[CIF]
data_HfFe2Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.12762809
_cell_length_b   3.12762809
_cell_length_c   6.02806552
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfFe2Ir
_chemical_formula_sum   'Hf1 Fe2 Ir1'
_cell_volume   58.96688316
_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
  Fe  Fe0  1  0.00000000  0.00000000  0.10591878  1
  Fe  Fe1  1  1.56381404  1.56381404  1.37008351  1
  Hf  Hf2  1  0.00000000  0.00000000  2.96853859  1
  Ir  Ir3  1  1.56381404  1.56381404  4.59755747  1
[/CIF]
