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{
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{
"id": "mp-1026812",
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"structure_string": "Rb1 Ce1 Mg14\n1.0\n6.739913 0.000000 -0.000000\n-3.369956 5.836935 -0.000000\n0.000000 0.000000 10.531829\nRb Ce Mg\n1 1 14\ndirect\n0.166667 0.333333 0.625000 Rb\n0.166667 0.333333 0.125000 Ce\n0.172957 0.836478 0.125000 Mg\n0.173480 0.836739 0.625000 Mg\n0.663522 0.327043 0.125000 Mg\n0.663261 0.326520 0.625000 Mg\n0.663522 0.836478 0.125000 Mg\n0.663261 0.836739 0.625000 Mg\n0.341323 0.158677 0.365935 Mg\n0.341323 0.158677 0.884065 Mg\n0.341323 0.682648 0.365935 Mg\n0.341323 0.682648 0.884065 Mg\n0.817352 0.158677 0.365935 Mg\n0.817352 0.158677 0.884065 Mg\n0.833333 0.666667 0.370668 Mg\n0.833333 0.666667 0.879332 Mg\n",
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{
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"structure_string": "Ta3 Ge6\n1.0\n2.504620 -4.338129 0.000000\n2.504620 4.338129 0.000000\n0.000000 0.000000 6.807668\nTa Ge\n3 6\ndirect\n0.500000 0.000000 0.500000 Ta\n0.500000 0.500000 0.833333 Ta\n0.000000 0.500000 0.166667 Ta\n0.164277 0.328553 0.500000 Ge\n0.835723 0.164277 0.833333 Ge\n0.328553 0.164277 0.166667 Ge\n0.671447 0.835723 0.166667 Ge\n0.164277 0.835723 0.833333 Ge\n0.835723 0.671447 0.500000 Ge\n",
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},
{
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"structure_string": "Na1 Cd2 Pd1\n1.0\n0.000000 3.412713 3.412713\n3.412713 0.000000 3.412713\n3.412713 3.412713 0.000000\nNa Cd Pd\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Na\n0.750000 0.750000 0.750000 Cd\n0.250000 0.250000 0.250000 Cd\n0.000000 0.000000 0.000000 Pd\n",
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"formula_full": "Na1 Cd2 Pd1",
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"spacegroup": 225
},
{
"id": "mp-720328",
"created_at": "2022-09-04T14:39:06.205273Z",
"structure_string": "K1 Mg8 Al17 Si19 O72\n1.0\n9.980098 0.000000 0.000000\n-4.978517 8.680804 0.000000\n-0.019034 -0.015042 18.857079\nK Mg Al Si O\n1 8 17 19 72\ndirect\n0.007181 0.024041 0.919715 K\n0.333315 0.666514 0.126141 Mg\n0.333206 0.666206 0.625618 Mg\n0.338080 0.661449 0.376190 Mg\n0.329502 0.659614 0.872664 Mg\n0.657834 0.321831 0.127554 Mg\n0.658210 0.320555 0.625780 Mg\n0.659002 0.325165 0.373409 Mg\n0.665433 0.331854 0.872384 Mg\n0.000810 0.500988 0.874937 Al\n0.106657 0.375157 0.999055 Al\n0.103671 0.372380 0.499474 Al\n0.729580 0.633882 0.251783 Al\n0.732392 0.633781 0.750812 Al\n0.898753 0.269132 0.250190 Al\n0.894451 0.269871 0.748772 Al\n0.500186 0.488712 0.376016 Al\n0.500490 0.490244 0.874756 Al\n0.731777 0.096900 0.000997 Al\n0.731740 0.094861 0.500836 Al\n0.373105 0.261187 0.000020 Al\n0.370749 0.261440 0.500096 Al\n0.496177 0.001090 0.125494 Al\n0.496446 0.000361 0.625315 Al\n0.362460 0.101296 0.250276 Al\n0.364172 0.102944 0.749494 Al\n0.622770 0.899293 0.250258 Si\n0.623581 0.898260 0.749771 Si\n0.630311 0.723609 