data_[Tl4Hg4N8O24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Hg  2.0000  1.5000  1.2450
  N  3.0400  0.6500  0.6300
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.7377]
_cell_length_b [10.7329]
_cell_length_c [7.3911]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.6661]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [TlHg(NO3)2]
_chemical_formula_sum '[Tl4 Hg4 N8 O24]'
_cell_volume [717.9016]
_cell_formula_units_Z [4]
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
[
  Tl  Tl0  4  0.0000  0.1012  0.7500  1.0
  Hg  Hg1  4  0.0000  0.3513  0.2500  1.0
  N  N2  8  0.2232  0.3836  0.7024  1.0
  O  O3  8  0.1212  0.3050  0.6152  1.0
  O  O4  8  0.1558  0.1551  0.1704  1.0
  O  O5  8  0.2047  0.4978  0.6576  1.0
]