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{
"id": "mp-776484",
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"structure_string": "Li12 Sn6 P16 O58\n1.0\n9.887325 0.000000 0.000000\n4.887932 8.595204 0.000000\n0.106385 0.106469 14.054273\nLi Sn P O\n12 6 16 58\ndirect\n0.016109 0.038087 0.505628 Li\n0.003226 0.003031 0.004295 Li\n0.089314 0.681097 0.058242 Li\n0.328810 0.326117 0.887982 Li\n0.232209 0.666110 0.556904 Li\n0.662144 0.105106 0.557261 Li\n0.339668 0.768055 0.946055 Li\n0.676375 0.230318 0.058489 Li\n0.330813 0.904064 0.440534 Li\n0.770115 0.334549 0.443983 Li\n0.896288 0.335756 0.942426 Li\n0.898042 0.771854 0.444056 Li\n0.000318 0.432511 0.745798 Sn\n0.997950 0.561902 0.249593 Sn\n0.434462 0.001684 0.244873 Sn\n0.566999 0.994306 0.751877 Sn\n0.437601 0.566016 0.748716 Sn\n0.564897 0.436023 0.251723 Sn\n0.082227 0.216158 0.339231 P\n0.217031 0.083206 0.840972 P\n0.089427 0.687056 0.847336 P\n0.331839 0.337705 0.124310 P\n0.337188 0.332516 0.624443 P\n0.222978 0.689114 0.343947 P\n0.308194 0.777681 0.156425 P\n0.690295 0.082273 0.346764 P\n0.305757 0.920059 0.650511 P\n0.684962 0.221740 0.844268 P\n0.776241 0.308350 0.655683 P\n0.670727 0.661441 0.876908 P\n0.664574 0.669328 0.378194 P\n0.915930 0.306419 0.150846 P\n0.782508 0.919069 0.157604 P\n0.918286 0.775932 0.658257 P\n0.013001 0.198660 0.239178 O\n0.987796 0.221070 0.060275 O\n0.075191 0.250036 0.844948 O\n0.200782 0.017167 0.739651 O\n0.218155 0.994608 0.560828 O\n0.250055 0.076226 0.342259 O\n0.082650 0.371439 0.337850 O\n0.205447 0.312684 0.673535 O\n0.108934 0.521269 0.836013 O\n0.006859 0.780346 0.571155 O\n0.002938 0.787283 0.753105 O\n0.077047 0.668672 0.346328 O\n0.312229 0.204665 0.168909 O\n0.366541 0.099548 0.838049 O\n0.191899 0.496244 0.161360 O\n0.334465 0.340626 0.017302 O\n0.339786 0.336597 0.518852 O\n0.318845 0.491763 0.663937 O\n0.531612 0.092769 0.334881 O\n0.496124 0.193057 0.665136 O\n0.254948 0.668809 0.845213 O\n0.204198 0.790848 0.249607 O\n0.217488 0.780618 0.069046 O\n0.222222 0.779277 0.430467 O\n0.370548 0.529732 0.335754 O\n0.489540 0.321495 0.161431 O\n0.324280 0.754396 0.657613 O\n0.519334 0.366862 0.834799 O\n0.667540 0.076277 0.846790 O\n0.208535 0.984511 0.919229 O\n0.800923 0.011355 0.078408 O\n0.799797 0.990519 0.258126 O\n0.327480 0.922031 0.156131 O\n0.466230 0.628150 0.164949 O\n0.671680 0.247954 0.346544 O\n0.512297 0.678226 0.837072 O\n0.627182 0.467495 0.661058 O\n0.781093 0.216146 0.568723 O\n0.771769 0.228971 0.930215 O\n0.784812 0.209765 0.750347 O\n0.749413 0.326844 0.159092 O\n0.508732 0.806090 0.335641 O\n0.465450 0.909831 0.659862 O\n0.684354 0.509861 0.339622 O\n0.667814 0.656872 0.982482 O\n0.663905 0.670845 0.484414 O\n0.809604 0.503631 0.836354 O\n0.629812 0.914040 0.160830 O\n0.687666 0.795356 0.828733 O\n0.922198 0.324743 0.656200 O\n0.987234 0.200282 0.417967 O\n0.904496 0.466742 0.160754 O\n0.804503 0.686807 0.336495 O\n0.904851 0.627908 0.663655 O\n0.754799 0.922716 0.657809 O\n0.774595 0.998291 0.436826 O\n0.923261 0.750860 0.157139 O\n0.006124 0.773283 0.934646 O\n",
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],
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"formula_full": "Li12 Sn6 P16 O58",
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{
"id": "mp-1213287",
"created_at": "2022-09-04T14:42:16.354215Z",
