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{
"id": "jvasp-90782",
"created_at": "2022-09-04T14:36:00.965528Z",
"updated_at": "2022-09-04T14:36:00.965551Z",
"structure_string": "Sr2 Mg6\n1.0\n7.187371 0.000000 0.000000\n-3.593686 6.224446 0.000000\n0.000000 -0.000000 5.339219\nSr Mg\n2 6\ndirect\n0.333333 0.666667 0.250000 Sr\n0.666667 0.333333 0.750000 Sr\n0.301557 0.150778 0.250000 Mg\n0.849222 0.150778 0.250000 Mg\n0.849221 0.698443 0.250000 Mg\n0.698442 0.849222 0.750000 Mg\n0.150778 0.301558 0.750000 Mg\n0.150778 0.849222 0.750000 Mg\n",
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{
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"structure_string": "Sr2 Mg6\n1.0\n5.425181 0.000000 0.000000\n0.000000 5.425181 -0.000000\n0.000000 0.000000 7.667684\nSr Mg\n2 6\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Sr\n0.500000 0.500000 0.000000 Mg\n0.500000 0.000000 0.250000 Mg\n0.000000 0.500000 0.250000 Mg\n0.000000 0.000000 0.500000 Mg\n0.000000 0.500000 0.750000 Mg\n0.500000 0.000000 0.750000 Mg\n",
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{
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"structure_string": "S1 F4\n1.0\n4.582059 -0.158243 0.223788\n2.153987 4.047301 0.223788\n2.428072 1.401848 3.965024\nS F\n1 4\ndirect\n0.000000 0.000000 0.000000 S\n0.345223 0.877589 0.122412 F\n0.654777 0.122412 0.345223 F\n0.122412 0.654778 0.877588 F\n0.877588 0.345224 0.654777 F\n",
"nsites": 5,
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{
"id": "jvasp-120029",
"created_at": "2022-09-04T14:38:53.357120Z",
"updated_at": "2022-09-04T14:38:53.357151Z",
"structure_string": "Sr1 H1 Br3\n1.0\n4.512546 -0.041097 0.008450\n-0.405809 5.916494 0.138865\n-1.725729 -2.277773 5.914413\nSr H Br\n1 1 3\ndirect\n0.646481 0.209645 0.082689 Sr\n0.887643 0.803458 0.805642 H\n0.701319 0.686211 0.016345 Br\n0.283158 0.336630 0.400823 Br\n0.988131 0.974766 0.691994 Br\n",
"nsites": 5,
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"elements": [
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"chemical_system": "Br-H-Sr",
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"density_atomic": 0.03137977547846635,
"volume": 159.33829747861438,
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"spacegroup": 1
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{
"id": "jvasp-16519",
"created_at": "2022-09-04T14:37:42.152846Z",
"updated_at": "2022-09-04T14:37:42.152878Z",
"structure_string": "Ga3 Ni2\n1.0\n2.034439 -3.523752 0.000000\n2.034439 3.523752 -0.000000\n0.000000 -0.000000 4.906810\nGa Ni\n3 2\ndirect\n0.666667 0.333333 0.639252 Ga\n0.333333 0.666667 0.360748 Ga\n0.000000 0.000000 0.000000 Ga\n0.666667 0.333333 0.142368 Ni\n0.333333 0.666667 0.857632 Ni\n",
"nsites": 5,
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{
"id": "jvasp-20108",
"created_at": "2022-09-04T14:36:58.886124Z",
"updated_at": "2022-09-04T14:36:58.886143Z",
"structure_string": "Tb1 Te1\n1.0\n3.778550 0.000000 2.181547\n1.259517 3.562452 2.181547\n-0.000000 0.000000 4.363095\nTb Te\n1 1\ndirect\n0.000000 0.000000 0.000000 Tb\n0.500000 0.500000 0.500000 Te\n",
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"elements": [
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"density": 8.10108679253,
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{
"id": "jvasp-36645",
