# generated using pymatgen data_Hf3TiRh2N _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.51561716 _cell_length_b 8.51561669 _cell_length_c 8.51561875 _cell_angle_alpha 59.99999960 _cell_angle_beta 60.00000144 _cell_angle_gamma 59.99999912 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf3TiRh2N _chemical_formula_sum 'Hf12 Ti4 Rh8 N4' _cell_volume 436.64998069 _cell_formula_units_Z 4 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 Hf Hf0 1 0.81303956 0.81303956 0.18696044 1.0 Hf Hf1 1 0.18696044 0.18696044 0.81303956 1.0 Hf Hf2 1 0.81303956 0.18696044 0.81303956 1.0 Hf Hf3 1 0.18696044 0.81303956 0.18696044 1.0 Hf Hf4 1 0.18696044 0.81303956 0.81303956 1.0 Hf Hf5 1 0.81303956 0.18696044 0.18696044 1.0 Hf Hf6 1 0.43696044 0.43696044 0.06303956 1.0 Hf Hf7 1 0.06303956 0.06303956 0.43696044 1.0 Hf Hf8 1 0.43696044 0.06303956 0.43696044 1.0 Hf Hf9 1 0.06303956 0.43696044 0.06303956 1.0 Hf Hf10 1 0.06303956 0.43696044 0.43696044 1.0 Hf Hf11 1 0.43696044 0.06303956 0.06303956 1.0 Ti Ti12 1 0.12500000 0.62500000 0.62500000 1.0 Ti Ti13 1 0.62500000 0.12500000 0.62500000 1.0 Ti Ti14 1 0.62500000 0.62500000 0.12500000 1.0 Ti Ti15 1 0.62500000 0.62500000 0.62500000 1.0 Rh Rh16 1 0.75450472 0.41516509 0.41516509 1.0 Rh Rh17 1 0.41516509 0.75450472 0.41516509 1.0 Rh Rh18 1 0.41516509 0.41516509 0.75450472 1.0 Rh Rh19 1 0.41516509 0.41516509 0.41516509 1.0 Rh Rh20 1 0.49549528 0.83483491 0.83483491 1.0 Rh Rh21 1 0.83483491 0.49549528 0.83483491 1.0 Rh Rh22 1 0.83483491 0.83483491 0.49549528 1.0 Rh Rh23 1 0.83483491 0.83483491 0.83483491 1.0 N N24 1 0.62500000 0.12500000 0.12500000 1.0 N N25 1 0.12500000 0.62500000 0.12500000 1.0 N N26 1 0.12500000 0.12500000 0.62500000 1.0 N N27 1 0.12500000 0.12500000 0.12500000 1.0