data_[Ho24Au8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [I-42m]
_cell_length_a [11.9701]
_cell_length_b [11.9701]
_cell_length_c [6.1471]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [121]
_chemical_formula_structural [Ho3Au]
_chemical_formula_sum '[Ho24 Au8]'
_cell_volume [880.7901]
_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  8  0.0000  0.3562  0.5000  1.0
  Ho  Ho1  8  0.0960  0.0960  0.2586  1.0
  Ho  Ho2  8  0.2025  0.2025  0.7733  1.0
  Au  Au3  8  0.0000  0.2923  0.0000  1.0
]