data_[Zn12Ag24Hg4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  Ag  1.9300  1.6000  1.0867
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [9.8348]
_cell_length_b [12.8174]
_cell_length_c [5.8137]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Zn3Ag6Hg]
_chemical_formula_sum '[Zn12 Ag24 Hg4]'
_cell_volume [732.8581]
_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
[
  Zn  Zn0  8  0.1299  0.1323  0.9068  1.0
  Zn  Zn1  4  0.0000  0.4961  0.3560  1.0
  Ag  Ag2  8  0.2294  0.4789  0.1066  1.0
  Ag  Ag3  8  0.2325  0.1979  0.3107  1.0
  Ag  Ag4  4  0.0000  0.0532  0.3185  1.0
  Ag  Ag5  4  0.0000  0.3142  0.0858  1.0
  Hg  Hg6  4  0.0000  0.2787  0.5769  1.0
]