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{
"id": "mp-758820",
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"structure_string": "Li7 Ni12 O24\n1.0\n4.252460 6.373984 0.000000\n-4.252460 6.373984 0.000000\n0.000000 6.260364 7.469469\nLi Ni O\n7 12 24\ndirect\n0.840820 0.159180 0.500000 Li\n0.745536 0.746718 0.755276 Li\n0.498514 0.501486 0.500000 Li\n0.614893 0.925955 0.235214 Li\n0.303113 0.696887 0.000000 Li\n0.253282 0.254464 0.244724 Li\n0.074045 0.385107 0.764786 Li\n0.702225 0.041808 0.876623 Ni\n0.958192 0.297775 0.123377 Ni\n0.878148 0.869455 0.379441 Ni\n0.793814 0.455662 0.621167 Ni\n0.619885 0.623920 0.128536 Ni\n0.544338 0.206186 0.378833 Ni\n0.458843 0.786486 0.624169 Ni\n0.376080 0.380115 0.871464 Ni\n0.213514 0.541157 0.375831 Ni\n0.130545 0.121852 0.620559 Ni\n0.037979 0.712725 0.872784 Ni\n0.287275 0.962021 0.127216 Ni\n0.915837 0.935853 0.711661 O\n0.855976 0.532089 0.954236 O\n0.977991 0.630052 0.550425 O\n0.608220 0.277434 0.701631 O\n0.900849 0.229571 0.783025 O\n0.781947 0.812331 0.056633 O\n0.516061 0.840259 0.965298 O\n0.722566 0.391780 0.298369 O\n0.648801 0.948410 0.559765 O\n0.770429 0.099151 0.216975 O\n0.542159 0.567890 0.801127 O\n0.676269 0.680301 0.461968 O\n0.319699 0.323731 0.538032 O\n0.432110 0.457841 0.198873 O\n0.223475 0.886144 0.791005 O\n0.369948 0.022009 0.449575 O\n0.291276 0.599613 0.695715 O\n0.467911 0.144024 0.045764 O\n0.187669 0.218053 0.943367 O\n0.113856 0.776525 0.208995 O\n0.400387 0.708724 0.304285 O\n0.051590 0.351199 0.440235 O\n0.159741 0.483939 0.034702 O\n0.064147 0.084163 0.288339 O\n",
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{
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{
"id": "mp-1198435",
"created_at": "2022-09-04T14:41:12.842535Z",
"structure_string": "K7 Na1 Te4 O32\n1.0\n-3.403234 7.987170 8.630154\n3.403234 -7.987170 8.630154\n3.403234 7.987170 -8.630154\nK Na Te O\n7 1 4 32\ndirect\n0.297301 0.797301 0.500000 K\n0.702699 0.202699 0.500000 K\n0.124759 0.624759 0.500000 K\n0.875241 0.375241 0.500000 K\n0.265161 0.500000 0.765161 K\n0.734839 0.500000 0.234839 K\n0.500000 0.000000 0.500000 K\n0.000000 0.000000 0.000000 Na\n0.307471 0.208879 0.098592 Te\n0.889713 0.791121 0.098592 Te\n0.110287 0.208879 0.901408 Te\n0.692529 0.791121 0.901408 Te\n0.283753 0.283753 0.000000 O\n0.716247 0.716247 0.000000 O\n0.132347 0.132347 0.000000 O\n0.867653 0.867653 0.000000 O\n0.471965 0.294721 0.177244 O\n0.882523 0.705279 0.177244 O\n0.117477 0.294721 0.822756 O\n0.528035 0.705279 0.822756 O\n0.296863 0.121909 0.174954 O\n0.053044 0.878091 0.174954 O\n0.946956 0.121909 0.825046 O\n0.703137 0.878091 0.825046 O\n0.312472 0.932742 0.825219 O\n0.892477 0.067258 0.379731 O\n0.107523 0.487254 0.174781 O\n0.687528 0.512746 0.620269 O\n0.687528 0.067258 0.174781 O\n0.107523 0.932742 0.620269 O\n0.892477 0.512746 0.825219 O\n0.312472 0.487254 0.379731 O\n0.099650 0.594855 0.694505 O\n0.099650 0.405145 0.504795 O\n0.900350 0.405145 0.305495 O\n0.900350 0.594855 0.495205 O\n0.443647 0.993468 0.264294 O\n0.270826 0.006532 0.450180 O\n0.729174 0.179354 0.735706 O\n0.556353 0.820646 0.549820 O\n0.556353 0.006532 0.735706 O\n0.729174 0.993468 0.549820 O\n0.270826 0.820646 0.264294 O\n0.443647 0.179354 0.450180 O\n",
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"formula_full": "K7 Na1 Te4 O32",
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{
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"created_at": "2022-09-04T14:41:12.862159Z",
