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{
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{
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{
"id": "mp-1206092",
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"structure_string": "Cs3 Dy1 Cl6\n1.0\n0.000000 5.934371 5.934371\n5.934371 0.000000 5.934371\n5.934371 5.934371 0.000000\nCs Dy Cl\n3 1 6\ndirect\n0.250000 0.250000 0.250000 Cs\n0.750000 0.750000 0.750000 Cs\n0.500000 0.500000 0.500000 Cs\n0.000000 0.000000 0.000000 Dy\n0.777582 0.222418 0.222418 Cl\n0.222418 0.777582 0.777582 Cl\n0.222418 0.777582 0.222418 Cl\n0.777582 0.222418 0.777582 Cl\n0.222418 0.222418 0.777582 Cl\n0.777582 0.777582 0.222418 Cl\n",
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{
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"structure_string": "Li2 Cd1 Bi1\n1.0\n0.000000 3.476758 3.476758\n3.476758 0.000000 3.476758\n3.476758 3.476758 0.000000\nLi Cd Bi\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Li\n0.750000 0.750000 0.750000 Li\n0.000000 0.000000 0.000000 Cd\n0.500000 0.500000 0.500000 Bi\n",
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{
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"structure_string": "Li9 V6 P12 H6 O48\n1.0\n12.587309 0.000000 0.000000\n-1.378956 9.292595 0.000000\n-1.456395 -1.234932 7.281451\nLi V P H O\n9 6 12 6 48\ndirect\n0.171745 0.038440 0.842038 Li\n0.155594 0.290905 0.155460 Li\n0.421722 0.058401 0.344381 Li\n0.243249 0.615816 0.647758 Li\n0.507438 0.378206 0.849488 Li\n0.759695 0.390018 0.349037 Li\n0.583178 0.948922 0.654802 Li\n0.840486 0.704611 0.844817 Li\n0.824891 0.960393 0.159782 Li\n0.999120 0.501628 0.004711 V\n0.331962 0.335089 0.497404 V\n0.001649 0.997976 0.495463 V\n0.668382 0.168000 0.003806 V\n0.334101 0.825393 0.006774 V\n0.662602 0.665191 0.488221 V\n0.172799 0.019885 0.230507 P\n0.156376 0.316204 0.764316 P\n0.404257 0.058658 0.740067 P\n0.072230 0.724041 0.737946 P\n0.255238 0.610906 0.266448 P\n0.507767 0.358172 0.233789 P\n0.492707 0.648704 0.766199 P\n0.741165 0.394940 0.738278 P\n0.929522 0.279230 0.269401 P\n0.594948 0.941621 0.267891 P\n0.840158 0.686080 0.229958 P\n0.824363 0.975660 0.755102 P\n0.006859 0.512227 0.508874 H\n0.319084 0.332095 0.989990 H\n0.337735 0.848320 0.507809 H\n0.676798 0.187437 0.516775 H\n0.653199 0.664215 0.990891 H\n0.984317 0.991633 0.983565 H\n0.110724 0.158807 0.660655 O\n0.069526 0.397076 0.823737 O\n0.098717 0.039115 0.049822 O\n0.007005 0.333934 0.144361 O\n0.232798 0.291560 0.948002 O\n0.224310 0.178435 0.336271 O\n0.065394 0.615796 0.560512 O\n0.225570 0.401826 0.650918 O\n0.385899 0.208178 0.691512 O\n0.053821 0.874782 0.690654 O\n0.525551 0.067783 0.842250 O\n0.192759 0.736696 0.846299 O\n0.135600 0.591203 0.150068 O\n0.275676 0.458611 0.305950 O\n0.442812 0.272772 0.354827 O\n0.108622 