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"structure_string": "Tm2 Au2\n1.0\n-3.670375 -0.000000 0.000000\n-0.000000 -0.000000 -4.588913\n-1.835187 -5.401568 0.000000\nTm Au\n2 2\ndirect\n0.138729 0.749999 0.722542 Tm\n0.861273 0.250000 0.277458 Tm\n0.408628 0.749999 0.182745 Au\n0.591374 0.250000 0.817256 Au\n",
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{
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"created_at": "2022-09-04T14:37:59.006096Z",
"updated_at": "2022-09-04T14:37:59.006108Z",
"structure_string": "Tl4 O2\n1.0\n3.553893 0.002775 0.484076\n1.741061 3.098204 0.484076\n0.040201 0.023544 12.953209\nTl O\n4 2\ndirect\n0.122829 0.122827 0.632116 Tl\n0.289067 0.289065 0.131203 Tl\n0.877172 0.877168 0.367885 Tl\n0.710934 0.710930 0.868797 Tl\n0.582930 0.582928 0.249834 O\n0.417070 0.417068 0.750167 O\n",
"nsites": 6,
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},
{
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"created_at": "2022-09-04T14:37:12.823341Z",
"updated_at": "2022-09-04T14:37:12.823366Z",
"structure_string": "Tl4 O2\n1.0\n3.554240 0.003303 0.483856\n1.741691 3.098249 0.483856\n0.039457 0.023109 12.952844\nTl O\n4 2\ndirect\n0.122663 0.122662 0.632034 Tl\n0.289230 0.289230 0.131275 Tl\n0.877338 0.877337 0.367965 Tl\n0.710770 0.710770 0.868725 Tl\n0.583165 0.583164 0.249914 O\n0.416836 0.416835 0.750086 O\n",
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},
{
"id": "jvasp-8656",
"created_at": "2022-09-04T14:37:04.836518Z",
"updated_at": "2022-09-04T14:37:04.836545Z",
"structure_string": "Tl4 O2\n1.0\n3.542135 -0.006251 12.462902\n1.731437 3.090127 12.462902\n-0.010690 -0.006251 12.956486\nTl O\n4 2\ndirect\n0.289560 0.289560 0.289559 Tl\n0.710441 0.710442 0.710438 Tl\n0.877344 0.877344 0.877340 Tl\n0.122657 0.122657 0.122657 Tl\n0.583352 0.583352 0.583349 O\n0.416649 0.416649 0.416648 O\n",
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},
{
"id": "jvasp-57638",
"created_at": "2022-09-04T14:38:36.694286Z",
"updated_at": "2022-09-04T14:38:36.694317Z",
"structure_string": "Ca4 Cd8\n1.0\n3.008589 -5.211028 0.000000\n3.008589 5.211028 -0.000000\n0.000000 -0.000000 9.578587\nCa Cd\n4 8\ndirect\n0.333333 0.666667 0.059836 Ca\n0.666667 0.333333 0.559836 Ca\n0.666667 0.333333 0.940165 Ca\n0.333333 0.666667 0.440164 Ca\n0.000000 0.000000 0.000000 Cd\n0.000000 0.000000 0.500000 Cd\n0.341753 0.170876 0.250000 Cd\n0.170876 0.341753 0.750000 Cd\n0.170876 0.829124 0.750000 Cd\n0.829124 0.170876 0.250000 Cd\n0.829124 0.658247 0.250000 Cd\n0.658247 0.829124 0.750000 Cd\n",
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{
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"created_at": "2022-09-04T14:37:52.366030Z",
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"structure_string": "C16\n1.0\n2.522127 0.000000 0.000000\n-1.261064 2.184226 -0.000000\n0.000000 -0.000000 16.559070\nC\n16\ndirect\n0.000000 0.000000 0.953300 C\n0.666669 0.333334 0.297422 C\n0.333335 0.666668 0.797422 C\n0.666669 0.333334 0.202578 C\n0.333335 0.666668 0.077867 C\n0.333335 0.666668 0.328793 C\n0.333335 0.666668 0.422133 C\n0.666669 0.333334 0.671207 C\n0.333335 0.666668 0.702578 C\n0.000000 0.000000 0.453300 C\n0.000000 0.000000 0.046700 C\n0.333335 0.666668 0.171207 C\n0.666669 0.333334 0.828793 C\n0.000000 0.000000 0.546700 C\n0.666669 0.333334 0.577867 C\n0.666669 0.333334 0.922133 C\n",
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