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{
"id": "mp-775099",
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"structure_string": "Li8 Mn12 Fe4 O32\n1.0\n8.306620 0.000944 0.006092\n0.000946 8.299197 0.001467\n0.006096 0.001457 8.308609\nLi Mn Fe O\n8 12 4 32\ndirect\n0.004277 0.004032 0.004297 Li\n0.245294 0.245194 0.245244 Li\n0.254574 0.754565 0.745591 Li\n0.495503 0.995748 0.504549 Li\n0.504994 0.495389 0.995650 Li\n0.745952 0.254425 0.754808 Li\n0.754284 0.745967 0.254523 Li\n0.995215 0.504767 0.495482 Li\n0.118293 0.131454 0.624968 Mn\n0.124844 0.381638 0.868271 Mn\n0.131702 0.625281 0.118334 Mn\n0.368333 0.374877 0.618195 Mn\n0.375109 0.618352 0.368244 Mn\n0.381512 0.868512 0.124823 Mn\n0.618354 0.368542 0.375033 Mn\n0.625066 0.118290 0.131673 Mn\n0.631641 0.874871 0.881504 Mn\n0.868467 0.124928 0.381707 Mn\n0.874907 0.881458 0.631691 Mn\n0.881423 0.631680 0.875001 Mn\n0.125108 0.875026 0.375052 Fe\n0.375040 0.125329 0.875117 Fe\n0.624837 0.624735 0.625154 Fe\n0.875338 0.375061 0.125374 Fe\n0.099303 0.123674 0.392478 O\n0.107381 0.900489 0.623511 O\n0.115867 0.616196 0.884181 O\n0.126262 0.150514 0.857422 O\n0.123532 0.392225 0.099156 O\n0.133987 0.366156 0.634185 O\n0.142302 0.626250 0.349191 O\n0.150917 0.857780 0.126509 O\n0.349008 0.142168 0.626615 O\n0.357501 0.374006 0.849102 O\n0.365936 0.633845 0.134054 O\n0.376399 0.607784 0.599025 O\n0.373614 0.849555 0.357274 O\n0.384077 0.383796 0.384072 O\n0.392722 0.099443 0.123356 O\n0.400870 0.876256 0.892434 O\n0.599195 0.375910 0.607393 O\n0.607383 0.599391 0.376405 O\n0.615967 0.883879 0.115754 O\n0.626768 0.349427 0.142475 O\n0.623717 0.107976 0.900942 O\n0.634180 0.133766 0.365786 O\n0.642307 0.873963 0.650914 O\n0.650880 0.642288 0.873557 O\n0.849181 0.357664 0.373528 O\n0.857842 0.125893 0.150837 O\n0.865810 0.866168 0.865834 O\n0.876451 0.892121 0.400976 O\n0.873296 0.650574 0.642687 O\n0.884006 0.116125 0.615848 O\n0.892529 0.400654 0.876655 O\n0.900745 0.624082 0.107699 O\n",
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"spacegroup": 212
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{
"id": "mp-759880",
"created_at": "2022-09-04T14:43:20.567822Z",
"structure_string": "Fe12 O12 F12\n1.0\n3.111903 0.000000 0.000000\n0.000000 9.460625 0.000000\n0.000000 0.012670 14.246901\nFe O F\n12 12 12\ndirect\n0.000000 0.981035 0.998245 Fe\n0.000000 0.987388 0.328594 Fe\n0.000000 0.981074 0.661507 Fe\n0.500000 0.772497 0.166876 Fe\n0.500000 0.771890 0.493849 Fe\n0.500000 0.772859 0.829639 Fe\n0.000000 0.480519 0.329857 Fe\n0.000000 0.484642 0.995649 Fe\n0.000000 0.483852 0.662164 Fe\n0.500000 0.238047 0.185505 Fe\n0.500000 0.270324 0.496944 Fe\n0.500000 0.269362 0.829165 Fe\n0.500000 0.899773 0.270554 O\n0.500000 0.904340 0.600306 O\n0.500000 0.902939 0.935329 O\n0.000000 0.847563 0.101848 O\n0.000000 0.848456 0.767897 O\n0.000000 0.848787 0.433499 O\n0.500000 0.404586 0.266036 O\n0.500000 0.399845 0.939098 O\n0.500000 0.404840 0.601647 O\n0.000000 0.348713 0.434941 O\n0.000000 0.350826 0.769041 O\n0.000000 0.147150 0.235591 O\n0.000000 0.652208 0.232851 F\n0.000000 0.653082 0.564682 F\n0.000000 0.650240 0.900650 F\n0.500000 0.592028 0.067529 F\n0.500000 0.598125 0.397805 F\n0.500000 0.600442 0.732585 F\n0.000000 0.344435 0.103591 F\n0.000000 0.153006 0.898284 F\n0.000000 0.154262 0.567557 F\n0.500000 0.102861 0.063308 F\n0.500000 0.098773 0.404648 F\n0.500000 0.099235 0.732729 F\n",
