data_[Li12V4F24]
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
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [Cc]
_cell_length_a [9.1967]
_cell_length_b [5.2276]
_cell_length_c [10.1530]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.6400]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [9]
_chemical_formula_structural [Li3VF6]
_chemical_formula_sum '[Li12 V4 F24]'
_cell_volume [482.5798]
_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  0.0386  0.3103  0.0423  1
  Li  Li1  4  0.2979  0.3129  0.6464  1
  Li  Li2  4  0.3401  0.3179  0.9058  1
  V  V3  4  0.1740  0.1779  0.3579  1
  F  F4  4  0.0008  0.2759  0.2240  1
  F  F5  4  0.0320  0.0323  0.4668  1
  F  F6  4  0.1891  0.4842  0.4865  1
  F  F7  4  0.1963  0.1391  0.7658  1
  F  F8  4  0.2949  0.3853  0.2614  1
  F  F9  4  0.3439  0.0465  0.4887  1
]