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{
"id": "jvasp-109923",
"created_at": "2022-09-04T14:38:19.501985Z",
"updated_at": "2022-09-04T14:38:19.501994Z",
"structure_string": "Ba2 Mg1 In1\n1.0\n5.235917 -0.000000 3.022958\n1.745306 4.936470 3.022958\n-0.000000 -0.000000 6.045917\nBa Mg In\n2 1 1\ndirect\n0.750001 0.750000 0.750000 Ba\n0.250000 0.250000 0.250000 Ba\n0.000000 0.000000 0.000000 Mg\n0.500001 0.500000 0.500000 In\n",
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{
"id": "jvasp-33806",
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"updated_at": "2022-09-04T14:38:05.665481Z",
"structure_string": "Pm2 Br6\n1.0\n9.554416 0.000000 -0.000000\n-4.777209 8.274367 -0.000000\n0.000000 0.000000 3.878971\nPm Br\n2 6\ndirect\n0.666666 0.333334 0.249999 Pm\n0.333334 0.666668 0.750000 Pm\n0.796412 0.203591 0.750000 Br\n0.407178 0.203591 0.750000 Br\n0.796411 0.592823 0.750000 Br\n0.203589 0.796411 0.249999 Br\n0.592822 0.796411 0.249999 Br\n0.203590 0.407180 0.249999 Br\n",
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{
"id": "jvasp-109443",
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"structure_string": "Na2 Ag1 Au1 F6\n1.0\n5.348128 -0.000000 3.087743\n1.782709 5.042264 3.087743\n-0.000000 -0.000000 6.175487\nNa Ag Au F\n2 1 1 6\ndirect\n0.750000 0.749999 0.750000 Na\n0.250000 0.250000 0.250000 Na\n0.500000 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 Au\n0.750320 0.249680 0.249680 F\n0.249681 0.249680 0.750320 F\n0.249681 0.750319 0.750319 F\n0.249681 0.750319 0.249680 F\n0.750320 0.249680 0.750319 F\n0.750320 0.750319 0.249680 F\n",
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"density": 4.634693812653112,
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"volume": 166.53234028495385,
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"formula_full": "Na2 Ag1 Au1 F6",
"formula_reduced": "Na2AgAuF6",
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{
"id": "jvasp-110106",
"created_at": "2022-09-04T14:38:19.868047Z",
"updated_at": "2022-09-04T14:38:19.868064Z",
"structure_string": "Yb1 Ga2 Cu3\n1.0\n5.211395 0.000000 0.000000\n-2.605698 4.513200 0.000000\n-0.000000 -0.000000 4.034876\nYb Ga Cu\n1 2 3\ndirect\n0.000000 0.000000 0.000000 Yb\n0.333333 0.666667 -0.000000 Ga\n0.666666 0.333333 -0.000000 Ga\n0.500000 -0.000000 0.500000 Cu\n-0.000000 0.500000 0.500000 Cu\n0.499999 0.500000 0.500000 Cu\n",
"nsites": 6,
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"elements": [
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"formula_full": "Yb1 Ga2 Cu3",
"formula_reduced": "YbGa2Cu3",
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"spacegroup": 191
},
{
"id": "jvasp-41122",
"created_at": "2022-09-04T14:38:05.586655Z",
"updated_at": "2022-09-04T14:38:05.586685Z",
"structure_string": "Li1 Tb1 Hg2\n1.0\n0.000000 3.540286 3.540286\n3.540286 0.000000 3.540286\n3.540286 3.540286 0.000000\nTb Li Hg\n1 1 2\ndirect\n0.750001 0.750001 0.750001 Tb\n0.249999 0.249999 0.249999 Li\n0.000000 0.000000 0.000000 Hg\n0.500001 0.500001 0.500001 Hg\n",
"nsites": 4,
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"elements": [
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"density": 10.610176735131251,
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"volume": 88.74523396299384,
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},
{
"id": "jvasp-17586",
"created_at": "2022-09-04T14:38:30.516988Z",
"updated_at": "2022-09-04T14:38:30.517015Z",
"structure_string": "Ca2 Pb2\n1.0\n4.563205 0.000000 0.000000\n0.000000 5.065384 0.000000\n0.000000 0.000000 5.065384\nCa Pb\n2 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.000000 0.500000 0.500000 Ca\n0.500001 0.000000 0.500000 Pb\n0.500001 0.500000 0.000000 Pb\n",
"nsites": 4,
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"elements": [
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"volume": 117.08323896639054,
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"spacegroup": 123
},
{
"id": "jvasp-36952",
"created_at": "2022-09-04T14:38:30.519149Z",
"updated_at": "2022-09-04T14:38:30.519175Z",
