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{
"id": "mp-765227",
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"structure_string": "Li12 Sn10 P16 O56\n1.0\n9.626733 0.000000 0.000000\n4.443575 10.519774 0.000000\n3.570913 1.712195 13.065612\nLi Sn P O\n12 10 16 56\ndirect\n0.039994 0.871592 0.575512 Li\n0.437939 0.654017 0.672039 Li\n0.000000 0.500000 0.500000 Li\n0.562061 0.345983 0.327961 Li\n0.960006 0.128408 0.424488 Li\n0.174737 0.057231 0.247574 Li\n0.050480 0.872813 0.051027 Li\n0.418937 0.704273 0.155947 Li\n0.000000 0.500000 0.000000 Li\n0.581063 0.295727 0.844053 Li\n0.949520 0.127187 0.948973 Li\n0.825263 0.942769 0.752426 Li\n0.596821 0.294082 0.597080 Sn\n0.194182 0.002076 0.752123 Sn\n0.260209 0.267762 0.571213 Sn\n0.739791 0.732238 0.428787 Sn\n0.805818 0.997924 0.247877 Sn\n0.403179 0.705918 0.402920 Sn\n0.586444 0.305527 0.100969 Sn\n0.265697 0.258036 0.078280 Sn\n0.734303 0.741964 0.921720 Sn\n0.413556 0.694473 0.899031 Sn\n0.224320 0.581291 0.595409 P\n0.679320 0.789965 0.659334 P\n0.897239 0.297599 0.717211 P\n0.718076 0.007895 0.513727 P\n0.281924 0.992105 0.486273 P\n0.102761 0.702401 0.282789 P\n0.320680 0.210035 0.340666 P\n0.775680 0.418709 0.404591 P\n0.225117 0.580394 0.094255 P\n0.664771 0.812515 0.157919 P\n0.894371 0.300911 0.216957 P\n0.713685 0.015026 0.995039 P\n0.286315 0.984974 0.004961 P\n0.105629 0.699089 0.783043 P\n0.335229 0.187485 0.842081 P\n0.774883 0.419606 0.905745 P\n0.046049 0.835863 0.726723 O\n0.117371 0.600242 0.707917 O\n0.258626 0.163516 0.765071 O\n0.394274 0.536287 0.604989 O\n0.540534 0.748339 0.705577 O\n0.840664 0.004699 0.568019 O\n0.611217 0.932093 0.591748 O\n0.731354 0.325919 0.707098 O\n0.183353 0.713049 0.528344 O\n0.181649 0.487874 0.554793 O\n0.611751 0.143738 0.485244 O\n0.002065 0.333765 0.619753 O\n0.798854 0.702411 0.580741 O\n0.207708 0.068073 0.581094 O\n0.792292 0.931927 0.418906 O\n0.201146 0.297589 0.419259 O\n0.997935 0.666235 0.380247 O\n0.388249 0.856262 0.514756 O\n0.818351 0.512126 0.445207 O\n0.816647 0.286951 0.471656 O\n0.268646 0.674081 0.292902 O\n0.388783 0.067907 0.408252 O\n0.159336 0.995301 0.431981 O\n0.459466 0.251661 0.294423 O\n0.035593 0.842816 0.230521 O\n0.605726 0.463713 0.395011 O\n0.741374 0.836484 0.234929 O\n0.114114 0.608040 0.205148 O\n0.882629 0.399758 0.292083 O\n0.250185 0.186462 0.262728 O\n0.394774 0.534263 0.106454 O\n0.953951 0.164137 0.273277 O\n0.521859 0.780217 0.213111 O\n0.851835 0.000804 0.040022 O\n0.604432 0.952377 0.086819 O\n0.727317 0.337026 0.203090 O\n0.190784 0.709787 0.024081 O\n0.179180 0.487644 0.056823 O\n0.616029 0.155400 0.970767 O\n0.003711 0.329799 0.119204 O\n0.780286 0.717485 0.085478 O\n0.234858 0.060395 0.096669 O\n0.765142 0.939605 0.903331 O\n0.219714 0.282515 0.914522 O\n0.996289 0.670201 0.880796 O\n0.383971 0.844600 0.029233 O\n0.820820 0.512356 0.943177 O\n0.809216 0.290213 0.975919 O\n0.272683 0.662974 0.796910 O\n0.395568 0.047623 0.913181 O\n0.148165 0.999196 0.959978 O\n0.478141 0.219783 0.786889 O\n0.605226 0.465737 0.893546 O\n0.749815 0.813538 0.737272 O\n0.885886 0.391960 0.794852 O\n0.964407 0.157184 0.769479 O\n",
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"formula_full": "Li12 Sn10 P16 O56",
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{
"id": "mp-555974",
