# generated using pymatgen data_Ti8Tc3Ir4Ru _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.16784376 _cell_length_b 4.36666201 _cell_length_c 8.73221131 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000515 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti8Tc3Ir4Ru _chemical_formula_sum 'Ti8 Tc3 Ir4 Ru1' _cell_volume 235.18367859 _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 0.00190112 0.74999900 0.12499838 1.0 Ti Ti1 1 0.49813298 0.74999900 0.12500164 1.0 Ti Ti2 1 0.00088630 0.24999900 0.37640354 1.0 Ti Ti3 1 0.49914872 0.24999900 0.37640639 1.0 Ti Ti4 1 0.49997515 0.74999900 0.62499982 1.0 Ti Ti5 1 0.99998816 0.74999900 0.62500154 1.0 Ti Ti6 1 0.49911301 0.24999900 0.87359454 1.0 Ti Ti7 1 0.00085445 0.24999900 0.87359602 1.0 Tc Tc8 1 0.24997887 0.74999900 0.37429466 1.0 Tc Tc9 1 0.75001846 0.24999900 0.62500446 1.0 Tc Tc10 1 0.24995378 0.74999900 0.87570204 1.0 Ir Ir11 1 0.24999680 0.24999900 0.12499993 1.0 Ir Ir12 1 0.75003221 0.74999900 0.37373802 1.0 Ir Ir13 1 0.24996435 0.24999900 0.62499858 1.0 Ir Ir14 1 0.75000737 0.74999900 0.87626364 1.0 Ru Ru15 1 0.75004728 0.24999900 0.12499981 1.0