data_[Dy16Ru8Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Ru  2.2000  1.3000  0.6610
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cc]
_cell_length_a [8.7429]
_cell_length_b [13.0720]
_cell_length_c [6.7588]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.8564]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [9]
_chemical_formula_structural [Dy4Ru2Au]
_chemical_formula_sum '[Dy16 Ru8 Au4]'
_cell_volume [648.8811]
_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
[
  Dy  Dy0  4  0.0537  0.0837  0.1751  1.0
  Dy  Dy1  4  0.1500  0.4691  0.6290  1.0
  Dy  Dy2  4  0.2986  0.1928  0.7526  1.0
  Dy  Dy3  4  0.4578  0.1892  0.3739  1.0
  Ru  Ru4  4  0.1781  0.3211  0.3520  1.0
  Ru  Ru5  4  0.3353  0.0085  0.1108  1.0
  Au  Au6  4  0.3990  0.6249  0.6066  1.0
]