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{
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{
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{
"id": "mp-574224",
"created_at": "2022-09-04T14:42:44.215238Z",
"structure_string": "Cs32 Si8 Te32\n1.0\n15.372116 0.000000 0.000000\n0.000000 15.372116 0.000000\n0.000000 0.000000 15.372116\nCs Si Te\n32 8 32\ndirect\n0.132745 0.912190 0.350515 Cs\n0.412190 0.632745 0.850515 Cs\n0.867255 0.912190 0.649485 Cs\n0.587810 0.632745 0.149485 Cs\n0.587810 0.367255 0.850515 Cs\n0.350515 0.867255 0.087810 Cs\n0.087810 0.350515 0.867255 Cs\n0.649924 0.649924 0.649924 Cs\n0.367255 0.850515 0.587810 Cs\n0.850076 0.850076 0.149924 Cs\n0.632745 0.149485 0.587810 Cs\n0.867255 0.087810 0.350515 Cs\n0.132745 0.087810 0.649485 Cs\n0.850515 0.587810 0.367255 Cs\n0.149924 0.850076 0.850076 Cs\n0.912190 0.649485 0.867255 Cs\n0.649485 0.132745 0.087810 Cs\n0.412190 0.367255 0.149485 Cs\n0.912190 0.350515 0.132745 Cs\n0.350515 0.132745 0.912190 Cs\n0.367255 0.149485 0.412190 Cs\n0.350076 0.649924 0.350076 Cs\n0.850515 0.412190 0.632745 Cs\n0.149924 0.149924 0.149924 Cs\n0.149485 0.587810 0.632745 Cs\n0.149485 0.412190 0.367255 Cs\n0.087810 0.649485 0.132745 Cs\n0.850076 0.149924 0.850076 Cs\n0.632745 0.850515 0.412190 Cs\n0.649485 0.867255 0.912190 Cs\n0.649924 0.350076 0.350076 Cs\n0.350076 0.350076 0.649924 Cs\n0.000000 0.750000 0.500000 Si\n0.500000 0.000000 0.250000 Si\n0.750000 0.500000 0.000000 Si\n0.500000 0.500000 0.500000 Si\n0.250000 0.500000 0.000000 Si\n0.000000 0.250000 0.500000 Si\n0.500000 0.000000 0.750000 Si\n0.000000 0.000000 0.000000 Si\n0.604709 0.907934 0.659378 Te\n0.840622 0.592066 0.104709 Te\n0.340622 0.395291 0.907934 Te\n0.659378 0.395291 0.092066 Te\n0.840622 0.407934 0.895291 Te\n0.104709 0.840622 0.592066 Te\n0.604709 0.092066 0.340622 Te\n0.592066 0.895291 0.159378 Te\n0.404354 0.404354 0.404354 Te\n0.159378 0.592066 0.895291 Te\n0.895291 0.840622 0.407934 Te\n0.092066 0.340622 0.604709 Te\n0.159378 0.407934 0.104709 Te\n0.395291 0.092066 0.659378 Te\n0.407934 0.895291 0.840622 Te\n0.592066 0.104709 0.840622 Te\n0.095646 0.095646 0.904354 Te\n0.595646 0.404354 0.595646 Te\n0.340622 0.604709 0.092066 Te\n0.404354 0.595646 0.595646 Te\n0.092066 0.659378 0.395291 Te\n0.907934 0.340622 0.395291 Te\n0.895291 0.159378 0.592066 Te\n0.595646 0.595646 0.404354 Te\n0.104709 0.159378 0.407934 Te\n0.904354 0.904354 0.904354 Te\n0.095646 0.904354 0.095646 Te\n0.407934 0.104709 0.159378 Te\n0.904354 0.095646 0.095646 Te\n0.659378 0.604709 0.907934 Te\n0.395291 0.907934 0.340622 Te\n0.907934 0.659378 0.604709 Te\n",
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"elements": [
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"formula_full": "Cs32 Si8 Te32",
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},
{
"id": "mp-1226291",
"created_at": "2022-09-04T14:42:44.220848Z",
"structure_string": "Cr2 Ag2 Sn2 S8\n1.0\n-3.678388 3.788110 5.265035\n3.678388 -3.788110 5.265035\n3.678388 3.788110 -5.265035\nCr Ag Sn S\n2 2 2 8\ndirect\n0.500000 0.000000 0.000000 Cr\n0.500000 0.500000 0.500000 Cr\n0.884819 0.634819 0.250000 Ag\n0.115181 0.365181 0.750000 Ag\n0.500000 0.000000 0.500000 Sn\n0.000000 0.000000 0.000000 Sn\n0.730000 0.740012 0.510012 S\n0.730000 0.219988 0.989988 S\n0.718458 0.755039 0.963420 S\n0.291619 0.755039 0.536580 S\n0.270000 0.259988 0.489988 S\n0.270000 0.780012 0.010012 S\n0.281542 0.244961 0.036580 S\n0.708381 0.244961 0.463420 S\n",
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"formula_full": "Cr2 Ag2 Sn2 S8",
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{
"id": "mp-1212758",
"created_at": "2022-09-04T14:42:44.239494Z",
