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{
"id": "mp-1333042",
"created_at": "2022-09-04T14:48:31.736557Z",
"structure_string": "Mg4 Cu2 W2 O12\n1.0\n5.175746 0.000000 0.000000\n0.000000 5.001219 0.000000\n0.000000 4.851618 8.527565\nMg Cu W O\n4 2 2 12\ndirect\n0.051994 0.294410 0.732203 Mg\n0.551994 0.705590 0.767797 Mg\n0.948006 0.705590 0.267797 Mg\n0.448006 0.294410 0.232203 Mg\n0.000000 0.500000 0.000000 Cu\n0.500000 0.500000 0.500000 Cu\n0.000000 0.000000 0.500000 W\n0.500000 0.000000 0.000000 W\n0.289708 0.700777 0.608877 O\n0.789708 0.299223 0.891123 O\n0.710292 0.299223 0.391123 O\n0.210292 0.700777 0.108877 O\n0.200873 0.361301 0.447653 O\n0.700873 0.638699 0.052347 O\n0.799127 0.638699 0.552347 O\n0.299127 0.361301 0.947653 O\n0.392559 0.038479 0.802759 O\n0.892559 0.961521 0.697241 O\n0.107441 0.038479 0.302759 O\n0.607441 0.961521 0.197241 O\n",
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{
"id": "mp-675700",
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"structure_string": "Cr2 Sb1 Te1\n1.0\n2.119432 -3.670964 0.000000\n2.119432 3.670964 0.000000\n0.000000 0.000000 4.851599\nCr Sb Te\n2 1 1\ndirect\n0.000000 0.000000 0.737479 Cr\n0.000000 0.000000 0.262521 Cr\n0.666667 0.333333 0.500000 Sb\n0.333333 0.666667 0.000000 Te\n",
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{
"id": "mp-759316",
"created_at": "2022-09-04T14:48:31.722593Z",
"structure_string": "Li2 Mn4 O6 F2\n1.0\n5.141345 -3.073302 0.000000\n5.141345 3.073302 0.000000\n3.304241 0.000000 4.996059\nLi Mn O F\n2 4 6 2\ndirect\n0.106275 0.106275 0.106275 Li\n0.893725 0.893725 0.893725 Li\n0.500000 0.000000 0.500000 Mn\n0.500000 0.500000 0.500000 Mn\n0.500000 0.500000 0.000000 Mn\n0.000000 0.500000 0.500000 Mn\n0.742027 0.742027 0.304912 O\n0.742027 0.304912 0.742027 O\n0.304912 0.742027 0.742027 O\n0.695088 0.257973 0.257973 O\n0.257973 0.257973 0.695088 O\n0.257973 0.695088 0.257973 O\n0.762596 0.762596 0.762596 F\n0.237404 0.237404 0.237404 F\n",
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"volume": 157.88451597182328,
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"formula_full": "Li2 Mn4 O6 F2",
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},
{
"id": "mp-569424",
"created_at": "2022-09-04T14:48:31.718340Z",
"structure_string": "Cr8 B4\n1.0\n0.000000 3.670955 7.299867\n2.109113 0.000000 7.299867\n2.109113 3.670955 0.000000\nCr B\n8 4\ndirect\n0.333049 0.333049 0.166951 Cr\n0.916951 0.916951 0.083049 Cr\n0.915538 0.584462 0.915538 Cr\n0.083049 0.083049 0.916951 Cr\n0.334462 0.665538 0.334462 Cr\n0.584462 0.915538 0.584462 Cr\n0.166951 0.166951 0.333049 Cr\n0.665538 0.334462 0.665538 Cr\n0.374623 0.374623 0.625377 B\n0.624623 0.624623 0.875377 B\n0.625377 0.625377 0.374623 B\n0.875377 0.875377 0.624623 B\n",
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"elements": [
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"spacegroup": 70
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{
"id": "mp-706252",
"created_at": "2022-09-04T14:48:31.718071Z",
"structure_string": "Li8 Fe40 O64\n1.0\n8.414081 -0.004909 -0.017322\n-0.004942 8.376634 -0.015388\n-0.033808 -0.029779 16.765603\nLi Fe O\n8 40 64\ndirect\n0.127107 0.622543 0.062820 Li\n0.122800 0.630441 0.564794 Li\n0.124449 0.871190 0.684456 Li\n0.132134 0.122189 0.316076 Li\n0.368794 0.123349 0.436287 Li\n0.372981 0.124608 0.934871 Li\n0.623705 0.627092 0.313924 Li\n0.621944 0.624796 0.811843 Li\n0.006789 0.506791 0.254218 Fe\n0.004236 0.498732 0.749605 Fe\n0.126074 0.371345 0.439246 Fe\n0.126767 0.871527 0.189932 Fe\n0.129685 0.373899 0.936268 Fe\n0.127090 0.125830 0.811666 Fe\n0.246127 0.742148 0.373704 Fe\n0.248526 0.744671 0.873279 Fe\n0.249031 0.250053 0.125318 Fe\n0.247126 0.246978 0.624454 Fe\n0.368030 0.871841 0.058993 Fe\n0.364740 0.877904 0.561301 Fe\n0.374234 0.624407 