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{
"id": "mp-649950",
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"structure_string": "Ru2 C6 Br4 O6\n1.0\n3.751962 5.437930 0.000000\n-3.751962 5.437930 0.000000\n0.000000 2.694271 9.179471\nRu C Br O\n2 6 4 6\ndirect\n0.936603 0.936603 0.211294 Ru\n0.063397 0.063397 0.788706 Ru\n0.908930 0.278556 0.647752 C\n0.278556 0.908930 0.647752 C\n0.091070 0.721444 0.352248 C\n0.237772 0.237772 0.797607 C\n0.721444 0.091070 0.352248 C\n0.762228 0.762228 0.202393 C\n0.171038 0.171038 0.225534 Br\n0.762742 0.237258 0.000000 Br\n0.828962 0.828962 0.774466 Br\n0.237258 0.762742 0.000000 Br\n0.344389 0.344389 0.794457 O\n0.655611 0.655611 0.205543 O\n0.191260 0.590186 0.434596 O\n0.590186 0.191260 0.434596 O\n0.409814 0.808740 0.565404 O\n0.808740 0.409814 0.565404 O\n",
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{
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{
"id": "mp-1516994",
"created_at": "2022-09-04T14:40:08.626470Z",
"structure_string": "Sr2 Nd1 Sb1 O6\n1.0\n-0.000000 -4.286584 -4.286584\n4.286584 0.000000 -4.286584\n4.286584 -4.286584 -0.000000\nSr Nd Sb O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.750000 0.750000 Sr\n-0.000000 0.000000 -0.000000 Nd\n0.500000 0.500000 0.500000 Sb\n0.732764 0.267236 0.267236 O\n0.267236 0.732764 0.732764 O\n0.732764 0.267236 0.732764 O\n0.267236 0.732764 0.267236 O\n0.732764 0.732764 0.267236 O\n0.267236 0.267236 0.732764 O\n",
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{
"id": "mp-684841",
"created_at": "2022-09-04T14:40:08.633358Z",
"structure_string": "K2 Mg6 Al2 Si6 O20 F4\n1.0\n12.408060 0.000000 0.000000\n0.000000 5.947898 0.000000\n0.000000 0.341085 7.084907\nK Mg Al Si O F\n2 6 2 6 20 4\ndirect\n0.499027 0.273233 0.056686 K\n0.999027 0.726767 0.943314 K\n0.539648 0.638347 0.538704 Mg\n0.610688 0.102948 0.612929 Mg\n0.831084 0.958031 0.603478 Mg\n0.039648 0.361653 0.461296 Mg\n0.110688 0.897052 0.387071 Mg\n0.331084 0.041969 0.396522 Mg\n0.766586 0.028411 0.208151 Al\n0.266586 0.971589 0.791849 Al\n0.768502 0.534594 0.234909 Si\n0.665871 0.763467 0.917848 Si\n0.801396 0.465621 0.647761 Si\n0.165871 0.236533 0.082152 Si\n0.301396 0.534379 0.352239 Si\n0.268502 0.465406 0.765091 Si\n0.425595 0.484671 0.402228 O\n0.829198 0.299506 0.196635 O\n0.660630 0.559812 0.088651 O\n0.839588 0.764550 0.197555 O\n0.772907 0.219540 0.730954 O\n0.709385 0.991081 0.428788 O\n0.675028 0.996458 0.023946 O\n0.775566 0.691823 0.785057 O\n0.718909 0.520255 0.456227 O\n0.073493 0.188434 0.237863 O\n0.925595 0.515329 0.597772 O\n0.272907 0.780460 0.269046 O\n0.175028 0.003542 0.976054 O\n0.275566 0.308177 0.214943 O\n0.329198 0.700494 0.803365 O\n0.218909 0.479745 0.543773 O\n0.160630 0.440188 0.911349 O\n0.339588 0.235450 0.802445 O\n0.209385 0.008919 0.571212 O\n0.573493 0.811566 0.762137 O\n0.556013 0.369135 0.704984 F\n0.480885 0.974121 0.445729 F\n0.980885 0.025879 0.554271 F\n0.056013 0.630865 0.295016 F\n",
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"formula_full": "K2 Mg6 Al2 Si6 O20 F4",
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{
"id": "mp-1202686",
"created_at": "2022-09-04T14:40:08.532411Z",
"structure_string": "La12 W6 O36\n1.0\n5.596811 0.000000 0.000000\n0.000000 8.930081 0.000000\n0.000000 0.000000 16.780803\nLa W O\n12 6 36\ndirect\n0.321764 0.790443 0.000000 La\n0.821764 0.209557 0.500000 La\n0.411930 0.495097 0.160075 La\n0.411930 0.495097 0.839925 La\n0.911930 0.504903 0.339925 La\n0.911930 0.504903 0.660075 La\n0.943268 0.157731 0.181200 La\n0.943268 0.157731 0.818800 La\n0.443268 0.842269 0.318800 La\n0.443268 0.842269 0.681200 La\n0.911517 0.458796 0.000000 La\n0.411517 0.541204 0.500000 La\n0.427233 0.252733 0.000000 W\n0.927233 0.747267 0.500000 W\n0.393903 0.232012 0.331794 W\n0.393903 0.232012 0.668206 W\n0.893903 0.767988 0.168206 W\n0.893903 0.767988 0.831794 W\n0.178111 0.287063 0.080498 O\n0.178111 0.287063 0.919502 O\n0.678111 0.712937 0.419502 O\n0.678111 0.712937 0.580498 O\n0.665939 0.287510 0.084258 O\n0.665939 0.287510 0.915742 O\n0.165939 0.712490 0.415742 O\n0.165939 0.712490 0.584258 O\n0.643680 0.298951 0.258138 O\n0.643680 0.298951 0.741862 O\n0.143680 0.701049 0.241862 