data_[Ho24Cd2Ni12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Cd  1.6900  1.5500  1.0900
  Ni  1.9100  1.3500  0.7400
]
_symmetry_space_group_name_H-M [Im-3]
_cell_length_a [9.6385]
_cell_length_b [9.6385]
_cell_length_c [9.6385]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [204]
_chemical_formula_structural [Ho12CdNi6]
_chemical_formula_sum '[Ho24 Cd2 Ni12]'
_cell_volume [895.4277]
_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
[
  Ho  Ho0  24  0.0000  0.3026  0.1869  1.0
  Cd  Cd1  2  0.0000  0.0000  0.0000  1.0
  Ni  Ni2  12  0.0000  0.1236  0.5000  1.0
]