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{
"id": "jvasp-102425",
"created_at": "2022-09-04T14:36:49.689018Z",
"updated_at": "2022-09-04T14:36:49.689043Z",
"structure_string": "Rb3 Pr1 Cl6\n1.0\n7.065990 -0.000000 4.079551\n2.355330 6.661879 4.079551\n-0.000000 -0.000000 8.159102\nRb Pr Cl\n3 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Pr\n0.763093 0.236907 0.236906 Cl\n0.236906 0.236906 0.763092 Cl\n0.236906 0.763093 0.763092 Cl\n0.236906 0.763094 0.236906 Cl\n0.763093 0.236907 0.763093 Cl\n0.763094 0.763094 0.236906 Cl\n",
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{
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"structure_string": "Na2 Ga1 Hg1 Br6\n1.0\n6.664411 -0.000000 3.847699\n2.221470 6.283267 3.847699\n-0.000000 -0.000000 7.695399\nNa Ga Hg Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 0.500000 Hg\n0.761100 0.238900 0.238900 Br\n0.238900 0.238900 0.761100 Br\n0.238900 0.761101 0.761100 Br\n0.238900 0.761101 0.238900 Br\n0.761100 0.238900 0.761100 Br\n0.761100 0.761101 0.238900 Br\n",
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{
"id": "jvasp-100691",
"created_at": "2022-09-04T14:36:53.148586Z",
"updated_at": "2022-09-04T14:36:53.148596Z",
"structure_string": "Rb2 In1 Au1 Cl6\n1.0\n6.387567 -0.000000 3.687863\n2.129189 6.022256 3.687863\n-0.000000 -0.000000 7.375727\nRb In Au Cl\n2 1 1 6\ndirect\n0.750000 0.750001 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 In\n0.500000 0.500000 0.499999 Au\n0.754508 0.245493 0.245492 Cl\n0.245493 0.245493 0.754508 Cl\n0.245493 0.754508 0.754507 Cl\n0.245493 0.754508 0.245492 Cl\n0.754508 0.245493 0.754507 Cl\n0.754508 0.754508 0.245491 Cl\n",
"nsites": 10,
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"formula_full": "Rb2 In1 Au1 Cl6",
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{
"id": "jvasp-107263",
"created_at": "2022-09-04T14:37:00.844324Z",
"updated_at": "2022-09-04T14:37:00.844346Z",
"structure_string": "Ba1 Mg2 In2\n1.0\n4.569038 -0.022807 -5.492423\n-0.614700 4.527557 -5.492423\n0.020020 0.022807 7.144398\nBa Mg In\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.750000 0.250000 0.500001 Mg\n0.250000 0.750001 0.500001 Mg\n0.383829 0.383829 0.000000 In\n0.616172 0.616171 0.000001 In\n",
"nsites": 5,
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"elements": [
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],
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"density": 4.636271885160799,
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"volume": 148.84269486715576,
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{
"id": "jvasp-101490",
"created_at": "2022-09-04T14:36:53.013447Z",
"updated_at": "2022-09-04T14:36:53.013455Z",
"structure_string": "K2 Sc1 In1 Br6\n1.0\n6.983797 -0.000000 4.032097\n2.327932 6.584387 4.032097\n-0.000000 -0.000000 8.064194\nK Sc In Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Sc\n0.500000 0.500000 0.500000 In\n0.768312 0.231688 0.231688 Br\n0.231688 0.231688 0.768311 Br\n0.231688 0.768312 0.768312 Br\n0.231688 0.768312 0.231688 Br\n0.768312 0.231688 0.768312 Br\n0.768312 0.768312 0.231689 Br\n",
"nsites": 10,
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"elements": [
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{
"id": "jvasp-103558",
"created_at": "2022-09-04T14:37:05.809235Z",
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"structure_string": "Na2 In1 Ag1 Cl6\n1.0\n6.321255 -0.000000 3.649579\n2.107085 5.959737 3.649579\n-0.000000 -0.000000 7.299157\nNa In Ag Cl\n2 1 1 6\ndirect\n0.750001 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 In\n0.500001 0.500000 0.500000 Ag\n0.755268 0.244733 0.244733 Cl\n0.244733 0.244733 0.755267 Cl\n0.244734 0.755267 0.755267 Cl\n0.244734 0.755267 0.244733 Cl\n0.755268 0.244733 0.755267 Cl\n0.755268 0.755267 0.244733 Cl\n",
