# generated using pymatgen data_Pr2NiIr3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.45150502 _cell_length_b 5.28271925 _cell_length_c 5.45150536 _cell_angle_alpha 58.93733814 _cell_angle_beta 60.00000392 _cell_angle_gamma 58.93733680 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr2NiIr3 _chemical_formula_sum 'Pr2 Ni1 Ir3' _cell_volume 109.19674073 _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 Pr Pr0 1 0.49985949 0.50042153 0.49985949 1.0 Pr Pr1 1 0.75014051 0.74957847 0.75014051 1.0 Ni Ni2 1 0.12500000 0.62500000 0.12500000 1.0 Ir Ir3 1 0.62500000 0.12500000 0.12500000 1.0 Ir Ir4 1 0.12500000 0.12500000 0.12500000 1.0 Ir Ir5 1 0.12500000 0.12500000 0.62500000 1.0