0.939976 0.354093 O\n0.274495 0.714743 0.447961 O\n0.601483 0.048674 0.445182 O\n0.442427 0.491827 0.660746 O\n0.731437 0.050072 0.808803 O\n0.399170 0.725387 0.813915 O\n0.433998 0.374936 0.054671 O\n0.673878 0.001313 0.148030 O\n0.330628 0.672461 0.142500 O\n0.658581 0.331844 0.848562 O\n0.324668 0.995440 0.853322 O\n0.566787 0.624375 0.946278 O\n0.269346 0.946239 0.186624 O\n0.604971 0.285639 0.192006 O\n0.559397 0.510545 0.356653 O\n0.728525 0.289513 0.552751 O\n0.392330 0.954528 0.551917 O\n0.557847 0.734985 0.648514 O\n0.892452 0.056257 0.640571 O\n0.722029 0.542879 0.683611 O\n0.859284 0.412833 0.853227 O\n0.474691 0.925538 0.156240 O\n0.807563 0.264228 0.157555 O\n0.947772 0.125622 0.307740 O\n0.621749 0.795524 0.318872 O\n0.773430 0.602568 0.350238 O\n0.939822 0.387405 0.444259 O\n0.774021 0.817496 0.653215 O\n0.766416 0.708639 0.050679 O\n0.991825 0.667379 0.855709 O\n0.897489 0.952334 0.941815 O\n0.928302 0.600268 0.181973 O\n0.890436 0.842649 0.338883 O\n",
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{
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"structure_string": "Na2 Sr2 Mg4 F14\n1.0\n-3.682517 3.809078 5.252295\n3.682517 -3.809078 5.252295\n3.682517 3.809078 -5.252295\nNa Sr Mg F\n2 2 4 14\ndirect\n0.000000 0.000000 0.500000 Na\n0.000000 0.500000 0.000000 Na\n0.000000 0.000000 0.000000 Sr\n0.500000 0.000000 0.500000 Sr\n0.500000 0.500000 0.500000 Mg\n0.500000 0.000000 0.000000 Mg\n0.500000 0.500000 0.000000 Mg\n0.000000 0.500000 0.500000 Mg\n0.117889 0.867889 0.250000 F\n0.882111 0.132111 0.750000 F\n0.421720 0.171720 0.250000 F\n0.818624 0.568624 0.250000 F\n0.433057 0.579237 0.258972 F\n0.820265 0.174085 0.241028 F\n0.433057 0.174085 0.853820 F\n0.820265 0.579237 0.646180 F\n0.578280 0.828280 0.750000 F\n0.181376 0.431376 0.750000 F\n0.566943 0.420763 0.741028 F\n0.179735 0.825915 0.758972 F\n0.566943 0.825915 0.146180 F\n0.179735 0.420763 0.353820 F\n",
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{
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"structure_string": "Nd20 B16 O48\n1.0\n7.919504 0.000000 0.000000\n0.000000 8.736060 0.000000\n0.000000 0.000000 15.207180\nNd B O\n20 16 48\ndirect\n0.336957 0.455549 0.750000 Nd\n0.663043 0.544451 0.250000 Nd\n0.163043 0.955549 0.250000 Nd\n0.836957 0.044451 0.750000 Nd\n0.003770 0.326229 0.597480 Nd\n0.996230 0.673771 0.402520 Nd\n0.496230 0.826229 0.402520 Nd\n0.996230 0.673771 0.097480 Nd\n0.503770 0.173771 0.597480 Nd\n0.003770 0.326229 0.902520 Nd\n0.503770 0.173771 0.902520 Nd\n0.496230 0.826229 0.097480 Nd\n0.333024 0.335575 0.129010 Nd\n0.666976 0.664425 0.870990 Nd\n0.166976 0.835575 0.870990 Nd\n0.666976 0.664425 0.629010 Nd\n0.833024 0.164425 0.129010 Nd\n0.333024 0.335575 0.370990 Nd\n0.833024 0.164425 0.370990 Nd\n0.166976 0.835575 0.629010 Nd\n0.514010 0.860340 0.750000 