# generated using pymatgen data_TbPa(SiRu)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.30462663 _cell_length_b 7.18277385 _cell_length_c 6.86210780 _cell_angle_alpha 89.92922784 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TbPa(SiRu)2 _chemical_formula_sum 'Tb2 Pa2 Si4 Ru4' _cell_volume 212.17044429 _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 0.25000000 0.48324414 0.67675184 1.0 Tb Tb1 1 0.75000000 0.51675586 0.32324816 1.0 Pa Pa2 1 0.25000000 0.98150455 0.82956165 1.0 Pa Pa3 1 0.75000000 0.01849545 0.17043835 1.0 Si Si4 1 0.25000000 0.30952044 0.11163694 1.0 Si Si5 1 0.75000000 0.69047956 0.88836306 1.0 Si Si6 1 0.25000000 0.79757419 0.38952347 1.0 Si Si7 1 0.75000000 0.20242581 0.61047653 1.0 Ru Ru8 1 0.75000000 0.86656262 0.57091877 1.0 Ru Ru9 1 0.25000000 0.13343738 0.42908123 1.0 Ru Ru10 1 0.75000000 0.34956944 0.93692450 1.0 Ru Ru11 1 0.25000000 0.65043056 0.06307550 1.0