data_[Tl4Hg2Pd2Cl12]
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
  Pd  2.2000  1.4000  0.8462
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.9171]
_cell_length_b [7.0774]
_cell_length_c [8.2213]
_cell_angle_alpha [90.0000]
_cell_angle_beta [115.3994]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tl2HgPdCl6]
_chemical_formula_sum '[Tl4 Hg2 Pd2 Cl12]'
_cell_volume [626.3818]
_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
[
  Tl  Tl0  4  0.2103  0.0000  0.6855  1.0
  Hg  Hg1  2  0.0000  0.0000  0.0000  1.0
  Pd  Pd2  2  0.0000  0.5000  0.5000  1.0
  Cl  Cl3  8  0.0574  0.2684  0.3478  1.0
  Cl  Cl4  4  0.2160  0.0000  0.1120  1.0
]