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{
"id": "mp-574684",
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"structure_string": "Na32 Sn16 As32\n1.0\n-7.180922 7.180922 10.821609\n7.180922 -7.180922 10.821609\n7.180922 7.180922 -10.821609\nNa Sn As\n32 16 32\ndirect\n0.850371 0.649629 0.500000 Na\n0.995460 0.538720 0.221975 Na\n0.961280 0.504540 0.778025 Na\n0.933254 0.211280 0.956740 Na\n0.495460 0.273485 0.456740 Na\n0.523485 0.245460 0.956740 Na\n0.726515 0.183254 0.221975 Na\n0.100371 0.100371 0.700742 Na\n0.649820 0.649820 0.799640 Na\n0.350371 0.850371 0.200742 Na\n0.850180 0.850180 0.200360 Na\n0.649629 0.149629 0.799258 Na\n0.899629 0.600371 0.000000 Na\n0.399629 0.399629 0.299258 Na\n0.788720 0.745460 0.721975 Na\n0.023485 0.066746 0.278025 Na\n0.399820 0.100180 0.500000 Na\n0.100180 0.600180 0.700360 Na\n0.600371 0.899629 0.000000 Na\n0.316746 0.773485 0.778025 Na\n0.899820 0.399820 0.299640 Na\n0.254540 0.976515 0.043260 Na\n0.754540 0.711280 0.278025 Na\n0.600180 0.899820 0.500000 Na\n0.350180 0.149820 0.000000 Na\n0.433254 0.476515 0.721975 Na\n0.816746 0.038720 0.543260 Na\n0.461280 0.683254 0.456740 Na\n0.149629 0.350371 0.500000 Na\n0.226515 0.004540 0.543260 Na\n0.288720 0.566746 0.043260 Na\n0.149820 0.350180 0.000000 Na\n0.699139 0.400132 0.461523 Sn\n0.487616 0.688609 0.038477 Sn\n0.811391 0.012384 0.961523 Sn\n0.987616 0.949139 0.799007 Sn\n0.262384 0.561391 0.461523 Sn\n0.550861 0.512384 0.200993 Sn\n0.311391 0.349868 0.799007 Sn\n0.599868 0.061391 0.299007 Sn\n0.650132 0.449139 0.961523 Sn\n0.150132 0.188609 0.200993 Sn\n0.050861 0.849868 0.038477 Sn\n0.099868 0.800861 0.538477 Sn\n0.938609 0.237616 0.538477 Sn\n0.438609 0.900132 0.700993 Sn\n0.199139 0.737616 0.299007 Sn\n0.762384 0.300861 0.700993 Sn\n0.625000 0.057790 0.932790 As\n0.125000 0.692210 0.067210 As\n0.218052 0.540355 0.252502 As\n0.531948 0.709645 0.247498 As\n0.648076 0.648076 0.000000 As\n0.942210 0.875000 0.567210 As\n0.462147 0.284450 0.752502 As\n0.898076 0.398076 0.500000 As\n0.625000 0.557790 0.432790 As\n0.101924 0.601924 0.500000 As\n0.959645 0.281948 0.747498 As\n0.290355 0.537853 0.822303 As\n0.031948 0.784450 0.822303 As\n0.398076 0.898076 0.500000 As\n0.034450 0.781948 0.322303 As\n0.715550 0.468052 0.177697 As\n0.459645 0.712147 0.677697 As\n0.215550 0.037853 0.247498 As\n0.851924 0.851924 0.000000 As\n0.307790 0.375000 0.432790 As\n0.125000 0.192210 0.567210 As\n0.351924 0.351924 0.000000 As\n0.790355 0.968052 0.752502 As\n0.442210 0.875000 0.067210 As\n0.148076 0.148076 0.000000 As\n0.807790 0.375000 0.932790 As\n0.718052 0.465550 0.677697 As\n0.601924 0.101924 0.500000 As\n0.287853 0.965550 0.747498 As\n0.962147 0.209645 0.177697 As\n0.534450 0.212147 0.252502 As\n0.787853 0.040355 0.322303 As\n",
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"formula_full": "Na32 Sn16 As32",
