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{
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{
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{
"id": "mp-1521740",
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"structure_string": "Ba1 Ti4 Sn1 O12\n1.0\n5.557055 0.000000 0.000000\n0.000000 5.557055 0.000000\n0.000000 0.000000 7.753710\nBa Ti Sn O\n1 4 1 12\ndirect\n0.500000 0.500000 0.000000 Ba\n-0.000000 0.500000 0.746814 Ti\n0.000000 0.500000 0.253186 Ti\n0.500000 0.000000 0.746814 Ti\n0.500000 0.000000 0.253186 Ti\n0.000000 0.000000 0.500000 Sn\n0.243453 0.243453 0.736215 O\n0.243453 0.243453 0.263785 O\n0.756547 0.756547 0.736215 O\n0.756547 0.756547 0.263785 O\n0.756547 0.243453 0.736215 O\n0.756547 0.243453 0.263785 O\n0.243453 0.756547 0.736215 O\n0.243453 0.756547 0.263785 O\n-0.000000 0.500000 0.500000 O\n-0.000000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.000000 0.000000 O\n",
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{
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"formula_full": "Na8 Nb8 O28",
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{
"id": "mp-1522533",
"created_at": "2022-09-04T14:48:11.874953Z",
"structure_string": "Sr2 Zr1 W1 O6\n1.0\n0.000000 -4.144107 -4.144107\n4.144107 -0.000000 -4.144107\n4.144107 -4.144107 0.000000\nSr Zr W 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 Zr\n0.500000 0.500000 0.500000 W\n0.747293 0.252707 0.252707 O\n0.252707 0.747293 0.747293 O\n0.747293 0.252707 0.747293 O\n0.252707 0.747293 0.252707 O\n0.747293 0.747293 0.252707 O\n0.252707 0.252707 0.747293 O\n",
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{
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"structure_string": "Fe6 O4 F8\n1.0\n4.785186 0.000000 0.000000\n0.100654 5.722036 0.000000\n0.072330 0.649608 7.845484\nFe O F\n6 4 8\ndirect\n0.505209 0.827745 0.661460 Fe\n0.527732 0.507441 0.000722 Fe\n0.462325 0.188277 0.352073 Fe\n0.000531 0.338088 0.673823 Fe\n0.008083 0.649451 0.306193 Fe\n0.989808 0.991358 0.003737 Fe\n0.797789 0.694099 0.105924 O\n0.678776 0.544180 0.766163 O\n0.311927 0.122256 0.571105 O\n0.307102 0.460422 0.227451 O\n0.798465 0.376992 0.424350 F\n0.793530 0.023682 0.765509 F\n0.693082 0.198087 0.112133 F\n0.707153 0.874948 0.429795 F\n0.302957 0.799460 0.895530 F\n0.209356 0.959122 0.242888 F\n0.195155 0.647646 0.548421 F\n0.211019 0.296743 0.912725 F\n",
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{
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{
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{
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"structure_string": "Cu4 S8 N8 O32\n1.0\n9.357260 0.000000 0.000000\n-0.128978 9.404218 0.000000\n-0.436203 -4.121211 9.295837\nCu S N O\n4 8 8 32\ndirect\n0.644715 0.933749 0.667174 Cu\n0.355285 0.066251 0.332826 Cu\n0.862272 0.654071 0.917243 Cu\n0.137728 0.345929 0.082757 Cu\n0.560850 0.709440 0.783135 S\n0.439150 0.290560 0.216865 S\n0.633729 0.890792 0.356106 S\n0.366271 0.109208 0.643894 S\n0.868255 