data_[Li8Mn8F32]
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
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.1549]
_cell_length_b [4.0144]
_cell_length_c [12.8309]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.0078]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [LiMnF4]
_chemical_formula_sum '[Li8 Mn8 F32]'
_cell_volume [654.6153]
_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  4  0.1463  0.5000  0.3001  1
  Li  Li1  4  0.1959  0.0000  0.1602  1
  Mn  Mn2  4  0.0372  0.0000  0.8700  1
  Mn  Mn3  4  0.1413  0.0000  0.6515  1
  F  F4  4  0.0183  0.5000  0.8485  1
  F  F5  4  0.0772  0.0000  0.7432  1
  F  F6  4  0.1085  0.0000  0.2563  1
  F  F7  4  0.1617  0.5000  0.6807  1
  F  F8  4  0.1735  0.0000  0.9980  1
  F  F9  4  0.2052  0.0000  0.5639  1
  F  F10  4  0.2086  0.5000  0.1968  1
  F  F11  2  0.0000  0.0000  0.0000  1
  F  F12  2  0.0000  0.0000  0.5000  1
]