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{
"id": "jvasp-12510",
"created_at": "2022-09-04T14:37:27.820306Z",
"updated_at": "2022-09-04T14:37:27.820342Z",
"structure_string": "Cu8 Cl8\n1.0\n6.573816 -0.000000 -0.000000\n0.000000 6.573816 -0.000000\n0.000000 -0.000000 6.573816\nCu Cl\n8 8\ndirect\n0.618939 0.881062 0.118939 Cu\n0.881062 0.118939 0.618939 Cu\n0.118939 0.618939 0.881062 Cu\n0.381061 0.381061 0.381061 Cu\n0.381061 0.118939 0.881062 Cu\n0.118939 0.881062 0.381061 Cu\n0.881062 0.381061 0.118939 Cu\n0.618939 0.618939 0.618939 Cu\n0.155606 0.344394 0.655606 Cl\n0.344394 0.655606 0.155606 Cl\n0.655606 0.155606 0.344394 Cl\n0.844394 0.844394 0.844394 Cl\n0.844394 0.655606 0.344394 Cl\n0.655606 0.344394 0.844394 Cl\n0.344394 0.844394 0.655606 Cl\n0.155606 0.155606 0.155606 Cl\n",
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{
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{
"id": "jvasp-10115",
"created_at": "2022-09-04T14:37:31.723141Z",
"updated_at": "2022-09-04T14:37:31.723161Z",
"structure_string": "Cd8 As8\n1.0\n6.126778 -0.000000 0.000000\n0.000000 7.912642 0.000000\n0.000000 0.000000 8.131887\nCd As\n8 8\ndirect\n0.050256 0.631958 0.861689 Cd\n0.550256 0.868042 0.138311 Cd\n0.949744 0.131958 0.638311 Cd\n0.449744 0.368042 0.361689 Cd\n0.949744 0.368042 0.138311 Cd\n0.449744 0.131958 0.861689 Cd\n0.050256 0.868042 0.361689 Cd\n0.550256 0.631958 0.638311 Cd\n0.633133 0.065382 0.403619 As\n0.133133 0.434617 0.596381 As\n0.366867 0.565382 0.096381 As\n0.866868 0.934617 0.903619 As\n0.366867 0.934617 0.596381 As\n0.866868 0.565382 0.403619 As\n0.633133 0.434617 0.903619 As\n0.133133 0.065382 0.096381 As\n",
"nsites": 16,
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{
"id": "jvasp-54642",
"created_at": "2022-09-04T14:37:09.010896Z",
"updated_at": "2022-09-04T14:37:09.010916Z",
"structure_string": "Tb12 Ni4\n1.0\n6.275412 -0.000000 0.000000\n0.000000 6.807285 0.000000\n0.000000 0.000000 9.561384\nTb Ni\n12 4\ndirect\n0.141447 0.031423 0.250000 Tb\n0.641447 0.468577 0.750000 Tb\n0.323913 0.820907 0.565036 Tb\n0.676087 0.179092 0.434963 Tb\n0.358553 0.531422 0.250000 Tb\n0.858553 0.968577 0.750000 Tb\n0.823912 0.679091 0.065036 Tb\n0.676087 0.179092 0.065036 Tb\n0.323913 0.820907 0.934963 Tb\n0.823912 0.679091 0.434963 Tb\n0.176087 0.320908 0.934963 Tb\n0.176087 0.320908 0.565036 Tb\n0.560396 0.888995 0.250000 Ni\n0.060396 0.611004 0.750000 Ni\n0.439603 0.111004 0.750000 Ni\n0.939603 0.388995 0.250000 Ni\n",
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{
"id": "jvasp-22289",
"created_at": "2022-09-04T14:37:31.656448Z",
"updated_at": "2022-09-04T14:37:31.656473Z",
