# generated using pymatgen data_Pr4As4IrRu3O4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.10834004 _cell_length_b 4.10834004 _cell_length_c 16.87795000 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr4As4IrRu3O4 _chemical_formula_sum 'Pr4 As4 Ir1 Ru3 O4' _cell_volume 284.87376878 _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 0.50000000 0.00000000 0.18239809 1.0 Pr Pr1 1 0.50000000 0.00000000 0.67842474 1.0 Pr Pr2 1 0.00000000 0.50000000 0.81760191 1.0 Pr Pr3 1 0.00000000 0.50000000 0.32157526 1.0 As As4 1 0.50000000 0.00000000 0.92223629 1.0 As As5 1 0.50000000 0.00000000 0.42391502 1.0 As As6 1 0.00000000 0.50000000 0.07776371 1.0 As As7 1 0.00000000 0.50000000 0.57608498 1.0 Ir Ir8 1 0.50000000 0.50000000 0.00000000 1.0 Ru Ru9 1 0.50000000 0.50000000 0.50000000 1.0 Ru Ru10 1 0.00000000 0.00000000 0.00000000 1.0 Ru Ru11 1 0.00000000 0.00000000 0.50000000 1.0 O O12 1 0.50000000 0.50000000 0.74958126 1.0 O O13 1 0.50000000 0.50000000 0.25041874 1.0 O O14 1 0.00000000 0.00000000 0.74916673 1.0 O O15 1 0.00000000 0.00000000 0.25083327 1.0