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{
"id": "mp-1048376",
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"structure_string": "Ca4 Co4 P8 O28\n1.0\n8.778753 0.000000 0.000000\n0.000000 7.378348 0.000000\n0.000000 4.138496 8.211396\nCa Co P O\n4 4 8 28\ndirect\n0.949099 0.729530 0.123610 Ca\n0.449099 0.270470 0.376390 Ca\n0.550901 0.729530 0.623610 Ca\n0.050901 0.270470 0.876390 Ca\n0.067235 0.229743 0.385757 Co\n0.932765 0.770257 0.614243 Co\n0.567235 0.770257 0.114243 Co\n0.432765 0.229743 0.885757 Co\n0.726498 0.047321 0.763721 P\n0.247132 0.529473 0.035308 P\n0.773502 0.047321 0.263721 P\n0.252868 0.529473 0.535308 P\n0.226498 0.952679 0.736279 P\n0.747132 0.470527 0.464692 P\n0.752868 0.470527 0.964692 P\n0.273502 0.952679 0.236279 P\n0.181688 0.742791 0.895112 O\n0.627783 0.068951 0.344280 O\n0.872217 0.068951 0.844280 O\n0.393102 0.564185 0.109826 O\n0.818312 0.257209 0.104888 O\n0.085061 0.987045 0.625976 O\n0.606898 0.435815 0.890174 O\n0.109333 0.467317 0.151655 O\n0.232978 0.388181 0.455743 O\n0.914939 0.012955 0.374024 O\n0.414939 0.987045 0.125976 O\n0.760829 0.893399 0.195360 O\n0.260829 0.106601 0.304640 O\n0.318312 0.742791 0.395112 O\n0.585061 0.012955 0.874024 O\n0.127783 0.931049 0.155720 O\n0.239171 0.106601 0.804640 O\n0.890667 0.532683 0.848345 O\n0.267022 0.388181 0.955743 O\n0.732978 0.611819 0.044257 O\n0.893102 0.435815 0.390174 O\n0.390667 0.467317 0.651655 O\n0.609333 0.532683 0.348345 O\n0.372217 0.931049 0.655720 O\n0.739171 0.893399 0.695360 O\n0.106898 0.564185 0.609826 O\n0.767022 0.611819 0.544257 O\n0.681688 0.257209 0.604888 O\n",
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{
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"created_at": "2022-09-04T14:39:21.152616Z",
"structure_string": "Ca6 Cu6 As8 O32\n1.0\n5.146026 0.000000 0.000000\n0.000000 9.272113 0.000000\n0.000000 7.600295 15.116437\nCa Cu As O\n6 6 8 32\ndirect\n0.531756 0.303212 0.232816 Ca\n0.031756 0.696788 0.267184 Ca\n0.468244 0.696788 0.767184 Ca\n0.968244 0.303212 0.732816 Ca\n0.500000 0.000000 0.500000 Ca\n0.000000 0.000000 0.000000 Ca\n0.473503 0.209474 0.618856 Cu\n0.526497 0.790526 0.381144 Cu\n0.973503 0.790526 0.881144 Cu\n0.026497 0.209474 0.118856 Cu\n0.000000 0.500000 0.500000 Cu\n0.500000 0.500000 0.000000 Cu\n0.007680 0.039593 0.340313 As\n0.493054 0.436000 0.406396 As\n0.993054 0.564000 0.093604 As\n0.006946 0.436000 0.906396 As\n0.992320 0.960407 0.659687 As\n0.506946 0.564000 0.593604 As\n0.492320 0.039593 0.840313 As\n0.507680 0.960407 0.159687 As\n0.444127 0.808895 0.266655 O\n0.935230 0.748131 0.004289 O\n0.387385 0.439244 0.311253 O\n0.405903 0.145743 0.150211 O\n0.612615 0.560756 0.688747 O\n0.055873 0.808895 0.766655 