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{
"id": "jvasp-10885",
"created_at": "2022-09-04T14:37:16.832175Z",
"updated_at": "2022-09-04T14:37:16.832194Z",
"structure_string": "Rb4 Si2 S6\n1.0\n6.269881 0.000000 2.733008\n2.753423 6.538569 2.241756\n-0.014946 0.007693 8.592761\nRb Si S\n4 2 6\ndirect\n0.803775 0.579265 0.813184 Rb\n0.196224 0.420734 0.186817 Rb\n0.580416 0.200891 0.638275 Rb\n0.419583 0.799109 0.361726 Rb\n0.116369 0.947720 0.819542 Si\n0.883630 0.052280 0.180460 Si\n0.238228 -0.000000 0.000000 S\n0.761772 -0.000000 0.000000 S\n0.888469 0.827342 0.395719 S\n0.111530 0.172658 0.604282 S\n0.709877 0.357509 0.222735 S\n0.290122 0.642490 0.777266 S\n",
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{
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"structure_string": "Hf2 Cu4 Te6\n1.0\n4.008784 -0.000000 -0.805014\n-0.189083 7.250100 -0.941588\n0.002955 -0.073299 10.398642\nHf Cu Te\n2 4 6\ndirect\n0.645792 0.055809 0.291585 Hf\n0.354209 0.944191 0.708415 Hf\n0.712762 0.428335 0.425525 Cu\n0.287239 0.571665 0.574475 Cu\n0.048101 0.150443 0.096201 Cu\n0.951900 0.849557 0.903799 Cu\n0.751123 0.786906 0.502245 Te\n0.916981 0.179729 0.833963 Te\n0.582691 0.366933 0.165383 Te\n0.248878 0.213094 0.497755 Te\n0.417310 0.633067 0.834617 Te\n0.083019 0.820270 0.166037 Te\n",
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{
"id": "jvasp-9415",
"created_at": "2022-09-04T14:37:09.646192Z",
"updated_at": "2022-09-04T14:37:09.646224Z",
"structure_string": "Na6 Ag2 O4\n1.0\n4.998251 0.000000 -2.196808\n-1.139956 5.223545 -2.593665\n-0.001988 -0.014031 6.779976\nNa Ag O\n6 2 4\ndirect\n0.760686 0.010686 0.521372 Na\n0.500000 0.250000 -0.000000 Na\n0.760685 0.510686 0.521372 Na\n0.239313 0.989315 0.478628 Na\n0.500000 0.750001 -0.000001 Na\n0.239314 0.489315 0.478628 Na\n-0.000000 0.500000 -0.000000 Ag\n0.000000 0.000000 0.000000 Ag\n0.139086 0.364602 0.729202 O\n0.409884 0.135399 0.270798 O\n0.860913 0.635399 0.270797 O\n0.590115 0.864602 0.729202 O\n",
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"volume": 176.77576214507778,
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"formula_full": "Na6 Ag2 O4",
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{
"id": "jvasp-47929",
"created_at": "2022-09-04T14:37:08.880297Z",
"updated_at": "2022-09-04T14:37:08.880317Z",
"structure_string": "Mn6 O3 F9\n1.0\n4.778855 -0.134389 0.000000\n-0.134389 4.778855 0.000000\n0.000000 0.000000 9.480133\nMn O F\n6 3 9\ndirect\n0.955874 0.955874 0.000000 Mn\n0.028942 0.028942 0.332651 Mn\n0.028942 0.028942 0.667349 Mn\n0.492160 0.492160 0.833498 Mn\n0.492160 0.492160 0.166502 Mn\n0.492421 0.492421 0.500000 Mn\n0.320846 0.320846 0.668274 O\n0.663815 0.663815 0.000000 O\n0.320846 0.320846 0.331725 O\n0.823387 0.215324 0.500000 F\n0.192527 0.789868 0.167317 F\n0.215324 0.823387 0.500000 F\n0.192527 0.789868 0.832683 F\n0.268412 0.268412 0.000000 F\n0.716044 0.716044 0.340696 F\n0.716044 0.716044 0.659303 F\n0.789868 0.192527 0.167317 F\n0.789868 0.192527 0.832683 F\n",
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"elements": [
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{
"id": "jvasp-12444",
"created_at": "2022-09-04T14:37:16.546903Z",
"updated_at": "2022-09-04T14:37:16.546923Z",
"structure_string": "Mn4 Co6 Ge2\n1.0\n2.344958 -4.061586 0.000000\n2.344958 4.061586 0.000000\n0.000000 -0.000000 7.168102\nMn Co Ge\n4 6 2\ndirect\n0.333333 0.666668 0.082623 Mn\n0.333333 0.666668 0.417376 Mn\n0.666668 0.333333 0.917376 Mn\n0.666668 0.333333 0.582623 Mn\n0.823945 0.647888 0.250000 Co\n0.176056 0.352113 0.750000 Co\n0.647888 0.823945 0.750000 Co\n0.352113 0.176056 0.250000 Co\n0.176056 0.823945 0.750000 Co\n0.823945 0.176056 0.250000 Co\n0.000000 0.000000 0.000000 Ge\n0.000000 0.000000 0.500000 Ge\n",
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"formula_full": "Mn4 Co6 Ge2",
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{
"id": "jvasp-50801",
"created_at": "2022-09-04T14:37:08.084739Z",
"updated_at": "2022-09-04T14:37:08.084760Z",
