# generated using pymatgen data_Sc3B2Ir4Rh _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.55280293 _cell_length_b 9.55280293 _cell_length_c 3.06276848 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc3B2Ir4Rh _chemical_formula_sum 'Sc6 B4 Ir8 Rh2' _cell_volume 279.49613510 _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 Sc Sc0 1 0.82420143 0.32420143 0.00000000 1.0 Sc Sc1 1 0.32420143 0.17579857 0.00000000 1.0 Sc Sc2 1 0.67579857 0.82420143 0.00000000 1.0 Sc Sc3 1 0.17579857 0.67579857 0.00000000 1.0 Sc Sc4 1 0.00000000 0.00000000 0.00000000 1.0 Sc Sc5 1 0.50000000 0.50000000 0.00000000 1.0 B B6 1 0.62163048 0.12163048 0.00000000 1.0 B B7 1 0.12163048 0.37836952 0.00000000 1.0 B B8 1 0.87836952 0.62163048 0.00000000 1.0 B B9 1 0.37836952 0.87836952 0.00000000 1.0 Ir Ir10 1 0.06934612 0.22352870 0.50000000 1.0 Ir Ir11 1 0.22352870 0.93065388 0.50000000 1.0 Ir Ir12 1 0.77647130 0.06934612 0.50000000 1.0 Ir Ir13 1 0.93065388 0.77647130 0.50000000 1.0 Ir Ir14 1 0.43065388 0.72352870 0.50000000 1.0 Ir Ir15 1 0.56934612 0.27647130 0.50000000 1.0 Ir Ir16 1 0.72352870 0.56934612 0.50000000 1.0 Ir Ir17 1 0.27647130 0.43065388 0.50000000 1.0 Rh Rh18 1 0.50000000 0.00000000 0.50000000 1.0 Rh Rh19 1 0.00000000 0.50000000 0.50000000 1.0