data_[Tl3Co6Hg3Cl24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Co  1.8800  1.3500  0.7683
  Hg  2.0000  1.5000  1.2450
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [R-3]
_cell_length_a [6.4304]
_cell_length_b [6.4304]
_cell_length_c [28.0704]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [148]
_chemical_formula_structural [TlCo2HgCl8]
_chemical_formula_sum '[Tl3 Co6 Hg3 Cl24]'
_cell_volume [1005.2017]
_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
[
  Tl  Tl0  3  -0.0000  0.0000  0.5000  1.0
  Co  Co1  6  0.0000  0.0000  0.2513  1.0
  Hg  Hg2  3  0.0000  0.0000  0.0000  1.0
  Cl  Cl3  18  0.0008  0.3436  0.0578  1.0
  Cl  Cl4  6  0.0000  0.0000  0.1736  1.0
]