# generated using pymatgen data_Mg2SiB2Ir5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.41888500 _cell_length_b 9.41888500 _cell_length_c 2.91488100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg2SiB2Ir5 _chemical_formula_sum 'Mg4 Si2 B4 Ir10' _cell_volume 258.59481825 _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 Mg Mg0 1 0.67525200 0.82474800 0.00000000 1.0 Mg Mg1 1 0.82474800 0.32474800 0.00000000 1.0 Mg Mg2 1 0.17525200 0.67525200 0.00000000 1.0 Mg Mg3 1 0.32474800 0.17525200 0.00000000 1.0 Si Si4 1 0.50000000 0.50000000 0.00000000 1.0 Si Si5 1 0.00000000 0.00000000 0.00000000 1.0 B B6 1 0.37429700 0.87429700 0.00000000 1.0 B B7 1 0.12570300 0.37429700 0.00000000 1.0 B B8 1 0.87429700 0.62570300 0.00000000 1.0 B B9 1 0.62570300 0.12570300 0.00000000 1.0 Ir Ir10 1 0.50000000 0.00000000 0.50000000 1.0 Ir Ir11 1 0.57180000 0.29057400 0.50000000 1.0 Ir Ir12 1 0.70942600 0.57180000 0.50000000 1.0 Ir Ir13 1 0.29057400 0.42820000 0.50000000 1.0 Ir Ir14 1 0.20942600 0.92820000 0.50000000 1.0 Ir Ir15 1 0.00000000 0.50000000 0.50000000 1.0 Ir Ir16 1 0.07180000 0.20942600 0.50000000 1.0 Ir Ir17 1 0.79057400 0.07180000 0.50000000 1.0 Ir Ir18 1 0.92820000 0.79057400 0.50000000 1.0 Ir Ir19 1 0.42820000 0.70942600 0.50000000 1.0