0.188184 Fe\n0.372429 0.626923 0.688573 Fe\n0.376998 0.370673 0.318187 Fe\n0.376984 0.372977 0.812600 Fe\n0.494680 0.506556 0.998541 Fe\n0.504492 0.504348 0.501497 Fe\n0.502790 0.003015 0.252324 Fe\n0.500411 0.006497 0.750890 Fe\n0.621983 0.873597 0.935361 Fe\n0.620937 0.877066 0.435570 Fe\n0.619160 0.127275 0.059345 Fe\n0.626129 0.127367 0.563399 Fe\n0.623572 0.382275 0.191126 Fe\n0.626758 0.373966 0.688037 Fe\n0.744614 0.745649 0.124244 Fe\n0.747945 0.745741 0.625050 Fe\n0.746796 0.243204 0.376528 Fe\n0.746349 0.245284 0.872003 Fe\n0.874767 0.625807 0.936263 Fe\n0.874965 0.622266 0.438039 Fe\n0.882648 0.377958 0.062361 Fe\n0.873166 0.374820 0.563432 Fe\n0.875198 0.873581 0.313179 Fe\n0.876263 0.872230 0.807971 Fe\n0.879236 0.124933 0.192580 Fe\n0.876767 0.125877 0.686305 Fe\n0.003792 0.007170 0.499364 Fe\n0.003006 0.005391 0.997756 Fe\n0.113592 0.606520 0.438043 O\n0.115063 0.608205 0.937093 O\n0.131659 0.875086 0.064994 O\n0.133487 0.880578 0.562613 O\n0.118847 0.371856 0.053790 O\n0.106711 0.368441 0.557351 O\n0.108210 0.874497 0.309300 O\n0.141972 0.631345 0.186464 O\n0.134116 0.622488 0.687926 O\n0.115615 0.892842 0.815734 O\n0.125461 0.144205 0.436912 O\n0.124627 0.140461 0.929553 O\n0.115008 0.114815 0.187725 O\n0.106810 0.133436 0.694806 O\n0.133408 0.373840 0.318680 O\n0.139241 0.362517 0.818108 O\n0.375426 0.633789 0.071599 O\n0.374403 0.633300 0.568185 O\n0.383974 0.873249 0.440139 O\n0.388473 0.869851 0.940683 O\n0.367699 0.862420 0.184688 O\n0.379415 0.866840 0.685512 O\n0.384459 0.115225 0.062884 O\n0.378928 0.379988 0.432891 O\n0.394892 0.119935 0.565595 O\n0.362952 0.378157 0.930126 O\n0.375116 0.615376 0.303991 O\n0.376757 0.605661 0.809359 O\n0.377767 0.138771 0.310942 O\n0.359803 0.140406 0.810334 O\n0.381262 0.387370 0.190622 O\n0.390697 0.376988 0.692856 O\n0.616945 0.882038 0.055343 O\n0.622014 0.892159 0.559624 O\n0.634232 0.639243 0.937825 O\n0.638609 0.635717 0.438007 O\n0.624544 0.110578 0.939779 O\n0.629297 0.115726 0.447721 O\n0.610159 0.616473 0.186530 O\n0.620485 0.605628 0.688211 O\n0.642589 0.876554 0.316459 O\n0.633885 0.882368 0.819915 O\n0.631641 0.368862 0.065147 O\n0.637117 0.363638 0.569867 O\n0.619082 0.374850 0.307972 O\n0.611673 0.367647 0.805177 O\n0.635409 0.136246 0.181853 O\n0.640323 0.137874 0.681930 O\n0.872527 0.867004 0.431154 O\n0.861211 0.869049 0.933820 O\n0.875285 0.614382 0.058625 O\n0.873594 0.607156 0.559762 O\n0.871703 0.640127 0.315876 O\n0.874660 0.634206 0.815955 O\n0.865088 0.133664 0.066239 O\n0.862096 0.139571 0.568942 O\n0.884773 0.379494 0.939152 O\n0.867962 0.382080 0.444240 O\n0.880764 0.878157 0.192866 O\n0.869424 0.893223 0.690515 O\n0.868620 0.371060 0.184474 O\n0.863133 0.361553 0.682355 O\n0.871419 0.109876 0.308231 O\n0.888684 0.120561 0.805172 O\n",
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{
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"structure_string": "Ce1 Er3\n1.0\n-2.496219 2.496219 4.970452\n2.496219 -2.496219 4.970452\n2.496219 2.496219 -4.970452\nCe Er\n1 3\ndirect\n0.000000 0.000000 0.000000 Ce\n0.750000 0.250000 0.500000 Er\n0.250000 0.750000 0.500000 Er\n0.500000 0.500000 0.000000 Er\n",
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{
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{
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"structure_string": "Ba2 Bi2 Cl2 O4\n1.0\n2.997008 -6.695921 0.000000\n2.997008 6.695921 0.000000\n0.000000 0.000000 5.783930\nBa Bi Cl O\n2 2 2 4\ndirect\n0.617443 0.382557 0.750000 Ba\n0.382557 0.617443 0.250000 Ba\n0.925932 0.074068 0.750000 Bi\n0.074068 0.925932 0.250000 Bi\n0.254142 0.745858 0.750000 Cl\n0.745858 0.254142 0.250000 Cl\n0.772374 0.772374 0.500000 O\n0.227626 0.227626 0.500000 O\n0.772374 0.772374 0.000000 O\n0.227626 0.227626 0.000000 O\n",
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