data_[Li2V1Pb1Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  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 [P-1]
_cell_length_a [6.3452]
_cell_length_b [6.7790]
_cell_length_c [8.1860]
_cell_angle_alpha [69.5378]
_cell_angle_beta [88.8348]
_cell_angle_gamma [79.5247]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Li2VPbCl8]
_chemical_formula_sum '[Li2 V1 Pb1 Cl8]'
_cell_volume [324.0427]
_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
[
  Li  Li0  2  0.4633  0.3411  0.6865  1.0
  V  V1  1  0.0000  0.0000  0.0000  1.0
  Pb  Pb2  1  0.0000  0.0000  0.5000  1.0
  Cl  Cl3  2  0.1054  0.2335  0.7275  1.0
  Cl  Cl4  2  0.1257  0.2025  0.1432  1.0
  Cl  Cl5  2  0.3278  0.7823  0.0392  1.0
  Cl  Cl6  2  0.4082  0.7217  0.5662  1.0
]