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{
"id": "jvasp-20917",
"created_at": "2022-09-04T14:38:35.612263Z",
"updated_at": "2022-09-04T14:38:35.612284Z",
"structure_string": "Li4 Ce4 Ge6\n1.0\n4.289425 0.000000 -1.019552\n0.000000 6.839396 -0.000000\n0.000802 0.000000 9.536317\nLi Ce Ge\n4 4 6\ndirect\n0.691477 0.063172 0.382953 Li\n0.308523 0.936828 0.617047 Li\n0.308523 0.563173 0.617047 Li\n0.691477 0.436828 0.382953 Li\n0.156310 0.750000 0.312619 Ce\n0.843691 0.250000 0.687381 Ce\n0.949718 0.750000 0.899436 Ce\n0.050282 0.250000 0.100564 Ce\n0.220528 0.250000 0.441056 Ge\n0.779472 0.750000 0.558945 Ge\n0.564087 0.561906 0.128172 Ge\n0.435914 0.438094 0.871828 Ge\n0.435914 0.061906 0.871828 Ge\n0.564087 0.938095 0.128172 Ge\n",
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{
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"structure_string": "Ca2 Sn2 S6\n1.0\n1.135456 -3.603097 -0.000000\n5.322502 3.657756 -0.000000\n-0.000000 -0.000000 9.385772\nCa Sn S\n2 2 6\ndirect\n0.746531 0.493063 0.750000 Ca\n0.253469 0.506938 0.250000 Ca\n0.000000 0.000000 0.500000 Sn\n0.000000 0.000000 0.000000 Sn\n0.081160 0.162320 0.750000 S\n0.918840 0.837680 0.250000 S\n0.357050 0.714100 0.548575 S\n0.642950 0.285900 0.451425 S\n0.357050 0.714100 0.951425 S\n0.642950 0.285900 0.048575 S\n",
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{
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"structure_string": "Tb4 Si6\n1.0\n4.340125 0.000000 0.000000\n0.000000 4.113340 -0.725546\n-0.000000 0.040317 12.251232\nTb Si\n4 6\ndirect\n0.250000 0.252573 0.505145 Tb\n0.750001 0.747428 0.494854 Tb\n0.250000 0.616627 0.233254 Tb\n0.750001 0.383373 0.766745 Tb\n0.250000 0.480135 0.960269 Si\n0.750001 0.519865 0.039731 Si\n0.250000 0.835380 0.670759 Si\n0.750001 0.164621 0.329241 Si\n0.750001 0.069187 0.138373 Si\n0.250000 0.930814 0.861627 Si\n",
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"formula_full": "Tb4 Si6",
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"spacegroup": 63
},
{
"id": "jvasp-40197",
"created_at": "2022-09-04T14:38:36.035154Z",
"updated_at": "2022-09-04T14:38:36.035175Z",
"structure_string": "Ca6 Sn4 S14\n1.0\n-0.000000 0.000000 -6.915922\n0.000000 -7.083848 0.000000\n-11.790347 3.541923 -0.000000\nCa Sn S\n6 4 14\ndirect\n0.250000 0.201461 0.000000 Ca\n0.750000 0.798539 0.000000 Ca\n0.250000 0.403308 0.370236 Ca\n0.750000 0.966928 0.370236 Ca\n0.750000 0.596693 0.629764 Ca\n0.250000 0.033073 0.629764 Ca\n0.250000 0.841328 0.207950 Sn\n0.750000 0.366623 0.207950 Sn\n0.750000 0.158673 0.792050 Sn\n0.250000 0.633378 0.792050 Sn\n0.500000 0.075531 0.151061 S\n0.000000 0.075531 0.151061 S\n0.000000 0.639062 0.278123 S\n0.500000 0.639062 0.278123 S\n0.000000 0.360939 0.721877 S\n0.500000 0.360939 0.721877 S\n0.750000 0.388214 0.000000 S\n0.750000 0.950335 0.588413 S\n0.750000 0.361921 0.411587 S\n0.250000 0.049666 0.411587 S\n0.000000 0.924470 0.848940 S\n0.250000 0.611786 0.000000 S\n0.250000 0.638080 0.588413 S\n0.500000 0.924470 0.848940 S\n",