"structure_string": "Pr1 Fe4 Sb12\n1.0\n-4.597048 4.597048 4.597048\n4.597048 -4.597048 4.597048\n4.597048 4.597048 -4.597048\nPr Fe Sb\n1 4 12\ndirect\n0.000000 0.000000 0.000000 Pr\n0.000000 0.000000 0.500000 Fe\n0.500000 0.000000 0.000000 Fe\n0.000000 0.500000 0.000000 Fe\n0.500000 0.500000 0.500000 Fe\n0.334609 0.171748 0.837139 Sb\n0.665391 0.828252 0.162861 Sb\n0.665391 0.502530 0.837139 Sb\n0.334609 0.497470 0.162861 Sb\n0.171748 0.837139 0.334609 Sb\n0.828252 0.162861 0.665391 Sb\n0.502530 0.837139 0.665391 Sb\n0.497470 0.162861 0.334609 Sb\n0.837139 0.334609 0.171748 Sb\n0.162861 0.665391 0.828252 Sb\n0.837139 0.665391 0.502530 Sb\n0.162861 0.334609 0.497470 Sb\n",
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"volume": 388.5949090866823,
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"formula_full": "Pr1 Fe4 Sb12",
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{
"id": "mp-1205849",
"created_at": "2022-09-04T14:41:12.745742Z",
"structure_string": "Sm3 Ni3 Sn3\n1.0\n3.689140 -6.389778 0.000000\n3.689140 6.389778 0.000000\n0.000000 0.000000 3.992912\nSm Ni Sn\n3 3 3\ndirect\n0.591700 0.000000 0.000000 Sm\n0.000000 0.591700 0.000000 Sm\n0.408300 0.408300 0.000000 Sm\n0.333333 0.666667 0.500000 Ni\n0.666667 0.333333 0.500000 Ni\n0.000000 0.000000 0.000000 Ni\n0.252403 0.000000 0.500000 Sn\n0.000000 0.252403 0.500000 Sn\n0.747597 0.747597 0.500000 Sn\n",
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{
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"structure_string": "Co4 P10 O32\n1.0\n6.626590 0.000000 0.000000\n0.000000 4.889074 0.000000\n0.000000 0.382543 18.507553\nCo P O\n4 10 32\ndirect\n0.822455 0.758847 0.406658 Co\n0.177545 0.241153 0.593342 Co\n0.177545 0.758847 0.906658 Co\n0.822455 0.241153 0.093342 Co\n0.452479 0.268971 0.870677 P\n0.547521 0.268971 0.370677 P\n0.124379 0.249033 0.425554 P\n0.253082 0.000000 0.750000 P\n0.746918 0.000000 0.250000 P\n0.875621 0.750967 0.574446 P\n0.547521 0.731029 0.129323 P\n0.875621 0.249033 0.925554 P\n0.452479 0.731029 0.629323 P\n0.124379 0.750967 0.074446 P\n0.974867 0.435869 0.386917 O\n0.055450 0.054297 0.067679 O\n0.025133 0.435869 0.886917 O\n0.784152 0.650646 0.504163 O\n0.689507 0.774227 0.631274 O\n0.652804 0.070246 0.421470 O\n0.594072 0.792263 0.212745 O\n0.405928 0.792263 0.712745 O\n0.347196 0.070246 0.921470 O\n0.944550 0.054297 0.567679 O\n0.215848 0.349354 0.495837 O\n0.871180 0.851562 0.306508 O\n0.652804 0.929754 0.078530 O\n0.689507 0.225773 0.868726 O\n0.310493 0.774227 0.131274 O\n0.215848 0.650646 0.004163 O\n0.310493 0.225773 0.368726 O\n0.580002 0.427845 0.117516 O\n0.419998 0.572155 0.882484 O\n0.871180 0.148438 0.193492 O\n0.405928 0.207737 0.787255 O\n0.944550 0.945703 0.932321 O\n0.025133 0.564131 0.613083 O\n0.128820 0.851562 0.806508 O\n0.784152 0.349354 0.995837 O\n0.055450 0.945703 0.432321 O\n0.974867 0.564131 0.113083 O\n0.594072 0.207737 0.287255 O\n0.580002 0.572155 0.382484 O\n0.128820 0.148438 0.693492 O\n0.347196 0.929754 0.578530 O\n0.419998 0.427845 0.617516 O\n",
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{
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{
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{
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{
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{
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"formula_full": "Sm1 Y1 Co10",
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},
{
"id": "mp-1446433",
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"structure_string": "Ca4 W2 N4\n1.0\n2.586502 5.520315 0.000000\n-2.586502 5.520315 0.000000\n0.000000 3.009740 5.884702\nCa W N\n4 2 4\ndirect\n0.322064 0.322064 0.629281 Ca\n0.677936 0.677936 0.370719 Ca\n0.974834 0.974834 0.767608 Ca\n0.025166 0.025166 0.232392 Ca\n0.643673 0.643673 0.869411 W\n0.356327 0.356327 0.130589 W\n0.816819 0.816819 0.614297 N\n0.183181 0.183181 0.385703 N\n0.502502 0.502502 0.218222 N\n0.497498 0.497498 0.781778 N\n",
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}
]
}