data_[Hf8Zn8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hf  1.3000  1.5500  0.8500
  Zn  1.6500  1.3500  0.8800
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [10.9138]
_cell_length_b [4.6851]
_cell_length_c [5.6858]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [HfZn]
_chemical_formula_sum '[Hf8 Zn8]'
_cell_volume [290.7275]
_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  0.0538  0.7500  0.6713  1.0
  Hf  Hf1  4  0.1831  0.2500  0.9373  1.0
  Zn  Zn2  4  0.0823  0.7500  0.1726  1.0
  Zn  Zn3  4  0.1915  0.2500  0.4403  1.0
]