[CIF]
data_HfNb2Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.98339890
_cell_length_b   2.98339890
_cell_length_c   8.21722394
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   92.52849313
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfNb2Ir
_chemical_formula_sum   'Hf1 Nb2 Ir1'
_cell_volume   73.06758276
_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  0.00000000  0.00000000  3.91633854  1
  Ir  Ir1  1  2.06252336  0.00000000  2.01558996  1
  Nb  Nb2  1  0.00000000  0.00000000  0.20713584  1
  Nb  Nb3  1  2.06252336  0.00000000  6.18677157  1
[/CIF]
