data_[Ho16Cd4Au2]
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 [C2/m]
_cell_length_a [17.9458]
_cell_length_b [5.1771]
_cell_length_c [6.9064]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.3318]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ho8Cd2Au]
_chemical_formula_sum '[Ho16 Cd4 Au2]'
_cell_volume [618.8262]
_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  4  0.0209  0.0000  0.7714  1.0
  Ho  Ho1  4  0.0919  0.5000  0.4503  1.0
  Ho  Ho2  4  0.1590  0.5000  0.9658  1.0
  Ho  Ho3  4  0.2020  0.0000  0.3073  1.0
  Cd  Cd4  4  0.1860  0.0000  0.7250  1.0
  Au  Au5  2  0.0000  0.5000  0.0000  1.0
]