# generated using pymatgen data_LaGaBIr3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.59140112 _cell_length_b 5.59140027 _cell_length_c 7.00676945 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999335 _symmetry_Int_Tables_number 1 _chemical_formula_structural LaGaBIr3 _chemical_formula_sum 'La2 Ga2 B2 Ir6' _cell_volume 189.70978001 _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 La La0 1 0.00000000 0.00000000 0.00000000 1.0 La La1 1 0.00000000 0.00000000 0.50000000 1.0 Ga Ga2 1 0.66666700 0.33333300 0.50000000 1.0 Ga Ga3 1 0.33333300 0.66666700 0.50000000 1.0 B B4 1 0.66666700 0.33333300 0.00000000 1.0 B B5 1 0.33333300 0.66666700 0.00000000 1.0 Ir Ir6 1 0.50000000 0.50000000 0.78870131 1.0 Ir Ir7 1 0.50000000 0.00000000 0.78870131 1.0 Ir Ir8 1 0.00000000 0.50000000 0.78870131 1.0 Ir Ir9 1 0.50000000 0.50000000 0.21129869 1.0 Ir Ir10 1 0.50000000 0.00000000 0.21129869 1.0 Ir Ir11 1 0.00000000 0.50000000 0.21129869 1.0