# generated using pymatgen data_Nd2B6Ir4Rh5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.63635001 _cell_length_b 5.63746958 _cell_length_c 8.57011532 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99343078 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd2B6Ir4Rh5 _chemical_formula_sum 'Nd2 B6 Ir4 Rh5' _cell_volume 235.84583341 _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 Nd Nd0 1 0.00000000 0.00000000 0.70495140 1.0 Nd Nd1 1 0.00000000 0.00000000 0.29435125 1.0 B B2 1 0.66649861 0.33299522 0.99998765 1.0 B B3 1 0.33350139 0.66700478 0.99998765 1.0 B B4 1 0.66638674 0.33277448 0.66739265 1.0 B B5 1 0.33361326 0.66722552 0.66739265 1.0 B B6 1 0.33318279 0.66636659 0.33270795 1.0 B B7 1 0.66681721 0.33363341 0.33270795 1.0 Ir Ir8 1 0.50000000 0.00000000 0.83853575 1.0 Ir Ir9 1 0.50000000 0.50000000 0.49972686 1.0 Ir Ir10 1 0.50000000 0.00000000 0.49888536 1.0 Ir Ir11 1 0.00000000 0.50000000 0.49972686 1.0 Rh Rh12 1 0.50000000 0.50000000 0.83817557 1.0 Rh Rh13 1 0.00000000 0.50000000 0.83817557 1.0 Rh Rh14 1 0.50000000 0.50000000 0.16212732 1.0 Rh Rh15 1 0.50000000 0.00000000 0.16304023 1.0 Rh Rh16 1 0.00000000 0.50000000 0.16212732 1.0