# generated using pymatgen data_Dy3IrI3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.27170968 _cell_length_b 8.78678327 _cell_length_c 12.24739775 _cell_angle_alpha 86.22791799 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Dy3IrI3 _chemical_formula_sum 'Dy6 Ir2 I6' _cell_volume 458.70514118 _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 Dy Dy0 1 0.75000000 0.14127887 0.12859375 1.0 Dy Dy1 1 0.25000000 0.85872113 0.87140625 1.0 Dy Dy2 1 0.75000000 0.09650093 0.68458486 1.0 Dy Dy3 1 0.25000000 0.90349907 0.31541514 1.0 Dy Dy4 1 0.25000000 0.24943626 0.90075783 1.0 Dy Dy5 1 0.75000000 0.75056374 0.09924217 1.0 Ir Ir6 1 0.75000000 0.04896257 0.90669595 1.0 Ir Ir7 1 0.25000000 0.95103743 0.09330405 1.0 I I8 1 0.25000000 0.42862570 0.13365953 1.0 I I9 1 0.75000000 0.57137430 0.86634047 1.0 I I10 1 0.25000000 0.35006019 0.63770731 1.0 I I11 1 0.75000000 0.64993981 0.36229269 1.0 I I12 1 0.75000000 0.14334659 0.39386259 1.0 I I13 1 0.25000000 0.85665341 0.60613741 1.0