# generated using pymatgen data_Ti2IrOs _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.18675680 _cell_length_b 10.18675680 _cell_length_c 10.18675680 _cell_angle_alpha 127.71305462 _cell_angle_beta 117.51276321 _cell_angle_gamma 85.77614081 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti2IrOs _chemical_formula_sum 'Ti2 Ir1 Os1' _cell_volume 708.02297302 _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 Ti Ti0 1 0.00000000 0.24671200 0.24671200 1.0 Ti Ti1 1 0.00000000 0.75328800 0.75328800 1.0 Ir Ir2 1 0.00000000 0.50000000 0.50000000 1.0 Os Os3 1 0.00000000 0.00000000 0.00000000 1.0