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{
"id": "mp-780670",
"created_at": "2022-09-04T14:45:29.158483Z",
"structure_string": "Li8 Cr8 P8 H16 O40\n1.0\n5.032170 0.000000 0.000000\n0.000000 10.405046 0.000000\n0.000000 0.000000 17.288409\nLi Cr P H O\n8 8 8 16 40\ndirect\n0.465377 0.174389 0.494828 Li\n0.534623 0.174389 0.994828 Li\n0.911186 0.398079 0.245894 Li\n0.088814 0.398079 0.745894 Li\n0.465377 0.674389 0.005172 Li\n0.534623 0.674389 0.505172 Li\n0.088814 0.898079 0.754106 Li\n0.911186 0.898079 0.254106 Li\n0.560312 0.146420 0.191001 Cr\n0.439688 0.146420 0.691001 Cr\n0.876502 0.424772 0.441385 Cr\n0.123498 0.424772 0.941385 Cr\n0.560312 0.646420 0.308999 Cr\n0.439688 0.646420 0.808999 Cr\n0.123498 0.924772 0.558615 Cr\n0.876502 0.924772 0.058615 Cr\n0.030184 0.232732 0.091077 P\n0.969816 0.232732 0.591077 P\n0.406490 0.339398 0.340624 P\n0.593510 0.339398 0.840624 P\n0.030184 0.732732 0.408923 P\n0.969816 0.732732 0.908923 P\n0.593510 0.839398 0.659376 P\n0.406490 0.839398 0.159376 P\n0.084957 0.001032 0.370993 H\n0.915043 0.001032 0.870993 H\n0.633060 0.053557 0.381336 H\n0.366940 0.053557 0.881336 H\n0.137349 0.109713 0.310399 H\n0.862651 0.109713 0.810399 H\n0.633551 0.449778 0.054700 H\n0.366449 0.449778 0.554700 H\n0.084957 0.501032 0.129007 H\n0.915043 0.501032 0.629007 H\n0.633060 0.553557 0.118664 H\n0.366940 0.553557 0.618664 H\n0.137349 0.609713 0.189601 H\n0.862651 0.609713 0.689601 H\n0.633551 0.949778 0.445300 H\n0.366449 0.949778 0.945300 H\n0.532175 0.024375 0.426889 O\n0.467825 0.024375 0.926889 O\n0.009697 0.040738 0.324172 O\n0.990303 0.040738 0.824172 O\n0.872632 0.124272 0.048265 O\n0.127368 0.124272 0.548265 O\n0.326633 0.194419 0.093497 O\n0.673367 0.194419 0.593497 O\n0.566704 0.210000 0.797401 O\n0.433296 0.210000 0.297401 O\n0.907707 0.249338 0.173853 O\n0.092293 0.249338 0.673853 O\n0.475187 0.323348 0.924127 O\n0.524813 0.323348 0.424127 O\n0.994004 0.361899 0.047742 O\n0.005996 0.361899 0.547742 O\n0.111144 0.379723 0.343859 O\n0.888856 0.379723 0.843859 O\n0.566851 0.446427 0.297438 O\n0.433149 0.446427 0.797438 O\n0.532175 0.524375 0.073111 O\n0.467825 0.524375 0.573111 O\n0.009697 0.540738 0.175828 O\n0.990303 0.540738 0.675828 O\n0.127368 0.624272 0.951735 O\n0.872632 0.624272 0.451735 O\n0.673367 0.694419 0.906503 O\n0.326633 0.694419 0.406503 O\n0.433296 0.710000 0.202599 O\n0.566704 0.710000 0.702599 O\n0.907707 0.749338 0.326147 O\n0.092293 0.749338 0.826147 O\n0.475187 0.823348 0.575873 O\n0.524813 0.823348 0.075873 O\n0.994004 0.861899 0.452258 O\n0.005996 0.861899 0.952258 O\n0.888856 0.879723 0.656141 O\n0.111144 0.879723 0.156141 O\n0.433149 0.946427 0.702562 O\n0.566851 0.946427 0.202562 O\n",
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"formula_full": "Li8 Cr8 P8 H16 O40",
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{
