# generated using pymatgen data_Tb2PaRu3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.84682740 _cell_length_b 5.84682670 _cell_length_c 8.02527373 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000958 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb2PaRu3 _chemical_formula_sum 'Tb4 Pa2 Ru6' _cell_volume 237.59152146 _cell_formula_units_Z 2 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 0.33333300 0.66666700 0.44134569 1.0 Tb Tb1 1 0.66666700 0.33333300 0.55865431 1.0 Tb Tb2 1 0.66666700 0.33333300 0.94134569 1.0 Tb Tb3 1 0.33333300 0.66666700 0.05865431 1.0 Pa Pa4 1 0.00000000 0.00000000 0.50000000 1.0 Pa Pa5 1 0.00000000 0.00000000 0.00000000 1.0 Ru Ru6 1 0.83401933 0.16598067 0.25000000 1.0 Ru Ru7 1 0.83401933 0.66803867 0.25000000 1.0 Ru Ru8 1 0.33196133 0.16598067 0.25000000 1.0 Ru Ru9 1 0.16598067 0.83401933 0.75000000 1.0 Ru Ru10 1 0.16598067 0.33196133 0.75000000 1.0 Ru Ru11 1 0.66803867 0.83401933 0.75000000 1.0