# generated using pymatgen data_Tb3AlAu5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.44310855 _cell_length_b 8.44310906 _cell_length_c 13.41156338 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 128.47029712 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb3AlAu5 _chemical_formula_sum 'Tb12 Al4 Au20' _cell_volume 748.52712181 _cell_formula_units_Z 4 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 Tb Tb0 1 0.92878477 0.07121523 0.25000000 1.0 Tb Tb1 1 0.07121523 0.92878477 0.75000000 1.0 Tb Tb2 1 0.31953408 0.68046592 0.25000000 1.0 Tb Tb3 1 0.68046592 0.31953408 0.75000000 1.0 Tb Tb4 1 0.63144928 0.36855072 0.46615401 1.0 Tb Tb5 1 0.36855072 0.63144928 0.53384599 1.0 Tb Tb6 1 0.63144928 0.36855072 0.03384599 1.0 Tb Tb7 1 0.36855072 0.63144928 0.96615401 1.0 Tb Tb8 1 0.88259917 0.11740083 0.95017914 1.0 Tb Tb9 1 0.11740083 0.88259917 0.04982086 1.0 Tb Tb10 1 0.88259917 0.11740083 0.54982086 1.0 Tb Tb11 1 0.11740083 0.88259917 0.45017914 1.0 Al Al12 1 0.72081556 0.27918444 0.25000000 1.0 Al Al13 1 0.27918444 0.72081556 0.75000000 1.0 Al Al14 1 0.53247710 0.46752290 0.25000000 1.0 Al Al15 1 0.46752290 0.53247710 0.75000000 1.0 Au Au16 1 0.32270668 0.06780635 0.25000000 1.0 Au Au17 1 0.06780635 0.32270668 0.75000000 1.0 Au Au18 1 0.67729332 0.93219365 0.75000000 1.0 Au Au19 1 0.93219365 0.67729332 0.25000000 1.0 Au Au20 1 0.57433231 0.00580177 0.39702120 1.0 Au Au21 1 0.00580177 0.57433231 0.60297880 1.0 Au Au22 1 0.57433231 0.00580177 0.10297880 1.0 Au Au23 1 0.00580177 0.57433231 0.89702120 1.0 Au Au24 1 0.42566769 0.99419823 0.60297880 1.0 Au Au25 1 0.99419823 0.42566769 0.39702120 1.0 Au Au26 1 0.42566769 0.99419823 0.89702120 1.0 Au Au27 1 0.99419823 0.42566769 0.10297880 1.0 Au Au28 1 0.68425008 0.73935330 0.39447546 1.0 Au Au29 1 0.73935330 0.68425008 0.60552454 1.0 Au Au30 1 0.68425008 0.73935330 0.10552454 1.0 Au Au31 1 0.73935330 0.68425008 0.89447546 1.0 Au Au32 1 0.31574992 0.26064670 0.60552454 1.0 Au Au33 1 0.26064670 0.31574992 0.39447546 1.0 Au Au34 1 0.31574992 0.26064670 0.89447546 1.0 Au Au35 1 0.26064670 0.31574992 0.10552454 1.0