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{
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{
"id": "mp-1391360",
"created_at": "2022-09-04T14:39:25.010437Z",
"structure_string": "Ca1 Fe1 W1 O6\n1.0\n2.771690 4.802462 0.000000\n-2.771690 4.802462 0.000000\n0.000000 3.199503 4.527190\nCa Fe W O\n1 1 1 6\ndirect\n0.751196 0.751196 0.732468 Ca\n0.499988 0.499988 0.474886 Fe\n0.000100 0.000100 0.975255 W\n0.246105 0.246105 0.721053 O\n0.753642 0.753642 0.226625 O\n0.251816 0.756141 0.214927 O\n0.756141 0.251816 0.214927 O\n0.240041 0.750573 0.730401 O\n0.750573 0.240041 0.730401 O\n",
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{
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"structure_string": "Li40 Mn8 H8 O32\n1.0\n8.814673 0.000000 0.000000\n0.000000 9.161645 0.000000\n0.000000 0.000000 10.921142\nLi Mn H O\n40 8 8 32\ndirect\n0.978945 0.580208 0.195448 Li\n0.978945 0.919792 0.195448 Li\n0.067263 0.073257 0.434413 Li\n0.067263 0.426743 0.434413 Li\n0.071045 0.750000 0.438878 Li\n0.119852 0.250000 0.981017 Li\n0.110068 0.568249 0.990423 Li\n0.110068 0.931751 0.990423 Li\n0.203125 0.576785 0.639764 Li\n0.203125 0.923215 0.639764 Li\n0.296875 0.076785 0.139764 Li\n0.296875 0.423215 0.139764 Li\n0.389932 0.068249 0.490423 Li\n0.389932 0.431751 0.490423 Li\n0.380148 0.750000 0.481017 Li\n0.428955 0.250000 0.938878 Li\n0.432737 0.573257 0.934413 Li\n0.432737 0.926743 0.934413 Li\n0.521055 0.080208 0.695448 Li\n0.521055 0.419792 0.695448 Li\n0.478945 0.580208 0.304552 Li\n0.478945 0.919792 0.304552 Li\n0.567263 0.073257 0.065587 Li\n0.567263 0.426743 0.065587 Li\n0.571045 0.750000 0.061122 Li\n0.619852 0.250000 0.518983 Li\n0.610068 0.568249 0.509577 Li\n0.610068 0.931751 0.509577 Li\n0.703125 0.576785 0.860236 Li\n0.703125 0.923215 0.860236 Li\n0.796875 0.076785 0.360236 Li\n0.796875 0.423215 0.360236 Li\n0.889932 0.068249 0.009577 Li\n0.889932 0.431751 0.009577 Li\n0.880148 0.750000 0.018983 Li\n0.928955 0.250000 0.561122 Li\n0.932737 0.926743 0.565587 Li\n0.932737 0.573257 0.565587 Li\n0.021055 0.080208 0.804552 Li\n0.021055 0.419792 0.804552 Li\n0.018931 0.250000 0.214939 Mn\n0.209415 0.250000 0.656149 Mn\n0.290585 0.750000 0.156149 Mn\n0.481069 0.750000 0.714939 Mn\n0.518931 0.250000 0.285061 Mn\n0.709415 0.250000 0.843851 Mn\n0.790585 0.750000 0.343851 Mn\n0.981069 0.750000 0.785061 Mn\n0.172490 0.578610 0.331444 H\n0.172490 0.921390 0.331444 H\n0.327510 0.078610 0.831444 H\n0.327510 0.421390 0.831444 H\n0.672490 0.578610 0.168556 H\n0.672490 0.921390 0.168556 H\n0.827510 0.078610 0.668556 H\n0.827510 0.421390 0.668556 H\n0.062435 0.750000 0.616512 O\n0.079375 0.418107 0.113533 O\n0.079375 0.081893 0.113533 O\n0.062207 0.414690 0.618319 O\n0.062207 0.085310 0.618319 O\n0.077063 0.750000 0.103097 O\n0.232682 0.063677 0.877417 O\n0.232682 0.436323 0.877417 O\n0.267318 0.563677 0.377417 O\n0.267318 0.936323 0.377417 O\n0.422937 0.250000 0.603097 O\n0.437793 0.585310 0.118319 O\n0.437793 0.914690 0.118319 O\n0.420625 0.581893 0.613533 O\n0.420625 0.918107 0.613533 O\n0.437565 0.250000 0.116512 O\n0.562435 0.750000 0.883488 O\n0.579375 0.081893 0.386467 O\n0.579375 0.418107 0.386467 O\n0.562207 0.085310 0.881681 O\n0.562207 0.414690 0.881681 O\n0.577063 0.750000 0.396903 O\n0.732682 0.063677 0.622583 O\n0.732682 0.436323 0.622583 O\n0.767318 0.563677 0.122583 O\n0.767318 0.936323 0.122583 O\n0.922937 0.250000 0.896903 O\n0.937793 0.914690 0.381681 O\n0.937793 0.585310 0.381681 O\n0.920625 0.918107 0.886467 O\n0.920625 0.581893 0.886467 O\n0.937565 0.250000 0.383488 O\n",
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"formula_full": "Li40 Mn8 H8 O32",
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"updated_at": "2021-11-28T01:34:38.153000Z",
"spacegroup": 62
},
{
"id": "mp-1245264",
"created_at": "2022-09-04T14:39:25.099747Z",
