 0.250506 0.456744 O\n0.249501 0.750505 0.956744 O\n0.250499 0.250506 0.043256 O\n0.000256 0.421380 0.750000 O\n",
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{
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"created_at": "2022-09-04T14:36:03.091220Z",
"updated_at": "2022-09-04T14:36:03.091240Z",
"structure_string": "Mn1 Al1 Fe2\n1.0\n3.470921 -0.000000 2.003937\n1.156974 3.272415 2.003937\n-0.000000 -0.000000 4.007874\nMn Al Fe\n1 1 2\ndirect\n0.499999 0.500001 0.500000 Mn\n0.000000 0.000000 0.000000 Al\n0.250000 0.250000 0.250000 Fe\n0.749999 0.750001 0.750000 Fe\n",
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{
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"created_at": "2022-09-04T14:38:52.511203Z",
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"structure_string": "H1 Pb1 O2\n1.0\n3.651409 0.000000 -0.000000\n0.000000 3.651409 0.000000\n-0.000000 0.000000 4.236248\nH Pb O\n1 1 2\ndirect\n0.500001 0.500001 0.671613 H\n0.000000 0.000000 0.968066 Pb\n0.000000 0.000000 0.465293 O\n0.500001 0.500001 0.905030 O\n",
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}