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{
"id": "mp-1210788",
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{
"id": "mp-505281",
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"structure_string": "Cs1 Sb1 S6 O18 F6\n1.0\n5.430375 -6.160932 0.000000\n5.430375 6.160932 0.000000\n-1.559396 0.000000 8.063147\nCs Sb S O F\n1 1 6 18 6\ndirect\n0.000000 0.000000 0.000000 Cs\n0.500000 0.500000 0.500000 Sb\n0.439739 0.736985 0.839127 S\n0.263015 0.160873 0.560261 S\n0.736985 0.839127 0.439739 S\n0.160873 0.560261 0.263015 S\n0.560261 0.263015 0.160873 S\n0.839127 0.439739 0.736985 S\n0.686660 0.647615 0.429736 O\n0.352385 0.570264 0.313340 O\n0.848447 0.862800 0.322481 O\n0.606403 0.771163 0.920940 O\n0.771163 0.920940 0.606403 O\n0.647615 0.429736 0.686660 O\n0.393597 0.228837 0.079060 O\n0.151553 0.137200 0.677519 O\n0.313340 0.352385 0.570264 O\n0.322481 0.848447 0.862800 O\n0.862800 0.322481 0.848447 O\n0.429736 0.686660 0.647615 O\n0.920940 0.606403 0.771163 O\n0.079060 0.393597 0.228837 O\n0.137200 0.677519 0.151553 O\n0.228837 0.079060 0.393597 O\n0.677519 0.151553 0.137200 O\n0.570264 0.313340 0.352385 O\n0.636623 0.434674 0.111305 F\n0.888695 0.363377 0.565326 F\n0.565326 0.888695 0.363377 F\n0.111305 0.636623 0.434674 F\n0.363377 0.565326 0.888695 F\n0.434674 0.111305 0.636623 F\n",
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"formula_full": "Cs1 Sb1 S6 O18 F6",
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{
"id": "mp-768979",
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"structure_string": "Ba12 Y8 Cl48\n1.0\n12.383275 0.000000 0.000000\n0.000000 12.900621 0.000000\n0.000000 12.806456 13.140432\nBa Y Cl\n12 8 48\ndirect\n0.217313 0.225170 0.798965 Ba\n0.611237 0.322541 0.690374 Ba\n0.991718 0.674556 0.518556 Ba\n0.491718 0.325444 0.981444 Ba\n0.111237 0.677459 0.809626 Ba\n0.717313 0.774830 0.701035 Ba\n0.282687 0.225170 0.298965 Ba\n0.888763 0.322541 0.190374 Ba\n0.508282 0.674556 0.018556 Ba\n0.008282 0.325444 0.481444 Ba\n0.388763 0.677459 0.309626 Ba\n0.782687 0.774830 0.201035 Ba\n0.852928 0.266510 0.925408 Y\n0.165191 0.043194 0.147565 Y\n0.352928 0.733490 0.574592 Y\n0.665191 0.956806 0.352435 Y\n0.334809 0.043194 0.647565 Y\n0.647072 0.266510 0.425408 Y\n0.834809 0.956806 0.852435 Y\n0.147072 0.733490 0.074592 Y\n0.755985 0.097455 0.902039 Cl\n0.138228 0.429153 0.570976 Cl\n0.452372 0.245811 0.850119 Cl\n0.428970 0.580959 0.540296 Cl\n0.118174 0.780298 0.316001 Cl\n0.608389 0.799571 0.317753 Cl\n0.974666 0.036098 0.075606 Cl\n0.982885 0.358986 0.779342 Cl\n0.702547 0.119449 0.067246 Cl\n0.367144 0.013887 0.203622 Cl\n0.225317 0.279314 0.959876 Cl\n0.704320 0.447428 0.796221 Cl\n0.204320 0.552572 0.703779 Cl\n0.725317 0.720686 0.540124 Cl\n0.867144 0.986113 0.296378 Cl\n0.202547 0.880551 0.432754 Cl\n0.482885 0.641014 0.720658 Cl\n0.474666 0.963902 0.424394 Cl\n0.108389 0.200429 0.182247 Cl\n0.928970 0.419041 0.959704 Cl\n0.618174 0.219702 0.183999 Cl\n0.952372 