0.000464 Si\n0.630356 0.723512 0.500302 Si\n0.269276 0.891531 0.999475 Si\n0.272004 0.894580 0.500177 Si\n0.502697 0.493286 0.624502 Si\n0.096020 0.731640 0.250063 Si\n0.100535 0.732564 0.749550 Si\n0.272391 0.377404 0.250301 Si\n0.270080 0.376642 0.749925 Si\n0.903362 0.632480 0.000075 Si\n0.907586 0.638498 0.499002 Si\n0.001397 0.504442 0.126812 Si\n0.001863 0.505758 0.624170 Si\n0.001703 0.504234 0.375581 Si\n0.503165 0.495013 0.124954 Si\n0.495389 0.998174 0.374795 Si\n0.495706 0.998749 0.874756 Si\n0.693376 0.904315 0.003132 O\n0.686443 0.901271 0.504892 O\n0.680306 0.777100 0.254554 O\n0.681985 0.776532 0.755798 O\n0.505090 0.859402 0.180871 O\n0.504645 0.857989 0.680999 O\n0.511695 0.869866 0.324078 O\n0.513953 0.871738 0.824204 O\n0.345402 0.854372 0.069215 O\n0.347243 0.853157 0.568765 O\n0.349209 0.866390 0.424905 O\n0.349211 0.867478 0.925250 O\n0.522868 0.640574 0.073947 O\n0.523897 0.639414 0.573754 O\n0.517528 0.644210 0.430779 O\n0.519710 0.644053 0.931313 O\n0.227153 0.906955 0.249367 O\n0.223115 0.911766 0.746290 O\n0.081015 0.775921 0.995330 O\n0.085340 0.775021 0.496103 O\n0.358874 0.482764 0.175062 O\n0.357156 0.480307 0.674428 O\n0.355333 0.493648 0.818183 O\n0.355891 0.493948 0.318870 O\n0.121262 0.647208 0.322078 O\n0.135919 0.651832 0.817795 O\n0.126599 0.646601 0.179122 O\n0.125400 0.649510 0.675791 O\n0.924095 0.698004 0.246537 O\n0.927536 0.699913 0.749263 O\n0.129154 0.489640 0.078821 O\n0.135273 0.500723 0.424027 O\n0.132038 0.495582 0.575849 O\n0.146890 0.507863 0.929274 O\n0.227255 0.301413 0.997828 O\n0.244133 0.326934 0.498643 O\n0.780434 0.695134 0.002348 O\n0.774633 0.685954 0.498968 O\n0.886212 0.540129 0.075908 O\n0.882038 0.532685 0.427091 O\n0.885054 0.538054 0.572075 O\n0.868290 0.522601 0.931919 O\n0.093074 0.327212 0.245807 O\n0.089918 0.323526 0.746941 O\n0.870264 0.363225 0.174220 O\n0.873730 0.360191 0.327973 O\n0.859178 0.352077 0.823555 O\n0.871520 0.362842 0.670614 O\n0.650200 0.523688 0.172597 O\n0.651338 0.524286 0.671853 O\n0.651128 0.506067 0.322355 O\n0.651682 0.508786 0.821960 O\n0.922788 0.223189 0.991045 O\n0.916518 0.237410 0.494416 O\n0.756758 0.077333 0.249162 O\n0.761363 0.073912 0.747332 O\n0.484849 0.351161 0.077861 O\n0.485105 0.349437 0.577990 O\n0.497950 0.344480 0.428815 O\n0.495803 0.344642 0.928061 O\n0.644057 0.135879 0.072049 O\n0.641195 0.133742 0.570840 O\n0.640815 0.115029 0.422165 O\n0.639765 0.114228 0.923330 O\n0.485288 0.137929 0.178574 O\n0.488096 0.138802 0.678659 O\n0.472935 0.120746 0.327544 O\n0.470536 0.119935 0.828136 O\n0.305580 0.237868 0.253719 O\n0.303085 0.236541 0.755248 O\n0.296524 0.061721 0.000718 O\n0.304735 0.065023 0.502827 O\n",
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{
