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{
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{
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{
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{
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{
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"structure_string": "Tc8 As12\n1.0\n6.667840 0.000000 0.000000\n-1.673485 6.487073 0.000000\n-1.625962 -1.247026 7.801055\nTc As\n8 12\ndirect\n0.915355 0.426038 0.141937 Tc\n0.084645 0.573962 0.858063 Tc\n0.368375 0.428646 0.132883 Tc\n0.631625 0.571354 0.867117 Tc\n0.531170 0.864299 0.364683 Tc\n0.468830 0.135701 0.635317 Tc\n0.088818 0.875914 0.375138 Tc\n0.911182 0.124086 0.624862 Tc\n0.736299 0.592125 0.346942 As\n0.263701 0.407875 0.653058 As\n0.235770 0.565943 0.385461 As\n0.764230 0.434057 0.614539 As\n0.859402 0.129053 0.314015 As\n0.140598 0.870947 0.685985 As\n0.372113 0.155113 0.320442 As\n0.627887 0.844887 0.679558 As\n0.545128 0.206053 0.963756 As\n0.454872 0.793947 0.036244 As\n0.032678 0.190084 0.950278 As\n0.967322 0.809916 0.049722 As\n",
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{
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"structure_string": "Cu1 Br1\n1.0\n0.000000 2.849508 2.849508\n2.849508 0.000000 2.849508\n2.849508 2.849508 0.000000\nCu Br\n1 1\ndirect\n0.250000 0.250000 0.250000 Cu\n0.000000 0.000000 0.000000 Br\n",
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{
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"structure_string": "Ca8 Cr16 Co8 O56\n1.0\n6.842466 0.002860 0.000000\n-1.869579 11.131226 0.000000\n0.000000 0.000000 14.643790\nCa Cr Co O\n8 16 8 56\ndirect\n0.077782 0.727785 0.502496 Ca\n0.330228 0.962194 0.879873 Ca\n0.669772 0.537806 0.379873 Ca\n0.669772 0.037806 0.120127 Ca\n0.330228 0.462194 0.620127 Ca\n0.077782 0.227785 0.997504 Ca\n0.922218 0.272215 0.497504 Ca\n0.922218 0.772215 0.002496 Ca\n0.841367 0.984697 0.869007 Cr\n0.422565 0.689482 0.015376 Cr\n0.422565 0.189482 0.484624 Cr\n0.577435 0.310518 0.984624 Cr\n0.505606 0.786110 0.704118 Cr\n0.494394 0.713890 0.204118 Cr\n0.494394 0.213890 0.295882 Cr\n0.505606 0.286110 0.795882 Cr\n0.577435 0.810518 0.515376 Cr\n0.868903 0.482832 0.136743 Cr\n0.131097 0.017168 0.636743 Cr\n0.131097 0.517168 0.863257 Cr\n0.158633 0.515303 0.369007 Cr\n0.841367 0.484697 0.630993 Cr\n0.158633 0.015303 0.130993 Cr\n0.868903 0.982832 0.363257 Cr\n0.634048 0.073268 0.672091 Co\n0.365952 0.426732 0.172091 Co\n0.365952 0.926732 0.327909 Co\n0.634048 0.573268 0.827909 Co\n0.998933 0.248808 0.754025 Co\n0.001067 0.251192 0.254025 Co\n0.001067 0.751192 0.245975 Co\n0.998933 0.748808 0.745975 Co\n0.758956 0.956345 0.977460 O\n0.241044 0.543655 0.477460 O\n0.241044 0.043655 0.022540 O\n0.758956 0.456345 0.522540 O\n0.991720 0.875034 0.851568 O\n0.008280 0.624966 0.351567 O\n0.008280 0.124966 0.148432 O\n0.991720 0.375034 0.648432 O\n0.995692 0.121043 0.857488 O\n0.004308 0.378957 0.357488 O\n0.004308 0.878957 0.142512 O\n0.995692 0.621043 0.642512 O\n0.685292 0.955665 0.288434 O\n0.314708 0.544335 0.788434 O\n0.314708 0.044335 0.711566 O\n0.685292 0.455665 0.211566 O\n0.966948 0.129342 0.363064 O\n0.033052 0.370658 0.863064 O\n0.033052 0.870658 0.636936 O\n0.966948 0.629342 0.136936 O\n0.043938 0.895896 0.339603 O\n0.378914 0.830179 0.441621 O\n0.956062 0.604104 0.839603 O\n0.043938 0.395896 0.160397 O\n0.731584 0.709607 0.479165 O\n0.268416 0.790393 0.979165 O\n0.268416 0.290393 0.520835 O\n0.731584 0.209607 0.020835 O\n0.775865 0.950256 0.466198 O\n0.224135 0.549744 0.966198 O\n0.224135 0.049744 0.533802 O\n0.775865 0.450257 0.033802 O\n0.424287 0.198428 0.894078 O\n0.575713 0.301572 0.394078 O\n0.575713 0.801572 0.105922 O\n0.424287 0.698428 0.605922 O\n0.693654 0.220379 0.751026 O\n0.306346 0.279621 0.251026 O\n0.306346 0.779621 0.248974 O\n0.693654 0.720379 0.748974 O\n0.635360 0.468447 0.702205 O\n0.364640 0.031553 0.202205 O\n0.364640 0.531553 0.297795 O\n0.635360 0.968447 0.797795 O\n0.297165 0.296584 0.736852 O\n0.702835 0.203416 0.236852 O\n0.702835 0.703416 0.263148 O\n0.297165 0.796584 0.763148 O\n0.595835 0.404867 0.876515 O\n0.404165 0.095133 0.376515 O\n0.404165 0.595133 0.123485 O\n0.595835 0.904867 0.623485 O\n0.378914 0.330179 0.058379 O\n0.621086 0.169821 0.558379 O\n0.621086 0.669821 0.941621 O\n0.956062 0.104104 0.660397 O\n",
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