# generated using pymatgen data_Tc2Ir5Ru _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.48072263 _cell_length_b 5.48072218 _cell_length_c 4.34363637 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.12959921 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tc2Ir5Ru _chemical_formula_sum 'Tc2 Ir5 Ru1' _cell_volume 112.84727210 _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 Tc Tc0 1 0.33305577 0.66694423 0.75000000 1.0 Tc Tc1 1 0.66763654 0.33236346 0.25000000 1.0 Ir Ir2 1 0.16536211 0.33342578 0.25000000 1.0 Ir Ir3 1 0.66657422 0.83463789 0.25000000 1.0 Ir Ir4 1 0.16776839 0.83223161 0.25000000 1.0 Ir Ir5 1 0.83167449 0.66506914 0.75000000 1.0 Ir Ir6 1 0.33493086 0.16832551 0.75000000 1.0 Ru Ru7 1 0.83299763 0.16700237 0.75000000 1.0