# generated using pymatgen data_Tb3(SiRu)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.55586770 _cell_length_b 7.59489175 _cell_length_c 13.40549278 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb3(SiRu)2 _chemical_formula_sum 'Tb12 Si8 Ru8' _cell_volume 565.66103855 _cell_formula_units_Z 4 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 Tb Tb0 1 0.14534293 0.40092957 0.60085097 1.0 Tb Tb1 1 0.85465707 0.59907043 0.10085097 1.0 Tb Tb2 1 0.14534293 0.09907043 0.39914903 1.0 Tb Tb3 1 0.85465707 0.90092957 0.89914903 1.0 Tb Tb4 1 0.85465707 0.59907043 0.39914903 1.0 Tb Tb5 1 0.14534293 0.40092957 0.89914903 1.0 Tb Tb6 1 0.85465707 0.90092957 0.60085097 1.0 Tb Tb7 1 0.14534293 0.09907043 0.10085097 1.0 Tb Tb8 1 0.62728051 0.25964548 0.75000000 1.0 Tb Tb9 1 0.37271949 0.74035452 0.25000000 1.0 Tb Tb10 1 0.62728051 0.24035452 0.25000000 1.0 Tb Tb11 1 0.37271949 0.75964548 0.75000000 1.0 Si Si12 1 0.14016290 0.10786595 0.75000000 1.0 Si Si13 1 0.85983710 0.89213405 0.25000000 1.0 Si Si14 1 0.14016290 0.39213405 0.25000000 1.0 Si Si15 1 0.85983710 0.60786595 0.75000000 1.0 Si Si16 1 0.60317977 0.25000000 0.50000000 1.0 Si Si17 1 0.39682023 0.75000000 0.00000000 1.0 Si Si18 1 0.39682023 0.75000000 0.50000000 1.0 Si Si19 1 0.60317977 0.25000000 0.00000000 1.0 Ru Ru20 1 0.35256851 0.02811185 0.59003430 1.0 Ru Ru21 1 0.64743149 0.97188815 0.09003430 1.0 Ru Ru22 1 0.35256851 0.47188815 0.40996570 1.0 Ru Ru23 1 0.64743149 0.52811185 0.90996570 1.0 Ru Ru24 1 0.64743149 0.97188815 0.40996570 1.0 Ru Ru25 1 0.35256851 0.02811185 0.90996570 1.0 Ru Ru26 1 0.64743149 0.52811185 0.59003430 1.0 Ru Ru27 1 0.35256851 0.47188815 0.09003430 1.0