# generated using pymatgen data_Hf4TiNb3As4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.58684692 _cell_length_b 6.98750328 _cell_length_c 8.51055809 _cell_angle_alpha 90.30324123 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf4TiNb3As4 _chemical_formula_sum 'Hf4 Ti1 Nb3 As4' _cell_volume 213.29802013 _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 0.25000000 0.04003108 0.66545403 1.0 Hf Hf1 1 0.25000000 0.53881871 0.83555851 1.0 Hf Hf2 1 0.75000000 0.45946983 0.16390067 1.0 Hf Hf3 1 0.75000000 0.95779899 0.33396848 1.0 Ti Ti4 1 0.75000000 0.86631714 0.94031702 1.0 Nb Nb5 1 0.25000000 0.63915161 0.43999399 1.0 Nb Nb6 1 0.75000000 0.36320816 0.56073538 1.0 Nb Nb7 1 0.25000000 0.13674677 0.06005085 1.0 As As8 1 0.25000000 0.25659352 0.35604695 1.0 As As9 1 0.25000000 0.75690343 0.13720841 1.0 As As10 1 0.75000000 0.74416150 0.64976399 1.0 As As11 1 0.75000000 0.24079926 0.85700272 1.0