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{
"id": "mp-760207",
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"structure_string": "Na4 Li8 Co4 C8 S2 O32\n1.0\n0.000000 6.938815 6.956556\n6.624022 0.000000 6.956556\n6.624022 6.938815 0.000000\nNa Li Co C S O\n4 8 4 8 2 32\ndirect\n0.472072 0.472072 0.027928 Na\n0.222072 0.222072 0.777928 Na\n0.027928 0.027928 0.472072 Na\n0.777928 0.777928 0.222072 Na\n0.943102 0.291736 0.152639 Li\n0.637477 0.097361 0.958264 Li\n0.152639 0.612523 0.943102 Li\n0.958264 0.306898 0.637477 Li\n0.291736 0.943102 0.612523 Li\n0.097361 0.637477 0.306898 Li\n0.612523 0.152639 0.291736 Li\n0.306898 0.958264 0.097361 Li\n0.625000 0.625000 0.125000 Co\n0.125000 0.625000 0.625000 Co\n0.625000 0.625000 0.625000 Co\n0.625000 0.125000 0.625000 Co\n0.851297 0.461596 0.839288 C\n0.402181 0.410712 0.788404 C\n0.461596 0.851297 0.847819 C\n0.839288 0.847819 0.851297 C\n0.410712 0.402181 0.398703 C\n0.788404 0.398703 0.402181 C\n0.847819 0.839288 0.461596 C\n0.398703 0.788404 0.410712 C\n0.000000 0.000000 0.000000 S\n0.250000 0.250000 0.250000 S\n0.063959 0.810023 0.060642 O\n0.717836 0.837887 0.997485 O\n0.810023 0.063959 0.065376 O\n0.060642 0.065376 0.063959 O\n0.446792 0.997485 0.837887 O\n0.065376 0.060642 0.810023 O\n0.831727 0.464682 0.982223 O\n0.528632 0.267777 0.785318 O\n0.729662 0.465440 0.818124 O\n0.263226 0.431876 0.784560 O\n0.465440 0.729662 0.986774 O\n0.997485 0.446792 0.717836 O\n0.431876 0.263226 0.520338 O\n0.412113 0.532164 0.803208 O\n0.982223 0.721368 0.831727 O\n0.785318 0.418273 0.528632 O\n0.464682 0.831727 0.721368 O\n0.267777 0.528632 0.418273 O\n0.837887 0.717836 0.446792 O\n0.818124 0.986774 0.729662 O\n0.252515 0.803208 0.532164 O\n0.784560 0.520338 0.263226 O\n0.986774 0.818124 0.465440 O\n0.520338 0.784560 0.431876 O\n0.721368 0.982223 0.464682 O\n0.418273 0.785318 0.267777 O\n0.184624 0.189358 0.439977 O\n0.803208 0.252515 0.412113 O\n0.189358 0.184624 0.186041 O\n0.439977 0.186041 0.184624 O\n0.532164 0.412113 0.252515 O\n0.186041 0.439977 0.189358 O\n",
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},
{
"id": "mp-780477",
"created_at": "2022-09-04T14:39:21.449858Z",
"structure_string": "Li6 Mn2 V2 P6 O24\n1.0\n6.388721 5.834385 0.000000\n-6.388721 5.834385 0.000000\n0.000000 2.573252 5.788741\nLi Mn V P O\n6 2 2 6 24\ndirect\n0.998310 0.001690 0.500000 Li\n0.710668 0.289332 0.000000 Li\n0.500525 0.502018 0.247020 Li\n0.497982 0.499475 0.752980 Li\n0.288961 0.711039 0.500000 Li\n0.003915 0.996085 0.000000 Li\n0.625305 0.942293 0.880061 Mn\n0.057707 0.374695 0.119939 Mn\n0.943006 0.622292 0.391586 V\n0.377708 0.056994 0.608414 V\n0.712997 0.287003 0.500000 P\n0.865645 0.665316 0.886097 P\n0.660827 0.861409 0.385546 P\n0.334684 0.134355 0.113903 P\n0.138591 0.339173 0.614454 P\n0.286113 0.713887 0.000000 P\n0.989638 0.655656 0.660999 O\n0.947636 0.609909 0.079764 O\n0.736886 0.171948 0.721891 O\n0.828052 0.263114 0.278109 O\n0.842574 0.841957 0.362106 O\n0.736568 0.461018 0.522774 O\n0.854532 0.850330 0.843964 O\n0.704335 0.548696 0.954765 O\n0.599271 0.952293 0.572913 O\n0.663537 0.985024 0.153120 O\n0.538982 0.263432 0.477226 O\n0.542609 0.701545 0.457414 O\n0.451304 0.295665 0.045235 O\n0.463022 0.738519 0.017424 O\n0.344344 0.010362 0.339001 O\n0.390091 0.052364 0.920236 O\n0.298455 0.457391 0.542586 O\n0.158043 0.157426 0.637894 O\n0.261481 0.536978 0.982576 O\n0.149670 0.145468 0.156036 O\n0.174018 0.740674 0.219119 O\n0.259326 0.825982 0.780881 O\n0.047707 0.400729 0.427087 O\n0.014976 0.336463 0.846880 O\n",
