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{
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{
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{
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{
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"structure_string": "K4 Se4 O14\n1.0\n3.893165 6.622382 0.000000\n-3.893165 6.622382 0.000000\n0.000000 0.429054 7.670279\nK Se O\n4 4 14\ndirect\n0.794995 0.495975 0.635739 K\n0.504025 0.205005 0.864261 K\n0.205005 0.504025 0.364261 K\n0.495975 0.794995 0.135739 K\n0.285230 0.925109 0.631172 Se\n0.074891 0.714770 0.868828 Se\n0.714770 0.074891 0.368828 Se\n0.925109 0.285230 0.131172 Se\n0.352920 0.759335 0.477276 O\n0.240665 0.647080 0.022724 O\n0.647080 0.240665 0.522724 O\n0.759335 0.352920 0.977276 O\n0.462035 0.857917 0.773542 O\n0.142083 0.537965 0.726458 O\n0.537965 0.142083 0.226458 O\n0.857917 0.462035 0.273542 O\n0.185185 0.159101 0.564174 O\n0.840899 0.814815 0.935826 O\n0.814815 0.840899 0.435826 O\n0.159101 0.185185 0.064174 O\n0.068185 0.931815 0.750000 O\n0.931815 0.068185 0.250000 O\n",
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{
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"structure_string": "Lu2 Mn10\n1.0\n2.422525 -4.195936 0.000000\n2.422525 4.195936 0.000000\n0.000000 0.000000 7.957781\nLu Mn\n2 10\ndirect\n0.666667 0.333333 0.757648 Lu\n0.333333 0.666667 0.257648 Lu\n0.828746 0.171254 0.448972 Mn\n0.657493 0.828746 0.948972 Mn\n0.000000 0.000000 0.202559 Mn\n0.000000 0.000000 0.702559 Mn\n0.333333 0.666667 0.628878 Mn\n0.666667 0.333333 0.128878 Mn\n0.171254 0.828746 0.948972 Mn\n0.342507 0.171254 0.448972 Mn\n0.828746 0.657493 0.448972 Mn\n0.171254 0.342507 0.948972 Mn\n",
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{
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"created_at": "2022-09-04T14:46:56.223215Z",
"structure_string": "Cs2 Ce2 Cd2 Se6\n1.0\n2.223353 -8.093505 0.000000\n2.223353 8.093505 0.000000\n0.000000 0.000000 11.563236\nCs Ce Cd Se\n2 2 2 6\ndirect\n0.742431 0.257569 0.250000 Cs\n0.257569 0.742431 0.750000 Cs\n0.000000 0.000000 0.000000 Ce\n0.000000 0.000000 0.500000 Ce\n0.460660 0.539340 0.250000 Cd\n0.539340 0.460660 0.750000 Cd\n0.059687 0.940313 0.250000 Se\n0.379564 0.620436 0.447393 Se\n0.620436 0.379564 0.947393 Se\n0.620436 0.379564 0.552607 Se\n0.379564 0.620436 0.052607 Se\n0.940313 0.059687 0.750000 Se\n",
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{
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{
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{
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"structure_string": "K8 Zr4 S8 O40 F8\n1.0\n7.596943 0.000000 0.000000\n0.000000 10.885151 0.000000\n0.000000 4.453745 13.247014\nK Zr S O F\n8 4 8 40 8\ndirect\n0.755395 0.976170 0.436307 K\n0.255395 0.023830 0.063693 K\n0.244605 0.023830 0.563693 K\n0.744605 0.976170 0.936307 K\n0.012241 0.348572 0.826492 K\n0.512241 0.651428 0.673508 K\n0.987759 0.651428 0.173508 K\n0.487759 0.348572 0.326492 K\n0.038650 0.729777 0.829090 Zr\n0.538650 0.270223 0.670910 Zr\n0.961350 0.270223 0.170910 Zr\n0.461350 0.729777 0.329090 Zr\n0.001343 0.666634 0.639769 S\n0.501343 0.333366 0.860231 S\n0.998657 0.333366 0.360231 S\n0.498657 0.666634 0.139769 S\n0.740811 0.971502 0.682829 S\n0.240811 0.028498 0.817171 S\n0.259189 0.028498 0.317171 S\n0.759189 0.971502 0.182829 S\n0.885535 0.626745 0.734449 O\n0.385535 0.373255 0.765551 O\n0.114465 0.373255 0.265551 O\n0.614465 0.626745 0.234449 O\n0.139958 0.751901 0.671608 O\n0.639958 0.248099 0.828392 O\n0.860042 0.248099 0.328392 O\n0.360042 0.751901 0.171608 O\n0.902333 0.749543 0.553913 O\n0.402333 0.250457 0.946087 O\n0.097667 0.250457 0.446087 O\n0.597667 0.749543 0.053913 O\n0.084429 0.555157 0.623720 O\n0.584429 0.444843 0.876280 O\n0.915571 0.444843 0.376280 O\n0.415571 0.555157 0.123720 O\n0.815463 0.866210 0.773092 O\n0.315463 0.133790 0.726908 O\n0.184537 0.133790 0.226908 O\n0.684537 0.866210 0.273092 O\n0.675625 0.073574 0.727861 O\n0.175625 0.926426 0.772139 O\n0.324375 0.926426 0.272139 O\n0.824375 0.073574 0.227861 O\n0.590949 0.920768 0.640851 O\n0.090949 0.079232 0.859149 O\n0.409051 0.079232 0.359149 O\n0.909051 0.920768 0.140851 O\n0.879837 0.024624 0.609157 O\n0.379837 0.975376 0.890843 O\n0.120163 0.975376 0.390843 O\n0.620163 0.024624 0.109157 O\n0.791794 0.640586 0.913183 O\n0.291794 0.359414 0.586817 O\n0.208206 0.359414 0.086817 O\n0.708206 0.640586 0.413183 O\n0.826156 0.269596 0.659389 O\n0.326156 0.730404 0.840611 O\n0.173844 0.730404 0.340611 O\n0.673844 0.269596 0.159389 O\n0.017588 0.773930 0.959984 F\n0.517588 0.226070 0.540016 F\n0.982412 0.226070 0.040016 F\n0.482412 0.773930 0.459984 F\n0.120771 0.544874 0.887826 F\n0.620771 0.455126 0.612174 F\n0.879229 0.455126 0.112174 F\n0.379229 0.544874 0.387826 F\n",
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{
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{
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},
{
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"formula_full": "Ti6 Al16 Co7",
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"updated_at": "2021-11-28T01:37:49.860000Z",
"spacegroup": 225
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]
}