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{
"id": "jvasp-16290",
"created_at": "2022-09-04T14:37:56.353949Z",
"updated_at": "2022-09-04T14:37:56.353961Z",
"structure_string": "Sm1 Te1\n1.0\n3.830795 -0.000000 0.000000\n0.000000 3.830795 0.000000\n-0.000000 -0.000000 3.830795\nSm Te\n1 1\ndirect\n0.499999 0.499999 0.499999 Sm\n0.000000 0.000000 0.000000 Te\n",
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{
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"structure_string": "Ga1 C3\n1.0\n3.353735 0.000000 0.000000\n0.000000 3.353735 -0.000000\n0.000000 -0.000000 3.353735\nGa C\n1 3\ndirect\n0.000000 0.000000 0.000000 Ga\n0.000000 0.499999 0.499999 C\n0.499999 0.000000 0.499999 C\n0.499999 0.499999 0.000000 C\n",
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{
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"structure_string": "Na1 Pd2 Pb1\n1.0\n0.000000 3.345596 3.345596\n3.345596 -0.000000 3.345596\n3.345596 3.345596 0.000000\nNa Pd Pb\n1 2 1\ndirect\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 Pd\n0.500001 0.500001 0.500001 Pd\n0.750001 0.750001 0.750001 Pb\n",
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{
"id": "jvasp-37389",
"created_at": "2022-09-04T14:37:56.338164Z",
"updated_at": "2022-09-04T14:37:56.338191Z",
"structure_string": "Th3 Br1\n1.0\n-2.474045 2.474045 5.023424\n2.474045 -2.474045 5.023424\n2.474045 2.474045 -5.023424\nTh Br\n3 1\ndirect\n0.749998 0.250000 0.499998 Th\n0.250000 0.749998 0.499998 Th\n0.500000 0.500000 0.000000 Th\n0.000000 0.000000 0.000000 Br\n",
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"volume": 122.99147696153709,
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"formula_full": "Th3 Br1",
"formula_reduced": "Th3Br",
"formula_anonymous": "AB3",
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"spacegroup": 139
},
{
"id": "jvasp-12743",
"created_at": "2022-09-04T14:37:56.333961Z",
"updated_at": "2022-09-04T14:37:56.333988Z",
"structure_string": "Na4 Mn2 Cl8\n1.0\n3.826929 0.000000 0.000000\n0.000000 6.900938 0.000000\n0.000000 -0.000000 11.827540\nNa Mn Cl\n4 2 8\ndirect\n0.500000 0.086612 0.679885 Na\n0.500000 0.913388 0.320115 Na\n0.500000 0.413388 0.179885 Na\n0.500000 0.586613 0.820114 Na\n0.000000 0.500000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.500000 0.741023 0.544486 Cl\n0.500000 0.258977 0.455514 Cl\n0.000000 0.120727 0.197912 Cl\n0.000000 0.879274 0.802088 Cl\n0.000000 0.620727 0.302088 Cl\n0.000000 0.379273 0.697912 Cl\n0.500000 0.241023 0.955514 Cl\n0.500000 0.758977 0.044486 Cl\n",
"nsites": 14,
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{
"id": "jvasp-109284",
"created_at": "2022-09-04T14:37:56.328378Z",
"updated_at": "2022-09-04T14:37:56.328399Z",
"structure_string": "La1 Pm1 Zn2\n1.0\n4.528925 -0.000000 2.614776\n1.509642 4.269911 2.614776\n-0.000000 -0.000000 5.229552\nLa Pm Zn\n1 1 2\ndirect\n0.499999 0.500000 0.500001 La\n0.000000 0.000000 0.000000 Pm\n0.749999 0.750000 0.750002 Zn\n0.250000 0.250000 0.250001 Zn\n",
"nsites": 4,
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{
"id": "jvasp-40594",
"created_at": "2022-09-04T14:37:56.325315Z",
"updated_at": "2022-09-04T14:37:56.325336Z",
