data_[Ho8Al8Ni8]
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 [Amm2]
_cell_length_a [8.6380]
_cell_length_b [5.3993]
_cell_length_c [9.1045]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [HoAlNi]
_chemical_formula_sum '[Ho8 Al8 Ni8]'
_cell_volume [424.6304]
_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
[
  Ho  Ho0  4  0.1823  0.0000  0.6704  1.0
  Ho  Ho1  4  0.2915  0.0000  0.3399  1.0
  Al  Al2  4  0.5000  0.2478  0.0863  1.0
  Al  Al3  2  0.0000  0.0000  0.1434  1.0
  Al  Al4  2  0.5000  0.0000  0.8366  1.0
  Ni  Ni5  4  0.0000  0.2448  0.9068  1.0
  Ni  Ni6  4  0.2606  0.0000  0.0066  1.0
]