data_[Li8V4Cl16]
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
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Imma]
_cell_length_a [7.3202]
_cell_length_b [7.4351]
_cell_length_c [10.4937]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [74]
_chemical_formula_structural [Li2VCl4]
_chemical_formula_sum '[Li8 V4 Cl16]'
_cell_volume [571.1338]
_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
[
  Li  Li0  4  0.0000  0.2500  0.8586  1.0
  Li  Li1  4  0.2500  0.2500  0.2500  1.0
  V  V2  4  0.0000  0.0000  0.5000  1.0
  Cl  Cl3  8  0.0000  0.0154  0.2640  1.0
  Cl  Cl4  8  0.2307  0.2500  0.5001  1.0
]