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"structure_string": "Fe2 Mo6 S8\n1.0\n6.491000 0.000000 0.000000\n-0.671425 6.478985 0.000000\n-0.148605 -0.859534 6.469550\nFe Mo S\n2 6 8\ndirect\n0.997102 0.147676 0.905151 Fe\n0.002898 0.852324 0.094849 Fe\n0.779437 0.590465 0.450126 Mo\n0.220563 0.409535 0.549874 Mo\n0.457245 0.781590 0.598061 Mo\n0.542755 0.218410 0.401939 Mo\n0.583686 0.462992 0.777321 Mo\n0.416314 0.537008 0.222679 Mo\n0.735536 0.359958 0.120520 S\n0.264464 0.640042 0.879480 S\n0.796479 0.813329 0.785691 S\n0.203521 0.186671 0.214309 S\n0.641578 0.860022 0.268911 S\n0.358422 0.139978 0.731089 S\n0.144370 0.723468 0.385294 S\n0.855630 0.276532 0.614706 S\n",
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{
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"structure_string": "Cs2 Ti6 Si4 P12 O50\n1.0\n4.181378 -7.242358 0.000000\n4.181378 7.242358 0.000000\n0.000000 0.000000 17.528521\nCs Ti Si P O\n2 6 4 12 50\ndirect\n0.333333 0.666667 0.250000 Cs\n0.666667 0.333333 0.750000 Cs\n0.333333 0.666667 0.022324 Ti\n0.333333 0.666667 0.477676 Ti\n0.666667 0.333333 0.977676 Ti\n0.666667 0.333333 0.522324 Ti\n0.666667 0.333333 0.250000 Ti\n0.333333 0.666667 0.750000 Ti\n0.000000 0.000000 0.091334 Si\n0.000000 0.000000 0.408666 Si\n0.000000 0.000000 0.908666 Si\n0.000000 0.000000 0.591334 Si\n0.384066 0.332238 0.109152 P\n0.667762 0.051829 0.109152 P\n0.948171 0.615934 0.109152 P\n0.667762 0.615934 0.390848 P\n0.948171 0.332238 0.390848 P\n0.384066 0.051829 0.390848 P\n0.615934 0.667762 0.890848 P\n0.332238 0.948171 0.890848 P\n0.051829 0.384066 0.890848 P\n0.332238 0.384066 0.609152 P\n0.051829 0.667762 0.609152 P\n0.615934 0.948171 0.609152 P\n0.117975 0.599780 0.089557 O\n0.400220 0.518196 0.089557 O\n0.481804 0.882025 0.089557 O\n0.400220 0.882025 0.410443 O\n0.481804 0.599780 0.410443 O\n0.117975 0.518196 0.410443 O\n0.882025 0.400220 0.910443 O\n0.599780 0.481804 0.910443 O\n0.518196 0.117975 0.910443 O\n0.599780 0.117975 0.589557 O\n0.518196 0.400220 0.589557 O\n0.882025 0.481804 0.589557 O\n0.807650 0.253405 0.456073 O\n0.746595 0.554246 0.456073 O\n0.445754 0.192350 0.456073 O\n0.746595 0.192350 0.043927 O\n0.445754 0.253405 0.043927 O\n0.807650 0.554246 0.043927 O\n0.192350 0.746595 0.543927 O\n0.253405 0.445754 0.543927 O\n0.554246 0.807650 0.543927 O\n0.253405 0.807650 0.956073 O\n0.554246 0.746595 0.956073 O\n0.192350 0.445754 0.956073 O\n0.478836 0.345784 0.185261 O\n0.654216 0.133053 0.185261 O\n0.866947 0.521164 0.185261 O\n0.654216 0.521164 0.314739 O\n0.866947 0.345784 0.314739 O\n0.478836 0.133053 0.314739 O\n0.521164 0.654216 0.814739 O\n0.345784 0.866947 0.814739 O\n0.133053 0.478836 0.814739 O\n0.345784 0.478836 0.685261 O\n0.133053 0.654216 0.685261 O\n0.521164 0.866947 0.685261 O\n0.000000 0.000000 0.000000 O\n0.000000 0.000000 0.500000 O\n0.022194 0.829972 0.124720 O\n0.170028 0.192223 0.124720 O\n0.807777 0.977806 0.124720 O\n0.170028 0.977806 0.375280 O\n0.807777 0.829972 0.375280 O\n0.022194 0.192223 0.375280 O\n0.977806 0.170028 0.875280 O\n0.829972 0.807777 0.875280 O\n0.192223 0.022194 0.875280 O\n0.829972 0.022194 0.624720 O\n0.192223 0.170028 0.624720 O\n0.977806 0.807777 0.624720 O\n",
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{
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{
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}