# generated using pymatgen
data_Hf2Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.21234948
_cell_length_b   5.47679926
_cell_length_c   5.47680014
_cell_angle_alpha   76.91242316
_cell_angle_beta   61.58482199
_cell_angle_gamma   61.58482916
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2Al
_chemical_formula_sum   'Hf4 Al2'
_cell_volume   120.94313620
_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  0.65105805  0.19788389  0.50000000  1.0
  Hf  Hf1  1  0.84894195  0.50000000  0.80211611  1.0
  Hf  Hf2  1  0.34894195  0.80211611  0.50000000  1.0
  Hf  Hf3  1  0.15105805  0.50000000  0.19788389  1.0
  Al  Al4  1  0.75000000  0.00000000  0.00000000  1.0
  Al  Al5  1  0.25000000  0.00000000  0.00000000  1.0