"structure_string": "K2 Ag2 Br6\n1.0\n6.490062 -0.059417 3.537791\n2.073834 6.150093 3.537791\n-0.083544 -0.059417 7.391204\nK Ag Br\n2 2 6\ndirect\n0.255551 0.255550 0.255551 K\n0.755551 0.755550 0.755551 K\n0.005749 0.005749 0.005749 Ag\n0.505749 0.505748 0.505748 Ag\n0.255712 0.819125 0.692363 Br\n0.819125 0.692363 0.255712 Br\n0.692364 0.255711 0.819125 Br\n0.192364 0.319125 0.755711 Br\n0.755712 0.192363 0.319126 Br\n0.319125 0.755711 0.192364 Br\n",
"nsites": 10,
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"Ag",
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"density": 4.29939922610736,
"density_atomic": 0.03347947627292592,
"volume": 298.6904549664885,
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"formula_full": "K2 Ag2 Br6",
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"formula_anonymous": "ABC3",
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"spacegroup": 167
},
{
"id": "jvasp-109544",
"created_at": "2022-09-04T14:38:19.525024Z",
"updated_at": "2022-09-04T14:38:19.525044Z",
"structure_string": "In3 Pb1\n1.0\n4.737832 -0.000000 2.735389\n1.579277 4.466871 2.735389\n-0.000000 -0.000000 5.470777\nIn Pb\n3 1\ndirect\n0.250000 0.250000 0.250000 In\n0.750000 0.750000 0.750001 In\n0.500000 0.500000 0.500001 In\n0.000000 0.000000 0.000000 Pb\n",
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"density": 7.911954647785252,
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"volume": 115.77960934123642,
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"formula_anonymous": "AB3",
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"spacegroup": 225
},
{
"id": "jvasp-56739",
"created_at": "2022-09-04T14:38:30.539553Z",
"updated_at": "2022-09-04T14:38:30.539581Z",
"structure_string": "Sr2 In8\n1.0\n5.216751 0.013259 -0.001557\n2.591761 6.085490 0.031555\n2.605372 1.855730 9.153613\nSr In\n2 8\ndirect\n0.835953 0.619674 0.708348 Sr\n0.164046 0.380326 0.291652 Sr\n0.155823 0.039197 0.649163 In\n0.565878 0.768180 0.101030 In\n0.844176 0.960803 0.350837 In\n0.422873 0.731308 0.422822 In\n0.434121 0.231820 0.898970 In\n0.847072 0.252400 0.052709 In\n0.577126 0.268693 0.577178 In\n0.152928 0.747600 0.947291 In\n",
"nsites": 10,
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"elements": [
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"density_atomic": 0.03448355547626657,
"volume": 289.9932985994596,
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"formula_full": "Sr2 In8",
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"spacegroup": 12
},
{
"id": "jvasp-17967",
"created_at": "2022-09-04T14:38:14.099778Z",
"updated_at": "2022-09-04T14:38:14.099805Z",
"structure_string": "Sr2 Pb2\n1.0\n4.669600 -0.000000 0.000000\n0.000000 4.683063 -1.921472\n-0.000000 -0.016458 6.627468\nSr Pb\n2 2\ndirect\n0.250000 0.867064 0.734131 Sr\n0.750000 0.132935 0.265870 Sr\n0.250000 0.586034 0.172069 Pb\n0.750000 0.413965 0.827931 Pb\n",
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},
{
"id": "jvasp-109978",
"created_at": "2022-09-04T14:38:20.249678Z",
"updated_at": "2022-09-04T14:38:20.249719Z",
"structure_string": "Yb1 La1 Mg2\n1.0\n4.800999 -0.000000 2.771858\n1.600333 4.526425 2.771858\n-0.000000 -0.000000 5.543716\nYb La Mg\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.500000 0.499999 0.500001 La\n0.250000 0.250000 0.250001 Mg\n0.750000 0.749999 0.750002 Mg\n",
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},
{
"id": "jvasp-10217",
"created_at": "2022-09-04T14:38:12.679393Z",
"updated_at": "2022-09-04T14:38:12.679419Z",
"structure_string": "Rb6 Pd2 F10\n1.0\n7.417377 0.000000 -0.000000\n0.000000 7.417377 -0.000000\n-0.000000 -0.000000 6.449096\nRb Pd F\n6 2 10\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500000 0.500000 0.000000 Rb\n0.328360 0.828361 0.500000 Rb\n0.828361 0.671640 0.500000 Rb\n0.171640 0.328360 0.500000 Rb\n0.671640 0.171640 0.500000 Rb\n0.500000 0.000000 0.000000 Pd\n0.000000 0.500000 0.000000 Pd\n0.864003 0.364003 0.212542 F\n0.364003 0.135997 0.212542 F\n0.635997 0.864003 0.212542 F\n0.135997 0.635997 0.212542 F\n0.135997 0.635997 0.787458 F\n0.364003 0.135997 0.787458 F\n0.864003 0.364003 0.787458 F\n0.000000 0.000000 0.500000 F\n0.635997 0.864003 0.787458 F\n0.500000 0.500000 0.500000 F\n",
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