O\n0.887385 0.560756 0.188747 O\n0.687116 0.501215 0.898633 O\n0.661945 0.106514 0.902927 O\n0.555873 0.191105 0.733345 O\n0.094097 0.145743 0.650211 O\n0.312884 0.498785 0.101367 O\n0.302966 0.580661 0.422504 O\n0.338055 0.893486 0.097073 O\n0.661237 0.961300 0.643589 O\n0.161237 0.038700 0.856411 O\n0.802966 0.419339 0.077496 O\n0.112615 0.439244 0.811253 O\n0.161945 0.893486 0.597073 O\n0.187116 0.498785 0.601367 O\n0.838763 0.961300 0.143589 O\n0.338763 0.038700 0.356411 O\n0.064770 0.251869 0.995711 O\n0.435230 0.251869 0.495711 O\n0.697034 0.419339 0.577496 O\n0.944127 0.191105 0.233345 O\n0.594097 0.854257 0.849789 O\n0.838055 0.106514 0.402927 O\n0.564770 0.748131 0.504289 O\n0.812884 0.501215 0.398633 O\n0.197034 0.580661 0.922504 O\n0.905903 0.854257 0.349789 O\n",
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{
"id": "mp-1198566",
"created_at": "2022-09-04T14:45:37.927547Z",
"structure_string": "Cu16 S4 O40\n1.0\n12.937528 0.000000 0.000000\n0.000000 5.838110 0.000000\n0.000000 5.830525 9.561599\nCu S O\n16 4 40\ndirect\n0.713742 0.614667 0.509930 Cu\n0.286258 0.385333 0.490070 Cu\n0.786258 0.614667 0.009930 Cu\n0.213742 0.385333 0.990070 Cu\n0.710798 0.114940 0.509392 Cu\n0.289202 0.885060 0.490608 Cu\n0.789202 0.114940 0.009392 Cu\n0.210798 0.885060 0.990608 Cu\n0.638315 0.133223 0.241869 Cu\n0.361685 0.866777 0.758131 Cu\n0.861685 0.133223 0.741869 Cu\n0.138315 0.866777 0.258131 Cu\n0.643974 0.628350 0.246590 Cu\n0.356026 0.371650 0.753410 Cu\n0.856026 0.628350 0.746590 Cu\n0.143974 0.371650 0.253410 Cu\n0.907769 0.085678 0.292507 S\n0.092231 0.914322 0.707493 S\n0.592231 0.085678 0.792507 S\n0.407769 0.914322 0.207493 S\n0.611933 0.763983 0.366425 O\n0.388067 0.236017 0.633575 O\n0.888067 0.763983 0.866425 O\n0.111933 0.236017 0.133575 O\n0.608544 0.254651 0.364988 O\n0.391456 0.745349 0.635012 O\n0.891456 0.254651 0.864988 O\n0.108544 0.745349 0.135012 O\n0.670605 0.998802 0.125263 O\n0.329395 0.001198 0.874737 O\n0.829395 0.998802 0.625263 O\n0.170605 0.001198 0.374737 O\n0.666642 0.501519 0.124252 O\n0.333358 0.498481 0.875748 O\n0.833358 0.501519 0.624252 O\n0.166642 0.498481 0.375748 O\n0.760720 0.456909 0.416465 O\n0.239280 0.543091 0.583535 O\n0.739280 0.456909 0.916465 O\n0.260720 0.543091 0.083535 O\n0.659665 0.780147 0.593278 O\n0.340335 0.219853 0.406722 O\n0.840335 0.780147 0.093278 O\n0.159665 0.219853 0.906722 O\n0.802448 0.014517 0.361183 O\n0.197552 0.985483 0.638817 O\n0.697552 0.014517 0.861183 O\n0.302448 0.985483 0.138817 O\n0.887686 0.238653 0.136862 O\n0.112314 0.761347 0.863138 O\n0.612314 0.238653 0.636862 O\n0.387686 0.761347 0.363138 O\n0.963145 0.258986 0.330160 O\n0.036855 0.741014 0.669840 O\n0.536855 0.258986 0.830160 O\n0.463145 0.741014 0.169840 O\n0.962916 0.834064 0.333598 O\n0.037084 0.165936 0.666402 O\n0.537084 0.834064 0.833598 O\n0.462916 0.165936 0.166402 O\n",
