data_[Ho2Al12Ni8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Al  1.6100  1.2500  0.6750
  Ni  1.9100  1.3500  0.7400
]
_symmetry_space_group_name_H-M [I-42m]
_cell_length_a [6.2242]
_cell_length_b [6.2242]
_cell_length_c [8.7947]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [121]
_chemical_formula_structural [Ho(Al3Ni2)2]
_chemical_formula_sum '[Ho2 Al12 Ni8]'
_cell_volume [340.7088]
_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  2  0.0000  0.0000  0.0000  1.0
  Al  Al1  8  0.1833  0.1833  0.7038  1.0
  Al  Al2  4  0.0000  0.5000  0.0000  1.0
  Ni  Ni3  8  0.1677  0.1677  0.4231  1.0
]