data_[Ho4Cd12Au4]
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
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [9.5687]
_cell_length_b [3.9705]
_cell_length_c [12.4227]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [HoCd3Au]
_chemical_formula_sum '[Ho4 Cd12 Au4]'
_cell_volume [471.9657]
_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
[
  Ho  Ho0  4  0.1756  0.2500  0.0056  1.0
  Cd  Cd1  4  0.0625  0.2500  0.4101  1.0
  Cd  Cd2  4  0.0682  0.7500  0.2028  1.0
  Cd  Cd3  4  0.1667  0.7500  0.7996  1.0
  Au  Au4  4  0.1535  0.2500  0.6281  1.0
]