# generated using pymatgen data_TbCl3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.41482522 _cell_length_b 6.41482522 _cell_length_c 11.69323067 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TbCl3 _chemical_formula_sum 'Tb4 Cl12' _cell_volume 481.17623865 _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 0.00000000 -0.00000000 0.67151126 1.0 Tb Tb1 1 0.00000000 -0.00000000 0.32848874 1.0 Tb Tb2 1 0.50000000 0.50000000 0.82848874 1.0 Tb Tb3 1 0.50000000 0.50000000 0.17151126 1.0 Cl Cl4 1 0.79313920 0.20686080 0.83119935 1.0 Cl Cl5 1 0.19228281 0.80771719 0.50000000 1.0 Cl Cl6 1 0.70686080 0.70686080 0.33119935 1.0 Cl Cl7 1 0.80771719 0.19228281 0.50000000 1.0 Cl Cl8 1 0.20686080 0.79313920 0.16880065 1.0 Cl Cl9 1 0.29313920 0.29313920 0.66880065 1.0 Cl Cl10 1 0.20686080 0.79313920 0.83119935 1.0 Cl Cl11 1 0.79313920 0.20686080 0.16880065 1.0 Cl Cl12 1 0.30771719 0.30771719 -0.00000000 1.0 Cl Cl13 1 0.29313920 0.29313920 0.33119935 1.0 Cl Cl14 1 0.69228281 0.69228281 -0.00000000 1.0 Cl Cl15 1 0.70686080 0.70686080 0.66880065 1.0