data_[Li8Ni6O12F2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ni  1.9100  1.3500  0.7400
  O  3.4400  0.6000  1.2600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.2244]
_cell_length_b [4.1247]
_cell_length_c [6.3680]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.8414]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li4Ni3O6F]
_chemical_formula_sum '[Li8 Ni6 O12 F2]'
_cell_volume [240.5641]
_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  4  0.0837  0.5000  0.7165  1.0
  Li  Li1  4  0.2184  0.5000  0.1414  1.0
  Ni  Ni2  4  0.1421  0.0000  0.4277  1.0
  Ni  Ni3  2  0.0000  0.0000  0.0000  1.0
  O  O4  4  0.0563  0.0000  0.6985  1.0
  O  O5  4  0.1611  0.5000  0.4395  1.0
  O  O6  4  0.2013  0.0000  0.1501  1.0
  F  F7  2  0.0000  0.5000  0.0000  1.0
]