# generated using pymatgen data_Hf4AlAsH2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.40495840 _cell_length_b 5.40497427 _cell_length_c 5.40500609 _cell_angle_alpha 104.97308972 _cell_angle_beta 104.97262504 _cell_angle_gamma 118.90154266 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf4AlAsH2 _chemical_formula_sum 'Hf4 Al1 As1 H2' _cell_volume 119.04364263 _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 0.16084426 0.66084494 0.82167513 1.0 Hf Hf1 1 0.83915307 0.33915229 0.17831759 1.0 Hf Hf2 1 0.33917388 0.16082331 0.50000575 1.0 Hf Hf3 1 0.66082895 0.83918452 0.50000693 1.0 Al Al4 1 0.24999786 0.24999785 0.99999609 1.0 As As5 1 0.75000082 0.74999759 0.99999766 1.0 H H6 1 0.74999847 0.24999729 0.50000265 1.0 H H7 1 0.25000269 0.75000221 0.49999820 1.0