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{
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{
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"created_at": "2022-09-04T14:47:23.814623Z",
"structure_string": "Ni15 Mo17 P12\n1.0\n7.037802 0.000000 0.000000\n-3.497448 6.130539 0.000000\n-0.687116 -2.666577 13.047530\nNi Mo P\n15 17 12\ndirect\n0.781198 0.168647 0.748840 Ni\n0.779924 0.666817 0.249310 Ni\n0.220076 0.333183 0.750690 Ni\n0.218802 0.831353 0.251160 Ni\n0.364978 0.033948 0.749482 Ni\n0.364517 0.533148 0.248916 Ni\n0.635483 0.466852 0.751084 Ni\n0.635022 0.966052 0.250518 Ni\n0.500539 0.748558 0.749005 Ni\n0.499461 0.251442 0.250995 Ni\n0.644301 0.296241 0.915619 Ni\n0.643750 0.795501 0.415342 Ni\n0.356250 0.204499 0.584658 Ni\n0.355699 0.703759 0.084381 Ni\n0.000000 0.500000 0.500000 Ni\n0.941625 0.915033 0.777793 Mo\n0.941742 0.413124 0.285675 Mo\n0.058258 0.586876 0.714325 Mo\n0.058375 0.084967 0.222207 Mo\n0.703286 0.631343 0.578938 Mo\n0.698628 0.133580 0.081495 Mo\n0.301372 0.866420 0.918505 Mo\n0.296714 0.368657 0.421062 Mo\n0.431541 0.851548 0.570553 Mo\n0.441100 0.357843 0.072179 Mo\n0.558900 0.642157 0.927821 Mo\n0.568459 0.148452 0.429447 Mo\n0.075690 0.391281 0.923916 Mo\n0.075211 0.884059 0.424751 Mo\n0.924789 0.115941 0.575249 Mo\n0.924310 0.608719 0.076084 Mo\n0.000000 0.000000 0.000000 Mo\n0.701936 0.015327 0.888745 P\n0.708194 0.517337 0.392906 P\n0.291806 0.482663 0.607094 P\n0.298064 0.984673 0.111255 P\n0.298686 0.215539 0.883557 P\n0.298970 0.716448 0.386136 P\n0.701030 0.283552 0.613864 P\n0.701314 0.784461 0.116443 P\n0.096963 0.881331 0.615073 P\n0.097154 0.382310 0.118358 P\n0.902846 0.617690 0.881642 P\n0.903037 0.118669 0.384927 P\n",
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{
"id": "mp-1224665",
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"structure_string": "Lu12 Co31 Sn16\n1.0\n-0.002475 0.001289 -7.454138\n-4.353366 -7.540207 -0.000143\n-13.141241 7.587051 -0.005682\nLu Co Sn\n12 31 16\ndirect\n0.497624 0.287509 0.238011 Lu\n0.505273 0.785218 0.738676 Lu\n0.497607 0.712452 0.238044 Lu\n0.505259 0.214734 0.738746 Lu\n0.498959 0.499903 0.024565 Lu\n0.504704 0.999892 0.522882 Lu\n0.998842 0.212569 0.261951 Lu\n0.994741 0.709607 0.763274 Lu\n0.998858 0.787360 0.261997 Lu\n0.994805 0.290382 0.763317 Lu\n0.995645 0.999850 0.473199 Lu\n0.999152 0.499989 0.975704 Lu\n0.032000 0.651347 0.450395 Co\n0.032501 0.150225 0.949374 Co\n0.031996 0.348846 0.450471 Co\n0.032449 0.849877 0.949419 Co\n0.029368 0.999971 0.099933 Co\n0.032640 0.500021 0.598786 Co\n0.530489 0.848755 0.049959 Co\n0.528696 0.348067 0.550659 Co\n0.530455 0.151277 0.049936 Co\n0.528713 0.652022 0.550695 Co\n0.528748 0.500003 0.400538 Co\n0.527990 0.000028 0.899620 Co\n0.339502 0.743290 0.420600 Co\n0.340786 0.240831 0.918349 Co\n0.339474 0.256733 0.420614 Co\n0.340693 0.759271 0.918364 Co\n0.342097 0.000015 0.161878 Co\n0.338971 0.500022 0.661250 Co\n0.843710 0.757713 0.080415 Co\n0.847970 0.257917 0.580809 Co\n0.843652 0.242290 0.080432 Co\n0.847983 0.742125 0.580830 Co\n0.845126 0.499997 