data_[Hf4Zr8Co8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hf  1.3000  1.5500  0.8500
  Zr  1.3300  1.5500  0.8600
  Co  1.8800  1.3500  0.7683
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.5523]
_cell_length_b [5.2031]
_cell_length_c [7.3300]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.7427]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Hf(ZrCo)2]
_chemical_formula_sum '[Hf4 Zr8 Co8]'
_cell_volume [353.8837]
_cell_formula_units_Z [4]
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  0.0000  0.1513  0.7500  1.0
  Zr  Zr1  8  0.1518  0.3576  0.1527  1.0
  Co  Co2  8  0.1381  0.1465  0.4993  1.0
]