"structure_string": "Rb4 Ba4 Ta4 S16\n1.0\n7.042254 0.000000 0.000000\n0.000000 9.396972 0.000000\n0.000000 0.000000 12.512297\nRb Ba Ta S\n4 4 4 16\ndirect\n0.750000 0.636659 0.090488 Rb\n0.250000 0.863341 0.590489 Rb\n0.750000 0.136659 0.409512 Rb\n0.250000 0.363341 0.909512 Rb\n0.750000 0.978589 0.825485 Ba\n0.250000 0.521410 0.325485 Ba\n0.750000 0.478590 0.674515 Ba\n0.250000 0.021410 0.174515 Ba\n0.250000 0.268795 0.578803 Ta\n0.750000 0.231205 0.078803 Ta\n0.250000 0.768795 0.921197 Ta\n0.750000 0.731205 0.421197 Ta\n0.489700 0.318879 0.162179 S\n0.510300 0.181121 0.662179 S\n0.989699 0.181121 0.662179 S\n0.010300 0.318879 0.162179 S\n0.510300 0.681120 0.837821 S\n0.489700 0.818879 0.337821 S\n0.250000 0.011825 0.912711 S\n0.250000 0.693639 0.094638 S\n0.250000 0.511825 0.587290 S\n0.750000 0.988175 0.087290 S\n0.250000 0.193639 0.405362 S\n0.750000 0.306361 0.905362 S\n0.989699 0.681120 0.837821 S\n0.750000 0.806361 0.594638 S\n0.750000 0.488175 0.412711 S\n0.010300 0.818879 0.337821 S\n",
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"S"
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"volume": 828.0120602814641,
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"formula_full": "Rb4 Ba4 Ta4 S16",
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"formula_anonymous": "ABCD4",
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{
"id": "jvasp-78357",
"created_at": "2022-09-04T14:37:56.324889Z",
"updated_at": "2022-09-04T14:37:56.324910Z",
"structure_string": "Ga1 N1\n1.0\n-2.270275 -2.270275 0.000000\n-2.270275 -0.000000 -2.270275\n-0.000000 -2.270275 -2.270275\nGa N\n1 1\ndirect\n0.749998 0.749998 0.749998 Ga\n0.000000 0.000000 0.000000 N\n",
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{
"id": "jvasp-23794",
"created_at": "2022-09-04T14:37:56.321945Z",
"updated_at": "2022-09-04T14:37:56.321968Z",
"structure_string": "Hf4 Fe4 P4\n1.0\n3.738348 -0.000000 0.000000\n-0.000000 6.249881 0.000000\n0.000000 0.000000 7.035615\nHf Fe P\n4 4 4\ndirect\n0.250000 0.516778 0.685231 Hf\n0.750000 0.483221 0.314768 Hf\n0.250000 0.016779 0.814768 Hf\n0.750000 0.983221 0.185232 Hf\n0.750000 0.851805 0.562740 Fe\n0.250000 0.148195 0.437260 Fe\n0.750000 0.351805 0.937259 Fe\n0.250000 0.648195 0.062740 Fe\n0.250000 0.280020 0.114321 P\n0.750000 0.719980 0.885678 P\n0.250000 0.780020 0.385679 P\n0.750000 0.219980 0.614321 P\n",
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{
"id": "jvasp-35229",
"created_at": "2022-09-04T14:37:56.319536Z",
"updated_at": "2022-09-04T14:37:56.319565Z",
"structure_string": "Ce1 Fe4 As12\n1.0\n-4.176316 -4.176316 4.176316\n-4.176316 4.176316 -4.176316\n4.176316 -4.176316 -4.176316\nCe Fe As\n1 4 12\ndirect\n0.000000 0.000000 0.000000 Ce\n0.500000 0.500000 0.500000 Fe\n0.500000 0.000000 0.000000 Fe\n0.000000 0.500000 0.000000 Fe\n0.000000 0.000000 0.500000 Fe\n0.497196 0.155989 0.341206 As\n0.502805 0.844012 0.658795 As\n0.341206 0.185217 0.844012 As\n0.658795 0.814784 0.155989 As\n0.341206 0.497196 0.155989 As\n0.844012 0.341206 0.185217 As\n0.814784 0.155989 0.658795 As\n0.155989 0.658795 0.814784 As\n0.155989 0.341206 0.497196 As\n0.844012 0.658795 0.502805 As\n0.658795 0.502805 0.844012 As\n0.185217 0.844012 0.341206 As\n",
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{
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"created_at": "2022-09-04T14:37:56.318323Z",
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"structure_string": "Pb1 S1\n1.0\n-3.734257 0.000000 1.990140\n-2.397442 3.486774 0.000000\n-3.590441 0.098885 -2.238517\nPb S\n1 1\ndirect\n0.977916 0.977914 0.066255 Pb\n0.477684 0.477683 0.566947 S\n",
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{
"id": "jvasp-37617",
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"updated_at": "2022-09-04T14:37:56.315664Z",
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}