# generated using pymatgen data_ZnIr4RuO12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.50503257 _cell_length_b 4.50503257 _cell_length_c 9.46067677 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.46216126 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZnIr4RuO12 _chemical_formula_sum 'Zn1 Ir4 Ru1 O12' _cell_volume 192.00120164 _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 Zn Zn0 1 0.50000000 0.50000000 0.50000000 1.0 Ir Ir1 1 0.50000000 0.50000000 0.83216739 1.0 Ir Ir2 1 0.00000000 0.00000000 0.33296905 1.0 Ir Ir3 1 0.50000000 0.50000000 0.16783261 1.0 Ir Ir4 1 0.00000000 0.00000000 0.66703095 1.0 Ru Ru5 1 0.00000000 0.00000000 0.00000000 1.0 O O6 1 0.69695472 0.69695472 0.67083002 1.0 O O7 1 0.30304528 0.30304528 0.67083002 1.0 O O8 1 0.69695472 0.69695472 0.32916998 1.0 O O9 1 0.19173858 0.80826142 0.16451749 1.0 O O10 1 0.80826142 0.19173858 0.16451749 1.0 O O11 1 0.80826142 0.19173858 0.83548251 1.0 O O12 1 0.30497619 0.30497619 0.00000000 1.0 O O13 1 0.18599675 0.81400325 0.50000000 1.0 O O14 1 0.81400325 0.18599675 0.50000000 1.0 O O15 1 0.69502381 0.69502381 0.00000000 1.0 O O16 1 0.30304528 0.30304528 0.32916998 1.0 O O17 1 0.19173858 0.80826142 0.83548251 1.0