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{
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"structure_string": "Fe12 O12 F12\n1.0\n3.087605 0.000000 0.000000\n0.000000 9.554470 0.000000\n0.000000 0.079097 14.262076\nFe O F\n12 12 12\ndirect\n0.000000 0.998981 0.985733 Fe\n0.000000 0.500249 0.997028 Fe\n0.500000 0.219030 0.827829 Fe\n0.500000 0.743272 0.848705 Fe\n0.000000 0.005473 0.658987 Fe\n0.000000 0.497120 0.656327 Fe\n0.500000 0.749575 0.520002 Fe\n0.500000 0.250240 0.515868 Fe\n0.000000 0.994129 0.326824 Fe\n0.000000 0.496716 0.322675 Fe\n0.500000 0.277852 0.159913 Fe\n0.500000 0.750875 0.182753 Fe\n0.500000 0.899844 0.938032 O\n0.000000 0.158130 0.901563 O\n0.000000 0.643897 0.902390 O\n0.500000 0.091750 0.729375 O\n0.500000 0.405154 0.604328 O\n0.500000 0.902223 0.602548 O\n0.000000 0.152350 0.556480 O\n0.000000 0.651007 0.565751 O\n0.500000 0.400548 0.268475 O\n0.500000 0.911826 0.267886 O\n0.000000 0.655930 0.232333 O\n0.000000 0.354464 0.095093 O\n0.500000 0.405583 0.932840 F\n0.000000 0.350974 0.770049 F\n0.000000 0.833732 0.773009 F\n0.500000 0.595262 0.735945 F\n0.000000 0.351568 0.432879 F\n0.000000 0.851660 0.433065 F\n0.500000 0.101931 0.391507 F\n0.500000 0.596486 0.397893 F\n0.000000 0.157618 0.228579 F\n0.000000 0.847935 0.103688 F\n0.500000 0.096506 0.069231 F\n0.500000 0.600105 0.064416 F\n",
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{
"id": "mp-578949",
"created_at": "2022-09-04T14:39:38.983406Z",
"structure_string": "Na16 Mn12 P16 O60\n1.0\n6.719124 0.000000 0.000000\n0.000000 10.896022 0.000000\n0.000000 0.000000 18.365665\nNa Mn P O\n16 12 16 60\ndirect\n0.658923 0.752845 0.207029 Na\n0.322918 0.043055 0.964296 Na\n0.191643 0.020174 0.492194 Na\n0.691643 0.520174 0.007806 Na\n0.566955 0.727688 0.398793 Na\n0.658923 0.747155 0.707029 Na\n0.066955 0.272312 0.601207 Na\n0.158923 0.247155 0.792971 Na\n0.566955 0.772312 0.898793 Na\n0.322918 0.456945 0.464296 Na\n0.066955 0.227688 0.101207 Na\n0.822918 0.956945 0.035704 Na\n0.158923 0.252845 0.292971 Na\n0.822918 0.543055 0.535704 Na\n0.191643 0.479826 0.992194 Na\n0.691643 0.979826 0.507806 Na\n0.409670 0.988883 0.640748 Mn\n0.398186 0.505549 0.661966 Mn\n0.409670 0.511117 0.140748 Mn\n0.676660 0.255033 0.238194 Mn\n0.898186 0.005549 0.838034 Mn\n0.909670 0.488883 0.859252 Mn\n0.909670 0.011117 0.359252 Mn\n0.176660 0.755033 0.261806 Mn\n0.676660 0.244967 0.738194 Mn\n0.898186 0.494451 0.338034 Mn\n0.398186 0.994451 0.161966 Mn\n0.176660 0.744967 0.761806 Mn\n0.354274 0.729793 0.551738 P\n0.417426 0.485756 0.820686 P\n0.407070 0.494180 0.298421 P\n0.544779 0.242135 0.063961 P\n0.354274 0.770207 0.051738 P\n0.854274 0.270207 0.448262 P\n0.917426 0.514244 0.179314 P\n0.407070 0.005820 0.798421 P\n0.907070 0.505820 0.701579 P\n0.917426 0.985756 0.679314 P\n0.044779 0.742135 0.436039 P\n0.417426 0.014244 0.320686 P\n0.854274 0.229793 0.948262 P\n0.907070 0.994180 0.201579 P\n0.044779 0.757865 0.936039 P\n0.544779 0.257865 0.563961 P\n0.446526 0.121010 0.263543 O\n0.717349 0.962934 0.157436 O\n0.080552 0.015716 0.148553 O\n0.893999 0.639108 0.420708 O\n0.939368 0.633150 0.943638 O\n0.628135 0.293098 0.482348 O\n0.594661 0.996608 