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{
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{
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"created_at": "2022-09-04T14:40:14.690423Z",
"structure_string": "Bi7 S9 Cl3\n1.0\n4.387896 0.000000 0.000000\n0.000000 11.137385 0.000000\n0.000000 5.090326 12.150245\nBi S Cl\n7 9 3\ndirect\n0.500000 0.730548 0.334000 Bi\n0.500000 0.478196 0.830941 Bi\n0.500000 0.898095 0.761439 Bi\n0.000000 0.088218 0.333333 Bi\n0.000000 0.636433 0.017152 Bi\n0.000000 0.988966 0.067745 Bi\n0.000000 0.294890 0.614051 Bi\n0.000000 0.704555 0.208684 S\n0.000000 0.467834 0.698125 S\n0.000000 0.836459 0.420440 S\n0.000000 0.196885 0.122523 S\n0.000000 0.707480 0.793770 S\n0.500000 0.965659 0.194523 S\n0.000000 0.058889 0.769039 S\n0.500000 0.465675 0.038095 S\n0.500000 0.828397 0.970933 S\n0.500000 0.093069 0.475982 Cl\n0.500000 0.416013 0.482378 Cl\n0.500000 0.222788 0.891358 Cl\n",
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"volume": 593.7786712406515,
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"formula_full": "Bi7 S9 Cl3",
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{
"id": "mp-759551",
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"structure_string": "Fe18 O18 F18\n1.0\n3.096670 0.000000 0.000000\n0.000000 14.216297 0.000000\n0.000000 0.087038 14.240185\nFe O F\n18 18 18\ndirect\n0.000000 0.996177 0.988565 Fe\n0.000000 0.996931 0.340763 Fe\n0.000000 0.989250 0.663474 Fe\n0.500000 0.840424 0.188687 Fe\n0.500000 0.846001 0.498781 Fe\n0.500000 0.847067 0.830617 Fe\n0.000000 0.662439 0.005897 Fe\n0.000000 0.664599 0.320873 Fe\n0.000000 0.653836 0.663744 Fe\n0.500000 0.497366 0.511286 Fe\n0.500000 0.511159 0.166632 Fe\n0.500000 0.498151 0.816482 Fe\n0.000000 0.320895 0.996020 Fe\n0.000000 0.318932 0.333991 Fe\n0.000000 0.341915 0.666342 Fe\n0.500000 0.180452 0.164612 Fe\n0.500000 0.165582 0.484976 Fe\n0.500000 0.164825 0.845609 Fe\n0.500000 0.942599 0.268199 O\n0.500000 0.935858 0.602989 O\n0.500000 0.928857 0.939518 O\n0.000000 0.890798 0.434238 O\n0.000000 0.899078 0.770232 O\n0.000000 0.766665 0.230519 O\n0.500000 0.596726 0.270366 O\n0.500000 0.602298 0.600348 O\n0.000000 0.568056 0.098612 O\n0.000000 0.567224 0.772222 O\n0.000000 0.431747 0.562122 O\n0.500000 0.393457 0.732804 O\n0.500000 0.270250 0.268456 O\n0.500000 0.274512 0.928582 O\n0.000000 0.232582 0.098763 O\n0.000000 0.236898 0.441010 O\n0.000000 0.101487 0.899018 O\n0.500000 0.065212 0.399645 O\n0.000000 0.898031 0.101947 F\n0.000000 0.766830 0.569840 F\n0.000000 0.760166 0.900349 F\n0.500000 0.734453 0.059254 F\n0.500000 0.731988 0.733906 F\n0.500000 0.724539 0.402602 F\n0.500000 0.603564 0.936549 F\n0.000000 0.565706 0.434825 F\n0.000000 0.435532 0.228011 F\n0.000000 0.441854 0.903848 F\n0.500000 0.401573 0.066013 F\n0.500000 0.404979 0.393789 F\n0.500000 0.264305 0.605480 F\n0.000000 0.227544 0.764018 F\n0.000000 0.104987 0.226694 F\n0.000000 0.103548 0.570209 F\n0.500000 0.061624 0.067036 F\n0.500000 0.068471 0.730635 F\n",
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{
"id": "mp-1178083",
"created_at": "2022-09-04T14:40:15.268219Z",
"structure_string": "Li12 Cr1 Ni3 P4 C4 O28\n1.0\n6.442190 0.000000 0.000000\n0.000000 8.435856 0.000000\n0.000000 0.821090 9.946810\nLi Cr Ni P C O\n12 1 3 4 4 28\ndirect\n0.000000 0.896568 0.618917 Li\n0.000000 0.904033 0.115851 Li\n0.229208 0.724491 0.875403 Li\n0.770792 0.724491 0.875403 Li\n0.227881 0.724889 0.375603 Li\n0.772119 0.724889 0.375603 Li\n0.730809 0.275506 0.628012 Li\n0.269191 0.275506 0.628012 Li\n0.729776 0.275198 0.122584 Li\n0.270224 0.275198 0.122584 Li\n0.500000 0.098621 0.883357 Li\n0.500000 0.097349 0.383519 Li\n0.000000 0.334524 0.392182 Cr\n0.500000 0.667241 0.604850 Ni\n0.500000 0.668832 0.102255 Ni\n0.000000 0.334221 0.897376 Ni\n0.000000 0.585848 0.642536 P\n0.000000 0.590717 0.136235 P\n0.500000 0.415260 0.860793 P\n0.500000 0.416534 0.359980 P\n0.500000 0.960468 0.649228 C\n0.500000 0.960915 0.149025 C\n0.000000 0.040798 0.850688 C\n0.000000 0.028869 0.351962 C\n0.500000 0.923753 0.525645 O\n0.000000 0.894566 0.820188 O\n0.500000 0.925533 0.025363 O\n0.500000 0.844597 0.744008 O\n0.000000 0.884213 0.317028 O\n0.500000 0.844202 0.243232 O\n0.187349 0.689787 0.590195 O\n0.812651 0.689787 0.590195 O\n0.187942 0.692243 0.081597 O\n0.812058 0.692243 0.081597 O\n0.500000 0.581432 0.914372 O\n0.000000 0.564765 0.799725 O\n0.500000 0.581713 0.415479 O\n0.000000 0.577396 0.292354 O\n0.500000 0.437180 0.703667 O\n0.000000 0.419016 0.589769 O\n0.500000 0.439028 0.203243 O\n0.000000 0.419870 0.088285 O\n0.312709 0.310047 0.912174 O\n0.687291 0.310047 0.912174 O\n0.686251 0.310490 0.411523 O\n0.313749 0.310490 0.411523 O\n0.000000 0.157633 0.756294 O\n0.500000 0.107466 0.679705 O\n0.000000 0.146569 0.257701 O\n0.000000 0.077761 0.974435 O\n0.500000 0.107756 0.180433 O\n0.000000 0.059451 0.476140 O\n",
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{
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{
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