data_[Tl1V1Pb2Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  V  1.6300  1.3500  0.7775
  Pb  2.3300  1.8000  1.1225
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [6.3371]
_cell_length_b [8.7192]
_cell_length_c [6.6900]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.6090]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [TlV(PbCl4)2]
_chemical_formula_sum '[Tl1 V1 Pb2 Cl8]'
_cell_volume [369.5074]
_cell_formula_units_Z [1]
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  1  0.0000  0.5000  0.0000  1.0
  V  V1  1  0.0000  0.0000  0.0000  1.0
  Pb  Pb2  2  0.5000  0.2402  0.5000  1.0
  Cl  Cl3  4  0.2237  0.1956  0.1422  1.0
  Cl  Cl4  2  0.2163  0.0000  0.7023  1.0
  Cl  Cl5  2  0.2697  0.5000  0.6225  1.0
]