data_[V2Pb2Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  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 [C2/m]
_cell_length_a [12.5647]
_cell_length_b [3.9049]
_cell_length_c [7.1097]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.6735]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [VPbCl4]
_chemical_formula_sum '[V2 Pb2 Cl8]'
_cell_volume [340.3292]
_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
[
  V  V0  2  0.0000  0.5000  0.5000  1
  Pb  Pb1  2  0.0000  0.0000  0.0000  1
  Cl  Cl2  4  0.1083  0.0000  0.4078  1
  Cl  Cl3  4  0.1214  0.5000  0.8296  1
]