data_[Hf8Co8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hf  1.3000  1.5500  0.8500
  Co  1.8800  1.3500  0.7683
]
_symmetry_space_group_name_H-M [P2_12_12_1]
_cell_length_a [4.9485]
_cell_length_b [5.0894]
_cell_length_c [10.0214]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [19]
_chemical_formula_structural [HfCo]
_chemical_formula_sum '[Hf8 Co8]'
_cell_volume [252.3904]
_cell_formula_units_Z [8]
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  4  0.1455  0.0761  0.5175  1.0
  Hf  Hf1  4  0.1544  0.6239  0.3025  1.0
  Co  Co2  4  0.1479  0.8782  0.7696  1.0
  Co  Co3  4  0.1594  0.5854  0.5642  1.0
]