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{
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{
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{
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{
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{
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"structure_string": "Cr8 P12 O48\n1.0\n8.572799 0.000000 0.000000\n0.000000 8.433457 0.000000\n0.000000 8.249929 11.864553\nCr P O\n8 12 48\ndirect\n0.466663 0.865876 0.380771 Cr\n0.530449 0.372415 0.881242 Cr\n0.533337 0.134124 0.619229 Cr\n0.469551 0.627585 0.118758 Cr\n0.969551 0.372415 0.381242 Cr\n0.030449 0.627585 0.618758 Cr\n0.966663 0.134124 0.119229 Cr\n0.033337 0.865876 0.880771 Cr\n0.612314 0.966271 0.143736 P\n0.112314 0.033729 0.356264 P\n0.247936 0.458999 0.008022 P\n0.747936 0.541001 0.491978 P\n0.617700 0.249500 0.354256 P\n0.252064 0.458999 0.508022 P\n0.887686 0.966271 0.643736 P\n0.387686 0.033729 0.856264 P\n0.382300 0.750500 0.645744 P\n0.117700 0.750500 0.145744 P\n0.752064 0.541001 0.991978 P\n0.882300 0.249500 0.854256 P\n0.576459 0.099865 0.328844 O\n0.125891 0.479987 0.426781 O\n0.185357 0.478212 0.600897 O\n0.491393 0.908846 0.237357 O\n0.332378 0.261875 0.565898 O\n0.991393 0.091154 0.262643 O\n0.706399 0.290563 0.831002 O\n0.519933 0.433722 0.273177 O\n0.924374 0.173539 0.975512 O\n0.075626 0.826461 0.024488 O\n0.575626 0.173539 0.475512 O\n0.725583 0.988541 0.679431 O\n0.625891 0.520013 0.073219 O\n0.374109 0.479987 0.926781 O\n0.008607 0.908846 0.737357 O\n0.424374 0.826461 0.524488 O\n0.885497 0.805802 0.622564 O\n0.667622 0.738125 0.434102 O\n0.793601 0.290563 0.331002 O\n0.832378 0.738125 0.934102 O\n0.314643 0.478212 0.100897 O\n0.274417 0.011459 0.320569 O\n0.019933 0.566278 0.226823 O\n0.508607 0.091154 0.762643 O\n0.167622 0.261875 0.065898 O\n0.628933 0.377331 0.565045 O\n0.874109 0.520013 0.573219 O\n0.814643 0.521788 0.399103 O\n0.938229 0.160162 0.537773 O\n0.480067 0.566278 0.726823 O\n0.561771 0.160162 0.037773 O\n0.923541 0.099865 0.828844 O\n0.438229 0.839838 0.962227 O\n0.076459 0.900135 0.171156 O\n0.871067 0.377331 0.065045 O\n0.128933 0.622669 0.934955 O\n0.114503 0.194198 0.377436 O\n0.293601 0.709437 0.168998 O\n0.225583 0.011459 0.820569 O\n0.206399 0.709437 0.668998 O\n0.685357 0.521788 0.899103 O\n0.980067 0.433722 0.773177 O\n0.423541 0.900135 0.671156 O\n0.614503 0.805802 0.122564 O\n0.385497 0.194198 0.877436 O\n0.061771 0.839838 0.462227 O\n0.774417 0.988541 0.179431 O\n0.371067 0.622669 0.434955 O\n",
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{
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{
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"elements": [
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],
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"formula_full": "Mo2 W1 Se4 S2",
"formula_reduced": "Mo2W(Se2S)2",
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"spacegroup": 156
},
{
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"structure_string": "Ge2 Br4 F20\n1.0\n14.185896 0.000000 0.000000\n0.000000 5.132149 0.000000\n0.000000 2.249846 5.993839\nGe Br F\n2 4 20\ndirect\n0.002252 0.993585 0.998212 Ge\n0.502930 0.494835 0.503410 Ge\n0.366590 0.155636 0.173398 Br\n0.865512 0.347299 0.323151 Br\n0.132387 0.654992 0.667101 Br\n0.633811 0.844100 0.833828 Br\n0.672906 0.948148 0.059268 F\n0.176285 0.553345 0.438256 F\n0.322772 0.059436 0.945455 F\n0.823013 0.443520 0.560837 F\n0.715040 0.556992 0.898541 F\n0.216612 0.937529 0.601831 F\n0.964975 0.698881 0.267769 F\n0.460285 0.792542 0.240719 F\n0.036684 0.285340 0.745727 F\n0.535120 0.201120 0.769189 F\n0.902951 0.238989 0.048487 F\n0.407367 0.259807 0.451087 F\n0.097778 0.771398 0.950248 F\n0.598026 0.731545 0.548662 F\n0.918220 0.896225 0.837083 F\n0.421457 0.603663 0.664451 F\n0.082805 0.112994 0.164849 F\n0.581412 0.378906 0.338657 F\n0.787610 0.057115 0.406183 F\n0.284873 0.442855 0.101481 F\n",
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},
{
"id": "mp-1245901",
"created_at": "2022-09-04T14:47:12.944448Z",
"structure_string": "Rb2 Sn2 N2\n1.0\n3.511268 0.000000 0.000000\n-1.755634 3.040844 0.000000\n0.000000 0.000000 12.791503\nRb Sn N\n2 2 2\ndirect\n0.666669 0.333339 0.749555 Rb\n0.333331 0.666661 0.249555 Rb\n0.999997 0.999993 0.506773 Sn\n0.000003 0.000007 0.006773 Sn\n0.333331 0.666661 0.588312 N\n0.666669 0.333339 0.088312 N\n",
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],
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"volume": 136.57766902315564,
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"formula_full": "Rb2 Sn2 N2",
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"updated_at": "2021-11-28T01:37:55.595000Z",
"spacegroup": 186
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]
}