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{
"id": "jvasp-102744",
"created_at": "2022-09-04T14:36:41.268766Z",
"updated_at": "2022-09-04T14:36:41.268791Z",
"structure_string": "Hg2 I1 Br3\n1.0\n4.219624 0.237045 0.051357\n1.593461 3.914371 0.051357\n-0.104633 -0.074724 12.719716\nHg I Br\n2 1 3\ndirect\n0.840590 0.840592 0.444195 Hg\n0.158045 0.158046 0.927782 Hg\n0.569559 0.569561 0.296505 I\n0.431175 0.431177 0.799576 Br\n0.110579 0.110579 0.575526 Br\n0.890048 0.890050 0.059459 Br\n",
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"formula_full": "Hg2 I1 Br3",
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"formula_anonymous": "AB2C3",
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"spacegroup": 8
},
{
"id": "jvasp-102799",
"created_at": "2022-09-04T14:36:41.268126Z",
"updated_at": "2022-09-04T14:36:41.268152Z",
"structure_string": "Ca2 Ga7 Ag1\n1.0\n4.305574 0.000000 0.000000\n0.000000 4.305574 0.000000\n-0.000000 0.000000 10.993190\nCa Ga Ag\n2 7 1\ndirect\n0.500000 -0.000000 0.752539 Ca\n-0.000000 0.500000 0.247461 Ca\n-0.000000 0.500000 0.862311 Ga\n0.500000 -0.000000 0.362615 Ga\n0.500000 -0.000000 0.137689 Ga\n-0.000000 0.500000 0.637385 Ga\n0.000000 0.000000 0.500000 Ga\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 0.500000 Ga\n0.500000 0.500000 -0.000000 Ag\n",
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{
"id": "jvasp-2349",
"created_at": "2022-09-04T14:36:41.251967Z",
"updated_at": "2022-09-04T14:36:41.251987Z",
"structure_string": "K2 Li2 Te2\n1.0\n4.800773 0.000000 0.000000\n0.000000 4.800773 0.000000\n0.000000 0.000000 7.675412\nK Li Te\n2 2 2\ndirect\n0.500000 0.000000 0.662780 K\n0.000000 0.500000 0.337220 K\n0.500000 0.500000 0.000000 Li\n0.000000 0.000000 0.000000 Li\n0.500000 0.000000 0.200080 Te\n0.000000 0.500000 0.799920 Te\n",
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{
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"created_at": "2022-09-04T14:36:51.977787Z",
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"structure_string": "Mg1 Pd1 F6\n1.0\n4.420844 0.027285 3.069558\n1.620109 4.113375 3.069558\n0.039808 0.027286 5.381865\nMg Pd F\n1 1 6\ndirect\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Pd\n0.392889 0.096589 0.757547 F\n0.096589 0.757549 0.392888 F\n0.242452 0.607113 0.903410 F\n0.903411 0.242452 0.607111 F\n0.607111 0.903412 0.242452 F\n0.757547 0.392888 0.096590 F\n",
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{
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"created_at": "2022-09-04T14:36:41.220799Z",
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"structure_string": "Zn1 Pb3\n1.0\n4.723963 -0.000000 2.727381\n1.574654 4.453795 2.727381\n-0.000000 -0.000000 5.454762\nZn Pb\n1 3\ndirect\n0.000000 0.000000 0.000000 Zn\n0.250000 0.250000 0.250000 Pb\n0.749999 0.749999 0.750000 Pb\n0.499999 0.499999 0.500000 Pb\n",
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{
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"structure_string": "Na2 Al1 Hg1 Br6\n1.0\n6.654774 -0.000000 3.842136\n2.218258 6.274181 3.842136\n-0.000000 -0.000000 7.684271\nNa Al Hg Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750001 Na\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500001 Hg\n0.767789 0.232211 0.232212 Br\n0.232211 0.232211 0.767789 Br\n0.232211 0.767789 0.767789 Br\n0.232211 0.767789 0.232212 Br\n0.767789 0.232211 0.767790 Br\n0.767789 0.767789 0.232212 Br\n",
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