data_[Rb36Hg12Au6O6]
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
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [8.6976]
_cell_length_b [8.6976]
_cell_length_c [45.7559]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Rb6Hg2AuO]
_chemical_formula_sum '[Rb36 Hg12 Au6 O6]'
_cell_volume [2997.5924]
_cell_formula_units_Z [6]
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  18  0.0286  0.5143  0.1315  1
  Rb  Rb1  18  0.0369  0.5185  0.7026  1
  Hg  Hg2  6  0.0000  0.0000  0.1150  1
  Hg  Hg3  6  0.0000  0.0000  0.3065  1
  Au  Au4  6  0.0000  0.0000  0.4099  1
  O  O5  3  -0.0000  -0.0000  0.5000  1
  O  O6  3  0.0000  0.0000  0.0000  1
]