# generated using pymatgen data_AcCl3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.69563581 _cell_length_b 7.69563523 _cell_length_c 4.56900298 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999730 _symmetry_Int_Tables_number 1 _chemical_formula_structural AcCl3 _chemical_formula_sum 'Ac2 Cl6' _cell_volume 234.33710785 _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 Ac Ac0 1 0.66666700 0.33333300 0.75000000 1.0 Ac Ac1 1 0.33333300 0.66666700 0.25000000 1.0 Cl Cl2 1 0.61040487 0.69620707 0.75000000 1.0 Cl Cl3 1 0.91419780 0.61040487 0.25000000 1.0 Cl Cl4 1 0.38959513 0.30379293 0.25000000 1.0 Cl Cl5 1 0.08580220 0.38959513 0.75000000 1.0 Cl Cl6 1 0.30379293 0.91419780 0.75000000 1.0 Cl Cl7 1 0.69620707 0.08580220 0.25000000 1.0