# generated using pymatgen data_Hf4Ta4AlAs3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.57810019 _cell_length_b 7.04302115 _cell_length_c 8.56467333 _cell_angle_alpha 89.65488507 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf4Ta4AlAs3 _chemical_formula_sum 'Hf4 Ta4 Al1 As3' _cell_volume 215.83129358 _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 0.04485983 0.66500408 1.0 Hf Hf1 1 0.25000000 0.54024292 0.83150906 1.0 Hf Hf2 1 0.75000000 0.45848537 0.16333628 1.0 Hf Hf3 1 0.75000000 0.95612359 0.33324194 1.0 Ta Ta4 1 0.75000000 0.85976864 0.93971443 1.0 Ta Ta5 1 0.25000000 0.63553468 0.44104655 1.0 Ta Ta6 1 0.75000000 0.37002602 0.56412464 1.0 Ta Ta7 1 0.25000000 0.13161912 0.05816570 1.0 Al Al8 1 0.25000000 0.25573966 0.35805741 1.0 As As9 1 0.25000000 0.75565578 0.14575363 1.0 As As10 1 0.75000000 0.74986560 0.64270972 1.0 As As11 1 0.75000000 0.24208079 0.85733457 1.0