[CIF]
data_HfFe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.47163364
_cell_length_b   4.47163364
_cell_length_c   5.03695401
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfFe2
_chemical_formula_sum   'Hf2 Fe4'
_cell_volume   87.22300542
_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
  Fe  Fe0  1  0.00000000  0.00000000  2.51847700  1
  Fe  Fe1  1  0.00000000  0.00000000  0.00000000  1
  Fe  Fe2  1  -0.00000000  2.58169889  1.25923850  1
  Fe  Fe3  1  2.23581682  1.29084944  3.77771551  1
  Hf  Hf4  1  -0.00000000  2.58169889  3.77771551  1
  Hf  Hf5  1  2.23581682  1.29084944  1.25923850  1
[/CIF]
