# generated using pymatgen data_TiRe(IrRh2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.45603366 _cell_length_b 5.45603255 _cell_length_c 4.36110604 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.98057810 _symmetry_Int_Tables_number 1 _chemical_formula_structural TiRe(IrRh2)2 _chemical_formula_sum 'Ti1 Re1 Ir2 Rh4' _cell_volume 112.45175401 _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 0.33507031 0.66492969 0.75000000 1.0 Re Re1 1 0.66578356 0.33421644 0.25000000 1.0 Ir Ir2 1 0.83358554 0.66473265 0.75000000 1.0 Ir Ir3 1 0.33526735 0.16641446 0.75000000 1.0 Rh Rh4 1 0.16288254 0.32968371 0.25000000 1.0 Rh Rh5 1 0.67031629 0.83711746 0.25000000 1.0 Rh Rh6 1 0.16461860 0.83538140 0.25000000 1.0 Rh Rh7 1 0.83247481 0.16752519 0.75000000 1.0