"structure_string": "Ta30 O75\n1.0\n12.213033 -0.108849 -0.148907\n-0.130654 11.835051 0.098158\n-0.125297 0.089710 11.721391\nTa O\n30 75\ndirect\n0.403792 0.650438 0.176287 Ta\n0.263341 0.676976 0.887455 Ta\n0.610380 0.570179 0.927167 Ta\n0.230576 0.390076 0.230148 Ta\n0.097356 0.769789 0.347730 Ta\n0.480329 0.838532 0.899840 Ta\n0.700843 0.086576 0.202541 Ta\n0.422377 0.527141 0.682273 Ta\n0.998894 0.741597 0.032643 Ta\n0.339203 0.714830 0.433859 Ta\n0.005710 0.548237 0.859353 Ta\n0.726537 0.515589 0.671022 Ta\n0.876289 0.026713 0.962596 Ta\n0.222564 0.042508 0.636886 Ta\n0.568328 0.296336 0.088823 Ta\n0.346421 0.948928 0.090570 Ta\n0.239594 0.330486 0.536248 Ta\n0.199233 0.091979 0.329199 Ta\n0.277846 0.242323 0.997828 Ta\n0.671538 0.219376 0.799821 Ta\n0.087572 0.727064 0.623708 Ta\n0.694080 0.665484 0.261690 Ta\n0.957787 0.534803 0.206013 Ta\n0.827343 0.790185 0.514462 Ta\n0.518841 0.053027 0.681549 Ta\n0.985798 0.470316 0.514888 Ta\n0.736233 0.373083 0.280381 Ta\n0.926156 0.174633 0.404332 Ta\n0.507257 0.980563 0.435482 Ta\n0.966437 0.974482 0.662266 Ta\n0.704211 0.356927 0.721908 O\n0.240474 0.021196 0.475321 O\n0.942011 0.097345 0.541138 O\n0.179797 0.738090 0.752827 O\n0.945055 0.793916 0.649288 O\n0.042214 0.119104 0.312972 O\n0.379803 0.640274 0.571595 O\n0.266361 0.412304 0.394065 O\n0.308503 0.556463 0.777188 O\n0.959405 0.798595 0.425282 O\n0.778637 0.131267 0.873331 O\n0.589211 0.729199 0.945686 O\n0.928307 0.421108 0.851857 O\n0.020181 0.584291 0.694871 O\n0.913229 0.967281 0.809558 O\n0.663982 0.115810 0.667326 O\n0.729058 0.772653 0.376788 O\n0.934634 0.694867 0.891328 O\n0.767134 0.663186 0.596497 O\n0.738555 0.244208 0.168840 O\n0.189119 0.216203 0.434923 O\n0.349921 0.798362 0.171405 O\n0.158486 0.552790 0.905665 O\n0.812782 0.930733 0.573816 O\n0.606835 0.004629 0.315339 O\n0.229421 0.677849 0.313975 O\n0.730208 0.568789 0.825462 O\n0.405576 0.737872 0.802199 O\n0.934505 0.883281 0.034309 O\n0.105186 0.904390 0.617405 O\n0.851174 0.456948 0.586779 O\n0.786820 0.280364 0.396644 O\n0.506440 0.505753 0.833721 O\n0.979454 0.119543 0.009841 O\n0.813724 0.656062 0.171503 O\n0.265168 0.272543 0.852419 O\n0.133311 0.912002 0.300294 O\n0.196439 0.770902 0.498074 O\n0.142461 0.754575 0.991531 O\n0.277848 0.076586 0.017791 O\n0.120623 0.406990 0.590805 O\n0.260530 0.196068 0.633206 O\n0.987285 0.322799 0.440526 O\n0.757538 0.009222 0.082670 O\n0.440303 0.640548 0.343688 O\n0.561250 0.679434 0.169912 O\n0.318912 0.017893 0.239830 O\n0.321880 0.852417 0.948830 O\n0.582978 0.355197 0.245912 O\n0.085593 0.076299 0.713807 O\n0.490221 0.943476 0.040988 O\n0.087604 0.453138 0.239080 O\n0.635766 0.283747 0.945533 O\n0.988448 0.564115 0.046675 O\n0.191763 0.350886 0.070195 O\n0.819789 0.085931 0.313990 O\n0.922014 0.524401 0.368344 O\n0.559139 0.142993 0.137138 O\n0.574993 0.924238 0.562748 O\n0.369985 0.637433 0.012601 O\n0.513321 0.170074 0.791504 O\n0.845312 0.426766 0.174706 O\n0.420763 0.303808 0.042349 O\n0.551738 0.934028 0.796124 O\n0.695697 0.526970 0.336273 O\n0.064402 0.617515 0.492413 O\n0.356046 0.996700 0.703096 O\n0.581175 0.530375 0.623674 O\n0.402352 0.860832 0.416428 O\n0.255623 0.227205 0.239256 O\n0.023180 0.701773 0.211587 O\n0.374160 0.395963 0.610603 O\n0.340941 0.497045 0.190088 O\n0.467015 0.105319 0.521018 O\n0.617215 0.475435 0.053618 O\n",
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{
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"structure_string": "Sc4 Ni4 Sn2\n1.0\n7.146639 0.000000 0.000000\n0.000000 7.146639 0.000000\n0.000000 0.000000 3.353580\nSc Ni Sn\n4 4 2\ndirect\n0.669177 0.169177 0.500000 Sc\n0.169177 0.330823 0.500000 Sc\n0.830823 0.669177 0.500000 Sc\n0.330823 0.830823 0.500000 Sc\n0.876503 0.376503 0.000000 Ni\n0.376503 0.123497 0.000000 Ni\n0.623497 0.876503 0.000000 Ni\n0.123497 0.623497 0.000000 Ni\n0.000000 0.000000 0.000000 Sn\n0.500000 0.500000 0.000000 Sn\n",
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{
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{
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