"structure_string": "Cs4 Re4 O8\n1.0\n6.766193 0.000000 0.000000\n0.000000 6.766193 0.000000\n-3.383097 -3.383097 7.199500\nCs Re O\n4 4 8\ndirect\n0.625000 0.875000 0.250000 Cs\n0.625000 0.375000 0.250000 Cs\n0.625000 0.375000 0.750000 Cs\n0.125000 0.375000 0.750000 Cs\n0.125000 0.375000 0.250000 Re\n0.125000 0.875000 0.250000 Re\n0.125000 0.875000 0.750000 Re\n0.625000 0.875000 0.750000 Re\n0.303768 0.143192 0.270618 O\n0.966851 0.127426 0.270618 O\n0.377426 0.053768 0.770618 O\n0.946232 0.606808 0.229382 O\n0.393192 0.716851 0.770618 O\n0.283149 0.622574 0.229382 O\n0.872574 0.696232 0.729382 O\n0.856808 0.033149 0.729382 O\n",
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"formula_full": "Cs4 Re4 O8",
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{
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"structure_string": "Mg8 Fe3 N8\n1.0\n8.604312 -0.167911 -0.065382\n1.185688 4.194015 0.000000\n1.741275 -0.492275 6.313289\nMg Fe N\n8 3 8\ndirect\n0.055467 0.972267 0.758173 Mg\n0.944533 0.027733 0.241827 Mg\n0.683945 0.658027 0.472471 Mg\n0.316055 0.341973 0.527529 Mg\n0.822395 0.588803 0.969391 Mg\n0.177605 0.411197 0.030609 Mg\n0.609130 0.195435 0.807770 Mg\n0.390870 0.804565 0.192230 Mg\n0.000000 0.500000 0.500000 Fe\n0.378281 0.810860 0.784314 Fe\n0.621719 0.189140 0.215686 Fe\n0.203718 0.898141 0.011413 N\n0.796282 0.101859 0.988587 N\n0.337697 0.831151 0.537859 N\n0.662303 0.168849 0.462141 N\n0.579712 0.710143 0.822229 N\n0.420288 0.289857 0.177771 N\n0.063037 0.468481 0.746991 N\n0.936963 0.531519 0.253009 N\n",
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},
{
"id": "mp-1227041",
"created_at": "2022-09-04T14:42:20.571042Z",
"structure_string": "Ca1 Nd1 Al1 O4\n1.0\n-1.854458 1.854458 6.109511\n1.854458 -1.854458 6.109511\n1.854458 1.854458 -6.109511\nCa Nd Al O\n1 1 1 4\ndirect\n0.642814 0.642814 0.000000 Ca\n0.357693 0.357693 0.000000 Nd\n0.008996 0.008996 0.000000 Al\n0.831384 0.831384 0.000000 O\n0.165632 0.165632 0.000000 O\n0.496741 0.996741 0.500000 O\n0.996741 0.496741 0.500000 O\n",
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{
"id": "mp-776975",
"created_at": "2022-09-04T14:42:16.359378Z",
"structure_string": "Nb8 O16\n1.0\n5.056238 0.000000 0.000000\n0.000000 5.357455 0.000000\n0.000000 0.000000 9.954671\nNb O\n8 16\ndirect\n0.054039 0.354064 0.642731 Nb\n0.445961 0.854064 0.642731 Nb\n0.945961 0.854064 0.857269 Nb\n0.554039 0.354064 0.857269 Nb\n0.445961 0.645936 0.142731 Nb\n0.054039 0.145936 0.142731 Nb\n0.945961 0.645936 0.357269 Nb\n0.554039 0.145936 0.357269 Nb\n0.323716 0.156493 0.531281 O\n0.176284 0.656493 0.531281 O\n0.742721 0.600901 0.714193 O\n0.757279 0.100901 0.714193 O\n0.242721 0.600901 0.785807 O\n0.257279 0.100901 0.785807 O\n0.676284 0.656493 0.968719 O\n0.823716 0.156493 0.968719 O\n0.176284 0.843507 0.031281 O\n0.323716 0.343507 0.031281 O\n0.742721 0.899099 0.214193 O\n0.757279 0.399099 0.214193 O\n0.242721 0.899099 0.285807 O\n0.257279 0.399099 0.285807 O\n0.676284 0.843507 0.468719 O\n0.823716 0.343507 0.468719 O\n",
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{
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"structure_string": "Rb8 Ti4 O12\n1.0\n3.045650 -6.063113 0.000000\n3.045650 6.063113 0.000000\n0.000000 0.000000 13.536122\nRb Ti O\n8 4 12\ndirect\n0.367215 0.632785 0.073440 Rb\n0.867215 0.132785 0.426560 Rb\n0.132785 0.867215 0.573440 Rb\n0.632785 0.367215 0.926560 Rb\n0.442303 0.557697 0.636881 Rb\n0.557697 0.442303 0.363119 Rb\n0.057697 0.942303 0.136881 Rb\n0.942303 0.057697 0.863119 Rb\n0.755114 0.244886 0.670642 Ti\n0.744886 0.255114 0.170642 Ti\n0.244886 0.755114 0.329358 Ti\n0.255114 0.744886 0.829358 Ti\n0.975065 0.524935 0.750000 O\n0.524935 0.975065 0.250000 O\n0.024935 0.475065 0.250000 O\n0.475065 0.024935 0.750000 O\n0.397563 0.602437 0.863161 O\n0.602437 0.397563 0.136839 O\n0.102437 0.897563 0.363161 O\n0.667891 0.332109 0.564435 O\n0.167891 0.832109 0.935565 O\n0.832109 0.167891 0.064435 O\n0.332109 0.667891 0.435565 O\n0.897563 0.102437 0.636839 O\n",