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"volume": 722.1943764281206,
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"formula_full": "Cu16 S4 O40",
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{
"id": "mp-753962",
"created_at": "2022-09-04T14:43:07.476616Z",
"structure_string": "Li8 Ni4 P8 O28\n1.0\n-0.008551 -7.030237 0.006531\n6.537298 3.532413 -10.071175\n6.501583 -3.510320 3.342482\nLi Ni P O\n8 4 8 28\ndirect\n0.385130 0.615134 0.844412 Li\n0.885008 0.114940 0.344534 Li\n0.115743 0.385563 0.154609 Li\n0.615651 0.885277 0.654503 Li\n0.884333 0.614627 0.845465 Li\n0.384556 0.114825 0.345295 Li\n0.115106 0.885127 0.655315 Li\n0.614923 0.384908 0.155242 Li\n0.500139 0.499794 0.499994 Ni\n0.500050 0.000132 0.999984 Ni\n0.999848 0.999850 0.000107 Ni\n0.999940 0.500009 0.500293 Ni\n0.145827 0.286177 0.494469 P\n0.645901 0.786088 0.994207 P\n0.965738 0.604515 0.174838 P\n0.465464 0.104546 0.674857 P\n0.034373 0.395532 0.825330 P\n0.534558 0.895387 0.325025 P\n0.854121 0.713859 0.505565 P\n0.353875 0.213803 0.005632 P\n0.031972 0.283054 0.717697 O\n0.532654 0.782856 0.217415 O\n0.967997 0.717019 0.282318 O\n0.467800 0.217016 0.782362 O\n0.085863 0.641019 0.971031 O\n0.586077 0.141059 0.471037 O\n0.109436 0.166890 0.445830 O\n0.609720 0.666794 0.945623 O\n0.914238 0.358958 0.029118 O\n0.413836 0.858941 0.528884 O\n0.890567 0.833165 0.554180 O\n0.389327 0.333048 0.054266 O\n0.280990 0.462550 0.761457 O\n0.780861 0.962495 0.261934 O\n0.105897 0.148433 0.072990 O\n0.606168 0.648809 0.572850 O\n0.033978 0.352652 0.425451 O\n0.533380 0.852118 0.925479 O\n0.082011 0.538494 0.239058 O\n0.581475 0.038413 0.739455 O\n0.917878 0.461633 0.761535 O\n0.418621 0.961587 0.260452 O\n0.966249 0.647562 0.574594 O\n0.466583 0.147965 0.074516 O\n0.719137 0.537355 0.238584 O\n0.219114 0.037492 0.738208 O\n0.894002 0.851395 0.926926 O\n0.393885 0.351137 0.427074 O\n",
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{
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"structure_string": "Li4 Mn12 O4 F32\n1.0\n5.735326 0.000000 0.000000\n0.000000 5.137873 0.000000\n0.000000 3.838197 22.836749\nLi Mn O F\n4 12 4 32\ndirect\n0.015718 0.100175 0.466332 Li\n0.984282 0.100175 0.966332 Li\n0.512893 0.881776 0.035498 Li\n0.487107 0.881776 0.535498 Li\n0.145256 0.770151 0.756778 Mn\n0.041034 0.623240 0.381383 Mn\n0.028334 0.868368 0.119514 Mn\n0.958966 0.623240 0.881383 Mn\n0.971666 0.868368 0.619514 Mn\n0.854744 0.770151 0.256778 Mn\n0.739484 0.377641 0.745817 Mn\n0.532262 0.360132 0.116916 Mn\n0.528469 0.113423 0.383557 Mn\n0.471531 0.113423 