data_[Li10V2F16]
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 [Cmmm]
_cell_length_a [5.8201]
_cell_length_b [8.5521]
_cell_length_c [5.9631]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [Li5VF8]
_chemical_formula_sum '[Li10 V2 F16]'
_cell_volume [296.8067]
_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  8  0.2500  0.2500  0.2284  1.0
  Li  Li1  2  0.0000  0.5000  0.0000  1.0
  V  V2  2  0.0000  0.5000  0.5000  1.0
  F  F3  8  0.2267  0.5000  0.2599  1.0
  F  F4  4  0.0000  0.2646  0.5000  1.0
  F  F5  4  0.0000  0.2686  0.0000  1.0
]