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{
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{
"id": "mp-675324",
"created_at": "2022-09-04T14:45:09.926675Z",
"structure_string": "Ba2 C2 O6\n1.0\n4.486155 0.000000 0.000000\n0.000000 5.466677 0.000000\n0.000000 0.000000 7.060908\nBa C O\n2 2 6\ndirect\n0.500000 0.010801 0.500000 Ba\n0.000000 0.510801 0.000000 Ba\n0.500000 0.000062 0.000000 C\n0.000000 0.500062 0.500000 C\n0.500000 0.237912 0.000000 O\n0.864701 0.371228 0.366255 O\n0.000000 0.737912 0.500000 O\n0.635299 0.871228 0.866255 O\n0.135299 0.371228 0.633745 O\n0.364701 0.871228 0.133745 O\n",
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"formula_full": "Ba2 C2 O6",
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"spacegroup": 34
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{
"id": "mp-2652",
"created_at": "2022-09-04T14:42:53.685599Z",
"structure_string": "Y16 O24\n1.0\n-5.351945 5.351945 5.351945\n5.351945 -5.351945 5.351945\n5.351945 5.351945 -5.351945\nY O\n16 24\ndirect\n0.717318 0.750000 0.467318 Y\n0.250000 0.032682 0.782682 Y\n0.467318 0.717318 0.750000 Y\n0.750000 0.467318 0.717318 Y\n0.032682 0.782682 0.250000 Y\n0.782682 0.250000 0.032682 Y\n0.282682 0.250000 0.532682 Y\n0.750000 0.967318 0.217318 Y\n0.532682 0.282682 0.250000 Y\n0.250000 0.532682 0.282682 Y\n0.967318 0.217318 0.750000 Y\n0.217318 0.750000 0.967318 Y\n0.500000 0.500000 0.000000 Y\n0.000000 0.000000 0.000000 Y\n0.000000 0.500000 0.500000 Y\n0.500000 0.000000 0.500000 Y\n0.229254 0.271877 0.760719 O\n0.011158 0.468535 0.739281 O\n0.270746 0.031465 0.042623 O\n0.739281 0.011158 0.468535 O\n0.271877 0.760719 0.229254 O\n0.228123 0.457377 0.488842 O\n0.457377 0.488842 0.228123 O\n0.468535 0.739281 0.011158 O\n0.042623 0.270746 0.031465 O\n0.031465 0.042623 0.270746 O\n0.760719 0.229254 0.271877 O\n0.488842 0.228123 0.457377 O\n0.770746 0.728123 0.239281 O\n0.988842 0.531465 0.260719 O\n0.729254 0.968535 0.957377 O\n0.260719 0.988842 0.531465 O\n0.511158 0.771877 0.542623 O\n0.239281 0.770746 0.728123 O\n0.968535 0.957377 0.729254 O\n0.957377 0.729254 0.968535 O\n0.531465 0.260719 0.988842 O\n0.542623 0.511158 0.771877 O\n0.771877 0.542623 0.511158 O\n0.728123 0.239281 0.770746 O\n",
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"elements": [
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{
"id": "mp-1213724",
"created_at": "2022-09-04T14:43:36.298533Z",
"structure_string": "Cs8 La4 Cl20\n1.0\n8.701094 0.000000 0.000000\n0.000000 9.281001 0.000000\n0.000000 0.000000 14.190241\nCs La Cl\n8 4 20\ndirect\n0.947858 0.006367 0.828297 Cs\n0.052142 0.993633 0.171703 Cs\n0.447858 0.993633 0.671703 Cs\n0.052142 0.506367 0.171703 Cs\n0.552142 0.006367 0.328297 Cs\n0.947858 0.493633 0.828297 Cs\n0.552142 0.493633 0.328297 Cs\n0.447858 0.506367 0.671703 Cs\n0.934263 0.750000 0.502305 La\n0.065737 0.250000 0.497695 La\n0.434263 0.250000 0.997695 La\n0.565737 0.750000 0.002305 La\n0.112193 0.750000 0.667490 Cl\n0.887807 0.250000 0.332510 Cl\n0.612193 0.250000 0.832510 Cl\n0.387807 0.750000 0.167490 Cl\n0.845540 0.038961 0.570119 Cl\n0.154460 0.961039 0.429881 Cl\n0.345540 0.961039 0.929881 Cl\n0.154460 0.538961 0.429881 Cl\n0.654460 0.038961 0.070119 Cl\n0.845540 0.461039 0.570119 Cl\n0.654460 0.461039 0.070119 Cl\n0.345540 0.538961 0.929881 Cl\n0.607207 0.750000 0.511828 Cl\n0.392793 0.250000 0.488172 Cl\n0.107207 0.250000 0.988172 Cl\n0.892793 0.750000 0.011828 Cl\n0.651854 0.750000 0.809896 Cl\n0.348146 0.250000 0.190104 Cl\n0.151854 0.250000 0.690104 Cl\n0.848146 0.750000 0.309896 Cl\n",
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{
"id": "mp-769070",
"created_at": "2022-09-04T14:41:07.956486Z",
