# generated using pymatgen data_Ga8BIr4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.26517765 _cell_length_b 12.26517765 _cell_length_c 12.26517765 _cell_angle_alpha 138.83048374 _cell_angle_beta 138.83048374 _cell_angle_gamma 59.63342519 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ga8BIr4 _chemical_formula_sum 'Ga32 B4 Ir16' _cell_volume 791.57271198 _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 0.15128300 0.87538700 0.15276800 1.0 Ga Ga1 1 0.50148400 0.77738100 0.15276800 1.0 Ga Ga2 1 0.62461300 0.34871700 0.84723200 1.0 Ga Ga3 1 0.09871700 0.75148400 0.22410400 1.0 Ga Ga4 1 0.52738100 0.87461300 0.77589600 1.0 Ga Ga5 1 0.62538700 0.97261900 0.22410400 1.0 Ga Ga6 1 0.74851600 0.40128300 0.77589600 1.0 Ga Ga7 1 0.72261900 0.99851600 0.84723200 1.0 Ga Ga8 1 0.59871700 0.37461300 0.34723200 1.0 Ga Ga9 1 0.24851600 0.47261900 0.34723200 1.0 Ga Ga10 1 0.12538700 0.90128300 0.65276800 1.0 Ga Ga11 1 0.65128300 0.49851600 0.27589600 1.0 Ga Ga12 1 0.25118100 0.03182400 0.65124500 1.0 Ga Ga13 1 0.78182400 0.63057900 0.28064400 1.0 Ga Ga14 1 0.34993600 0.50118100 0.71935600 1.0 Ga Ga15 1 0.99881900 0.15006400 0.28064400 1.0 Ga Ga16 1 0.86942100 0.71817600 0.71935600 1.0 Ga Ga17 1 0.90006400 0.11942100 0.65124500 1.0 Ga Ga18 1 0.46817600 0.24881900 0.34875500 1.0 Ga Ga19 1 0.38057900 0.59993600 0.34875500 1.0 Ga Ga20 1 0.49881900 0.21817600 0.84875500 1.0 Ga Ga21 1 0.96817600 0.61942100 0.21935600 1.0 Ga Ga22 1 0.40006400 0.74881900 0.78064400 1.0 Ga Ga23 1 0.75118100 0.09993600 0.21935600 1.0 Ga Ga24 1 0.88057900 0.53182400 0.78064400 1.0 Ga Ga25 1 0.84993600 0.13057900 0.84875500 1.0 Ga Ga26 1 0.28182400 0.00118100 0.15124500 1.0 Ga Ga27 1 0.36942100 0.65006400 0.15124500 1.0 Ga Ga28 1 0.02738100 0.25148400 0.65276800 1.0 Ga Ga29 1 0.00148400 0.84871700 0.72410400 1.0 Ga Ga30 1 0.12461300 0.27738100 0.27589600 1.0 Ga Ga31 1 0.22261900 0.37538700 0.72410400 1.0 B B32 1 0.50000000 0.00000000 0.50000000 1.0 B B33 1 0.75000000 0.75000000 0.00000000 1.0 B B34 1 0.25000000 0.25000000 0.00000000 1.0 B B35 1 0.00000000 0.50000000 0.50000000 1.0 Ir Ir36 1 0.64798800 0.64798800 0.00000000 1.0 Ir Ir37 1 0.39798800 0.89798800 0.50000000 1.0 Ir Ir38 1 0.60201200 0.10201200 0.50000000 1.0 Ir Ir39 1 0.85201200 0.85201200 0.00000000 1.0 Ir Ir40 1 0.10201200 0.60201200 0.50000000 1.0 Ir Ir41 1 0.35201200 0.35201200 0.00000000 1.0 Ir Ir42 1 0.14798800 0.14798800 0.00000000 1.0 Ir Ir43 1 0.89798800 0.39798800 0.50000000 1.0 Ir Ir44 1 0.07428000 0.42572000 0.00000000 1.0 Ir Ir45 1 0.17572000 0.67572000 0.85144100 1.0 Ir Ir46 1 0.82428000 0.32428000 0.14855900 1.0 Ir Ir47 1 0.42572000 0.07428000 0.00000000 1.0 Ir Ir48 1 0.67572000 0.82428000 0.50000000 1.0 Ir Ir49 1 0.57428000 0.57428000 0.64855900 1.0 Ir Ir50 1 0.92572000 0.92572000 0.35144100 1.0 Ir Ir51 1 0.32428000 0.17572000 0.50000000 1.0