B\n0.485990 0.139660 0.250000 B\n0.985990 0.360340 0.250000 B\n0.014010 0.639660 0.750000 B\n0.156329 0.169607 0.750000 B\n0.843671 0.830393 0.250000 B\n0.343671 0.669607 0.250000 B\n0.656329 0.330393 0.750000 B\n0.155995 0.059002 0.040368 B\n0.844005 0.940998 0.959632 B\n0.344005 0.559002 0.959632 B\n0.844005 0.940998 0.540368 B\n0.655995 0.440998 0.040368 B\n0.155995 0.059002 0.459632 B\n0.655995 0.440998 0.459632 B\n0.344005 0.559002 0.540368 B\n0.244602 0.223970 0.669200 O\n0.755398 0.776030 0.330800 O\n0.255398 0.723970 0.330800 O\n0.755398 0.776030 0.169200 O\n0.744602 0.276030 0.669200 O\n0.244602 0.223970 0.830800 O\n0.744602 0.276030 0.830800 O\n0.255398 0.723970 0.169200 O\n0.101848 0.212224 0.042783 O\n0.898152 0.787776 0.957217 O\n0.398152 0.712224 0.957217 O\n0.898152 0.787776 0.542783 O\n0.601848 0.287776 0.042783 O\n0.101848 0.212224 0.457217 O\n0.601848 0.287776 0.457217 O\n0.398152 0.712224 0.542783 O\n0.065086 0.570097 0.670014 O\n0.934914 0.429903 0.329986 O\n0.434914 0.070097 0.329986 O\n0.934914 0.429903 0.170014 O\n0.565086 0.929903 0.670014 O\n0.065086 0.570097 0.829986 O\n0.565086 0.929903 0.829986 O\n0.434914 0.070097 0.170014 O\n0.140403 0.001590 0.750000 O\n0.859597 0.998410 0.250000 O\n0.359597 0.501590 0.250000 O\n0.640403 0.498410 0.750000 O\n0.382837 0.747841 0.750000 O\n0.617163 0.252159 0.250000 O\n0.117163 0.247841 0.250000 O\n0.882837 0.752159 0.750000 O\n0.293822 0.013697 0.508302 O\n0.706178 0.986303 0.491698 O\n0.206178 0.513697 0.491698 O\n0.706178 0.986303 0.008302 O\n0.793822 0.486303 0.508302 O\n0.293822 0.013697 0.991698 O\n0.793822 0.486303 0.991698 O\n0.206178 0.513697 0.008302 O\n0.435505 0.461878 0.595278 O\n0.564495 0.538122 0.404722 O\n0.064495 0.961878 0.404722 O\n0.564495 0.538122 0.095278 O\n0.935505 0.038122 0.595278 O\n0.435505 0.461878 0.904722 O\n0.935505 0.038122 0.904722 O\n0.064495 0.961878 0.095278 O\n",
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{
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"structure_string": "Mg1 Ti4 Cu3 O12\n1.0\n6.056392 0.008450 -2.139760\n-3.040720 5.316913 -2.125044\n0.001412 -0.008450 6.423276\nMg Ti Cu O\n1 4 3 12\ndirect\n0.945440 0.873802 0.928360 Mg\n0.999787 0.976144 0.483758 Ti\n0.987803 0.455576 0.984259 Ti\n0.471317 0.455576 0.467773 Ti\n0.492387 0.976144 0.976357 Ti\n0.500018 0.487248 0.987230 Cu\n0.994059 0.490328 0.496269 Cu\n0.494356 0.979521 0.485165 Cu\n0.817879 0.296953 0.123167 O\n0.170755 0.692583 0.869946 O\n0.822637 0.692583 0.521829 O\n0.306435 0.472897 0.166463 O\n0.477782 0.162965 0.294517 O\n0.119210 0.809478 0.287344 O\n0.699370 0.861443 0.162072 O\n0.522136 0.809478 0.690268 O\n0.173786 0.296953 0.479071 O\n0.696252 0.506563 0.810310 O\n0.868448 0.162965 0.685182 O\n0.304726 0.113716 0.808989 O\n",
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