0.754189 0.649881 Cl\n0.638228 0.570847 0.929024 Cl\n0.255985 0.902545 0.597961 Cl\n0.744015 0.097455 0.402039 Cl\n0.361772 0.429153 0.070976 Cl\n0.047628 0.245811 0.350119 Cl\n0.381826 0.780298 0.816001 Cl\n0.071030 0.580959 0.040296 Cl\n0.891611 0.799571 0.817753 Cl\n0.525334 0.036098 0.575606 Cl\n0.517115 0.358986 0.279342 Cl\n0.797453 0.119449 0.567246 Cl\n0.132856 0.013887 0.703622 Cl\n0.274683 0.279314 0.459876 Cl\n0.795680 0.447428 0.296221 Cl\n0.295680 0.552572 0.203779 Cl\n0.774683 0.720686 0.040124 Cl\n0.632856 0.986113 0.796378 Cl\n0.297453 0.880551 0.932754 Cl\n0.017115 0.641014 0.220658 Cl\n0.025334 0.963902 0.924394 Cl\n0.391611 0.200429 0.682247 Cl\n0.881826 0.219702 0.683999 Cl\n0.571030 0.419041 0.459704 Cl\n0.547628 0.754189 0.149881 Cl\n0.861772 0.570847 0.429024 Cl\n0.244015 0.902545 0.097961 Cl\n",
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{
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"structure_string": "Zr2 Sn2\n1.0\n3.179108 0.000000 0.000000\n0.000000 5.204478 0.000000\n0.000000 0.000000 5.759967\nZr Sn\n2 2\ndirect\n0.000000 0.077298 0.000000 Zr\n0.500000 0.922702 0.500000 Zr\n0.500000 0.585446 0.000000 Sn\n0.000000 0.414554 0.500000 Sn\n",
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{
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"structure_string": "P6 Pb10 Cl2 O24\n1.0\n5.117154 -8.863171 0.000000\n5.117154 8.863171 0.000000\n0.000000 0.000000 7.357246\nP Pb Cl O\n6 10 2 24\ndirect\n0.413071 0.378195 0.250000 P\n0.034875 0.413071 0.750000 P\n0.378195 0.965125 0.750000 P\n0.621805 0.034875 0.250000 P\n0.965125 0.586929 0.250000 P\n0.586929 0.621805 0.750000 P\n0.333333 0.666667 0.006080 Pb\n0.666667 0.333333 0.506080 Pb\n0.666667 0.333333 0.993920 Pb\n0.333333 0.666667 0.493920 Pb\n0.261852 0.019623 0.250000 Pb\n0.242229 0.261852 0.750000 Pb\n0.019623 0.757771 0.750000 Pb\n0.980377 0.242229 0.250000 Pb\n0.757771 0.738148 0.250000 Pb\n0.738148 0.980377 0.750000 Pb\n0.000000 0.000000 0.000000 Cl\n0.000000 0.000000 0.500000 Cl\n0.351339 0.488339 0.250000 O\n0.862999 0.351339 0.750000 O\n0.488339 0.137001 0.750000 O\n0.511661 0.862999 0.250000 O\n0.137001 0.648661 0.250000 O\n0.648661 0.511661 0.750000 O\n0.591609 0.468286 0.250000 O\n0.123323 0.591609 0.750000 O\n0.468286 0.876677 0.750000 O\n0.531714 0.123323 0.250000 O\n0.876677 0.408391 0.250000 O\n0.408391 0.531714 0.750000 O\n0.362595 0.273082 0.079339 O\n0.089512 0.362595 0.579339 O\n0.273082 0.910488 0.579339 O\n0.726918 0.089512 0.079339 O\n0.910488 0.637405 0.079339 O\n0.637405 0.726918 0.579339 O\n0.637405 0.726918 0.920661 O\n0.910488 0.637405 0.420661 O\n0.726918 0.089512 0.420661 O\n0.273082 0.910488 0.920661 O\n0.089512 0.362595 0.920661 O\n0.362595 0.273082 0.420661 O\n",
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{
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{
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{
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