# generated using pymatgen data_Th2B6Ir8Rh _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.66071057 _cell_length_b 5.66070885 _cell_length_c 8.66398962 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.08094587 _symmetry_Int_Tables_number 1 _chemical_formula_structural Th2B6Ir8Rh _chemical_formula_sum 'Th2 B6 Ir8 Rh1' _cell_volume 240.23457217 _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 Th Th0 1 0.00000000 0.00000000 0.70515829 1.0 Th Th1 1 0.00000000 0.00000000 0.29374561 1.0 B B2 1 0.66625078 0.33374922 0.00051656 1.0 B B3 1 0.33374922 0.66625078 0.00051656 1.0 B B4 1 0.66640871 0.33359129 0.66807931 1.0 B B5 1 0.33359129 0.66640871 0.66807931 1.0 B B6 1 0.33399530 0.66600470 0.33154553 1.0 B B7 1 0.66600470 0.33399530 0.33154553 1.0 Ir Ir8 1 0.50000000 0.50000000 0.83755778 1.0 Ir Ir9 1 0.50000000 0.00000000 0.83855457 1.0 Ir Ir10 1 0.00000000 0.50000000 0.83855457 1.0 Ir Ir11 1 0.50000000 0.00000000 0.16314234 1.0 Ir Ir12 1 0.00000000 0.50000000 0.16314234 1.0 Ir Ir13 1 0.50000000 0.50000000 0.49881270 1.0 Ir Ir14 1 0.50000000 0.00000000 0.49995260 1.0 Ir Ir15 1 0.00000000 0.50000000 0.49995260 1.0 Rh Rh16 1 0.50000000 0.50000000 0.16114380 1.0