# generated using pymatgen data_Hf4Al3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.32683223 _cell_length_b 5.32683223 _cell_length_c 5.40543529 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000729 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf4Al3 _chemical_formula_sum 'Hf4 Al3' _cell_volume 132.83095943 _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 -0.00000000 -0.00000000 0.74031658 1.0 Hf Hf1 1 0.00000000 0.00000000 0.25968342 1.0 Hf Hf2 1 0.66666700 0.33333300 0.50000000 1.0 Hf Hf3 1 0.33333300 0.66666700 0.50000000 1.0 Al Al4 1 0.50000000 0.50000000 0.00000000 1.0 Al Al5 1 -0.00000000 0.50000000 0.00000000 1.0 Al Al6 1 0.50000000 0.00000000 -0.00000000 1.0