0.338338 Co\n0.848065 0.999961 0.837897 Co\n0.786743 0.000007 0.999001 Co\n0.786368 0.500045 0.500058 Co\n0.285864 0.000023 0.999167 Co\n0.285351 0.500026 0.502071 Co\n0.656751 0.999955 0.333258 Co\n0.657805 0.499972 0.832189 Co\n0.151655 0.500023 0.167316 Co\n0.711921 0.756333 0.413621 Sn\n0.712328 0.258002 0.914308 Sn\n0.711924 0.243609 0.413600 Sn\n0.712280 0.741997 0.914354 Sn\n0.711298 0.999940 0.171709 Sn\n0.711428 0.499977 0.670533 Sn\n0.213755 0.741965 0.086355 Sn\n0.210179 0.228682 0.590631 Sn\n0.213692 0.258080 0.086403 Sn\n0.210146 0.771235 0.590586 Sn\n0.213541 0.499987 0.328500 Sn\n0.209432 0.999989 0.819620 Sn\n0.303200 0.999980 0.333255 Sn\n0.303198 0.500024 0.833952 Sn\n0.801287 0.500065 0.166540 Sn\n0.805115 0.999964 0.666393 Sn\n",
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{
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"created_at": "2022-09-04T14:41:01.972506Z",
"structure_string": "Sr16 V12 O39\n1.0\n7.859848 0.000000 0.000000\n3.921548 7.858675 0.000000\n1.973786 1.961492 14.149886\nSr V O\n16 12 39\ndirect\n0.924680 0.847437 0.598323 Sr\n0.888891 0.778087 0.863583 Sr\n0.401428 0.778098 0.862991 Sr\n0.428765 0.848547 0.594577 Sr\n0.853070 0.709592 0.134063 Sr\n0.820618 0.646168 0.404380 Sr\n0.330252 0.647210 0.404554 Sr\n0.370278 0.710047 0.133764 Sr\n0.673306 0.352501 0.595441 Sr\n0.633042 0.290030 0.863261 Sr\n0.144647 0.290495 0.863390 Sr\n0.175130 0.355368 0.595387 Sr\n0.595898 0.223420 0.133926 Sr\n0.567671 0.151234 0.405496 Sr\n0.113671 0.223045 0.133910 Sr\n0.078811 0.150384 0.405377 Sr\n0.963526 0.926782 0.292639 V\n0.465171 0.930846 0.276870 V\n0.786557 0.566448 0.718027 V\n0.283958 0.573915 0.717931 V\n0.715605 0.428485 0.279163 V\n0.250014 0.499690 0.000668 V\n0.749687 0.500179 0.000564 V\n0.214250 0.431381 0.279385 V\n0.534242 0.070119 0.720434 V\n0.035630 0.070772 0.717594 V\n0.001659 0.003119 0.987357 V\n0.499936 0.000070 0.000063 V\n0.946844 0.894483 0.423559 O\n0.662773 0.811159 0.725865 O\n0.483376 0.966647 0.133463 O\n0.198166 0.933182 0.266945 O\n0.735179 0.933101 0.267195 O\n0.165208 0.809130 0.721499 O\n0.447661 0.895131 0.418875 O\n0.770270 0.523027 0.868419 O\n0.627182 0.747853 0.998030 O\n0.801071 0.607626 0.578337 O\n0.534487 0.568926 0.724251 O\n0.261377 0.543446 0.868808 O\n0.034573 0.568777 0.724334 O\n0.091143 0.682734 0.272228 O\n0.115255 0.762591 0.014262 O\n0.591219 0.678587 0.275757 O\n0.305434 0.601300 0.578355 O\n0.904935 0.329895 0.721770 O\n0.966929 0.429755 0.276580 O\n0.499898 0.499480 0.002142 O\n0.999231 0.499277 0.003266 O\n0.698033 0.393946 0.417982 O\n0.732994 0.466631 0.136939 O\n0.232882 0.465249 0.136610 O\n0.464470 0.431785 0.276455 O\n0.405608 0.325994 0.726163 O\n0.197773 0.396518 0.418186 O\n0.881316 0.230713 0.013768 O\n0.775310 0.069120 0.723477 O\n0.841752 0.181981 0.271917 O\n0.052887 0.106454 0.578829 O\n0.516797 0.033507 0.866109 O\n0.017937 0.034781 0.859098 O\n0.373419 0.253281 0.997964 O\n0.551364 0.105640 0.580761 O\n0.339855 0.182453 0.275813 O\n0.293716 0.069384 0.723665 O\n0.753646 0.998833 0.005438 O\n0.244898 0.998674 0.005664 O\n",
