# generated using pymatgen data_Sr5(IrO3)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.14655721 _cell_length_b 8.14655721 _cell_length_c 8.14655721 _cell_angle_alpha 109.47122063 _cell_angle_beta 109.47122063 _cell_angle_gamma 109.47122063 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr5(IrO3)6 _chemical_formula_sum 'Sr5 Ir6 O18' _cell_volume 416.19843704 _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 Sr Sr0 1 0.50000000 0.50000000 0.50000000 1.0 Sr Sr1 1 0.00000000 0.00000000 0.00000000 1.0 Sr Sr2 1 0.00000000 0.00000000 0.50000000 1.0 Sr Sr3 1 0.00000000 0.50000000 0.00000000 1.0 Sr Sr4 1 0.50000000 0.00000000 0.00000000 1.0 Ir Ir5 1 0.50000000 0.84467200 0.34467200 1.0 Ir Ir6 1 0.15532800 0.65532800 0.50000000 1.0 Ir Ir7 1 0.34467200 0.50000000 0.84467200 1.0 Ir Ir8 1 0.65532800 0.50000000 0.15532800 1.0 Ir Ir9 1 0.50000000 0.15532800 0.65532800 1.0 Ir Ir10 1 0.84467200 0.34467200 0.50000000 1.0 O O11 1 0.66509900 0.71135500 0.37645400 1.0 O O12 1 0.28864500 0.62354600 0.33490100 1.0 O O13 1 0.00000000 0.34793600 0.34793600 1.0 O O14 1 0.00000000 0.65206400 0.65206400 1.0 O O15 1 0.28864500 0.95374400 0.66509900 1.0 O O16 1 0.34793600 0.34793600 0.00000000 1.0 O O17 1 0.65206400 0.65206400 0.00000000 1.0 O O18 1 0.33490100 0.71135500 0.04625600 1.0 O O19 1 0.95374400 0.66509900 0.28864500 1.0 O O20 1 0.62354600 0.33490100 0.28864500 1.0 O O21 1 0.04625600 0.33490100 0.71135500 1.0 O O22 1 0.37645400 0.66509900 0.71135500 1.0 O O23 1 0.66509900 0.28864500 0.95374400 1.0 O O24 1 0.65206400 0.00000000 0.65206400 1.0 O O25 1 0.71135500 0.04625600 0.33490100 1.0 O O26 1 0.71135500 0.37645400 0.66509900 1.0 O O27 1 0.34793600 0.00000000 0.34793600 1.0 O O28 1 0.33490100 0.28864500 0.62354600 1.0