# generated using pymatgen data_Ga3Ir _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.52093372 _cell_length_b 6.52093372 _cell_length_c 6.61285530 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ga3Ir _chemical_formula_sum 'Ga12 Ir4' _cell_volume 281.19564591 _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 Ga Ga0 1 0.00000000 0.50000000 0.50000000 1.0 Ga Ga1 1 0.50000000 0.00000000 -0.00000000 1.0 Ga Ga2 1 0.50000000 0.00000000 0.50000000 1.0 Ga Ga3 1 0.00000000 0.50000000 -0.00000000 1.0 Ga Ga4 1 0.36223589 0.63776411 0.25837275 1.0 Ga Ga5 1 0.63776411 0.36223589 0.25837275 1.0 Ga Ga6 1 0.13776411 0.13776411 0.75837275 1.0 Ga Ga7 1 0.86223589 0.86223589 0.75837275 1.0 Ga Ga8 1 0.63776411 0.36223589 0.74162725 1.0 Ga Ga9 1 0.36223589 0.63776411 0.74162725 1.0 Ga Ga10 1 0.86223589 0.86223589 0.24162725 1.0 Ga Ga11 1 0.13776411 0.13776411 0.24162725 1.0 Ir Ir12 1 0.16030357 0.83969643 0.50000000 1.0 Ir Ir13 1 0.83969643 0.16030357 0.50000000 1.0 Ir Ir14 1 0.33969643 0.33969643 -0.00000000 1.0 Ir Ir15 1 0.66030357 0.66030357 -0.00000000 1.0