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"structure_string": "Li12 Mn2 V6 P12 O48\n1.0\n8.839666 0.000000 0.000000\n0.000000 8.491777 0.000000\n0.000000 0.470568 12.413536\nLi Mn V P O\n12 2 6 12 48\ndirect\n0.999152 0.000086 0.749340 Li\n0.100326 0.000000 0.000000 Li\n0.999152 0.999914 0.250660 Li\n0.897635 0.000000 0.500000 Li\n0.805796 0.293212 0.798707 Li\n0.197802 0.290813 0.300385 Li\n0.501962 0.507066 0.749213 Li\n0.402946 0.500000 0.000000 Li\n0.501962 0.492934 0.250787 Li\n0.601008 0.500000 0.500000 Li\n0.805796 0.706788 0.201293 Li\n0.197802 0.709187 0.699615 Li\n0.499395 0.209035 0.397575 Mn\n0.499395 0.790965 0.602425 Mn\n0.499531 0.212467 0.893960 V\n0.996625 0.283536 0.108146 V\n0.003039 0.284710 0.608936 V\n0.996625 0.716464 0.891854 V\n0.003039 0.715290 0.391064 V\n0.499531 0.787533 0.106040 V\n0.796014 0.000000 0.000000 P\n0.198202 0.000000 0.500000 P\n0.354230 0.156803 0.143952 P\n0.645917 0.155984 0.646831 P\n0.147281 0.350295 0.853694 P\n0.853748 0.351485 0.353200 P\n0.706988 0.500000 0.000000 P\n0.293261 0.500000 0.500000 P\n0.147281 0.649705 0.146306 P\n0.853748 0.648515 0.646800 P\n0.354230 0.843197 0.856048 P\n0.645917 0.844016 0.353169 P\n0.412405 0.011863 0.854487 O\n0.590159 0.014375 0.354415 O\n0.905485 0.067340 0.085911 O\n0.087311 0.069366 0.585073 O\n0.701760 0.127090 0.940147 O\n0.289402 0.126021 0.437485 O\n0.177400 0.141875 0.156310 O\n0.822805 0.145066 0.662148 O\n0.402577 0.245782 0.038874 O\n0.063172 0.252204 0.768437 O\n0.405605 0.258716 0.237940 O\n0.600699 0.254428 0.546553 O\n0.939094 0.253176 0.268404 O\n0.095081 0.274892 0.962586 O\n0.591471 0.249101 0.745573 O\n0.905012 0.276696 0.462611 O\n0.322069 0.345997 0.840561 O\n0.679838 0.353175 0.340341 O\n0.804810 0.382289 0.063739 O\n0.196175 0.381906 0.563979 O\n0.599461 0.427738 0.914832 O\n0.399418 0.424957 0.414346 O\n0.107687 0.473122 0.158293 O\n0.898434 0.472254 0.659476 O\n0.107687 0.526878 0.841707 O\n0.898434 0.527746 0.340524 O\n0.599461 0.572262 0.085168 O\n0.399418 0.575043 0.585654 O\n0.804810 0.617711 0.936261 O\n0.196175 0.618094 0.436021 O\n0.322069 0.654003 0.159439 O\n0.679838 0.646825 0.659659 O\n0.095081 0.725108 0.037414 O\n0.405605 0.741284 0.762060 O\n0.905012 0.723304 0.537389 O\n0.063172 0.747796 0.231563 O\n0.402577 0.754218 0.961126 O\n0.591471 0.750899 0.254427 O\n0.939094 0.746824 0.731596 O\n0.600699 0.745572 0.453447 O\n0.177400 0.858125 0.843690 O\n0.822805 0.854934 0.337852 O\n0.701760 0.872910 0.059853 O\n0.289402 0.873979 0.562515 O\n0.905485 0.932660 0.914089 O\n0.087311 0.930634 0.414927 O\n0.412405 0.988137 0.145513 O\n0.590159 0.985625 0.645585 O\n",
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{
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{
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{
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}