data_[Co20O30F10]
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 [Amm2]
_cell_length_a [14.8164]
_cell_length_b [6.0588]
_cell_length_c [6.3235]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [Co2O3F]
_chemical_formula_sum '[Co20 O30 F10]'
_cell_volume [567.6531]
_cell_formula_units_Z [10]
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  0.1006  0.0000  0.4765  1
  Co  Co1  4  0.2005  0.0000  0.0023  1
  Co  Co2  4  0.3002  0.0000  0.5280  1
  Co  Co3  4  0.4002  0.0000  0.0022  1
  Co  Co4  2  0.0000  0.0000  0.0097  1
  Co  Co5  2  0.5000  0.0000  0.4766  1
  O  O6  8  0.2005  0.1935  0.5045  1
  O  O7  8  0.4003  0.1942  0.5021  1
  O  O8  4  0.0000  0.1954  0.4844  1
  O  O9  4  0.1017  0.0000  0.1938  1
  O  O10  4  0.3003  0.0000  0.8113  1
  O  O11  2  0.5000  0.0000  0.1930  1
  F  F12  4  0.0980  0.0000  0.7850  1
  F  F13  4  0.3004  0.0000  0.2227  1
  F  F14  2  0.5000  0.0000  0.7818  1
]