"structure_string": "Fe2 Co3 H4 Se6 O20\n1.0\n6.583959 0.000000 0.000000\n1.931689 7.894234 0.000000\n1.768381 0.237929 8.866753\nFe Co H Se O\n2 3 4 6 20\ndirect\n0.135714 0.397399 0.117942 Fe\n0.864286 0.602601 0.882058 Fe\n0.314073 0.677714 0.265081 Co\n0.685927 0.322286 0.734919 Co\n0.500000 0.000000 0.000000 Co\n0.146208 0.637250 0.560042 H\n0.853792 0.362750 0.439958 H\n0.320537 0.465158 0.535894 H\n0.679463 0.534842 0.464106 H\n0.235816 0.077917 0.365455 Se\n0.764184 0.922083 0.634545 Se\n0.669411 0.290939 0.128882 Se\n0.330589 0.709061 0.871118 Se\n0.200626 0.214660 0.775475 Se\n0.799374 0.785340 0.224525 Se\n0.263920 0.573916 0.485101 O\n0.736080 0.426084 0.514899 O\n0.023928 0.618186 0.233631 O\n0.976072 0.381814 0.766369 O\n0.458617 0.058925 0.222938 O\n0.541383 0.941075 0.777062 O\n0.234301 0.204932 0.967107 O\n0.765699 0.795068 0.032893 O\n0.056540 0.247425 0.289467 O\n0.943460 0.752575 0.710533 O\n0.830915 0.438162 0.069630 O\n0.169085 0.561838 0.930370 O\n0.137122 0.906831 0.346773 O\n0.862878 0.093169 0.653227 O\n0.397062 0.308277 0.683790 O\n0.602938 0.691723 0.316210 O\n0.329698 0.799482 0.036854 O\n0.670302 0.200518 0.963146 O\n0.416885 0.431365 0.161923 O\n0.583115 0.568635 0.838077 O\n",
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{
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{
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"structure_string": "Sr1 Ga1 Cu3 Se4\n1.0\n6.079860 0.000000 0.000000\n0.000000 6.079860 0.000000\n0.000000 0.000000 6.079860\nSr Ga Cu Se\n1 1 3 4\ndirect\n0.500000 0.500000 0.500000 Sr\n0.000000 0.000000 0.000000 Ga\n0.000000 0.500000 0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.500000 0.000000 0.000000 Cu\n0.226651 0.226651 0.226651 Se\n0.773349 0.773349 0.226651 Se\n0.226651 0.773349 0.773349 Se\n0.773349 0.226651 0.773349 Se\n",
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{
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"structure_string": "Nd8 Si4 Te4 O16\n1.0\n6.357658 0.000000 0.000000\n0.000000 7.267206 0.000000\n0.000000 0.000000 11.301884\nNd Si Te O\n8 4 4 16\ndirect\n0.387928 0.750000 0.500000 Nd\n0.387928 0.750000 0.000000 Nd\n0.612072 0.250000 0.500000 Nd\n0.612072 0.250000 0.000000 Nd\n0.887245 0.961078 0.750000 Nd\n0.887245 0.538922 0.250000 Nd\n0.112755 0.461078 0.750000 Nd\n0.112755 0.038922 0.250000 Nd\n0.114272 0.250000 0.000000 Si\n0.885728 0.750000 0.000000 Si\n0.885728 0.750000 0.500000 Si\n0.114272 0.250000 0.500000 Si\n0.596089 0.579164 0.750000 Te\n0.596089 0.920836 0.250000 Te\n0.403911 0.079164 0.750000 Te\n0.403911 0.420836 0.250000 Te\n0.269527 0.077117 0.464373 O\n0.269527 0.422883 0.535627 O\n0.730473 0.577117 0.035627 O\n0.730473 0.922883 0.964373 O\n0.730473 0.922883 0.535627 O\n0.730473 0.577117 0.464373 O\n0.269527 0.422883 0.964373 O\n0.269527 0.077117 0.035627 O\n0.047854 0.769300 0.384829 O\n0.047854 0.769300 0.115171 O\n0.952146 0.269300 0.115171 O\n0.952146 0.230700 0.884829 O\n0.952146 0.230700 0.615171 O\n0.952146 0.269300 0.384829 O\n0.047854 0.730700 0.884829 O\n0.047854 0.730700 0.615171 O\n",
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"formula_full": "Nd8 Si4 Te4 O16",
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{
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"structure_string": "Rb2 Au2 Br8\n1.0\n6.374775 0.000000 0.000000\n0.000000 7.683372 0.000000\n0.000000 5.899514 9.203424\nRb Au Br\n2 2 8\ndirect\n0.000000 0.500000 0.500000 Rb\n0.500000 0.500000 0.000000 Rb\n0.500000 0.000000 0.500000 Au\n0.000000 0.000000 0.000000 Au\n0.218597 0.961362 0.670118 Br\n0.718597 0.038638 0.829882 Br\n0.781403 0.038638 0.329882 Br\n0.281403 0.961362 0.170118 Br\n0.984957 0.619737 0.121475 Br\n0.484957 0.380263 0.378525 Br\n0.015043 0.380263 0.878525 Br\n0.515043 0.619737 0.621475 Br\n",
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