data_[Hg8Au2O10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  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 [I4]
_cell_length_a [7.4310]
_cell_length_b [7.4310]
_cell_length_c [6.0772]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [79]
_chemical_formula_structural [Hg4AuO5]
_chemical_formula_sum '[Hg8 Au2 O10]'
_cell_volume [335.5797]
_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
[
  Hg  Hg0  8  0.0945  0.2908  0.4472  1
  Au  Au1  2  0.0000  0.0000  0.0220  1
  O  O2  8  0.0431  0.2740  0.0417  1
  O  O3  2  0.0000  0.0000  0.5119  1
]