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{
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"structure_string": "K16 Zr12 Se61\n1.0\n12.781520 0.000000 0.000000\n4.827353 14.312086 0.000000\n3.521671 3.407989 14.738609\nK Zr Se\n16 12 61\ndirect\n0.005229 0.029355 0.175594 K\n0.131672 0.614423 0.346843 K\n0.282630 0.300553 0.142978 K\n0.213773 0.252689 0.825925 K\n0.155288 0.636078 0.638636 K\n0.600283 0.103533 0.340547 K\n0.372370 0.832459 0.320468 K\n0.418108 0.462012 0.849923 K\n0.582545 0.538438 0.148129 K\n0.628409 0.167581 0.679699 K\n0.401560 0.895003 0.659619 K\n0.864875 0.365237 0.347026 K\n0.787417 0.747540 0.174671 K\n0.717782 0.699415 0.855415 K\n0.890037 0.387608 0.652730 K\n0.993985 0.970580 0.824830 K\n0.116825 0.065731 0.501141 Zr\n0.076281 0.583337 0.003380 Zr\n0.253544 0.248938 0.503877 Zr\n0.243147 0.742292 0.005851 Zr\n0.405375 0.424454 0.487205 Zr\n0.382918 0.929736 0.006326 Zr\n0.616878 0.068598 0.996054 Zr\n0.581439 0.575343 0.513515 Zr\n0.756934 0.256766 0.994418 Zr\n0.743995 0.749262 0.497117 Zr\n0.923737 0.416301 0.997154 Zr\n0.883354 0.932393 0.498891 Zr\n0.015455 0.778621 0.019983 Se\n0.067674 0.536083 0.183280 Se\n0.071916 0.392785 0.451592 Se\n0.131558 0.253191 0.379839 Se\n0.106560 0.152930 0.635127 Se\n0.271148 0.092409 0.069743 Se\n0.252714 0.072962 0.334711 Se\n0.086655 0.799377 0.145593 Se\n0.069281 0.818103 0.415395 Se\n0.246656 0.551964 0.099745 Se\n0.014759 0.723050 0.853230 Se\n0.446614 0.008924 0.123305 Se\n0.339362 0.069438 0.459097 Se\n0.022873 0.922805 0.616858 Se\n0.288502 0.009645 0.849091 Se\n0.214595 0.397172 0.598075 Se\n0.143281 0.421051 0.953664 Se\n0.318391 0.391505 0.357144 Se\n0.369651 0.131301 0.641708 Se\n0.213911 0.872066 0.549072 Se\n0.212374 0.676543 0.861467 Se\n0.358452 0.768001 0.133332 Se\n0.373617 0.384471 0.668816 Se\n0.474285 0.215402 0.511216 Se\n0.371866 0.607202 0.459757 Se\n0.593997 0.196549 0.118808 Se\n0.553418 0.370189 0.051024 Se\n0.170996 0.940283 0.982310 Se\n0.520830 0.358371 0.334870 Se\n0.450887 0.224326 0.931480 Se\n0.548902 0.774367 0.070945 Se\n0.467312 0.655016 0.659123 Se\n0.828994 0.058357 0.019441 Se\n0.626124 0.386648 0.496336 Se\n0.446875 0.628929 0.949312 Se\n0.406205 0.802860 0.882488 Se\n0.522236 0.780711 0.487987 Se\n0.633267 0.615695 0.328098 Se\n0.641436 0.229269 0.869135 Se\n0.628818 0.407505 0.642503 Se\n0.788163 0.322870 0.138793 Se\n0.787347 0.126820 0.451141 Se\n0.631436 0.865479 0.357930 Se\n0.667315 0.620529 0.646203 Se\n0.857124 0.578664 0.046673 Se\n0.781683 0.594842 0.410367 Se\n0.712491 0.989167 0.152879 Se\n0.977888 0.076077 0.383109 Se\n0.660122 0.929491 0.540247 Se\n0.552248 0.989872 0.878777 Se\n0.986067 0.276097 0.146934 Se\n0.753765 0.447528 0.900693 Se\n0.931218 0.181857 0.582758 Se\n0.913139 0.200862 0.854111 Se\n0.746506 0.927150 0.664673 Se\n0.728280 0.906597 0.931350 Se\n0.892894 0.846401 0.364844 Se\n0.871372 0.745499 0.618592 Se\n0.931079 0.609208 0.543939 Se\n0.932138 0.465816 0.817791 Se\n0.984831 0.220842 0.979224 Se\n",
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{