0.373222 O\n0.442062 0.112955 0.742560 O\n0.094661 0.496608 0.126778 O\n0.217872 0.743702 0.382499 O\n0.725796 0.544335 0.136081 O\n0.942062 0.887045 0.257440 O\n0.939368 0.866850 0.443638 O\n0.128135 0.793098 0.017652 O\n0.580552 0.515716 0.351447 O\n0.942062 0.612955 0.757440 O\n0.887051 0.389358 0.751790 O\n0.946526 0.621010 0.236457 O\n0.446526 0.378990 0.763543 O\n0.387051 0.610642 0.248210 O\n0.217349 0.462934 0.342564 O\n0.717872 0.256298 0.617501 O\n0.898471 0.396558 0.228346 O\n0.904886 0.365576 0.961537 O\n0.628135 0.206902 0.982348 O\n0.439368 0.133150 0.556362 O\n0.337059 0.798918 0.133367 O\n0.837059 0.201082 0.866633 O\n0.898471 0.103442 0.728346 O\n0.837059 0.298918 0.366633 O\n0.989306 0.360672 0.488090 O\n0.094661 0.003392 0.626778 O\n0.594661 0.503392 0.873222 O\n0.398471 0.896558 0.271654 O\n0.489306 0.860672 0.011910 O\n0.217349 0.037066 0.842564 O\n0.725796 0.955665 0.636081 O\n0.489306 0.639328 0.511910 O\n0.946526 0.878990 0.736457 O\n0.387051 0.889358 0.748210 O\n0.398471 0.603442 0.771654 O\n0.580552 0.984284 0.851447 O\n0.337059 0.701082 0.633367 O\n0.717872 0.243702 0.117501 O\n0.989306 0.139328 0.988090 O\n0.404886 0.634424 0.038463 O\n0.904886 0.134424 0.461537 O\n0.439368 0.366850 0.056362 O\n0.442062 0.387045 0.242560 O\n0.225796 0.044335 0.363919 O\n0.080552 0.484284 0.648553 O\n0.404886 0.865576 0.538463 O\n0.893999 0.860892 0.920708 O\n0.717349 0.537066 0.657436 O\n0.225796 0.455665 0.863919 O\n0.393999 0.360892 0.579292 O\n0.887051 0.110642 0.251790 O\n0.128135 0.706902 0.517652 O\n0.393999 0.139108 0.079292 O\n0.217872 0.756298 0.882499 O\n",
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{
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{
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"structure_string": "Zn6 Fe12 O24\n1.0\n3.032970 -5.253259 0.000000\n3.032970 5.253259 0.000000\n0.000000 0.000000 14.853533\nZn Fe O\n6 12 24\ndirect\n0.666667 0.333333 0.955666 Zn\n0.000000 0.000000 0.621434 Zn\n0.333333 0.666667 0.665263 Zn\n0.333333 0.666667 0.291967 Zn\n0.000000 0.000000 0.999239 Zn\n0.000000 0.000000 0.377010 Zn\n0.163870 0.836130 0.833812 Fe\n0.163870 0.327741 0.833812 Fe\n0.497983 0.502017 0.500825 Fe\n0.672259 0.836130 0.833812 Fe\n0.497983 0.995966 0.500825 Fe\n0.666667 0.333333 0.335608 Fe\n0.666667 0.333333 0.711629 Fe\n0.832217 0.167783 0.167538 Fe\n0.004034 0.502017 0.500825 Fe\n0.832217 0.664435 0.167538 Fe\n0.335565 0.167783 0.167538 Fe\n0.333333 0.666667 0.042916 Fe\n0.844755 0.155245 0.909441 O\n0.000000 0.000000 0.758390 O\n0.844755 0.689509 0.909441 O\n0.310491 0.155245 0.909441 O\n0.177544 0.822456 0.575243 O\n0.015607 0.507803 0.755828 O\n0.333333 0.666667 0.425397 O\n0.492197 0.984393 0.755828 O\n0.333333 0.666667 0.910565 O\n0.177544 0.355088 0.575243 O\n0.644912 0.822456 0.575243 O\n0.492197 0.507803 0.755828 O\n0.514252 0.485748 0.246350 O\n0.363167 0.181583 0.419986 O\n0.818417 0.636833 0.419986 O\n0.666667 0.333333 0.092832 O\n0.666667 0.333333 0.579232 O\n0.514252 0.028503 0.246350 O\n0.971497 0.485748 0.246350 O\n0.818417 0.181583 0.419986 O\n0.679074 0.839537 0.089034 O\n0.160463 0.320926 0.089034 O\n0.000000 0.000000 0.238500 O\n0.160463 0.839537 0.089034 O\n",
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{
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