0.330157 0.878288 S\n0.131745 0.669843 0.121712 S\n0.926762 0.750746 0.681914 S\n0.073238 0.249254 0.318086 S\n0.800929 0.536490 0.307353 N\n0.199071 0.463510 0.692647 N\n0.684407 0.330846 0.545614 N\n0.315593 0.669154 0.454386 N\n0.500000 0.500000 0.000000 N\n0.227200 0.944599 0.908848 N\n0.772800 0.055401 0.091152 N\n0.000000 0.000000 0.500000 N\n0.763660 0.868039 0.276295 O\n0.236340 0.131961 0.723705 O\n0.909061 0.804553 0.844033 O\n0.090939 0.195447 0.155967 O\n0.618031 0.878103 0.825281 O\n0.381969 0.121897 0.174719 O\n0.666969 0.630144 0.848807 O\n0.333031 0.369856 0.151193 O\n0.964279 0.274433 0.973366 O\n0.035721 0.725567 0.026634 O\n0.822949 0.494897 0.980402 O\n0.177051 0.505103 0.019598 O\n0.887561 0.585676 0.607527 O\n0.112439 0.414324 0.392473 O\n0.744564 0.222081 0.840190 O\n0.255436 0.777919 0.159810 O\n0.832303 0.854469 0.633965 O\n0.167697 0.145531 0.366035 O\n0.939757 0.342955 0.759205 O\n0.060243 0.657045 0.240795 O\n0.427805 0.709657 0.852027 O\n0.572195 0.290343 0.147973 O\n0.563003 0.746746 0.345353 O\n0.436997 0.253254 0.654647 O\n0.073723 0.787150 0.657920 O\n0.926277 0.212850 0.342080 O\n0.667098 0.999201 0.515786 O\n0.332902 0.000799 0.484214 O\n0.554294 0.630735 0.626478 O\n0.445706 0.369265 0.373522 O\n0.541168 0.986698 0.296059 O\n0.458832 0.013302 0.703941 O\n",
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{
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},
{
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"formula_full": "Ba4 Ca2 Mn2 V4 F28",
"formula_reduced": "Ba2CaMnV2F14",
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},
{
"id": "mp-758488",
"created_at": "2022-09-04T14:48:14.217597Z",
"structure_string": "Li2 P6 W4 O26\n1.0\n7.101596 5.420887 0.000000\n-7.101596 5.420887 0.000000\n0.000000 5.218788 7.218190\nLi P W O\n2 6 4 26\ndirect\n0.000000 0.500000 0.500000 Li\n0.500000 0.000000 0.000000 Li\n0.488282 0.511718 0.250000 P\n0.848388 0.260055 0.060325 P\n0.260055 0.848388 0.560325 P\n0.739945 0.151612 0.439675 P\n0.151612 0.739945 0.939675 P\n0.511718 0.488282 0.750000 P\n0.172060 0.338982 0.170921 W\n0.661018 0.827940 0.329079 W\n0.338982 0.172060 0.670921 W\n0.827940 0.661018 0.829079 W\n0.151579 0.599939 0.096890 O\n0.603228 0.501376 0.082290 O\n0.036976 0.299262 0.032902 O\n0.555683 0.709546 0.206559 O\n0.197727 0.143624 0.232239 O\n0.745646 0.070393 0.094199 O\n0.400061 0.848421 0.403110 O\n0.856376 0.802273 0.267761 O\n0.070393 0.745646 0.594199 O\n0.290454 0.444317 0.293441 O\n0.738894 0.261106 0.250000 O\n0.501376 0.603228 0.582290 O\n0.299262 0.036976 0.532902 O\n0.700738 0.963024 0.467098 O\n0.498624 0.396772 0.417710 O\n0.261106 0.738894 0.750000 O\n0.709546 0.555683 0.706559 O\n0.929607 0.254354 0.405801 O\n0.143624 0.197727 0.732239 O\n0.599939 0.151579 0.596890 O\n0.254354 0.929607 0.905801 O\n0.802273 0.856376 0.767761 O\n0.444317 0.290454 0.793441 O\n0.963024 0.700738 0.967098 O\n0.396772 0.498624 0.917710 O\n0.848421 0.400061 0.903110 O\n",
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}
]
}