data_[Cs4Rb16Hg4Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Rb  0.8200  2.3500  1.6600
  Hg  2.0000  1.5000  1.2450
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.0863]
_cell_length_b [10.9660]
_cell_length_c [10.6287]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.8416]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CsRb4HgAu]
_chemical_formula_sum '[Cs4 Rb16 Hg4 Au4]'
_cell_volume [1874.7063]
_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
[
  Cs  Cs0  4  0.0392  0.0000  0.8121  1.0
  Rb  Rb1  8  0.1833  0.3079  0.1651  1.0
  Rb  Rb2  4  0.0913  0.5000  0.7961  1.0
  Rb  Rb3  4  0.1940  0.0000  0.4478  1.0
  Hg  Hg4  4  0.0847  0.5000  0.4355  1.0
  Au  Au5  4  0.1965  0.0000  0.0783  1.0
]