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{
"id": "mp-558302",
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"structure_string": "Bi20 Br4 O28\n1.0\n2.721344 -8.237742 0.000000\n2.721344 8.237742 0.000000\n0.000000 0.000000 23.773791\nBi Br O\n20 4 28\ndirect\n0.385769 0.042590 0.060829 Bi\n0.284150 0.284150 0.201694 Bi\n0.784150 0.784150 0.298306 Bi\n0.985169 0.634300 0.190736 Bi\n0.014831 0.365700 0.809264 Bi\n0.134300 0.485169 0.309264 Bi\n0.514831 0.865700 0.690736 Bi\n0.885769 0.542590 0.439171 Bi\n0.114231 0.457410 0.560829 Bi\n0.634300 0.985169 0.190736 Bi\n0.865700 0.514831 0.690736 Bi\n0.614231 0.957410 0.939171 Bi\n0.215850 0.215850 0.701694 Bi\n0.457410 0.114231 0.560829 Bi\n0.957410 0.614231 0.939171 Bi\n0.042590 0.385769 0.060829 Bi\n0.542590 0.885769 0.439171 Bi\n0.365700 0.014831 0.809264 Bi\n0.715850 0.715850 0.798306 Bi\n0.485169 0.134300 0.309264 Bi\n0.318879 0.318879 0.394784 Br\n0.818879 0.818879 0.105216 Br\n0.681121 0.681121 0.605216 Br\n0.181121 0.181121 0.894784 Br\n0.992840 0.611501 0.850235 O\n0.270115 0.770115 0.250000 O\n0.611501 0.992840 0.850235 O\n0.729885 0.229885 0.750000 O\n0.553977 0.390860 0.746963 O\n0.390860 0.553977 0.746963 O\n0.111501 0.492840 0.649765 O\n0.629930 0.038804 0.049966 O\n0.492840 0.111501 0.649765 O\n0.538804 0.129930 0.450034 O\n0.370070 0.961196 0.950034 O\n0.770115 0.270115 0.250000 O\n0.609140 0.446023 0.253037 O\n0.053977 0.890860 0.753037 O\n0.038804 0.629930 0.049966 O\n0.507160 0.888499 0.350235 O\n0.961196 0.370070 0.950034 O\n0.109140 0.946023 0.246963 O\n0.946023 0.109140 0.246963 O\n0.229885 0.729885 0.750000 O\n0.388499 0.007160 0.149765 O\n0.890860 0.053977 0.753037 O\n0.007160 0.388499 0.149765 O\n0.446023 0.609140 0.253037 O\n0.888499 0.507160 0.350235 O\n0.129930 0.538804 0.450034 O\n0.870070 0.461196 0.549966 O\n0.461196 0.870070 0.549966 O\n",
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},
{
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"structure_string": "Cs2 K1 Bi1 F6\n1.0\n0.000000 4.883971 4.883971\n4.883971 0.000000 4.883971\n4.883971 4.883971 0.000000\nCs K Bi F\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Cs\n0.250000 0.250000 0.250000 Cs\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Bi\n0.766532 0.233468 0.233468 F\n0.233468 0.233468 0.766532 F\n0.233468 0.766532 0.766532 F\n0.233468 0.766532 0.233468 F\n0.766532 0.233468 0.766532 F\n0.766532 0.766532 0.233468 F\n",
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{
"id": "mp-558711",
"created_at": "2022-09-04T14:39:07.445608Z",
"structure_string": "V6 Cd10 P12 O50\n1.0\n2.403419 8.572902 0.000000\n-2.403419 8.572902 0.000000\n0.000000 5.591743 23.990993\nV Cd P O\n6 10 12 50\ndirect\n0.773407 0.764900 0.087058 V\n0.060420 0.939580 0.250000 V\n0.226593 0.235100 0.912942 V\n0.939580 0.060420 0.750000 V\n0.235100 0.226593 0.412942 V\n0.764900 0.773407 0.587058 V\n0.583905 0.536838 0.116444 Cd\n0.536838 0.583905 0.616444 Cd\n0.416095 0.463162 0.883556 Cd\n0.463162 0.416095 0.383556 Cd\n0.692943 0.641010 0.291376 Cd\n0.358990 0.307057 0.208624 Cd\n0.307057 0.358990 0.708624 Cd\n0.641010 0.692943 0.791376 Cd\n0.000000 0.000000 0.500000 Cd\n0.000000 0.000000 0.000000 Cd\n0.188931 0.163731 0.674524 P\n0.811069 