data_[Tl2Cd2Sn4Hg2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Cd  1.6900  1.5500  1.0900
  Sn  1.9600  1.4500  0.8300
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.3540]
_cell_length_b [4.6762]
_cell_length_c [8.9780]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.0824]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [TlCdSn2Hg]
_chemical_formula_sum '[Tl2 Cd2 Sn4 Hg2]'
_cell_volume [295.1260]
_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  2  0.0665  0.2500  0.8575  1.0
  Cd  Cd1  2  0.3468  0.7500  0.7029  1.0
  Sn  Sn2  2  0.1082  0.2500  0.4473  1.0
  Sn  Sn3  2  0.3919  0.7500  0.0472  1.0
  Hg  Hg4  2  0.3897  0.7500  0.3797  1.0
]