data_[Li8Mn8O8F16]
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 [C2/c]
_cell_length_a [9.2933]
_cell_length_b [5.4651]
_cell_length_c [9.4849]
_cell_angle_alpha [90.0000]
_cell_angle_beta [116.1065]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [LiMnOF2]
_chemical_formula_sum '[Li8 Mn8 O8 F16]'
_cell_volume [432.5774]
_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
[
  Li  Li0  8  0.1535  0.3016  0.6584  1.0
  Mn  Mn1  4  0.0000  0.1767  0.2500  1.0
  Mn  Mn2  4  0.2500  0.2500  0.0000  1.0
  O  O3  8  0.1681  0.0469  0.8212  1.0
  F  F4  8  0.0452  0.2474  0.0247  1.0
  F  F5  8  0.1597  0.4414  0.3429  1.0
]