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0.000000\n-0.000000 5.798760 0.000000\n0.000000 0.000000 8.350715\nLu Tl O\n4 4 12\ndirect\n0.500000 0.000000 0.000000 Lu\n0.500000 0.000000 0.500000 Lu\n0.000000 0.500000 0.000000 Lu\n0.000000 0.500000 0.500000 Lu\n0.987753 0.046990 0.250000 Tl\n0.487754 0.453010 0.750000 Tl\n0.512246 0.546990 0.250000 Tl\n0.012246 0.953010 0.750000 Tl\n0.824927 0.820722 0.069164 O\n0.324927 0.679278 0.930836 O\n0.324927 0.679278 0.569163 O\n0.876893 0.585172 0.750000 O\n0.123106 0.414828 0.250000 O\n0.175073 0.179278 0.569163 O\n0.675072 0.320722 0.430836 O\n0.175073 0.179278 0.930836 O\n0.824927 0.820722 0.430836 O\n0.623106 0.085172 0.750000 O\n0.675072 0.320722 0.069164 O\n0.376893 0.914828 0.250000 O\n","nsites":20,"nelements":3,"elements":["Lu","Tl","O"],"chemical_system":"Lu-O-Tl","density":10.297295624044144,"density_atomic":0.07255409076755368,"volume":275.65640735648276,"volume_molar":8.300208432483194,"formula_full":"Lu4 Tl4 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