data_[K2Rb12Hg2Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  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 [P4_2nm]
_cell_length_a [9.9044]
_cell_length_b [9.9044]
_cell_length_c [13.1756]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [102]
_chemical_formula_structural [KRb6HgAu]
_chemical_formula_sum '[K2 Rb12 Hg2 Au2]'
_cell_volume [1292.4878]
_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  4  0.1630  0.8370  0.4939  1.0
  Rb  Rb1  4  0.2437  0.2437  0.3131  1.0
  Rb  Rb2  4  0.2442  0.7558  0.1861  1.0
  K  K3  2  0.0000  0.0000  0.0080  1.0
  Hg  Hg4  2  0.0000  0.0000  0.7340  1.0
  Au  Au5  2  0.0000  0.0000  0.2718  1.0
]