data_[Hg8W8O32]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hg  2.0000  1.5000  1.2450
  W  2.3600  1.3500  0.7667
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.7405]
_cell_length_b [7.2055]
_cell_length_c [14.0259]
_cell_angle_alpha [90.0000]
_cell_angle_beta [117.9167]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [HgWO4]
_chemical_formula_sum '[Hg8 W8 O32]'
_cell_volume [601.9456]
_cell_formula_units_Z [8]
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  4  0.2429  0.5612  0.3656  1
  Hg  Hg1  4  0.3001  0.1872  0.6498  1
  W  W2  4  0.1831  0.6693  0.5889  1
  W  W3  4  0.2531  0.0458  0.4016  1
  O  O4  4  0.0096  0.0694  0.6904  1
  O  O5  4  0.0256  0.0835  0.0850  1
  O  O6  4  0.1193  0.2474  0.9314  1
  O  O7  4  0.2019  0.6086  0.0297  1
  O  O8  4  0.3145  0.7273  0.7305  1
  O  O9  4  0.3253  0.1531  0.3100  1
  O  O10  4  0.4100  0.5341  0.5870  1
  O  O11  4  0.4844  0.6444  0.9484  1
]