# generated using pymatgen data_Nd2B6Ir7Rh2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.65182883 _cell_length_b 5.65182851 _cell_length_c 8.60221855 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.94565016 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd2B6Ir7Rh2 _chemical_formula_sum 'Nd2 B6 Ir7 Rh2' _cell_volume 238.09850488 _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 0.70349422 1.0 Nd Nd1 1 0.00000000 0.00000000 0.29650578 1.0 B B2 1 0.66683109 0.33316891 0.00000000 1.0 B B3 1 0.33316891 0.66683109 0.00000000 1.0 B B4 1 0.66660863 0.33339137 0.66763826 1.0 B B5 1 0.33339137 0.66660863 0.66763826 1.0 B B6 1 0.33339137 0.66660863 0.33236174 1.0 B B7 1 0.66660863 0.33339137 0.33236174 1.0 Ir Ir8 1 0.50000000 0.00000000 0.83713954 1.0 Ir Ir9 1 0.00000000 0.50000000 0.83713954 1.0 Ir Ir10 1 0.50000000 0.00000000 0.16286046 1.0 Ir Ir11 1 0.00000000 0.50000000 0.16286046 1.0 Ir Ir12 1 0.50000000 0.50000000 0.50000000 1.0 Ir Ir13 1 0.50000000 0.00000000 0.50000000 1.0 Ir Ir14 1 0.00000000 0.50000000 0.50000000 1.0 Rh Rh15 1 0.50000000 0.50000000 0.83757970 1.0 Rh Rh16 1 0.50000000 0.50000000 0.16242030 1.0