data_[Li20Mn4O12F4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Mn  1.5500  1.4000  0.6483
  O  3.4400  0.6000  1.2600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [9.6002]
_cell_length_b [9.6202]
_cell_length_c [4.7427]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.1338]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Li5MnO3F]
_chemical_formula_sum '[Li20 Mn4 O12 F4]'
_cell_volume [420.7639]
_cell_formula_units_Z [4]
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  0.2539  0.2854  0.7564  1.0
  Li  Li1  4  0.2563  0.2173  0.2462  1.0
  Li  Li2  4  0.4941  0.2916  0.5070  1.0
  Li  Li3  4  0.4958  0.2179  0.9921  1.0
  Li  Li4  2  0.2709  0.5000  0.2611  1.0
  Li  Li5  2  0.4844  0.0000  0.5103  1.0
  Mn  Mn6  2  0.0013  0.0000  0.0141  1.0
  Mn  Mn7  2  0.2383  0.0000  0.6989  1.0
  O  O8  4  0.1210  0.1454  0.8894  1.0
  O  O9  4  0.3751  0.1532  0.6185  1.0
  O  O10  4  0.3809  0.3573  0.1230  1.0
  F  F11  4  0.1255  0.3560  0.3753  1.0
]