# generated using pymatgen data_Th4In3Cu20Sn _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.05029103 _cell_length_b 8.27546323 _cell_length_c 10.57820818 _cell_angle_alpha 90.03040836 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Th4In3Cu20Sn _chemical_formula_sum 'Th4 In3 Cu20 Sn1' _cell_volume 442.10025714 _cell_formula_units_Z 1 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Th Th0 1 0.75000000 0.24612539 0.94248227 1.0 Th Th1 1 0.25000000 0.75218726 0.06007154 1.0 Th Th2 1 0.75000000 0.74803596 0.55813766 1.0 Th Th3 1 0.25000000 0.25219620 0.43867495 1.0 In In4 1 0.25000000 0.63909132 0.36135538 1.0 In In5 1 0.75000000 0.86114285 0.86120318 1.0 In In6 1 0.25000000 0.13896024 0.13826242 1.0 Cu Cu7 1 0.00081641 0.43189377 0.18700160 1.0 Cu Cu8 1 0.50027369 0.56888647 0.81317926 1.0 Cu Cu9 1 0.49889133 0.93183963 0.31286906 1.0 Cu Cu10 1 0.99940870 0.06814149 0.68684907 1.0 Cu Cu11 1 0.99972631 0.56888647 0.81317926 1.0 Cu Cu12 1 0.49918359 0.43189377 0.18700160 1.0 Cu Cu13 1 0.50059130 0.06814149 0.68684907 1.0 Cu Cu14 1 0.00110867 0.93183963 0.31286906 1.0 Cu Cu15 1 0.75000000 0.43808644 0.39228284 1.0 Cu Cu16 1 0.25000000 0.56433007 0.60747093 1.0 Cu Cu17 1 0.75000000 0.93785280 0.10789880 1.0 Cu Cu18 1 0.25000000 0.06115040 0.89229135 1.0 Cu Cu19 1 0.75000000 0.18074070 0.25519718 1.0 Cu Cu20 1 0.25000000 0.81932762 0.74508907 1.0 Cu Cu21 1 0.75000000 0.68060353 0.24550085 1.0 Cu Cu22 1 0.25000000 0.31827953 0.75545971 1.0 Cu Cu23 1 0.75000000 0.08235301 0.48292100 1.0 Cu Cu24 1 0.25000000 0.91817189 0.51643281 1.0 Cu Cu25 1 0.75000000 0.58297507 0.01662846 1.0 Cu Cu26 1 0.25000000 0.41665323 0.98290191 1.0 Sn Sn27 1 0.75000000 0.36021073 0.63993870 1.0