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{
"id": "mp-769572",
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"structure_string": "Li6 Al6 V6 O24\n1.0\n5.245991 -0.061031 -0.025588\n-0.066868 5.786894 0.073968\n-0.298496 -2.795416 14.206664\nLi Al V O\n6 6 6 24\ndirect\n0.494452 0.990079 0.498411 Li\n0.994606 0.490519 0.998714 Li\n0.170699 0.815409 0.172873 Li\n0.670971 0.314893 0.673242 Li\n0.341804 0.179803 0.330835 Li\n0.841727 0.679367 0.830756 Li\n0.650884 0.590375 0.170406 Al\n0.151142 0.090212 0.670520 Al\n0.828908 0.918479 0.333181 Al\n0.328063 0.418360 0.833226 Al\n0.996586 0.243489 0.498982 Al\n0.496341 0.743113 0.998941 Al\n0.984281 0.750841 0.501505 V\n0.698986 0.081976 0.161756 V\n0.199211 0.581994 0.661717 V\n0.484503 0.250615 0.001351 V\n0.838334 0.423231 0.332791 V\n0.338459 0.923305 0.832996 V\n0.386117 0.028257 0.074357 O\n0.885956 0.528419 0.574532 O\n0.367199 0.545564 0.080948 O\n0.867023 0.045801 0.580980 O\n0.551384 0.367042 0.247570 O\n0.051776 0.866591 0.747703 O\n0.536090 0.884063 0.241381 O\n0.035949 0.383657 0.741464 O\n0.703642 0.713015 0.411623 O\n0.203351 0.212703 0.911732 O\n0.706056 0.185456 0.410249 O\n0.205410 0.685075 0.910583 O\n0.792365 0.784717 0.087330 O\n0.292367 0.284813 0.587525 O\n0.788390 0.312400 0.092065 O\n0.288452 0.812220 0.592193 O\n0.940020 0.648961 0.254445 O\n0.439957 0.148979 0.754530 O\n0.979741 0.120129 0.256474 O\n0.479233 0.619799 0.756828 O\n0.127694 0.965252 0.426015 O\n0.627476 0.464770 0.925938 O\n0.116381 0.449336 0.418254 O\n0.616814 0.948172 0.918172 O\n",
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},
{
"id": "mp-540725",
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"structure_string": "Cs1 Be4 Al4 B12 O28\n1.0\n7.418220 0.000000 0.000000\n0.000000 7.418220 0.000000\n0.000000 0.000000 7.418220\nCs Be Al B O\n1 4 4 12 28\ndirect\n0.000000 0.000000 0.000000 Cs\n0.739869 0.739869 0.739869 Be\n0.260131 0.739869 0.260131 Be\n0.260131 0.260131 0.739869 Be\n0.739869 0.260131 0.260131 Be\n0.360365 0.360365 0.360365 Al\n0.639635 0.360365 0.639635 Al\n0.639635 0.639635 0.360365 Al\n0.360365 0.639635 0.639635 Al\n0.249494 0.500000 0.000000 B\n0.750506 0.000000 0.500000 B\n0.000000 0.500000 0.249494 B\n0.000000 0.500000 0.750506 B\n0.500000 0.750506 0.000000 B\n0.500000 0.249494 0.000000 B\n0.000000 0.249494 0.500000 B\n0.500000 0.000000 0.249494 B\n0.000000 0.750506 0.500000 B\n0.500000 0.000000 0.750506 B\n0.750506 0.500000 0.000000 B\n0.249494 0.000000 0.500000 B\n0.618444 0.618444 0.618444 O\n0.381556 0.618444 0.381556 O\n0.381556 0.381556 0.618444 O\n0.618444 0.381556 0.381556 O\n0.362089 0.362089 0.095163 O\n0.637911 0.095163 0.637911 O\n0.637911 0.904837 0.362089 O\n0.904837 0.637911 0.362089 O\n0.095163 0.637911 0.637911 O\n0.362089 0.637911 0.904837 O\n0.637911 0.362089 