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{
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"structure_string": "Hg1 Ru1 O3\n1.0\n3.944331 0.000000 0.000000\n0.000000 3.944331 0.000000\n0.000000 0.000000 3.944331\nHg Ru O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Hg\n0.500000 0.500000 0.500000 Ru\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
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{
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"structure_string": "K6 Fe10 P12 O48\n1.0\n15.722282 3.272366 0.000000\n-15.722282 3.272366 0.000000\n0.000000 0.043126 10.852689\nK Fe P O\n6 10 12 48\ndirect\n0.939768 0.060231 0.750000 K\n0.785634 0.509066 0.987719 K\n0.060231 0.939769 0.250000 K\n0.509066 0.785634 0.487719 K\n0.490934 0.214366 0.512281 K\n0.214366 0.490934 0.012281 K\n0.703272 0.802985 0.077600 Fe\n0.802985 0.703272 0.577600 Fe\n0.806686 0.193314 0.250000 Fe\n0.197015 0.296728 0.422400 Fe\n0.810443 0.189557 0.750000 Fe\n0.000000 0.500000 0.500000 Fe\n0.296728 0.197015 0.922400 Fe\n0.189557 0.810443 0.250000 Fe\n0.500000 0.000000 0.000000 Fe\n0.193314 0.806686 0.750000 Fe\n0.294791 0.996789 0.997536 P\n0.216889 0.277529 0.122878 P\n0.783111 0.722471 0.877122 P\n0.003211 0.705209 0.502464 P\n0.722471 0.783111 0.377122 P\n0.718116 0.281884 0.250000 P\n0.277529 0.216889 0.622878 P\n0.705209 0.003211 0.002464 P\n0.996789 0.294791 0.497536 P\n0.281884 0.718116 0.750000 P\n0.721514 0.278486 0.750000 P\n0.278486 0.721514 0.250000 P\n0.839031 0.133115 0.882643 O\n0.768388 0.737437 0.432083 O\n0.836013 0.620359 0.511251 O\n0.163987 0.379641 0.488749 O\n0.119977 0.007973 0.571977 O\n0.501051 0.610307 0.409846 O\n0.713793 0.211071 0.141549 O\n0.788929 0.286207 0.358451 O\n0.794311 0.749114 0.735620 O\n0.211071 0.713793 0.641549 O\n0.205689 0.250886 0.264380 O\n0.379641 0.163987 0.988749 O\n0.519936 0.895214 0.997961 O\n0.262563 0.231612 0.067917 O\n0.749114 0.794311 0.235620 O\n0.156715 0.850144 0.885514 O\n0.880023 0.992027 0.428023 O\n0.498949 0.389693 0.590154 O\n0.389693 0.498949 0.090154 O\n0.895214 0.519936 0.497961 O\n0.497479 0.878971 0.722483 O\n0.502521 0.121029 0.277517 O\n0.133115 0.839031 0.382643 O\n0.118093 0.506352 0.224608 O\n0.881907 0.493648 0.775392 O\n0.866885 0.160969 0.617357 O\n0.878971 0.497479 0.222483 O\n0.992027 0.880023 0.928023 O\n0.850144 0.156715 0.385514 O\n0.208236 0.717619 0.358833 O\n0.160969 0.866885 0.117357 O\n0.480064 0.104786 0.002039 O\n0.737437 0.768388 0.932083 O\n0.717619 0.208236 0.858833 O\n0.791764 0.282381 0.641167 O\n0.250886 0.205689 0.764380 O\n0.843285 0.149856 0.114486 O\n0.620359 0.836013 0.011251 O\n0.104786 0.480064 0.502039 O\n0.282381 0.791764 0.141167 O\n0.007973 0.119977 0.071977 O\n0.286207 0.788929 0.858451 O\n0.149856 0.843285 0.614486 O\n0.231612 0.262563 0.567917 O\n0.610307 0.501051 0.909846 O\n0.121029 0.502521 0.777517 O\n0.493648 0.881907 0.275392 O\n0.506352 0.118093 0.724608 O\n",
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