data_[Li6Mn6O6F10]
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 [10.8215]
_cell_length_b [5.8486]
_cell_length_c [6.0637]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.7446]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Li3Mn3O3F5]
_chemical_formula_sum '[Li6 Mn6 O6 F10]'
_cell_volume [322.7931]
_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  2  0.1056  0.5000  0.3512  1.0
  Li  Li1  2  0.2613  0.0000  0.7511  1.0
  Li  Li2  2  0.4989  0.5000  0.0327  1.0
  Mn  Mn3  4  0.3745  0.2430  0.3655  1.0
  Mn  Mn4  2  0.1258  0.5000  0.8720  1.0
  O  O5  2  0.3588  0.5000  0.1476  1.0
  O  O6  2  0.3805  0.0000  0.1598  1.0
  O  O7  2  0.3916  0.0000  0.5975  1.0
  F  F8  4  0.1241  0.2525  0.6094  1.0
  F  F9  4  0.1274  0.2582  0.1442  1.0
  F  F10  2  0.3757  0.5000  0.5998  1.0
]