# generated using pymatgen data_Ca2Bi3Au10 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 23.73737106 _cell_length_b 23.73737106 _cell_length_c 23.73737106 _cell_angle_alpha 13.78783561 _cell_angle_beta 13.78783561 _cell_angle_gamma 13.78783498 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca2Bi3Au10 _chemical_formula_sum 'Ca4 Bi6 Au20' _cell_volume 661.09913640 _cell_formula_units_Z 2 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 Ca Ca0 1 0.05013300 0.05013300 0.05013300 1.0 Ca Ca1 1 0.44989200 0.44989200 0.44989200 1.0 Ca Ca2 1 0.84971200 0.84971200 0.84971200 1.0 Ca Ca3 1 0.24944600 0.24944600 0.24944600 1.0 Bi Bi4 1 0.60146600 0.60146600 0.60146600 1.0 Bi Bi5 1 0.19969400 0.19969400 0.19969400 1.0 Bi Bi6 1 0.80023000 0.80023000 0.80023000 1.0 Bi Bi7 1 0.99897300 0.99897300 0.99897300 1.0 Bi Bi8 1 0.40009900 0.40009900 0.40009900 1.0 Bi Bi9 1 0.65037000 0.65037000 0.65037000 1.0 Au Au10 1 0.52535100 0.52535100 0.02532000 1.0 Au Au11 1 0.92558700 0.92558700 0.42376500 1.0 Au Au12 1 0.32539900 0.32539900 0.82419500 1.0 Au Au13 1 0.72495100 0.72495100 0.22593300 1.0 Au Au14 1 0.12549000 0.12549000 0.62260000 1.0 Au Au15 1 0.52535100 0.02532000 0.52535100 1.0 Au Au16 1 0.92558700 0.42376500 0.92558700 1.0 Au Au17 1 0.32539900 0.82419500 0.32539900 1.0 Au Au18 1 0.72495100 0.22593300 0.72495100 1.0 Au Au19 1 0.12549000 0.62260000 0.12549000 1.0 Au Au20 1 0.72499800 0.72499800 0.72499800 1.0 Au Au21 1 0.12481600 0.12481600 0.12481600 1.0 Au Au22 1 0.52485500 0.52485500 0.52485500 1.0 Au Au23 1 0.92483600 0.92483600 0.92483600 1.0 Au Au24 1 0.32511100 0.32511100 0.32511100 1.0 Au Au25 1 0.02532000 0.52535100 0.52535100 1.0 Au Au26 1 0.42376500 0.92558700 0.92558700 1.0 Au Au27 1 0.82419500 0.32539900 0.32539900 1.0 Au Au28 1 0.22593300 0.72495100 0.72495100 1.0 Au Au29 1 0.62260000 0.12549000 0.12549000 1.0