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"elements": [
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"updated_at": "2021-11-28T01:34:39.135000Z",
"spacegroup": 5
},
{
"id": "mp-1229054",
"created_at": "2022-09-04T14:46:22.289516Z",
"structure_string": "Al53 Fe17 Si12\n1.0\n8.782992 0.000000 0.000000\n-2.891105 8.301763 0.000000\n-2.991123 -4.107884 16.077544\nAl Fe Si\n53 17 12\ndirect\n0.421886 0.385826 0.808108 Al\n0.921884 0.386223 0.306625 Al\n0.078116 0.613777 0.693375 Al\n0.578114 0.614174 0.191892 Al\n0.802223 0.704682 0.896070 Al\n0.287355 0.687705 0.388342 Al\n0.249562 0.209744 0.953134 Al\n0.758974 0.220678 0.449642 Al\n0.435545 0.101044 0.657096 Al\n0.939267 0.093465 0.146643 Al\n0.712645 0.312295 0.611658 Al\n0.197777 0.295318 0.103930 Al\n0.241026 0.779322 0.550358 Al\n0.750438 0.790256 0.046866 Al\n0.060733 0.906535 0.853357 Al\n0.564455 0.898956 0.342904 Al\n0.198057 0.460319 0.877944 Al\n0.696473 0.460306 0.374621 Al\n0.199554 0.249587 0.662437 Al\n0.701972 0.247869 0.159751 Al\n0.524300 0.679851 0.772361 Al\n0.021122 0.676889 0.266787 Al\n0.303527 0.539694 0.625379 Al\n0.801943 0.539681 0.122056 Al\n0.298028 0.752131 0.840249 Al\n0.800446 0.750413 0.337563 Al\n0.978878 0.323111 0.733213 Al\n0.475700 0.320149 0.227639 Al\n0.827379 0.062753 0.582527 Al\n0.308944 0.056677 0.074248 Al\n0.563268 0.839282 0.625109 Al\n0.058275 0.847357 0.115800 Al\n0.121568 0.764229 0.971179 Al\n0.631590 0.756138 0.469200 Al\n0.691056 0.943323 0.925752 Al\n0.172621 0.937247 0.417473 Al\n0.941725 0.152643 0.884200 Al\n0.436732 0.160718 0.374891 Al\n0.368410 0.243862 0.530800 Al\n0.878432 0.235771 0.028821 Al\n0.500000 0.000000 0.500000 Al\n0.709603 0.359003 0.781071 Al\n0.208016 0.351908 0.277155 Al\n0.609296 0.442596 0.964599 Al\n0.110315 0.441112 0.465084 Al\n0.379569 0.070105 0.824170 Al\n0.882168 0.071553 0.320030 Al\n0.791984 0.648092 0.722845 Al\n0.290397 0.640997 0.218929 Al\n0.889685 0.558888 0.534916 Al\n0.390704 0.557404 0.035401 Al\n0.117832 0.928447 0.679970 Al\n0.620431 0.929895 0.175830 Al\n0.688954 0.207446 0.896288 Fe\n0.190304 0.206514 0.397327 Fe\n0.809696 0.793486 0.602673 Fe\n0.311046 0.792554 0.103712 Fe\n0.992909 0.594193 0.829020 Fe\n0.492615 0.595556 0.329993 Fe\n0.987465 0.341002 0.580727 Fe\n0.486984 0.341430 0.081572 Fe\n0.360521 0.837147 0.702717 Fe\n0.862493 0.836953 0.203494 Fe\n0.507385 0.404444 0.670007 Fe\n0.007091 0.405807 0.170980 Fe\n0.513016 0.658570 0.918428 Fe\n0.012535 0.658998 0.419273 Fe\n0.137507 0.163047 0.796506 Fe\n0.639479 0.162853 0.297283 Fe\n0.000000 0.000000 0.000000 Fe\n0.909207 0.453218 0.928989 Si\n0.407096 0.454852 0.429101 Si\n0.538899 0.144145 0.990696 Si\n0.034245 0.140576 0.489090 Si\n0.630600 0.018986 0.775621 Si\n0.132103 0.022240 0.270878 Si\n0.592904 0.545148 0.570899 Si\n0.090793 0.546782 0.071011 Si\n0.965755 0.859424 0.510910 Si\n0.461101 0.855855 0.009304 Si\n0.867897 0.977760 0.729122 Si\n0.369400 0.981014 0.224379 Si\n",
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"formula_full": "Al53 Fe17 Si12",
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}
]
}