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{
"id": "mp-562662",
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"structure_string": "Ba8 Co4 C8 O24 F8\n1.0\n6.749409 0.000000 0.000000\n0.000000 9.088334 0.000000\n0.000000 0.000000 11.704113\nBa Co C O F\n8 4 8 24 8\ndirect\n0.985429 0.891404 0.325075 Ba\n0.514571 0.391404 0.674925 Ba\n0.514571 0.891404 0.825075 Ba\n0.985429 0.391404 0.174925 Ba\n0.485429 0.608596 0.325075 Ba\n0.014571 0.608596 0.825075 Ba\n0.014571 0.108596 0.674925 Ba\n0.485429 0.108596 0.174925 Ba\n0.000000 0.500000 0.500000 Co\n0.000000 0.000000 0.000000 Co\n0.500000 0.000000 0.500000 Co\n0.500000 0.500000 0.000000 Co\n0.747856 0.259779 0.412162 C\n0.747856 0.759779 0.087838 C\n0.247856 0.240221 0.412162 C\n0.252144 0.740221 0.587838 C\n0.752144 0.759779 0.587838 C\n0.247856 0.740221 0.087838 C\n0.252144 0.240221 0.912162 C\n0.752144 0.259779 0.912162 C\n0.803903 0.687416 0.176536 O\n0.174001 0.804337 0.998389 O\n0.265608 0.095802 0.413013 O\n0.674001 0.195663 0.501611 O\n0.734392 0.404198 0.913013 O\n0.234392 0.095802 0.913013 O\n0.234392 0.595802 0.586987 O\n0.765608 0.904198 0.086987 O\n0.803903 0.187416 0.323464 O\n0.325999 0.304337 0.001611 O\n0.734392 0.904198 0.586987 O\n0.196097 0.812584 0.676536 O\n0.825999 0.695663 0.498389 O\n0.196097 0.312584 0.823464 O\n0.825999 0.195663 0.001611 O\n0.696097 0.687416 0.676536 O\n0.265608 0.595802 0.086987 O\n0.303903 0.812584 0.176536 O\n0.174001 0.304337 0.501611 O\n0.674001 0.695663 0.998389 O\n0.325999 0.804337 0.498389 O\n0.303903 0.312584 0.323464 O\n0.696097 0.187416 0.823464 O\n0.765608 0.404198 0.413013 O\n0.094165 0.591645 0.344248 F\n0.594165 0.908355 0.344248 F\n0.094165 0.091645 0.155752 F\n0.905835 0.908355 0.844248 F\n0.405835 0.091645 0.655752 F\n0.905835 0.408355 0.655752 F\n0.405835 0.591645 0.844248 F\n0.594165 0.408355 0.155752 F\n",
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{
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{
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"structure_string": "V8 Cu20 O40\n1.0\n6.333509 0.000000 0.000000\n0.000000 8.442669 0.000000\n0.000000 5.184914 15.642822\nV Cu O\n8 20 40\ndirect\n0.811124 0.566557 0.605913 V\n0.311124 0.433443 0.894087 V\n0.188876 0.433443 0.394087 V\n0.688876 0.566557 0.105913 V\n0.830201 0.787162 0.833994 V\n0.330201 0.212838 0.666006 V\n0.169799 0.212838 0.166006 V\n0.669799 0.787162 0.333994 V\n0.575618 0.939126 0.600612 Cu\n0.075618 0.060874 0.899388 Cu\n0.424382 0.060874 0.399388 Cu\n0.924382 0.939126 0.100612 Cu\n0.269998 0.733230 0.980869 Cu\n0.769998 0.266770 0.519131 Cu\n0.730002 0.266770 0.019131 Cu\n0.230002 0.733230 0.480869 Cu\n0.370740 0.839606 0.780725 Cu\n0.870740 0.160394 0.719275 Cu\n0.629260 0.160394 0.219275 Cu\n0.129260 0.839606 0.280725 Cu\n0.071637 0.969286 0.590002 Cu\n0.571637 0.030714 0.909998 Cu\n0.928363 0.030714 0.409998 Cu\n0.428363 0.969286 