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"structure_string": "Rb4 U2 Si8 O24\n1.0\n-6.916231 0.000000 0.000000\n1.872692 8.285518 0.000000\n-0.240616 -3.356122 -10.866731\nRb U Si O\n4 2 8 24\ndirect\n0.196266 0.309580 0.994534 Rb\n0.822784 0.729569 0.646174 Rb\n0.803734 0.690420 0.005466 Rb\n0.177216 0.270431 0.353826 Rb\n0.324635 0.717474 0.826055 U\n0.675365 0.282526 0.173945 U\n0.301055 0.757175 0.516249 Si\n0.325310 0.137999 0.625388 Si\n0.382238 0.868267 0.166869 Si\n0.030336 0.677757 0.287513 Si\n0.969664 0.322243 0.712487 Si\n0.698945 0.242825 0.483751 Si\n0.674690 0.862001 0.374612 Si\n0.617762 0.131733 0.833131 Si\n0.059892 0.495203 0.818261 O\n0.556591 0.826496 0.244506 O\n0.424946 0.068736 0.181310 O\n0.940108 0.504797 0.181739 O\n0.575054 0.931264 0.818690 O\n0.491727 0.417373 0.203375 O\n0.377282 0.748505 0.026621 O\n0.467354 0.202178 0.523686 O\n0.854119 0.764616 0.358881 O\n0.840217 0.358409 0.606880 O\n0.227236 0.936398 0.565563 O\n0.772764 0.063602 0.434437 O\n0.622718 0.251495 0.973379 O\n0.145881 0.235384 0.641119 O\n0.443409 0.173504 0.755494 O\n0.831777 0.180521 0.769187 O\n0.721881 0.339514 0.381057 O\n0.532646 0.797822 0.476314 O\n0.856313 0.144291 0.141545 O\n0.159783 0.641591 0.393120 O\n0.143687 0.855709 0.858455 O\n0.508273 0.582627 0.796625 O\n0.168223 0.819479 0.230813 O\n0.278119 0.660486 0.618943 O\n",
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"formula_full": "Rb4 U2 Si8 O24",
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{
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"created_at": "2022-09-04T14:39:10.002208Z",
"structure_string": "Ti2 Ge2 O6\n1.0\n6.617458 -2.522509 0.000000\n6.617458 2.522509 0.000000\n5.655903 0.000000 4.261990\nTi Ge O\n2 2 6\ndirect\n0.837470 0.837470 0.837470 Ti\n0.162530 0.162530 0.162530 Ti\n0.606416 0.606416 0.606416 Ge\n0.393584 0.393584 0.393584 Ge\n0.556086 0.898310 0.212709 O\n0.212709 0.556086 0.898310 O\n0.898310 0.212709 0.556086 O\n0.101690 0.787291 0.443914 O\n0.787291 0.443914 0.101690 O\n0.443914 0.101690 0.787291 O\n",
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"volume": 142.2873660627807,
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"formula_full": "Ti2 Ge2 O6",
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{
"id": "mp-1197141",
"created_at": "2022-09-04T14:39:10.004033Z",
"structure_string": "Cr6 Bi2 N2 O24\n1.0\n6.931247 0.000000 0.000000\n-0.781980 7.244904 0.000000\n-0.760335 -1.789563 10.981290\nCr Bi N O\n6 2 2 24\ndirect\n0.838670 0.754988 0.961755 Cr\n0.161330 0.245012 0.038245 Cr\n0.351118 0.522351 0.745918 Cr\n0.648882 0.477649 0.254082 Cr\n0.600715 0.813199 0.612745 Cr\n0.399285 0.186801 0.387255 Cr\n0.367447 0.790024 0.078399 Bi\n0.632553 0.209976 0.921601 Bi\n0.873359 0.986717 0.325681 N\n0.126641 0.013283 0.674319 N\n0.916897 0.782528 0.833128 O\n0.083103 0.217472 0.166872 O\n0.032958 0.787336 0.066094 O\n0.967042 0.212664 0.933906 O\n0.673176 0.915431 0.997662 O\n0.326824 0.084569 0.002338 O\n0.718291 0.541994 0.951355 O\n0.281709 0.458006 0.048645 O\n0.618725 0.681804 0.208404 O\n0.381275 0.318196 0.791596 O\n0.838035 0.504001 0.347268 O\n0.161965 0.495999 0.652732 O\n0.677049 0.313985 0.137321 O\n0.322951 0.686015 0.862679 O\n0.441248 0.398903 0.326939 O\n0.558752 0.601097 0.673061 O\n0.606383 0.998034 0.729997 O\n0.393617 0.001966 0.270003 O\n0.799203 0.821958 0.544933 O\n0.200797 0.178042 0.455067 O\n0.580204 0.185366 0.484786 O\n0.419796 0.814634 0.515214 O\n0.779207 0.247709 0.739711 O\n0.220793 0.752291 0.260289 O\n",
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{
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"structure_string": "La2 B4 Cl2 O8\n1.0\n-4.266817 0.000000 0.000000\n2.043814 6.348712 0.000000\n-0.102436 -1.186346 -8.179795\nLa B Cl O\n2 4 2 8\ndirect\n0.788718 0.032847 0.777878 La\n0.211282 0.967153 0.222122 La\n0.835179 0.349904 0.147376 B\n0.561533 0.437267 0.807151 B\n0.164821 0.650096 0.852624 B\n0.438467 0.562733 0.192849 B\n0.852275 0.200230 0.456741 Cl\n0.147725 0.799770 0.543259 Cl\n0.100791 0.535070 0.177006 O\n0.524591 0.375617 0.181584 O\n0.365287 0.236225 0.791776 O\n0.475409 0.624383 0.818416 O\n0.634713 0.763775 0.208224 O\n0.899209 0.464930 0.822994 O\n0.161056 0.845597 0.920201 O\n0.838944 0.154403 0.079799 O\n",
