data_[Tl2Sn6Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Sn  1.9600  1.4500  0.8300
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [11.9630]
_cell_length_b [4.1868]
_cell_length_c [12.4535]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.7129]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Tl(SnCl2)3]
_chemical_formula_sum '[Tl2 Sn6 Cl12]'
_cell_volume [614.8066]
_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  0.0197  0.7500  0.6815  1
  Sn  Sn1  2  0.1703  0.7500  0.0560  1
  Sn  Sn2  2  0.3218  0.2500  0.5194  1
  Sn  Sn3  2  0.3684  0.7500  0.8842  1
  Cl  Cl4  2  0.0591  0.2500  0.9029  1
  Cl  Cl5  2  0.1435  0.7500  0.4627  1
  Cl  Cl6  2  0.2142  0.2500  0.2026  1
  Cl  Cl7  2  0.2448  0.2500  0.7060  1
  Cl  Cl8  2  0.4565  0.7500  0.6147  1
  Cl  Cl9  2  0.4582  0.7500  0.0997  1
]