0.090002 Cu\n0.293563 0.626538 0.672720 Cu\n0.793563 0.373462 0.827280 Cu\n0.706437 0.373462 0.327280 Cu\n0.206437 0.626538 0.172720 Cu\n0.334423 0.601040 0.797351 O\n0.834423 0.398960 0.702649 O\n0.665577 0.398960 0.202649 O\n0.165577 0.601040 0.297351 O\n0.250956 0.513280 0.973794 O\n0.750956 0.486720 0.526206 O\n0.749044 0.486720 0.026206 O\n0.249044 0.513280 0.473794 O\n0.614086 0.711033 0.609830 O\n0.114086 0.288967 0.890170 O\n0.385914 0.288967 0.390170 O\n0.885914 0.711033 0.109830 O\n0.061125 0.673749 0.585169 O\n0.561125 0.326251 0.914831 O\n0.938875 0.326251 0.414831 O\n0.438875 0.673749 0.085169 O\n0.850027 0.594967 0.823916 O\n0.350027 0.405033 0.676084 O\n0.149973 0.405033 0.176084 O\n0.649973 0.594967 0.323916 O\n0.038904 0.833711 0.898686 O\n0.538904 0.166289 0.601314 O\n0.961096 0.166289 0.101314 O\n0.461096 0.833711 0.398686 O\n0.575856 0.816201 0.874287 O\n0.075856 0.183799 0.625713 O\n0.424144 0.183799 0.125713 O\n0.924144 0.816201 0.374287 O\n0.845057 0.927745 0.730173 O\n0.345057 0.072255 0.769827 O\n0.154943 0.072255 0.269827 O\n0.654943 0.927745 0.230173 O\n0.309798 0.866340 0.659205 O\n0.809798 0.133660 0.840795 O\n0.690202 0.133660 0.340795 O\n0.190202 0.866340 0.159205 O\n0.311036 0.967825 0.971511 O\n0.811036 0.032175 0.528489 O\n0.688964 0.032175 0.028489 O\n0.188964 0.967825 0.471511 O\n",
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{
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"structure_string": "Li7 Mn2 Co3 O12\n1.0\n2.973326 0.000000 0.000000\n-1.483650 6.257289 0.000000\n-0.808641 -2.957239 11.555940\nLi Mn Co O\n7 2 3 12\ndirect\n0.996276 0.998765 0.252392 Li\n0.325141 0.657800 0.583780 Li\n0.666797 0.338822 0.416818 Li\n0.004148 0.997146 0.749436 Li\n0.672677 0.348813 0.916111 Li\n0.336893 0.660304 0.075947 Li\n0.322910 0.661505 0.838712 Li\n0.998691 0.990366 0.995650 Mn\n0.997805 0.001396 0.500421 Mn\n0.335445 0.665461 0.331718 Co\n0.666045 0.347755 0.674762 Co\n0.679043 0.335732 0.165454 Co\n0.531974 0.014669 0.112630 O\n0.809811 0.678701 0.453314 O\n0.147160 0.346626 0.286186 O\n0.485519 0.021851 0.625042 O\n0.136214 0.330709 0.781413 O\n0.839002 0.690442 0.964301 O\n0.516644 0.985845 0.374356 O\n0.822875 0.633874 0.700849 O\n0.182886 0.319729 0.545809 O\n0.479492 0.001628 0.891502 O\n0.193690 0.320616 0.048597 O\n0.852863 0.651444 0.214799 O\n",
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{
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"structure_string": "Li1 V6 O7 F5\n1.0\n4.940602 0.000000 0.000000\n0.450679 5.655687 0.000000\n0.337164 0.741111 7.776815\nLi V O F\n1 6 7 5\ndirect\n0.500677 0.785904 0.216937 Li\n0.003660 0.007705 0.997781 V\n0.447835 0.456702 0.979539 V\n0.560716 0.210031 0.340376 V\n0.505977 0.818616 0.675621 V\n0.982650 0.340827 0.674828 V\n0.996828 0.653960 0.341294 V\n0.173524 0.284936 0.892550 O\n0.326371 0.485938 0.238339 O\n0.309696 0.793482 0.906078 O\n0.686260 0.189676 0.093239 O\n0.679798 0.520969 0.760556 O\n0.676129 0.871712 0.426012 O\n0.836295 0.372460 0.436695 O\n0.178177 0.969266 0.240530 F\n0.188749 0.639030 0.576036 F\n0.313400 0.141717 0.574457 F\n0.808363 0.021928 0.761726 F\n0.822066 0.697173 0.102018 F\n",
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