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{
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{
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"structure_string": "Al8 Sb16 Te16 Cl32\n1.0\n9.854880 0.000000 0.000000\n0.487630 13.714101 0.000000\n0.617328 3.958644 18.127967\nAl Sb Te Cl\n8 16 16 32\ndirect\n0.006595 0.251978 0.185093 Al\n0.529401 0.517337 0.331492 Al\n0.523539 0.996177 0.337970 Al\n0.470599 0.482663 0.668508 Al\n0.993405 0.748022 0.814907 Al\n0.476461 0.003823 0.662030 Al\n0.021234 0.758087 0.140273 Al\n0.978766 0.241913 0.859727 Al\n0.881393 0.263748 0.416744 Sb\n0.683556 0.242959 0.052206 Sb\n0.316444 0.757041 0.947794 Sb\n0.663417 0.983288 0.937093 Sb\n0.118607 0.736252 0.583256 Sb\n0.813949 0.047040 0.464940 Sb\n0.704718 0.763845 0.995789 Sb\n0.295282 0.236155 0.004211 Sb\n0.807820 0.514347 0.532345 Sb\n0.566468 0.506506 0.895862 Sb\n0.186051 0.952960 0.535060 Sb\n0.192180 0.485653 0.467655 Sb\n0.336583 0.016712 0.062907 Sb\n0.037742 0.223425 0.616114 Sb\n0.962258 0.776575 0.383886 Sb\n0.433532 0.493494 0.104138 Sb\n0.624073 0.017879 0.084262 Te\n0.304655 0.514568 0.964352 Te\n0.375927 0.982121 0.915738 Te\n0.055809 0.468209 0.609512 Te\n0.943009 0.015468 0.605916 Te\n0.944191 0.531791 0.390488 Te\n0.056991 0.984532 0.394084 Te\n0.847747 0.752269 0.530239 Te\n0.152253 0.247731 0.469761 Te\n0.695345 0.485432 0.035648 Te\n0.434760 0.258874 0.133885 Te\n0.775313 0.286356 0.558794 Te\n0.565240 0.741126 0.866115 Te\n0.458108 0.731814 0.083156 Te\n0.224687 0.713644 0.441206 Te\n0.541892 0.268186 0.916844 Te\n0.792758 0.251354 0.215828 Cl\n0.732497 0.970109 0.302566 Cl\n0.513026 0.103595 0.556494 Cl\n0.317296 0.538571 0.301973 Cl\n0.207242 0.748646 0.784172 Cl\n0.121809 0.282617 0.274166 Cl\n0.386248 0.966045 0.258217 Cl\n0.546175 0.386256 0.419477 Cl\n0.066394 0.109118 0.161967 Cl\n0.598823 0.643424 0.370313 Cl\n0.501798 0.147983 0.350004 Cl\n0.353933 0.502901 0.764937 Cl\n0.401177 0.356576 0.629687 Cl\n0.453825 0.613744 0.580523 Cl\n0.906532 0.383717 0.879855 Cl\n0.052568 0.869431 0.039019 Cl\n0.093468 0.616283 0.120145 Cl\n0.193232 0.242978 0.831846 Cl\n0.041698 0.365267 0.086838 Cl\n0.958302 0.634733 0.913162 Cl\n0.267503 0.029891 0.697434 Cl\n0.866252 0.203958 0.772191 Cl\n0.682704 0.461429 0.698027 Cl\n0.613752 0.033955 0.741783 Cl\n0.646067 0.497099 0.235063 Cl\n0.933606 0.890882 0.838033 Cl\n0.947432 0.130569 0.960981 Cl\n0.878191 0.717383 0.725834 Cl\n0.498202 0.852017 0.649996 Cl\n0.133748 0.796042 0.227809 Cl\n0.806768 0.757022 0.168154 Cl\n0.486974 0.896405 0.443506 Cl\n",
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{
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"structure_string": "Rb2 Li1 Dy1 Br6\n1.0\n0.000000 5.541196 5.541196\n5.541196 0.000000 5.541196\n5.541196 5.541196 0.000000\nRb Li Dy Br\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.750000 0.750000 Rb\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Dy\n0.747605 0.252395 0.252395 Br\n0.252395 0.252395 0.747605 Br\n0.747605 0.252395 0.747605 Br\n0.252395 0.747605 0.252395 Br\n0.747605 0.747605 0.252395 Br\n0.252395 0.747605 0.747605 Br\n",
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{
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{