"structure_string": "Ba4 Y16 Cl56\n1.0\n7.466963 0.000000 0.000000\n0.000000 9.371375 0.000000\n0.000000 0.000000 43.698498\nBa Y Cl\n4 16 56\ndirect\n0.226388 0.268096 0.716603 Ba\n0.273612 0.731904 0.216603 Ba\n0.726388 0.231904 0.283397 Ba\n0.773612 0.768096 0.783397 Ba\n0.245062 0.915002 0.621131 Y\n0.244402 0.581114 0.523604 Y\n0.235727 0.893470 0.330300 Y\n0.244401 0.245655 0.425823 Y\n0.255599 0.754345 0.925823 Y\n0.264273 0.106530 0.830300 Y\n0.255598 0.418886 0.023604 Y\n0.254938 0.084998 0.121131 Y\n0.745062 0.584998 0.378869 Y\n0.744402 0.918886 0.476396 Y\n0.735727 0.606530 0.669700 Y\n0.744401 0.254345 0.574177 Y\n0.755599 0.745655 0.074177 Y\n0.764273 0.393470 0.169700 Y\n0.755598 0.081114 0.976396 Y\n0.754938 0.415002 0.878869 Y\n0.038406 0.719186 0.648606 Cl\n0.045696 0.720733 0.364895 Cl\n0.119073 0.913600 0.793117 Cl\n0.017098 0.069444 0.453634 Cl\n0.019162 0.399333 0.550666 Cl\n0.034916 0.889178 0.096818 Cl\n0.028025 0.235444 0.997858 Cl\n0.030925 0.573590 0.897254 Cl\n0.069574 0.504103 0.187569 Cl\n0.231885 0.710643 0.284226 Cl\n0.256056 0.080551 0.377008 Cl\n0.245125 0.417836 0.474136 Cl\n0.238783 0.745164 0.572656 Cl\n0.239399 0.980022 0.176538 Cl\n0.260601 0.019978 0.676538 Cl\n0.261217 0.254836 0.072656 Cl\n0.254875 0.582164 0.974136 Cl\n0.243944 0.919449 0.877008 Cl\n0.268115 0.289357 0.784226 Cl\n0.430426 0.495897 0.687569 Cl\n0.469075 0.426410 0.397254 Cl\n0.471975 0.764556 0.497858 Cl\n0.465084 0.110822 0.596818 Cl\n0.480838 0.600667 0.050666 Cl\n0.482902 0.930556 0.953634 Cl\n0.380927 0.086400 0.293117 Cl\n0.454304 0.279267 0.864895 Cl\n0.461594 0.280814 0.148606 Cl\n0.538406 0.780814 0.351394 Cl\n0.545696 0.779267 0.635105 Cl\n0.619073 0.586400 0.206883 Cl\n0.517098 0.430556 0.546366 Cl\n0.519162 0.100667 0.449334 Cl\n0.534916 0.610822 0.903182 Cl\n0.528025 0.264556 0.002142 Cl\n0.530925 0.926410 0.102746 Cl\n0.569574 0.995897 0.812431 Cl\n0.731885 0.789357 0.715774 Cl\n0.756056 0.419449 0.622992 Cl\n0.745125 0.082164 0.525864 Cl\n0.738783 0.754836 0.427344 Cl\n0.739399 0.519978 0.823462 Cl\n0.760601 0.480022 0.323462 Cl\n0.761217 0.245164 0.927344 Cl\n0.754875 0.917836 0.025864 Cl\n0.743944 0.580551 0.122992 Cl\n0.768115 0.210643 0.215774 Cl\n0.930426 0.004103 0.312431 Cl\n0.969075 0.073590 0.602746 Cl\n0.971975 0.735444 0.502142 Cl\n0.965084 0.389178 0.403182 Cl\n0.980838 0.899333 0.949334 Cl\n0.982902 0.569444 0.046366 Cl\n0.880927 0.413600 0.706883 Cl\n0.954304 0.220733 0.135105 Cl\n0.961594 0.219186 0.851394 Cl\n",
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{
"id": "mp-752730",
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"structure_string": "Ba8 Ge4 O16\n1.0\n7.709139 0.000000 0.000000\n0.000000 6.046811 0.000000\n0.000000 6.045923 10.589782\nBa Ge O\n8 4 16\ndirect\n0.993622 0.443292 0.303172 Ba\n0.838607 0.168494 0.086076 Ba\n0.661393 0.168494 0.586076 Ba\n0.506378 0.443292 0.803172 Ba\n0.493622 0.556708 0.196828 Ba\n0.338607 0.831506 0.413924 Ba\n0.161393 0.831506 0.913924 Ba\n0.006378 0.556708 0.696828 Ba\n0.776907 0.829458 0.421569 Ge\n0.723093 0.829458 0.921569 Ge\n0.276907 0.170542 0.078431 Ge\n0.223093 0.170542 0.578431 Ge\n0.993732 0.171393 0.576954 O\n0.809127 0.627843 0.866464 O\n0.811217 0.712158 0.076965 O\n0.798705 0.145529 0.823948 O\n0.701295 0.145529 0.323948 O\n0.688783 0.712158 0.576965 O\n0.690873 0.627843 0.366464 O\n0.506268 0.171393 0.076954 O\n0.493732 0.828607 0.923046 O\n0.309127 0.372157 0.633536 O\n0.311217 0.287842 0.423035 O\n0.298705 0.854471 0.676052 O\n0.201295 0.854471 0.176052 O\n0.188783 0.287842 0.923035 O\n0.190873 0.372157 0.133536 O\n0.006268 0.828607 0.423046 O\n",
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{
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