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{
"id": "mp-1247049",
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{
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{
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{
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"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": "Mo4 Se8\n1.0\n1.663474 -2.881222 0.000000\n1.663474 2.881222 0.000000\n0.000000 0.000000 40.902846\nMo Se\n4 8\ndirect\n0.666667 0.333333 0.905560 Mo\n0.666667 0.333333 0.283319 Mo\n0.333333 0.666667 0.716681 Mo\n0.333333 0.666667 0.094440 Mo\n0.333333 0.666667 0.946453 Se\n0.333333 0.666667 0.324212 Se\n0.666667 0.333333 0.757573 Se\n0.666667 0.333333 0.135332 Se\n0.333333 0.666667 0.864668 Se\n0.333333 0.666667 0.242427 Se\n0.666667 0.333333 0.675788 Se\n0.666667 0.333333 0.053547 Se\n",
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{
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"structure_string": "Mg2 P4 H24 O22\n1.0\n-7.793480 0.000000 0.000000\n2.316962 7.548548 0.000000\n-0.827701 -3.469686 -8.586214\nMg P H O\n2 4 24 22\ndirect\n0.357925 0.231944 0.711122 Mg\n0.642075 0.768056 0.288878 Mg\n0.415714 0.097737 0.319998 P\n0.584286 0.902263 0.680002 P\n0.269843 0.435326 0.085995 P\n0.730157 0.564674 0.914005 P\n0.186237 0.013471 0.168039 H\n0.813763 0.986529 0.831961 H\n0.490650 0.320982 0.214632 H\n0.509350 0.679018 0.785368 H\n0.322686 0.736759 0.138452 H\n0.677314 0.263241 0.861548 H\n0.000042 0.267391 0.127636 H\n0.999958 0.732609 0.872364 H\n0.184885 0.440025 0.616608 H\n0.815115 0.559975 0.383392 H\n0.095884 0.414096 0.767957 H\n0.904116 0.585904 0.232043 H\n0.031204 0.961479 0.627614 H\n0.968796 0.038521 0.372386 H\n0.164376 0.833832 0.581355 H\n0.835624 0.166168 0.418645 H\n0.140952 0.500051 0.407639 H\n0.859048 0.499949 0.592361 H\n0.324545 0.631637 0.493940 H\n0.675455 0.368363 0.506060 H\n0.242537 0.895723 0.926566 H\n0.757463 0.104277 0.073434 H\n0.204621 0.977658 0.936620 H\n0.795379 0.022342 0.063380 H\n0.449743 0.222224 0.490396 O\n0.550257 0.777776 0.509604 O\n0.458034 0.906802 0.266646 O\n0.541966 0.093198 0.733354 O\n0.205515 0.057395 0.280610 O\n0.794485 0.942605 0.719390 O\n0.521458 0.203911 0.211501 O\n0.478542 0.796089 0.788499 O\n0.254981 0.271694 0.931796 O\n0.745019 0.728306 0.068204 O\n0.434261 0.499427 0.191744 O\n0.565739 0.500573 0.808256 O\n0.240603 0.613777 0.063183 O\n0.759397 0.386223 0.936817 O\n0.099993 0.372253 0.188714 O\n0.900007 0.627747 0.811286 O\n0.170071 0.361828 0.681990 O\n0.829929 0.638172 0.318010 O\n0.158728 0.966875 0.615760 O\n0.841272 0.033125 0.384240 O\n0.194978 0.582055 0.511866 O\n0.805022 0.417945 0.488134 O\n",
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{
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{
"id": "mp-1211067",
"created_at": "2022-09-04T14:39:06.291229Z",
"structure_string": "Li2 Tm4 Br10\n1.0\n3.330217 9.171285 0.000000\n-3.330217 9.171285 0.000000\n0.000000 2.225775 7.672344\nLi Tm Br\n2 4 10\ndirect\n0.000000 0.500000 0.500000 Li\n0.500000 0.000000 0.000000 Li\n0.172711 0.725261 0.968646 Tm\n0.827289 0.274739 0.031354 Tm\n0.274739 0.827289 0.531354 Tm\n0.725261 0.172711 0.468646 Tm\n0.111198 0.888802 0.250000 Br\n0.888802 0.111198 0.750000 Br\n0.870831 0.742718 0.108488 Br\n0.129169 0.257282 0.891512 Br\n0.257282 0.129169 0.391512 Br\n0.742718 0.870831 0.608488 Br\n0.672299 0.510942 0.321060 Br\n0.327701 0.489058 0.678940 Br\n0.489058 0.327701 0.178940 Br\n0.510942 0.672299 0.821060 Br\n",
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