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{
"id": "jvasp-34071",
"created_at": "2022-09-04T14:38:36.311685Z",
"updated_at": "2022-09-04T14:38:36.311695Z",
"structure_string": "Te8 Mo6 S4\n1.0\n-1.543696 3.080000 0.000000\n0.000001 -0.000000 -13.956969\n-7.176090 -5.523719 0.000001\nTe Mo S\n8 6 4\ndirect\n0.900309 0.617249 0.800595 Te\n0.099691 0.117249 0.199406 Te\n0.099692 0.382751 0.199406 Te\n0.775071 0.119163 0.550154 Te\n0.224930 0.619163 0.449848 Te\n0.224930 0.880837 0.449848 Te\n0.775071 0.380837 0.550154 Te\n0.900309 0.882752 0.800595 Te\n0.785143 0.750000 0.570255 Mo\n0.888807 0.250000 0.777608 Mo\n0.458695 0.750000 0.917369 Mo\n0.541304 0.250000 0.082631 Mo\n0.111193 0.750000 0.222393 Mo\n0.214858 0.250000 0.429747 Mo\n0.436648 0.140436 0.873288 S\n0.563352 0.859564 0.126712 S\n0.563351 0.640436 0.126712 S\n0.436648 0.359564 0.873288 S\n",
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{
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"created_at": "2022-09-04T14:38:36.541299Z",
"updated_at": "2022-09-04T14:38:36.541326Z",
"structure_string": "Ti4 Pd6\n1.0\n4.626837 0.000000 -0.000000\n-0.000000 4.486736 -1.452788\n-0.000000 -0.035343 7.545574\nTi Pd\n4 6\ndirect\n0.750000 0.336380 0.215735 Ti\n0.250000 0.663622 0.784265 Ti\n0.750000 0.120645 0.784265 Ti\n0.250000 0.879356 0.215735 Ti\n0.250000 0.087616 0.610951 Pd\n0.750000 0.912385 0.389048 Pd\n0.750000 0.523337 0.610951 Pd\n0.250000 0.476665 0.389048 Pd\n0.750000 0.706044 -0.000000 Pd\n0.250000 0.293957 -0.000000 Pd\n",
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{
"id": "jvasp-119634",
"created_at": "2022-09-04T14:38:36.436622Z",
"updated_at": "2022-09-04T14:38:36.436642Z",
"structure_string": "Rb2 Yb2 Zn2 Te6\n1.0\n8.579346 0.000097 0.000000\n-7.569983 4.037391 0.000000\n-0.000000 -0.000000 11.808325\nYb Rb Zn Te\n2 2 2 6\ndirect\n0.000000 0.000000 0.000000 Yb\n0.000000 0.000000 0.500000 Yb\n0.262405 0.737595 0.250000 Rb\n0.737596 0.262405 0.750000 Rb\n0.547346 0.452655 0.250000 Zn\n0.452655 0.547345 0.750000 Zn\n0.635425 0.364577 0.061097 Te\n0.364577 0.635424 0.938902 Te\n0.364577 0.635424 0.561097 Te\n0.635425 0.364577 0.438902 Te\n0.942387 0.057615 0.250000 Te\n0.057614 0.942386 0.750000 Te\n",
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{
"id": "jvasp-119672",
"created_at": "2022-09-04T14:38:36.707029Z",
"updated_at": "2022-09-04T14:38:36.707056Z",
