data_[Mn4F20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.5814]
_cell_length_b [5.0304]
_cell_length_c [7.1098]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.9098]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [MnF5]
_chemical_formula_sum '[Mn4 F20]'
_cell_volume [317.9315]
_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
[
  Mn  Mn0  4  0.0000  0.0000  0.0000  1.0
  F  F1  8  0.0870  0.2933  0.9622  1.0
  F  F2  8  0.1780  0.1416  0.6299  1.0
  F  F3  4  0.0000  0.1478  0.2500  1.0
]