0.904837 O\n0.095163 0.362089 0.362089 O\n0.362089 0.095163 0.362089 O\n0.904837 0.362089 0.637911 O\n0.362089 0.904837 0.637911 O\n0.637911 0.637911 0.095163 O\n0.137028 0.137028 0.596399 O\n0.862972 0.596399 0.862972 O\n0.862972 0.403601 0.137028 O\n0.403601 0.862972 0.137028 O\n0.596399 0.862972 0.862972 O\n0.137028 0.862972 0.403601 O\n0.862972 0.137028 0.403601 O\n0.596399 0.137028 0.137028 O\n0.137028 0.596399 0.137028 O\n0.403601 0.137028 0.862972 O\n0.137028 0.403601 0.862972 O\n0.862972 0.862972 0.596399 O\n",
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{
"id": "mp-1244995",
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"structure_string": "Ga50 N50\n1.0\n11.200499 0.099281 -0.675869\n0.083261 11.323720 -0.002904\n-0.695108 -0.012126 11.724736\nGa N\n50 50\ndirect\n0.766766 0.870921 0.397383 Ga\n0.555864 0.216809 0.309598 Ga\n0.112978 0.267531 0.772992 Ga\n0.487002 0.550602 0.416822 Ga\n0.444695 0.365292 0.167557 Ga\n0.809538 0.662843 0.732411 Ga\n0.643813 0.697841 0.937383 Ga\n0.845303 0.581661 0.274524 Ga\n0.747638 0.274878 0.428823 Ga\n0.021060 0.537809 0.897231 Ga\n0.775684 0.889943 0.895895 Ga\n0.163058 0.950593 0.156049 Ga\n0.707527 0.553164 0.525216 Ga\n0.745047 0.417698 0.059895 Ga\n0.189088 0.380576 0.491984 Ga\n0.193695 0.691196 0.579388 Ga\n0.885343 0.085506 0.258156 Ga\n0.628331 0.564782 0.252952 Ga\n0.028685 0.475342 0.102301 Ga\n0.989686 0.087186 0.032810 Ga\n0.997288 0.858322 0.474239 Ga\n0.272665 0.370523 0.927784 Ga\n0.974141 0.358520 0.312959 Ga\n0.445414 0.799940 0.185143 Ga\n0.028556 0.637336 0.702970 Ga\n0.425351 0.025499 0.325429 Ga\n0.387807 0.113842 0.073600 Ga\n0.084808 0.605676 0.362647 Ga\n0.194572 0.825119 0.755686 Ga\n0.718818 0.126584 0.730297 Ga\n0.274441 0.466246 0.260058 Ga\n0.596958 0.834656 0.656655 Ga\n0.225413 0.658195 0.919979 Ga\n0.995122 0.863382 0.950021 Ga\n0.563537 0.794657 0.437835 Ga\n0.200648 0.041349 0.852676 Ga\n0.504046 0.010499 0.838083 Ga\n0.490925 0.561428 0.985140 Ga\n0.340622 0.902047 0.588007 Ga\n0.865902 0.788453 0.167492 Ga\n0.772825 0.136816 0.990531 Ga\n0.639376 0.916223 0.143712 Ga\n0.172790 0.194399 0.230839 Ga\n0.918181 0.329344 0.881826 Ga\n0.371876 0.836130 0.967874 Ga\n0.151468 0.702699 0.115162 Ga\n0.007350 0.183907 0.518223 Ga\n0.280801 0.770997 0.361421 Ga\n0.961941 0.464645 0.567121 Ga\n0.775997 0.340316 0.698598 Ga\n0.229880 0.549361 0.481527 N\n0.837510 0.558172 0.875183 N\n0.731640 0.018527 0.505054 N\n0.080001 0.319368 0.596862 N\n0.123760 0.762146 0.423863 N\n0.018007 0.814294 0.110584 N\n0.163912 0.331718 0.333175 N\n0.795492 0.395438 0.546772 N\n0.432585 0.177940 0.514682 N\n0.635839 0.453590 0.745269 N\n0.960894 0.505749 0.402950 N\n0.514303 0.682858 0.301159 N\n0.509853 0.214998 0.834572 N\n0.723466 0.818313 0.039502 N\n0.331589 0.526470 0.936744 N\n0.534304 0.272836 