data_[Li6V6O6F10]
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 [Cm]
_cell_length_a [10.4866]
_cell_length_b [6.0062]
_cell_length_c [6.0431]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.8953]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Li3V3O3F5]
_chemical_formula_sum '[Li6 V6 O6 F10]'
_cell_volume [319.5973]
_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  0.0077  0.0000  0.9847  1.0
  Li  Li1  2  0.2373  0.5000  0.2391  1.0
  Li  Li2  2  0.3884  0.0000  0.6442  1.0
  V  V3  4  0.1252  0.2607  0.6350  1.0
  V  V4  2  0.3763  0.0000  0.1252  1.0
  O  O5  2  0.1129  0.5000  0.3949  1.0
  O  O6  2  0.1175  0.5000  0.8447  1.0
  O  O7  2  0.1398  0.0000  0.8500  1.0
  F  F8  4  0.3654  0.2447  0.8575  1.0
  F  F9  4  0.3866  0.2430  0.3927  1.0
  F  F10  2  0.1342  0.0000  0.3989  1.0
]