data_[Rb22Hg2Au10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  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 [13.2916]
_cell_length_b [15.9355]
_cell_length_c [8.7619]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.0359]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Rb11HgAu5]
_chemical_formula_sum '[Rb22 Hg2 Au10]'
_cell_volume [1754.3557]
_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
[
  Rb  Rb0  8  0.0789  0.2276  0.2934  1
  Rb  Rb1  8  0.1993  0.3752  0.9122  1
  Rb  Rb2  4  0.1663  0.5000  0.3894  1
  Rb  Rb3  2  0.0000  0.0000  0.5000  1
  Hg  Hg4  2  0.0000  0.0000  0.0000  1
  Au  Au5  8  0.1771  0.1727  0.6920  1
  Au  Au6  2  0.0000  0.5000  0.0000  1
]