"structure_string": "Lu8 Al8\n1.0\n5.506175 0.000000 0.000000\n0.000000 5.749018 0.000000\n0.000000 0.000000 11.179928\nLu Al\n8 8\ndirect\n0.250000 0.394610 0.330047 Lu\n0.749999 0.605391 0.669953 Lu\n0.749999 0.394610 0.169953 Lu\n0.250000 0.605391 0.830047 Lu\n0.250000 0.158198 0.018045 Lu\n0.749999 0.841803 0.981955 Lu\n0.749999 0.158198 0.481955 Lu\n0.250000 0.841803 0.518045 Lu\n0.000000 0.930006 0.250000 Al\n0.500000 0.069994 0.750000 Al\n0.000000 0.069994 0.750000 Al\n0.500000 0.930006 0.250000 Al\n0.250000 0.655370 0.095506 Al\n0.749999 0.344631 0.904494 Al\n0.749999 0.655370 0.404494 Al\n0.250000 0.344631 0.595506 Al\n",
"nsites": 16,
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{
"id": "jvasp-9719",
"created_at": "2022-09-04T14:37:16.406312Z",
"updated_at": "2022-09-04T14:37:16.406346Z",
"structure_string": "Tl2 Pd6 O8\n1.0\n5.935938 -0.000000 3.427115\n1.978646 5.596456 3.427115\n0.000000 -0.000000 6.854231\nTl Pd O\n2 6 8\ndirect\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Tl\n0.000000 0.000000 0.500000 Pd\n0.000000 0.500000 0.000000 Pd\n0.000000 0.500000 0.500000 Pd\n0.500000 0.500000 0.000000 Pd\n0.500000 0.000000 0.000000 Pd\n0.500000 0.000000 0.500000 Pd\n0.857624 0.857624 0.857624 O\n0.142377 0.142377 0.572870 O\n0.142377 0.572871 0.142377 O\n0.572871 0.142377 0.142377 O\n0.857624 0.427130 0.857624 O\n0.427130 0.857624 0.857624 O\n0.142377 0.142377 0.142377 O\n0.857624 0.857624 0.427130 O\n",
"nsites": 16,
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],
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"volume": 227.69903320793776,
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"formula_full": "Tl2 Pd6 O8",
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},
{
"id": "jvasp-10326",
"created_at": "2022-09-04T14:37:16.299888Z",
"updated_at": "2022-09-04T14:37:16.299915Z",
"structure_string": "Zn2 Sn4 O10\n1.0\n3.967517 -0.000000 -0.000000\n-1.983757 5.240512 0.000000\n-0.000000 0.000000 10.410376\nZn Sn O\n2 4 10\ndirect\n0.818714 0.637427 0.750000 Zn\n0.181287 0.362574 0.250000 Zn\n0.136153 0.272306 0.567440 Sn\n0.863848 0.727694 0.432560 Sn\n0.863848 0.727694 0.067441 Sn\n0.136153 0.272306 0.932561 Sn\n0.774395 0.548788 0.250000 O\n0.225606 0.451212 0.750000 O\n0.306669 0.613337 0.060398 O\n0.693333 0.386664 0.939602 O\n0.693333 0.386664 0.560398 O\n0.306669 0.613337 0.439601 O\n0.948568 0.897134 0.613324 O\n0.051432 0.102865 0.386676 O\n0.948568 0.897134 0.886676 O\n0.051432 0.102865 0.113325 O\n",
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{
"id": "jvasp-9800",
"created_at": "2022-09-04T14:37:27.630647Z",
"updated_at": "2022-09-04T14:37:27.630657Z",
