# generated using pymatgen data_HfZrCl2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.37802643 _cell_length_b 9.37802678 _cell_length_c 9.37802591 _cell_angle_alpha 20.93386858 _cell_angle_beta 20.93385970 _cell_angle_gamma 20.93386801 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfZrCl2 _chemical_formula_sum 'Hf1 Zr1 Cl2' _cell_volume 92.19554237 _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 Hf Hf0 1 0.62432425 0.62432425 0.62432425 1.0 Zr Zr1 1 0.37530403 0.37530403 0.37530403 1.0 Cl Cl2 1 0.89481714 0.89481714 0.89481714 1.0 Cl Cl3 1 0.10555459 0.10555459 0.10555459 1.0