data_[Tl4In4Sn4Cl16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  In  1.7800  1.5500  0.9400
  Sn  1.9600  1.4500  0.8300
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [7.9288]
_cell_length_b [15.8344]
_cell_length_c [7.9400]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [TlInSnCl4]
_chemical_formula_sum '[Tl4 In4 Sn4 Cl16]'
_cell_volume [996.8572]
_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  0.3853  0.2500  1.0
  In  In1  4  0.0000  0.1048  0.2500  1.0
  Sn  Sn2  4  0.0000  0.2523  0.7500  1.0
  Cl  Cl3  8  0.2500  0.2500  0.0000  1.0
  Cl  Cl4  4  0.0000  0.0699  0.7500  1.0
  Cl  Cl5  4  0.0000  0.4257  0.7500  1.0
]