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{
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{
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{
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{
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"structure_string": "Ca9 Pr11 Mn20 O60\n1.0\n5.443907 -0.001068 0.000000\n-0.001059 5.476526 0.000000\n0.000000 0.000000 38.427748\nCa Pr Mn O\n9 11 20 60\ndirect\n0.491150 0.460130 0.349407 Ca\n0.491150 0.460130 0.150593 Ca\n0.510414 0.537923 0.650527 Ca\n0.510414 0.537923 0.849473 Ca\n0.991234 0.039816 0.250000 Ca\n0.990165 0.037930 0.050953 Ca\n0.989668 0.037840 0.650361 Ca\n0.990165 0.037930 0.449047 Ca\n0.989668 0.037840 0.849639 Ca\n0.008344 0.963985 0.150448 Pr\n0.008344 0.963985 0.349552 Pr\n0.007253 0.965394 0.550504 Pr\n0.006618 0.964365 0.750000 Pr\n0.007253 0.965394 0.949496 Pr\n0.493450 0.464916 0.551019 Pr\n0.493935 0.464402 0.750000 Pr\n0.493450 0.464916 0.948981 Pr\n0.508284 0.535302 0.051268 Pr\n0.508153 0.535895 0.250000 Pr\n0.508284 0.535302 0.448732 Pr\n0.500296 0.001193 0.100507 Mn\n0.500038 0.000486 0.000905 Mn\n0.500475 0.001434 0.299729 Mn\n0.500502 0.999151 0.601904 Mn\n0.500502 0.999151 0.898096 Mn\n0.500475 0.001434 0.200271 Mn\n0.500296 0.001193 0.399493 Mn\n0.500038 0.000486 0.499095 Mn\n0.500549 0.998960 0.698638 Mn\n0.500549 0.998960 0.801362 Mn\n0.000826 0.497965 0.100650 Mn\n0.999937 0.499188 0.000821 Mn\n0.000242 0.498684 0.200129 Mn\n0.000242 0.498684 0.299871 Mn\n0.000826 0.497965 0.399350 Mn\n0.999937 0.499188 0.499179 Mn\n0.999038 0.499712 0.601903 Mn\n0.999900 0.498925 0.698636 Mn\n0.999900 0.498925 0.801364 Mn\n0.999038 0.499712 0.898097 Mn\n0.071254 0.482062 0.050338 O\n0.071421 0.484153 0.250000 O\n0.071254 0.482062 0.449662 O\n0.079631 0.478197 0.650214 O\n0.079631 0.478197 0.849786 O\n0.219481 0.218925 0.192543 O\n0.221817 0.221263 0.591789 O\n0.219395 0.217987 0.392091 O\n0.222711 0.221305 0.791662 O\n0.224178 0.223158 0.991593 O\n0.219395 0.217987 0.107909 O\n0.219481 0.218925 0.307457 O\n0.224178 0.223158 0.508407 O\n0.222711 0.221305 0.708338 O\n0.221817 0.221263 0.908211 O\n0.283062 0.716955 0.192008 O\n0.284124 0.715644 0.108362 O\n0.283062 0.716955 0.307992 O\n0.284124 0.715644 0.391638 O\n0.276783 0.722265 0.591819 O\n0.280035 0.719446 0.507776 O\n0.277849 0.721178 0.708331 O\n0.277849 0.721178 0.791669 O\n0.276783 0.722265 0.908181 O\n0.280035 0.719446 0.992224 O\n0.422775 0.987076 0.050334 O\n0.423555 0.986429 0.250000 O\n0.420399 0.978243 0.650219 O\n0.422775 0.987076 0.449666 O\n0.420399 0.978243 0.849781 O\n0.571609 0.015672 0.150325 O\n0.571609 0.015672 0.349675 O\n0.569012 0.007660 0.550105 O\n0.568079 0.007941 0.750000 O\n0.569012 0.007660 0.949895 O\n0.720243 0.280048 0.092635 O\n0.716215 0.283984 0.007114 O\n0.719224 0.281473 0.292293 O\n0.719224 0.281473 0.207707 O\n0.716215 0.283984 0.492886 O\n0.713517 0.286319 0.607364 O\n0.720243 0.280048 0.407365 O\n0.715026 0.284784 0.692780 O\n0.713517 0.286319 0.892636 O\n0.715026 0.284784 0.807220 O\n0.783198 0.782475 0.092099 O\n0.780340 0.781373 0.491715 O\n0.785419 0.784799 0.692768 O\n0.783293 0.783392 0.291740 O\n0.783293 0.783392 0.208260 O\n0.785487 0.785982 0.892604 O\n0.780340 0.781373 0.008285 O\n0.785487 0.785982 0.607396 O\n0.783198 0.782475 0.407901 O\n0.785419 0.784799 0.807232 O\n0.923660 0.513561 0.150320 O\n0.932041 0.510130 0.550119 O\n0.932389 0.508046 0.750000 O\n0.923660 0.513561 0.349680 O\n0.932041 0.510130 0.949881 O\n",
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{
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"structure_string": "Sr2 Li1 H8 O6\n1.0\n3.994392 0.003507 -0.003217\n0.004775 5.858132 -0.295746\n-0.008363 -0.362321 8.855855\nSr Li H O\n2 1 8 6\ndirect\n0.001652 0.679501 0.679957 Sr\n0.997793 0.229034 0.089633 Sr\n0.498079 0.398601 0.356791 Li\n0.203877 0.161323 0.756443 H\n0.800193 0.161304 0.756094 H\n0.803948 0.898066 0.372310 H\n0.195199 0.898726 0.372358 H\n0.501307 0.005001 0.574902 H\n0.498262 0.946845 0.200942 H\n0.502363 0.326870 0.612233 H\n0.496249 0.607021 0.101307 H\n0.001768 0.251110 0.802809 O\n0.000160 0.816785 0.414169 O\n0.501962 0.999440 0.684947 O\n0.498275 0.061775 0.289833 O\n0.501645 0.474691 0.569360 O\n0.497268 0.458908 0.145117 O\n",
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]
}