data_[Na6Li3V3Cl18]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  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 [R3]
_cell_length_a [6.7244]
_cell_length_b [6.7244]
_cell_length_c [17.3902]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [146]
_chemical_formula_structural [Na2LiVCl6]
_chemical_formula_sum '[Na6 Li3 V3 Cl18]'
_cell_volume [680.9877]
_cell_formula_units_Z [3]
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
[
  Na  Na0  3  0.0000  0.0000  0.4666  1.0
  Na  Na1  3  0.0000  0.0000  0.9758  1.0
  Li  Li2  3  0.0000  0.0000  0.1898  1.0
  V  V3  3  0.0000  0.0000  0.6753  1.0
  Cl  Cl4  9  0.0151  0.4029  0.4188  1.0
  Cl  Cl5  9  0.0692  0.7129  0.2584  1.0
]