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"structure_string": "Cs2 Hg2 Sb2 Se6\n1.0\n2.177552 -8.108062 0.000000\n2.177552 8.108062 0.000000\n0.000000 0.000000 11.564179\nCs Hg Sb Se\n2 2 2 6\ndirect\n0.255929 0.744071 0.247930 Cs\n0.744071 0.255929 0.747930 Cs\n0.549316 0.450684 0.257215 Hg\n0.450684 0.549316 0.757215 Hg\n0.991266 0.008734 0.010745 Sb\n0.008734 0.991266 0.510745 Sb\n0.624945 0.375055 0.458186 Se\n0.386985 0.613015 0.545207 Se\n0.613015 0.386985 0.045207 Se\n0.375055 0.624945 0.958186 Se\n0.940815 0.059185 0.231017 Se\n0.059185 0.940815 0.731017 Se\n",
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"formula_full": "Cs2 Hg2 Sb2 Se6",
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{
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{
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"structure_string": "Tl9 Bi1 Te6\n1.0\n-4.491627 4.491627 6.746967\n4.491627 -4.491627 6.746967\n4.491627 4.491627 -6.746967\nTl Bi Te\n9 1 6\ndirect\n0.988686 0.488768 0.793374 Tl\n0.804688 0.011314 0.500082 Tl\n0.000000 0.000000 0.000000 Tl\n0.695395 0.195312 0.206626 Tl\n0.511232 0.304605 0.499918 Tl\n0.488768 0.695395 0.500082 Tl\n0.304605 0.804688 0.793374 Tl\n0.195312 0.988686 0.499918 Tl\n0.011314 0.511232 0.206626 Tl\n0.500000 0.500000 0.000000 Bi\n0.738879 0.738879 0.000000 Te\n0.826353 0.651971 0.478324 Te\n0.651971 0.173647 0.825618 Te\n0.261121 0.261121 0.000000 Te\n0.348029 0.826353 0.174382 Te\n0.173647 0.348029 0.521676 Te\n",
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{
"id": "mp-1195835",
"created_at": "2022-09-04T14:45:08.686152Z",
"structure_string": "Ga8 Sb4 Te16 Cl28\n1.0\n19.524479 0.000000 0.000000\n0.000000 7.356120 0.000000\n0.000000 6.428417 13.269928\nGa Sb Te Cl\n8 4 16 28\ndirect\n0.279654 0.931120 0.765272 Ga\n0.220346 0.931120 0.265272 Ga\n0.720346 0.068880 0.234728 Ga\n0.779654 0.068880 0.734728 Ga\n0.146837 0.264876 0.555143 Ga\n0.353163 0.264876 0.055143 Ga\n0.853163 0.735124 0.444857 Ga\n0.646837 0.735124 0.944857 Ga\n0.982690 0.180279 0.083791 Sb\n0.517310 0.180279 0.583791 Sb\n0.017310 0.819721 0.916209 Sb\n0.482690 0.819721 0.416209 Sb\n0.920477 0.490533 0.907082 Te\n0.579523 0.490533 0.407082 Te\n0.079523 0.509467 0.092918 Te\n0.420477 0.509467 0.592918 Te\n0.984506 0.440312 0.750165 Te\n0.515494 0.440312 0.250165 Te\n0.015494 0.559688 0.249835 Te\n0.484506 0.559688 0.749835 Te\n0.112375 0.459898 0.817523 Te\n0.387625 0.459898 0.317523 Te\n0.887625 0.540102 0.182477 Te\n0.612375 0.540102 0.682477 Te\n0.101693 0.100271 0.992760 Te\n0.398307 0.100271 0.492760 Te\n0.898307 0.899729 0.007240 Te\n0.601693 0.899729 0.507240 Te\n0.267398 0.760678 0.677674 Cl\n0.232602 0.760678 0.177674 Cl\n0.732602 0.239322 0.322326 Cl\n0.767398 0.239322 0.822326 Cl\n0.386407 0.992246 0.786115 Cl\n0.113593 0.992246 0.286115 Cl\n0.613593 0.007754 0.213885 Cl\n0.886407 0.007754 0.713885 Cl\n0.218466 0.814874 0.902261 Cl\n0.281534 0.814874 0.402261 Cl\n0.781534 0.185126 0.097739 Cl\n0.718466 0.185126 0.597739 Cl\n0.237926 0.254434 0.664248 Cl\n0.262074 0.254434 0.164248 Cl\n0.762074 0.745566 0.335752 Cl\n0.737926 0.745566 0.835752 Cl\n0.093640 0.539835 0.533889 Cl\n0.406360 0.539835 0.033889 Cl\n0.906360 0.460165 0.466111 Cl\n0.593640 0.460165 0.966111 Cl\n0.085029 0.998112 0.637734 Cl\n0.414971 0.998112 0.137734 Cl\n0.914971 0.001888 0.362266 Cl\n0.585029 0.001888 0.862266 Cl\n0.196868 0.287279 0.419426 Cl\n0.303132 0.287279 0.919426 Cl\n0.803132 0.712721 0.580574 Cl\n0.696868 0.712721 0.080574 Cl\n",
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}