# generated using pymatgen data_TbThP7Ru12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.40183805 _cell_length_b 9.40183771 _cell_length_c 3.94244261 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000024 _symmetry_Int_Tables_number 1 _chemical_formula_structural TbThP7Ru12 _chemical_formula_sum 'Tb1 Th1 P7 Ru12' _cell_volume 301.80159234 _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 0.66666700 0.33333300 0.50000000 1.0 Th Th1 1 0.33333300 0.66666700 0.00000000 1.0 P P2 1 0.60649846 0.71616136 0.50000000 1.0 P P3 1 0.00000000 0.00000000 0.00000000 1.0 P P4 1 0.28383864 0.89033711 0.50000000 1.0 P P5 1 0.10966289 0.39350154 0.50000000 1.0 P P6 1 0.88697297 0.57377718 0.00000000 1.0 P P7 1 0.42622282 0.31319579 0.00000000 1.0 P P8 1 0.68680421 0.11302703 0.00000000 1.0 Ru Ru9 1 0.55718122 0.94889253 0.50000000 1.0 Ru Ru10 1 0.39171231 0.44281878 0.50000000 1.0 Ru Ru11 1 0.91367072 0.11974209 0.50000000 1.0 Ru Ru12 1 0.20607136 0.08632928 0.50000000 1.0 Ru Ru13 1 0.88025791 0.79392864 0.50000000 1.0 Ru Ru14 1 0.72867175 0.89218272 0.00000000 1.0 Ru Ru15 1 0.10781728 0.83648803 0.00000000 1.0 Ru Ru16 1 0.16351197 0.27132825 0.00000000 1.0 Ru Ru17 1 0.42428274 0.06912755 0.00000000 1.0 Ru Ru18 1 0.93087245 0.35515519 0.00000000 1.0 Ru Ru19 1 0.64484481 0.57571726 0.00000000 1.0 Ru Ru20 1 0.05110747 0.60828769 0.50000000 1.0