"structure_string": "Zn2 Bi4 O10\n1.0\n-3.799462 -0.069595 0.123475\n-0.103259 -5.238345 0.158742\n1.315969 0.730733 11.825253\nZn Bi O\n2 4 10\ndirect\n0.376875 0.795036 0.773039 Zn\n0.975304 0.132063 0.206270 Zn\n0.977384 0.279211 0.865058 Bi\n0.440387 0.602397 0.095642 Bi\n0.051982 0.684749 0.393871 Bi\n0.641880 0.275137 0.574746 Bi\n0.012579 0.535656 0.226971 O\n0.644534 0.493024 0.736585 O\n0.180284 0.646915 0.909607 O\n0.958247 0.312736 0.046762 O\n0.097706 0.535413 0.560689 O\n0.562803 0.512305 0.403384 O\n0.035885 0.053072 0.708291 O\n0.033158 0.074399 0.403653 O\n0.477441 -0.012288 0.190901 O\n0.504950 0.077328 0.889701 O\n",
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{
"id": "jvasp-10335",
"created_at": "2022-09-04T14:37:27.649597Z",
"updated_at": "2022-09-04T14:37:27.649605Z",
"structure_string": "Mg2 Mo4 O10\n1.0\n3.807287 -0.000060 0.000000\n-1.903738 5.198301 0.000000\n0.000000 0.000000 11.078189\nMg Mo O\n2 4 10\ndirect\n0.867642 0.734552 0.750000 Mg\n0.132359 0.265449 0.250000 Mg\n0.177860 0.355248 0.595539 Mo\n0.822141 0.644753 0.404460 Mo\n0.822141 0.644753 0.095540 Mo\n0.177860 0.355248 0.904461 Mo\n0.706322 0.413481 0.250000 O\n0.293679 0.586520 0.750000 O\n0.247093 0.494747 0.079117 O\n0.752909 0.505253 0.920883 O\n0.752909 0.505253 0.579117 O\n0.247093 0.494747 0.420882 O\n0.014754 0.028614 0.626505 O\n0.985246 0.971385 0.373495 O\n0.014754 0.028614 0.873496 O\n0.985246 0.971385 0.126506 O\n",
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{
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"structure_string": "Ca4 Mn4 O8\n1.0\n3.310516 -0.003226 -0.001142\n0.008041 7.961730 0.039702\n0.005377 2.725226 7.545277\nCa Mn O\n4 4 8\ndirect\n0.750009 0.199975 0.928816 Ca\n0.249993 0.800025 0.071184 Ca\n0.249996 0.065361 0.313089 Ca\n0.750006 0.934639 0.686912 Ca\n0.250026 0.563949 0.810975 Mn\n0.249894 0.317880 0.557236 Mn\n0.750107 0.682120 0.442764 Mn\n0.749976 0.436051 0.189026 Mn\n0.249854 0.550791 0.322555 O\n0.250038 0.799896 0.564689 O\n0.749963 0.200104 0.435311 O\n0.750148 0.449209 0.677445 O\n0.750005 0.673006 0.939857 O\n0.250009 0.068508 0.806234 O\n0.249997 0.326994 0.060144 O\n0.749993 0.931492 0.193767 O\n",
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{
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{
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"updated_at": "2022-09-04T14:37:16.164795Z",
"structure_string": "V2 Zn2 S2 F10\n1.0\n6.029803 0.336833 -0.038310\n-2.459929 5.913441 -0.347110\n-2.640369 -1.881516 7.477571\nV Zn S F\n2 2 2 10\ndirect\n-0.002249 0.500807 -0.000664 V\n0.497765 0.000799 -0.000664 V\n0.695616 0.605197 0.264947 Zn\n0.299868 0.396379 0.733715 Zn\n0.651960 0.648914 0.535628 S\n0.343478 0.352586 0.463020 S\n0.296662 0.116450 0.830321 F\n0.681936 0.528206 0.913372 F\n0.698864 0.885141 0.168348 F\n0.313550 0.473374 0.085289 F\n-0.018200 0.393630 0.760149 F\n0.584489 0.242092 0.195864 F\n0.013727 0.608010 0.238522 F\n0.411057 0.759533 0.802803 F\n0.812141 0.182676 -0.020396 F\n0.183389 0.818936 0.019060 F\n",
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}
]
}