# generated using pymatgen
data_HfAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.80937000
_cell_length_b   2.80937000
_cell_length_c   11.55554500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfAu
_chemical_formula_sum   'Hf2 Au2'
_cell_volume   91.20282990
_cell_formula_units_Z   2
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  0.50000000  0.50000000  0.13657400  1.0
  Hf  Hf1  1  0.50000000  0.50000000  0.86342600  1.0
  Au  Au2  1  0.50000000  0.50000000  0.62991200  1.0
  Au  Au3  1  0.50000000  0.50000000  0.37008800  1.0