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"structure_string": "Zr1 H8 C6 O4\n1.0\n3.767325 0.060977 0.168254\n1.158482 4.441881 0.895502\n0.173617 0.026666 9.425518\nZr H C O\n1 8 6 4\ndirect\n0.035184 0.849315 0.301805 Zr\n0.792174 0.212161 0.920265 H\n0.328242 0.315470 0.873702 H\n0.820589 0.743248 0.856382 H\n0.338429 0.875878 0.856264 H\n0.068701 0.340162 0.669559 H\n0.667085 0.234269 0.647003 H\n0.274135 0.733615 0.631932 H\n0.638574 0.900012 0.604036 H\n0.537388 0.394395 0.920329 C\n0.568130 0.694571 0.827465 C\n0.558943 0.701110 0.664061 C\n0.879235 0.455636 0.452065 C\n0.800846 0.418840 0.614600 C\n0.414262 0.395905 0.075974 C\n0.192315 0.632806 0.109009 O\n0.963700 0.174197 0.411115 O\n0.587335 0.661905 0.364372 O\n0.517325 0.145760 0.166838 O\n",
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"structure_string": "Nb2 Tl5 S4 Br9\n1.0\n6.721929 0.000117 -2.565668\n-1.933770 8.579160 -5.066027\n0.029111 0.004725 10.163266\nNb Tl S Br\n2 5 4 9\ndirect\n0.409410 0.909394 0.818788 Nb\n0.590590 0.090606 0.181212 Nb\n0.163263 0.880386 0.326525 Tl\n0.500000 0.500000 -0.000000 Tl\n0.836736 0.553859 0.673474 Tl\n0.836737 0.119614 0.673474 Tl\n0.163264 0.446141 0.326526 Tl\n0.750183 0.900103 0.000005 S\n0.249817 0.099897 0.999994 S\n0.750182 0.099903 0.000006 S\n0.249818 0.900096 0.999994 S\n-0.000000 0.500000 -0.000000 Br\n0.535416 0.784629 0.569258 Br\n0.464584 0.215371 0.430742 Br\n0.364647 0.130495 0.729259 Br\n0.635354 0.401236 0.270741 Br\n0.033872 0.784624 0.569248 Br\n0.966128 0.215376 0.430752 Br\n0.364646 0.598764 0.729259 Br\n0.635353 0.869504 0.270741 Br\n",
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}