0.836269 0.325476 P\n0.163731 0.188931 0.174524 P\n0.836269 0.811069 0.825476 P\n0.673918 0.625995 0.496925 P\n0.115854 0.027148 0.359206 P\n0.374005 0.326082 0.003075 P\n0.625995 0.673918 0.996925 P\n0.972852 0.884146 0.140794 P\n0.884146 0.972852 0.640794 P\n0.027148 0.115854 0.859206 P\n0.326082 0.374005 0.503075 P\n0.437175 0.197366 0.951532 O\n0.137571 0.855715 0.092354 O\n0.019323 0.291684 0.864415 O\n0.708316 0.980677 0.635585 O\n0.754702 0.054631 0.811805 O\n0.686710 0.911852 0.270801 O\n0.942168 0.569840 0.354081 O\n0.662027 0.209535 0.147838 O\n0.313290 0.088148 0.729199 O\n0.144285 0.862429 0.407646 O\n0.280896 0.719104 0.750000 O\n0.337973 0.790465 0.852162 O\n0.444472 0.694188 0.522196 O\n0.569840 0.942168 0.854081 O\n0.911852 0.686710 0.770801 O\n0.057832 0.430160 0.645919 O\n0.868065 0.258054 0.803312 O\n0.945369 0.245298 0.688195 O\n0.131935 0.741946 0.196688 O\n0.873110 0.547282 0.958092 O\n0.741946 0.131935 0.696688 O\n0.054631 0.754702 0.311805 O\n0.100659 0.562467 0.862170 O\n0.655404 0.074548 0.035972 O\n0.790465 0.337973 0.352162 O\n0.802634 0.562825 0.548468 O\n0.126890 0.452718 0.041908 O\n0.344596 0.925452 0.964028 O\n0.862429 0.144285 0.907646 O\n0.694188 0.444472 0.022196 O\n0.719104 0.280896 0.250000 O\n0.437533 0.899341 0.637830 O\n0.855715 0.137571 0.592354 O\n0.074548 0.655404 0.535972 O\n0.547282 0.873110 0.458092 O\n0.305812 0.555528 0.977804 O\n0.430160 0.057832 0.145919 O\n0.258054 0.868065 0.303312 O\n0.555528 0.305812 0.477804 O\n0.899341 0.437533 0.137830 O\n0.925452 0.344596 0.464028 O\n0.291684 0.019323 0.364415 O\n0.088148 0.313290 0.229199 O\n0.980677 0.708316 0.135585 O\n0.562467 0.100659 0.362170 O\n0.197366 0.437175 0.451532 O\n0.245298 0.945369 0.188195 O\n0.209535 0.662027 0.647838 O\n0.452718 0.126890 0.541908 O\n0.562825 0.802634 0.048468 O\n",
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{
"id": "mp-10274",
"created_at": "2022-09-04T14:39:07.477157Z",
"structure_string": "Er3 Ga1 C1\n1.0\n5.253141 0.000000 0.000000\n0.000000 5.253141 0.000000\n0.000000 0.000000 5.253141\nEr Ga C\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Er\n0.500000 0.000000 0.500000 Er\n0.500000 0.500000 0.000000 Er\n0.500000 0.500000 0.500000 Ga\n0.000000 0.000000 0.000000 C\n",
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{
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"structure_string": "Ca10 Al12 O28\n1.0\n5.544304 -5.690127 0.000000\n5.544304 5.690127 0.000000\n0.000000 0.000000 10.396850\nCa Al O\n10 12 28\ndirect\n0.474764 0.474764 0.742067 Ca\n0.525236 0.525236 0.242067 Ca\n0.675437 0.959389 0.199090 Ca\n0.324563 0.040611 0.699090 Ca\n0.040611 0.324563 0.699090 Ca\n0.959389 0.675437 0.199090 Ca\n0.264285 0.947370 0.249659 Ca\n0.735715 0.052630 0.749659 Ca\n0.052630 0.735715 0.749659 Ca\n0.947370 0.264285 0.249659 Ca\n0.646588 0.156957 0.475944 Al\n0.353412 0.843043 0.975944 Al\n0.843043 0.353412 0.975944 Al\n0.156957 0.646588 0.475944 Al\n0.000681 0.000681 0.962529 Al\n0.999319 0.999319 0.462529 Al\n0.700860 0.700860 0.940772 Al\n0.299140 0.299140 0.440772 Al\n0.502362 0.789086 0.508472 Al\n0.497638 0.210914 0.008472 Al\n0.210914 0.497638 0.008472 Al\n0.789086 0.502362 0.508472 Al\n0.699745 0.699745 0.109695 O\n0.300255 0.300255 