"structure_string": "Li12 Cu4 S8\n1.0\n-3.927884 3.927884 5.969496\n3.927884 -3.927884 5.969496\n3.927884 3.927884 -5.969496\nLi Cu S\n12 4 8\ndirect\n0.843759 0.156241 0.250000 Li\n0.406240 0.156240 0.812482 Li\n0.593759 0.406240 0.749999 Li\n0.156240 0.406240 0.312483 Li\n-0.000000 -0.000000 0.499999 Li\n0.000000 0.500000 0.000000 Li\n0.156240 0.843759 0.749999 Li\n0.406241 0.593760 0.250000 Li\n0.843759 0.593760 0.687516 Li\n0.499999 0.000000 0.499999 Li\n0.000000 0.000000 0.000000 Li\n0.593760 0.843760 0.187517 Li\n0.246865 0.496865 0.749999 Cu\n0.503134 0.753134 0.749999 Cu\n0.496866 0.246866 0.250000 Cu\n0.753134 0.503135 0.250000 Cu\n0.210702 0.232844 0.977858 S\n0.789298 0.767156 0.022141 S\n0.754985 0.232845 0.522140 S\n0.232844 0.210703 0.477859 S\n0.767155 0.245015 0.977858 S\n0.232845 0.754985 0.022141 S\n0.767156 0.789297 0.522140 S\n0.245015 0.767155 0.477859 S\n",
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],
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"density": 2.6774270946365157,
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"volume": 368.39604909505096,
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"formula_full": "Li12 Cu4 S8",
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{
"id": "jvasp-35285",
"created_at": "2022-09-04T14:37:31.235986Z",
"updated_at": "2022-09-04T14:37:31.236013Z",
"structure_string": "Y1 Si2 Ru3\n1.0\n2.779612 -4.814430 -0.000000\n2.779612 4.814430 0.000000\n0.000000 -0.000000 3.654131\nY Si Ru\n1 2 3\ndirect\n0.000000 0.000000 0.000000 Y\n0.333333 0.666667 0.000000 Si\n0.666667 0.333333 0.000000 Si\n-0.000000 0.500000 0.500000 Ru\n0.500000 0.500000 0.500000 Ru\n0.500000 -0.000000 0.500000 Ru\n",
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],
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"formula_full": "Y1 Si2 Ru3",
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{
"id": "jvasp-56919",
"created_at": "2022-09-04T14:37:08.693861Z",
"updated_at": "2022-09-04T14:37:08.693889Z",
"structure_string": "Er4 Al6 Co2\n1.0\n2.734245 -4.735851 0.000000\n2.734245 4.735851 0.000000\n-0.000000 0.000000 8.494736\nEr Al Co\n4 6 2\ndirect\n0.333332 0.666666 0.555884 Er\n0.666666 0.333332 0.055884 Er\n0.666666 0.333332 0.444116 Er\n0.333332 0.666666 0.944116 Er\n0.324257 0.162129 0.750000 Al\n0.162129 0.324257 0.250000 Al\n0.162129 0.837870 0.250000 Al\n0.837870 0.162129 0.750000 Al\n0.675741 0.837869 0.250000 Al\n0.837869 0.675741 0.750000 Al\n0.000000 0.000000 0.000000 Co\n0.000000 0.000000 0.500000 Co\n",
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{
"id": "jvasp-12964",
"created_at": "2022-09-04T14:37:16.574776Z",
"updated_at": "2022-09-04T14:37:16.574798Z",
"structure_string": "Cd4 As6 Br2\n1.0\n6.299552 -0.018091 -0.846262\n-0.944463 6.228377 -0.846262\n-0.011316 -0.013124 8.116444\nCd As Br\n4 6 2\ndirect\n0.907334 0.607848 0.697577 Cd\n0.392152 0.092667 0.802422 Cd\n0.607847 0.907334 0.197578 Cd\n0.092666 0.392153 0.302423 Cd\n0.919218 0.821745 0.023535 As\n0.178255 0.080782 0.476465 As\n0.080782 0.178256 0.976465 As\n0.789680 0.210320 0.750000 As\n0.210319 0.789681 0.250000 As\n0.821745 0.919219 0.523535 As\n0.365034 0.634966 0.750000 Br\n0.634965 0.365035 0.250000 Br\n",
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{
"id": "jvasp-10550",
"created_at": "2022-09-04T14:37:08.319185Z",
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"structure_string": "Rb6 B2 As4\n1.0\n6.536916 0.010376 1.759937\n-0.218245 6.533280 1.759937\n0.005040 0.005219 9.622857\nRb B As\n6 2 4\ndirect\n0.848640 0.151361 0.750000 Rb\n0.151361 0.848640 0.250000 Rb\n0.243827 0.349306 0.982671 Rb\n0.650696 0.756173 0.517330 Rb\n0.756174 0.650695 0.017329 Rb\n0.349306 0.243827 0.482671 Rb\n0.784861 0.215140 0.250000 B\n0.215140 0.784861 0.750000 B\n0.908136 0.347106 0.357289 As\n0.652895 0.091865 0.142711 As\n0.347106 0.908136 0.857290 As\n0.091865 0.652895 0.642711 As\n",
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{
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"structure_string": "Er1 Si2 Rh3\n1.0\n2.752900 -4.768163 -0.000000\n2.752900 4.768163 0.000000\n0.000000 0.000000 3.675376\nEr Si Rh\n1 2 3\ndirect\n0.000000 0.000000 0.000000 Er\n0.666667 0.333333 0.000000 Si\n0.333333 0.666667 0.000000 Si\n0.000000 0.500000 0.500001 Rh\n0.500000 0.000000 0.500001 Rh\n0.500000 0.500000 0.500001 Rh\n",
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{
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}
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}