data_[Hf14Co6]
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 [P6_3mc]
_cell_length_a [8.8257]
_cell_length_b [8.8257]
_cell_length_c [5.5659]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [186]
_chemical_formula_structural [Hf7Co3]
_chemical_formula_sum '[Hf14 Co6]'
_cell_volume [375.4570]
_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  6  0.0754  0.5377  0.8746  1.0
  Hf  Hf1  6  0.1306  0.8694  0.5682  1.0
  Hf  Hf2  2  0.3333  0.6667  0.3776  1.0
  Co  Co3  6  0.1900  0.3800  0.1286  1.0
]