0.911738 N\n0.565751 0.078792 0.108094 N\n0.932954 0.067186 0.658411 N\n0.358640 0.277261 0.043307 N\n0.887350 0.438808 0.177469 N\n0.336774 0.355242 0.631209 N\n0.354346 0.354449 0.727750 N\n0.445811 0.650737 0.686420 N\n0.132835 0.566792 0.211920 N\n0.212825 0.037361 0.552743 N\n0.269036 0.808137 0.200449 N\n0.692872 0.769683 0.790933 N\n0.397051 0.884895 0.432118 N\n0.108259 0.028426 0.518779 N\n0.036969 0.254292 0.012782 N\n0.958720 0.968903 0.670814 N\n0.117960 0.985815 0.982412 N\n0.504694 0.175953 0.589484 N\n0.903703 0.215596 0.378974 N\n0.293525 0.072704 0.202716 N\n0.042486 0.077446 0.204451 N\n0.599997 0.469214 0.831974 N\n0.099862 0.303464 0.092584 N\n0.766815 0.562329 0.952803 N\n0.681499 0.038947 0.865451 N\n0.797152 0.933184 0.249332 N\n0.315251 0.584365 0.403667 N\n0.699843 0.998723 0.596299 N\n0.373988 0.008795 0.934209 N\n0.581578 0.470353 0.112907 N\n0.472019 0.936671 0.697317 N\n0.747142 0.160664 0.153238 N\n0.637204 0.148526 0.176213 N\n0.447571 0.565991 0.636886 N\n0.776901 0.299482 0.951420 N\n",
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},
{
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"structure_string": "Al2 F6\n1.0\n7.079555 1.406216 6.217755\n-2.128311 2.148847 2.023562\n-4.703792 -3.102180 -1.766800\nAl F\n2 6\ndirect\n0.555288 0.305779 0.034099 Al\n0.830228 0.305626 0.848218 Al\n0.193217 0.305751 0.440671 F\n0.694023 0.305788 0.943271 F\n0.836702 0.805635 0.863956 F\n0.548238 0.805795 0.017795 F\n0.910090 0.298661 0.654316 F\n0.475077 0.312693 0.227672 F\n",
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{
"id": "mp-1183478",
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"structure_string": "Ca1 Dy1 Zn2\n1.0\n0.000000 3.607713 3.607713\n3.607713 0.000000 3.607713\n3.607713 3.607713 0.000000\nCa Dy Zn\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Ca\n0.000000 0.000000 0.000000 Dy\n0.250000 0.250000 0.250000 Zn\n0.750000 0.750000 0.750000 Zn\n",
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{
"id": "mp-1221556",
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"structure_string": "Na4 Mg1 V10 H44 O52\n1.0\n9.066134 0.000000 0.000000\n-2.146145 11.251902 0.000000\n-1.359657 -3.433835 11.247818\nNa Mg V H O\n4 1 10 44 52\ndirect\n0.713613 0.594637 0.294918 Na\n0.286387 0.405363 0.705082 Na\n0.500000 0.500000 0.500000 Na\n0.500000 0.500000 0.000000 Na\n0.500000 0.000000 0.500000 Mg\n0.030836 0.973582 0.226722 V\n0.969164 0.026418 0.773278 V\n0.168079 0.257185 0.245624 V\n0.831921 0.742815 0.754376 V\n0.813603 0.158550 0.208611 V\n0.186397 0.841450 0.791389 V\n0.961326 0.235247 0.001356 V\n0.038674 0.764753 0.998644 V\n0.184143 0.052077 0.020757 V\n0.815857 0.947923 0.979243 V\n0.245518 0.595759 0.102938 H\n0.754482 0.404241 0.897062 H\n0.746020 0.741782 0.119412 H\n0.253980 0.258218 0.880588 