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{
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"structure_string": "Mn6 O4 F8\n1.0\n3.604803 4.555221 0.000000\n-3.604803 4.555221 0.000000\n0.000000 2.444375 6.711967\nMn O F\n6 4 8\ndirect\n0.667188 0.667188 0.836087 Mn\n0.349412 0.349412 0.670491 Mn\n0.650588 0.650588 0.329509 Mn\n0.332812 0.332812 0.163913 Mn\n0.000000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.570659 0.570659 0.627259 O\n0.241058 0.241058 0.960731 O\n0.758942 0.758942 0.039269 O\n0.429341 0.429341 0.372741 O\n0.639824 0.021762 0.673071 F\n0.978238 0.360176 0.326929 F\n0.878843 0.878843 0.305243 F\n0.121157 0.121157 0.694757 F\n0.360176 0.978238 0.326929 F\n0.021762 0.639824 0.673071 F\n0.692573 0.307427 0.000000 F\n0.307427 0.692573 0.000000 F\n",
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"formula_full": "Mn6 O4 F8",
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"spacegroup": 12
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{
"id": "mp-32023",
"created_at": "2022-09-04T14:39:09.997228Z",
"structure_string": "Li2 Mn4 P6 O24\n1.0\n2.604296 3.947644 0.000000\n-2.604296 3.947644 0.000000\n0.000000 0.680959 19.289691\nLi Mn P O\n2 4 6 24\ndirect\n0.998529 0.998529 0.838187 Li\n0.001471 0.001471 0.161813 Li\n0.001159 0.001159 0.331285 Mn\n0.998841 0.998841 0.668715 Mn\n0.000000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.343964 0.343964 0.412538 P\n0.656036 0.656036 0.587462 P\n0.346810 0.346810 0.745156 P\n0.653190 0.653190 0.254844 P\n0.649669 0.649669 0.922857 P\n0.350331 0.350331 0.077143 P\n0.767752 0.767752 0.318378 O\n0.289877 0.774840 0.927638 O\n0.775518 0.292839 0.261293 O\n0.257602 0.257602 0.815665 O\n0.782610 0.293740 0.588040 O\n0.240384 0.240384 0.481308 O\n0.762522 0.762522 0.651403 O\n0.237478 0.237478 0.348597 O\n0.759616 0.759616 0.518692 O\n0.225160 0.710123 0.072362 O\n0.259887 0.259887 0.148224 O\n0.293740 0.782610 0.588040 O\n0.765101 0.765101 0.985433 O\n0.234899 0.234899 0.014567 O\n0.707161 0.224482 0.738707 O\n0.232248 0.232248 0.681622 O\n0.706260 0.217390 0.411960 O\n0.742398 0.742398 0.184335 O\n0.740113 0.740113 0.851776 O\n0.224482 0.707161 0.738707 O\n0.217390 0.706260 0.411960 O\n0.710123 0.225160 0.072362 O\n0.292839 0.775518 0.261293 O\n0.774840 0.289877 0.927638 O\n",
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{
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"structure_string": "Ta4 Te2 O16\n1.0\n3.054905 9.973701 0.000000\n-3.054905 9.973701 0.000000\n0.000000 0.343056 5.249555\nTa Te O\n4 2 16\ndirect\n0.695545 0.038746 0.236577 Ta\n0.961254 0.304455 0.263423 Ta\n0.304455 0.961254 0.763423 Ta\n0.038746 0.695545 0.736577 Ta\n0.353229 0.646771 0.250000 Te\n0.646771 0.353229 0.750000 Te\n0.794306 0.089831 0.917764 O\n0.910169 0.205694 0.582236 O\n0.205694 0.910169 0.082236 O\n0.089831 0.794306 0.417764 O\n0.555149 0.340206 0.432336 O\n0.659794 0.444851 0.067664 O\n0.444851 0.659794 0.567664 O\n0.340206 0.555149 0.932336 O\n0.756412 0.915317 0.569488 O\n0.084683 0.243588 0.930512 O\n0.203610 0.427618 0.650386 O\n0.572382 0.796390 0.849614 O\n0.796390 0.572382 0.349614 O\n0.427618 0.203610 0.150386 O\n0.915317 0.756412 0.069488 O\n0.243588 0.084683 0.430512 O\n",
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