data_[Ag36Hg3O21]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ag  1.9300  1.6000  1.0867
  Hg  2.0000  1.5000  1.2450
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [R-3]
_cell_length_a [11.5919]
_cell_length_b [11.5919]
_cell_length_c [8.0987]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [148]
_chemical_formula_structural [Ag12HgO7]
_chemical_formula_sum '[Ag36 Hg3 O21]'
_cell_volume [942.4312]
_cell_formula_units_Z [3]
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
[
  Ag  Ag0  18  0.0082  0.4177  0.6736  1.0
  Ag  Ag1  18  0.0450  0.8510  0.3536  1.0
  Hg  Hg2  3  0.0000  0.0000  0.0000  1.0
  O  O3  18  0.0247  0.8426  0.8331  1.0
  O  O4  3  0.0000  0.0000  0.5000  1.0
]