data_[Li10Co4O4F10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Co  1.8800  1.3500  0.7683
  O  3.4400  0.6000  1.2600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [I4/mmm]
_cell_length_a [2.9483]
_cell_length_b [2.9483]
_cell_length_c [28.9594]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [139]
_chemical_formula_structural [Li5Co2O2F5]
_chemical_formula_sum '[Li10 Co4 O4 F10]'
_cell_volume [251.7363]
_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  0.0000  0.0000  0.0688  1
  Li  Li1  4  0.0000  0.0000  0.3612  1
  Li  Li2  2  0.0000  0.0000  0.5000  1
  Co  Co3  4  0.0000  0.0000  0.2187  1
  O  O4  4  0.0000  0.0000  0.2897  1
  F  F5  4  0.0000  0.0000  0.1384  1
  F  F6  4  0.0000  0.0000  0.4311  1
  F  F7  2  0.0000  0.0000  0.0000  1
]