H\n0.988914 0.591304 0.184316 H\n0.011086 0.408696 0.815684 H\n0.649909 0.334892 0.112592 H\n0.350091 0.665108 0.887408 H\n0.793112 0.457189 0.468251 H\n0.206888 0.542811 0.531749 H\n0.582702 0.738891 0.148336 H\n0.417298 0.261109 0.851664 H\n0.239294 0.464853 0.120065 H\n0.760706 0.535147 0.879935 H\n0.943009 0.820005 0.412090 H\n0.056991 0.179995 0.587910 H\n0.398573 0.857489 0.279842 H\n0.601427 0.142511 0.720158 H\n0.253725 0.844763 0.343470 H\n0.746275 0.155237 0.656530 H\n0.364759 0.864498 0.100978 H\n0.635241 0.135502 0.899022 H\n0.641190 0.874762 0.631287 H\n0.358810 0.125238 0.368713 H\n0.483959 0.320565 0.137702 H\n0.516041 0.679435 0.862298 H\n0.411986 0.600392 0.290281 H\n0.588014 0.399608 0.709719 H\n0.464845 0.845349 0.641232 H\n0.535155 0.154651 0.358768 H\n0.741295 0.899531 0.432539 H\n0.258705 0.100469 0.567461 H\n0.876413 0.808530 0.527851 H\n0.123587 0.191470 0.472149 H\n0.689717 0.366705 0.353737 H\n0.310283 0.633295 0.646263 H\n0.955519 0.461987 0.209557 H\n0.044481 0.538013 0.790443 H\n0.540448 0.919262 0.125674 H\n0.459552 0.080738 0.874326 H\n0.746698 0.004123 0.370826 H\n0.253302 0.995877 0.629174 H\n0.472409 0.712127 0.403839 H\n0.527591 0.287873 0.596161 H\n0.109383 0.148954 0.919813 O\n0.890617 0.851046 0.080187 O\n0.849127 0.792127 0.441730 O\n0.150873 0.207873 0.558270 O\n0.170762 0.930770 0.107295 O\n0.829238 0.069230 0.892705 O\n0.295337 0.179522 0.131646 O\n0.704663 0.820478 0.868354 O\n0.057213 0.880527 0.308754 O\n0.942787 0.119473 0.691246 O\n0.571480 0.382399 0.132320 O\n0.428520 0.617601 0.867680 O\n0.485272 0.628408 0.365328 O\n0.514728 0.371592 0.634672 O\n0.708146 0.452193 0.406711 O\n0.291854 0.547807 0.593289 O\n0.937548 0.546214 0.234433 O\n0.062452 0.453786 0.765567 O\n0.869025 0.035019 0.274243 O\n0.130975 0.964981 0.725757 O\n0.460808 0.858696 0.144179 O\n0.539192 0.141304 0.855821 O\n0.661943 0.690527 0.143716 O\n0.338057 0.309473 0.856284 O\n0.930987 0.327812 0.919320 O\n0.069013 0.672188 0.080680 O\n0.364073 0.849997 0.355228 O\n0.635927 0.150003 0.644772 O\n0.311779 0.541933 0.120830 O\n0.688221 0.458067 0.879170 O\n0.985826 0.271100 0.297027 O\n0.014174 0.728900 0.702973 O\n0.697249 0.008114 0.073559 O\n0.302751 0.991886 0.926441 O\n0.996355 0.087172 0.095826 O\n0.003645 0.912828 0.904174 O\n0.113506 0.331232 0.123799 O\n0.886494 0.668767 0.876201 O\n0.172748 0.119542 0.307013 O\n0.827252 0.880458 0.692987 O\n0.537073 0.870725 0.590772 O\n0.462927 0.129275 0.409228 O\n0.296650 0.367250 0.343224 O\n0.703350 0.632750 0.656776 O\n0.809432 0.244080 0.092616 O\n0.190568 0.755920 0.907384 O\n0.687700 0.965729 0.422389 O\n0.312300 0.034271 0.577611 O\n0.675826 0.197928 0.280270 O\n0.324174 0.802072 0.719730 O\n0.110419 0.646733 0.448156 O\n0.889581 0.353267 0.551844 O\n",
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