# generated using pymatgen data_MgSc2B2IrRh4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.44602623 _cell_length_b 9.44602623 _cell_length_c 3.03178977 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgSc2B2IrRh4 _chemical_formula_sum 'Mg2 Sc4 B4 Ir2 Rh8' _cell_volume 270.51875390 _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 0.50000000 0.50000000 0.00000000 1.0 Mg Mg1 1 0.00000000 0.00000000 0.00000000 1.0 Sc Sc2 1 0.67758448 0.17758448 0.00000000 1.0 Sc Sc3 1 0.32241552 0.82241552 0.00000000 1.0 Sc Sc4 1 0.17758448 0.32241552 0.00000000 1.0 Sc Sc5 1 0.82241552 0.67758448 0.00000000 1.0 B B6 1 0.12484188 0.62484188 0.00000000 1.0 B B7 1 0.87515812 0.37515812 0.00000000 1.0 B B8 1 0.62484188 0.87515812 0.00000000 1.0 B B9 1 0.37515812 0.12484188 0.00000000 1.0 Ir Ir10 1 0.50000000 0.00000000 0.50000000 1.0 Ir Ir11 1 0.00000000 0.50000000 0.50000000 1.0 Rh Rh12 1 0.57096852 0.72048512 0.50000000 1.0 Rh Rh13 1 0.42903148 0.27951488 0.50000000 1.0 Rh Rh14 1 0.07096852 0.77951488 0.50000000 1.0 Rh Rh15 1 0.92903148 0.22048512 0.50000000 1.0 Rh Rh16 1 0.27951488 0.57096852 0.50000000 1.0 Rh Rh17 1 0.72048512 0.42903148 0.50000000 1.0 Rh Rh18 1 0.22048512 0.07096852 0.50000000 1.0 Rh Rh19 1 0.77951488 0.92903148 0.50000000 1.0