data_[Li4V2O4F4]
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
  O  3.4400  0.6000  1.2600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P2/c]
_cell_length_a [5.1114]
_cell_length_b [5.8915]
_cell_length_c [5.0657]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.6580]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [13]
_chemical_formula_structural [Li2V(OF)2]
_chemical_formula_sum '[Li4 V2 O4 F4]'
_cell_volume [143.6575]
_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
[
  Li  Li0  2  0.0000  0.1329  0.2500  1.0
  Li  Li1  2  0.0000  0.3947  0.7500  1.0
  V  V2  2  0.5000  0.1175  0.7500  1.0
  O  O3  4  0.2770  0.1042  0.9748  1.0
  F  F4  4  0.2252  0.3522  0.5173  1.0
]