0.609695 O\n0.495013 0.243242 0.373082 O\n0.504987 0.756758 0.873082 O\n0.756758 0.504987 0.873082 O\n0.243242 0.495013 0.373082 O\n0.993035 0.993035 0.131260 O\n0.006965 0.006965 0.631260 O\n0.489320 0.808754 0.339724 O\n0.510680 0.191246 0.839724 O\n0.191246 0.510680 0.839724 O\n0.808754 0.489320 0.339724 O\n0.853917 0.853917 0.887801 O\n0.146083 0.146083 0.387801 O\n0.808887 0.062858 0.384487 O\n0.191113 0.937142 0.884487 O\n0.937142 0.191113 0.884487 O\n0.062858 0.808887 0.384487 O\n0.298635 0.752344 0.584423 O\n0.701365 0.247656 0.084423 O\n0.247656 0.701365 0.084423 O\n0.752344 0.298635 0.584423 O\n0.991023 0.562811 0.576096 O\n0.008977 0.437189 0.076096 O\n0.437189 0.008977 0.076096 O\n0.562811 0.991023 0.576096 O\n0.625578 0.625578 0.566824 O\n0.374422 0.374422 0.066824 O\n",
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{
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"structure_string": "Cs8 Zn4 Sn12 Se32\n1.0\n8.030131 0.000000 0.000000\n0.000000 13.656237 0.000000\n0.000000 0.000000 18.797053\nCs Zn Sn Se\n8 4 12 32\ndirect\n0.748915 0.631193 0.052799 Cs\n0.751085 0.368807 0.552799 Cs\n0.248915 0.868807 0.947201 Cs\n0.251085 0.131193 0.447201 Cs\n0.228968 0.811497 0.341754 Cs\n0.271032 0.188503 0.841754 Cs\n0.728968 0.688503 0.658246 Cs\n0.771032 0.311497 0.158246 Cs\n0.990504 0.500684 0.347297 Zn\n0.509496 0.499316 0.847297 Zn\n0.490504 0.999316 0.652703 Zn\n0.009496 0.000684 0.152703 Zn\n0.761300 0.047162 0.319134 Sn\n0.738700 0.952838 0.819134 Sn\n0.261300 0.452838 0.680866 Sn\n0.238700 0.547162 0.180866 Sn\n0.728515 0.936253 0.485053 Sn\n0.771485 0.063747 0.985053 Sn\n0.228515 0.563747 0.514947 Sn\n0.271485 0.436253 0.014947 Sn\n0.505975 0.987607 0.150861 Sn\n0.994025 0.012393 0.650861 Sn\n0.005975 0.512393 0.849139 Sn\n0.494025 0.487607 0.349139 Sn\n0.505718 0.613053 0.454903 Se\n0.994282 0.386947 0.954903 Se\n0.005718 0.886947 0.545097 Se\n0.494282 0.113053 0.045097 Se\n0.968671 0.615380 0.450882 Se\n0.531329 0.384620 0.950882 Se\n0.468671 0.884620 0.549118 Se\n0.031329 0.115380 0.049118 Se\n0.769366 0.884549 0.155148 Se\n0.730634 0.115451 0.655148 Se\n0.269366 0.615451 0.844852 Se\n0.230634 0.384549 0.344852 Se\n0.748774 0.618896 0.851931 Se\n0.751226 0.381104 0.351931 Se\n0.248774 0.881104 0.148069 Se\n0.251226 0.118896 0.648069 Se\n0.507127 0.608733 0.241140 Se\n0.992873 0.391267 0.741140 Se\n0.007127 0.891267 0.758860 Se\n0.492873 0.108733 0.258860 Se\n0.971966 0.603747 0.236819 Se\n0.528034 0.396253 0.736819 Se\n0.471966 0.896253 0.763181 Se\n0.028034 0.103747 0.263181 Se\n0.741193 0.119565 0.447865 Se\n0.758807 0.880435 0.947865 Se\n0.241193 0.380435 0.552135 Se\n0.258807 0.619565 0.052135 Se\n0.741317 0.864931 0.357009 Se\n0.758683 0.135069 0.857009 Se\n0.241317 0.635069 0.642991 Se\n0.258683 0.364931 0.142991 Se\n",
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{
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"structure_string": "Hg1 F2\n1.0\n0.000000 2.826404 2.826404\n2.826404 0.000000 2.826404\n2.826404 2.826404 0.000000\nHg F\n1 2\ndirect\n0.000000 0.000000 0.000000 Hg\n0.250000 0.250000 0.250000 F\n0.750000 0.750000 0.750000 F\n",
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{
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