# generated using pymatgen data_PrPIrN _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.91642874 _cell_length_b 3.91642874 _cell_length_c 8.15822688 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural PrPIrN _chemical_formula_sum 'Pr2 P2 Ir2 N2' _cell_volume 125.13426167 _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 Pr Pr0 1 0.50000000 0.00000000 0.16557942 1.0 Pr Pr1 1 0.00000000 0.50000000 0.83442058 1.0 P P2 1 0.00000000 0.50000000 0.33808938 1.0 P P3 1 0.50000000 0.00000000 0.66191062 1.0 Ir Ir4 1 0.00000000 0.00000000 0.50000000 1.0 Ir Ir5 1 0.50000000 0.50000000 0.50000000 1.0 N N6 1 0.00000000 0.50000000 0.13460087 1.0 N N7 1 0.50000000 0.00000000 0.86539913 1.0