O\n0.143680 0.701049 0.758138 O\n0.627493 0.730337 0.098970 O\n0.627493 0.730337 0.901030 O\n0.127493 0.269663 0.401030 O\n0.127493 0.269663 0.598970 O\n0.178397 0.361974 0.255083 O\n0.178397 0.361974 0.744917 O\n0.678397 0.638026 0.244917 O\n0.678397 0.638026 0.755083 O\n0.554855 0.081686 0.390066 O\n0.554855 0.081686 0.609934 O\n0.054855 0.918314 0.109934 O\n0.054855 0.918314 0.890066 O\n0.445424 0.049113 0.000000 O\n0.945424 0.950887 0.500000 O\n0.441936 0.491574 0.000000 O\n0.941936 0.508426 0.500000 O\n0.263757 0.070591 0.269645 O\n0.263757 0.070591 0.730355 O\n0.763757 0.929409 0.230355 O\n0.763757 0.929409 0.769645 O\n0.573981 0.376766 0.404469 O\n0.573981 0.376766 0.595531 O\n0.073981 0.623234 0.095531 O\n0.073981 0.623234 0.904469 O\n",
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"formula_full": "La12 W6 O36",
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{
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"created_at": "2022-09-04T14:40:08.544339Z",
"structure_string": "Te4 Mo2 W2 Se2 S2\n1.0\n1.700666 -2.945639 0.000000\n1.700666 2.945639 0.000000\n0.000000 0.000000 38.791836\nTe Mo W Se S\n4 2 2 2 2\ndirect\n0.000000 0.000000 0.330206 Te\n0.333333 0.666667 0.421212 Te\n0.333333 0.666667 0.518190 Te\n0.000000 0.000000 0.233239 Te\n0.000000 0.000000 0.093952 Mo\n0.333333 0.666667 0.657536 Mo\n0.000000 0.000000 0.469727 W\n0.333333 0.666667 0.281733 W\n0.000000 0.000000 0.699977 Se\n0.000000 0.000000 0.615100 Se\n0.333333 0.666667 0.055163 S\n0.333333 0.666667 0.132712 S\n",
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{
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{
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"structure_string": "Ba4 Ge2 Te4 Se4\n1.0\n7.287597 0.000000 0.000000\n0.000000 7.563825 0.000000\n0.000000 3.005464 9.005659\nBa Ge Te Se\n4 2 4 4\ndirect\n0.250000 0.762062 0.059739 Ba\n0.250000 0.786275 0.551151 Ba\n0.750000 0.213725 0.448849 Ba\n0.750000 0.237938 0.940261 Ba\n0.250000 0.211338 0.702984 Ge\n0.750000 0.788662 0.297016 Ge\n0.250000 0.401723 0.888657 Te\n0.250000 0.379104 0.417740 Te\n0.750000 0.620896 0.582260 Te\n0.750000 0.598277 0.111343 Te\n0.504803 0.002499 0.759850 Se\n0.004803 0.997501 0.240150 Se\n0.495197 0.997501 0.240150 Se\n0.995197 0.002499 0.759850 Se\n",
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{
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"structure_string": "Cs2 Dy4 Cu6 Se10\n1.0\n2.069798 -7.348395 0.000000\n2.069798 7.348395 0.000000\n0.000000 0.000000 17.431245\nCs Dy Cu Se\n2 4 6 10\ndirect\n0.939230 0.060770 0.250000 Cs\n0.060770 0.939230 0.750000 Cs\n0.192114 0.807886 0.408856 Dy\n0.192114 0.807886 0.091144 Dy\n0.807886 0.192114 0.591144 Dy\n0.807886 0.192114 0.908856 Dy\n0.584338 0.415662 0.530203 Cu\n0.415662 0.584338 0.469797 Cu\n0.341705 0.658295 0.750000 Cu\n0.658295 0.341705 0.250000 Cu\n0.584338 0.415662 0.969797 Cu\n0.415662 0.584338 0.030203 Cu\n0.439319 0.560681 0.887955 Se\n0.832310 0.167690 0.070104 Se\n0.439319 0.560681 0.612045 Se\n0.167690 0.832310 0.570104 Se\n0.832310 0.167690 0.429896 Se\n0.167690 0.832310 0.929896 Se\n0.762115 0.237885 0.750000 Se\n0.237885 0.762115 0.250000 Se\n0.560681 0.439319 0.387955 Se\n0.560681 0.439319 0.112045 Se\n",
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{
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"structure_string": "Nb4 Cd4 O14\n1.0\n0.000000 5.131793 5.131793\n5.131793 0.000000 5.131793\n5.131793 5.131793 0.000000\nNb Cd O\n4 4 14\ndirect\n0.125000 0.625000 0.625000 Nb\n0.625000 0.625000 0.125000 Nb\n0.625000 0.625000 0.625000 Nb\n0.625000 0.125000 0.625000 Nb\n0.625000 0.125000 0.125000 Cd\n0.125000 0.625000 0.125000 Cd\n0.125000 0.125000 0.625000 Cd\n0.125000 0.125000 0.125000 Cd\n0.733050 0.266950 0.266950 O\n0.266950 0.733050 0.266950 O\n0.516950 0.983050 0.983050 O\n0.733050 0.266950 0.733050 O\n0.500000 0.500000 0.500000 O\n0.266950 0.733050 0.733050 O\n0.983050 0.516950 0.516950 O\n0.516950 0.983050 0.516950 O\n0.983050 0.516950 0.983050 O\n0.750000 0.750000 0.750000 O\n0.733050 0.733050 0.266950 O\n0.516950 0.516950 0.983050 O\n0.983050 0.983050 0.516950 O\n0.266950 0.266950 0.733050 O\n",
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}