# generated using pymatgen data_TbTh7(Si3Ru)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.25593519 _cell_length_b 8.25593493 _cell_length_c 8.28907030 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000498 _symmetry_Int_Tables_number 1 _chemical_formula_structural TbTh7(Si3Ru)4 _chemical_formula_sum 'Tb1 Th7 Si12 Ru4' _cell_volume 489.29296266 _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 Tb Tb0 1 0.00000000 0.00000000 0.75000000 1.0 Th Th1 1 0.50005153 0.00010107 0.25000000 1.0 Th Th2 1 0.49994874 0.99989948 0.75000000 1.0 Th Th3 1 0.99989893 0.49994847 0.25000000 1.0 Th Th4 1 0.00010052 0.50005126 0.75000000 1.0 Th Th5 1 0.50005153 0.49994847 0.25000000 1.0 Th Th6 1 0.49994874 0.50005126 0.75000000 1.0 Th Th7 1 0.00000000 0.00000000 0.25000000 1.0 Si Si8 1 0.16582815 0.33165431 0.99930499 1.0 Si Si9 1 0.83416688 0.66833376 0.99921244 1.0 Si Si10 1 0.66834569 0.83417185 0.99930499 1.0 Si Si11 1 0.83416688 0.66833376 0.50078756 1.0 Si Si12 1 0.33166624 0.16583312 0.99921244 1.0 Si Si13 1 0.16582815 0.33165431 0.50069501 1.0 Si Si14 1 0.16582815 0.83417185 0.99930499 1.0 Si Si15 1 0.33166624 0.16583312 0.50078756 1.0 Si Si16 1 0.83416688 0.16583312 0.99921244 1.0 Si Si17 1 0.66834569 0.83417185 0.50069501 1.0 Si Si18 1 0.83416688 0.16583312 0.50078756 1.0 Si Si19 1 0.16582815 0.83417185 0.50069501 1.0 Ru Ru20 1 0.33333300 0.66666700 0.99600295 1.0 Ru Ru21 1 0.66666700 0.33333300 0.99575259 1.0 Ru Ru22 1 0.66666700 0.33333300 0.50424741 1.0 Ru Ru23 1 0.33333300 0.66666700 0.50399705 1.0