0.883557 Mn\n0.467738 0.360132 0.616916 Mn\n0.260516 0.377641 0.245817 Mn\n0.045935 0.532486 0.304677 O\n0.029600 0.651258 0.196222 O\n0.954065 0.532486 0.804677 O\n0.970400 0.651258 0.696222 O\n0.286691 0.926512 0.353226 F\n0.279055 0.145451 0.148903 F\n0.218381 0.297785 0.912043 F\n0.253007 0.634692 0.584691 F\n0.013551 0.084830 0.045958 F\n0.014588 0.746193 0.452060 F\n0.012012 0.093368 0.250638 F\n0.987988 0.093368 0.750638 F\n0.985412 0.746193 0.952060 F\n0.986449 0.084830 0.545958 F\n0.781619 0.297785 0.412043 F\n0.746993 0.634692 0.084691 F\n0.713309 0.926512 0.853226 F\n0.720945 0.145451 0.648903 F\n0.784868 0.850039 0.347220 F\n0.783063 0.068241 0.145635 F\n0.715651 0.683730 0.590136 F\n0.751295 0.340962 0.915452 F\n0.523327 0.351013 0.310998 F\n0.538181 0.473243 0.191014 F\n0.556959 0.894116 0.246316 F\n0.513527 0.886702 0.454573 F\n0.512169 0.240949 0.046153 F\n0.486473 0.886702 0.954573 F\n0.487831 0.240949 0.546153 F\n0.443041 0.894116 0.746316 F\n0.476673 0.351013 0.810998 F\n0.461819 0.473243 0.691014 F\n0.248705 0.340962 0.415452 F\n0.284349 0.683730 0.090136 F\n0.215132 0.850039 0.847220 F\n0.216937 0.068241 0.645635 F\n",
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{
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"structure_string": "V8 Cr4 O28\n1.0\n8.635839 0.000000 0.000000\n0.000000 8.635839 0.000000\n0.000000 0.000000 8.635839\nV Cr O\n8 4 28\ndirect\n0.119152 0.880848 0.380848 V\n0.119152 0.619152 0.880848 V\n0.380848 0.380848 0.380848 V\n0.380848 0.119152 0.880848 V\n0.619152 0.619152 0.619152 V\n0.619152 0.880848 0.119152 V\n0.880848 0.119152 0.619152 V\n0.880848 0.380848 0.119152 V\n0.000000 0.000000 0.000000 Cr\n0.000000 0.500000 0.500000 Cr\n0.500000 0.000000 0.500000 Cr\n0.500000 0.500000 0.000000 Cr\n0.000000 0.000000 0.500000 O\n0.000000 0.500000 0.000000 O\n0.062440 0.691916 0.407494 O\n0.062440 0.808084 0.907494 O\n0.092506 0.562440 0.691916 O\n0.092506 0.937560 0.191916 O\n0.191916 0.092506 0.937560 O\n0.191916 0.407494 0.437560 O\n0.308084 0.592506 0.937560 O\n0.308084 0.907494 0.437560 O\n0.407494 0.062440 0.691916 O\n0.407494 0.437560 0.191916 O\n0.437560 0.308084 0.907494 O\n0.437560 0.191916 0.407494 O\n0.500000 0.500000 0.500000 O\n0.500000 0.000000 0.000000 O\n0.562440 0.691916 0.092506 O\n0.562440 0.808084 0.592506 O\n0.592506 0.562440 0.808084 O\n0.592506 0.937560 0.308084 O\n0.691916 0.092506 0.562440 O\n0.691916 0.407494 0.062440 O\n0.808084 0.592506 0.562440 O\n0.808084 0.907494 0.062440 O\n0.907494 0.062440 0.808084 O\n0.907494 0.437560 0.308084 O\n0.937560 0.191916 0.092506 O\n0.937560 0.308084 0.592506 O\n",
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{
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