data_[Co16O24F8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  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 [C2/m]
_cell_length_a [8.7634]
_cell_length_b [6.2967]
_cell_length_c [8.6750]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.0847]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Co2O3F]
_chemical_formula_sum '[Co16 O24 F8]'
_cell_volume [477.4775]
_cell_formula_units_Z [8]
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
[
  Co  Co0  4  0.1036  0.5000  0.1361  1
  Co  Co1  4  0.1341  0.0000  0.6403  1
  Co  Co2  4  0.2404  0.0000  0.2584  1
  Co  Co3  2  0.0000  0.0000  0.0000  1
  Co  Co4  2  0.0000  0.5000  0.5000  1
  O  O5  8  0.2362  0.3006  0.2461  1
  O  O6  4  0.0000  0.3051  0.0000  1
  O  O7  4  0.0247  0.0000  0.2218  1
  O  O8  4  0.0419  0.5000  0.7157  1
  O  O9  4  0.2238  0.5000  0.5261  1
  F  F10  4  0.0000  0.1900  0.5000  1
  F  F11  4  0.2312  0.0000  0.0322  1
]