"structure_string": "Ti4 Cr4 Ag4 S16\n1.0\n7.171213 -0.000000 0.000000\n0.000000 7.277131 0.000000\n-0.000000 -0.000000 10.649043\nTi Cr Ag S\n4 4 4 16\ndirect\n0.750000 -0.000041 0.250014 Ti\n0.250000 0.000041 0.749986 Ti\n0.250000 0.500041 0.750014 Ti\n0.750000 0.499958 0.249986 Ti\n0.250000 0.250016 0.110118 Cr\n0.750000 0.749984 0.889881 Cr\n0.750000 0.249984 0.610118 Cr\n0.250000 0.750016 0.389882 Cr\n0.250000 0.750067 0.112261 Ag\n0.750000 0.249933 0.887739 Ag\n0.750000 0.749933 0.612261 Ag\n0.250000 0.250067 0.387739 Ag\n0.250000 0.973611 0.523769 S\n0.750000 0.026389 0.476231 S\n0.250000 0.026451 0.976205 S\n0.750000 0.973549 0.023794 S\n0.750000 0.473549 0.476206 S\n0.250000 0.526451 0.523794 S\n0.483749 0.250011 0.728470 S\n0.983749 0.749989 0.271530 S\n0.516251 0.249989 0.228470 S\n0.483749 0.750011 0.771530 S\n0.016251 0.750011 0.771530 S\n0.983749 0.249989 0.228470 S\n0.250000 0.473611 0.976231 S\n0.016251 0.250011 0.728470 S\n0.516251 0.749989 0.271530 S\n0.750000 0.526389 0.023769 S\n",
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{
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"structure_string": "Te8 Mo6 S4\n1.0\n-0.347504 -5.943759 -0.000003\n0.000034 0.000003 13.951332\n-4.982029 3.273330 -0.000013\nTe Mo S\n8 6 4\ndirect\n0.651382 0.380654 0.668236 Te\n0.016860 0.880653 0.668245 Te\n0.983148 0.380654 0.331761 Te\n0.983149 0.119346 0.331761 Te\n0.016860 0.619347 0.668245 Te\n0.348615 0.880654 0.331755 Te\n0.348615 0.619347 0.331755 Te\n0.651382 0.119346 0.668236 Te\n0.317750 0.250000 0.311931 Mo\n0.682251 0.750001 0.688066 Mo\n0.628579 0.250000 -0.000000 Mo\n0.994185 0.750001 0.311933 Mo\n0.005820 0.250000 0.688072 Mo\n0.371417 0.750000 0.000002 Mo\n0.682848 0.861272 -0.000001 S\n0.317149 0.138723 0.000004 S\n0.317149 0.361277 0.000003 S\n0.682849 0.638729 -0.000001 S\n",
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{
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"structure_string": "Ca2 Sn2 S6\n1.0\n9.394606 -0.000000 0.000000\n0.000000 3.734219 -0.581382\n-0.000000 -0.912192 6.389985\nCa Sn S\n2 2 6\ndirect\n0.750010 0.753626 0.006980 Ca\n0.250010 0.246375 0.993021 Ca\n-0.000005 0.500004 0.499983 Sn\n0.499995 0.499997 0.500018 Sn\n0.749994 0.418636 0.337543 S\n0.249994 0.581365 0.662458 S\n0.048405 -0.143140 0.213555 S\n0.451597 0.856846 0.213589 S\n0.548405 0.143140 0.786445 S\n0.951597 0.143155 0.786412 S\n",
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{
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{
"id": "jvasp-110897",
"created_at": "2022-09-04T14:38:37.419012Z",
"updated_at": "2022-09-04T14:38:37.419040Z",
"structure_string": "Nd2 Si2 Os4 C2\n1.0\n5.926886 -0.002504 0.000000\n-4.589529 3.750227 0.000000\n-0.000000 -0.000000 7.204064\nNd Si Os C\n2 2 4 2\ndirect\n0.549163 0.450839 0.250000 Nd\n0.450839 0.549163 0.750000 Nd\n0.270434 0.729568 0.250000 Si\n0.729568 0.270434 0.750000 Si\n0.834049 0.165953 0.058796 Os\n0.165953 0.834049 0.941204 Os\n0.165953 0.834049 0.558795 Os\n0.834049 0.165953 0.441204 Os\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
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}
]
}