# generated using pymatgen data_Ga12MoIr3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.52397272 _cell_length_b 6.52397272 _cell_length_c 6.82896853 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 89.74528478 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ga12MoIr3 _chemical_formula_sum 'Ga12 Mo1 Ir3' _cell_volume 290.65318913 _cell_formula_units_Z 1 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 0.99786081 0.50305235 0.50000000 1.0 Ga Ga1 1 0.51612630 0.00712778 0.00000000 1.0 Ga Ga2 1 0.49694765 0.00213919 0.50000000 1.0 Ga Ga3 1 0.99287222 0.48387370 0.00000000 1.0 Ga Ga4 1 0.34863206 0.65136794 0.23963025 1.0 Ga Ga5 1 0.65467998 0.34532002 0.22792528 1.0 Ga Ga6 1 0.15700133 0.15164538 0.73526292 1.0 Ga Ga7 1 0.84835462 0.84299867 0.73526292 1.0 Ga Ga8 1 0.65467998 0.34532002 0.77207472 1.0 Ga Ga9 1 0.34863206 0.65136794 0.76036975 1.0 Ga Ga10 1 0.84835462 0.84299867 0.26473708 1.0 Ga Ga11 1 0.15700133 0.15164538 0.26473708 1.0 Mo Mo12 1 0.15414080 0.84585920 0.50000000 1.0 Ir Ir13 1 0.82921108 0.17078892 0.50000000 1.0 Ir Ir14 1 0.33588819 0.34038303 0.00000000 1.0 Ir Ir15 1 0.65961697 0.66411181 0.00000000 1.0