data_[Mn6O2F10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  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 [P1]
_cell_length_a [5.8583]
_cell_length_b [5.8919]
_cell_length_c [7.5749]
_cell_angle_alpha [73.7559]
_cell_angle_beta [73.4797]
_cell_angle_gamma [71.8955]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Mn3OF5]
_chemical_formula_sum '[Mn6 O2 F10]'
_cell_volume [232.9454]
_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
[
  Mn  Mn0  1  0.0002  0.0060  0.5011  1.0
  Mn  Mn1  1  0.0215  0.9685  0.9945  1.0
  Mn  Mn2  1  0.3385  0.3548  0.6750  1.0
  Mn  Mn3  1  0.3396  0.3478  0.1566  1.0
  Mn  Mn4  1  0.6380  0.6651  0.8281  1.0
  Mn  Mn5  1  0.6606  0.6707  0.3486  1.0
  O  O6  1  0.3148  0.6699  0.9992  1.0
  O  O7  1  0.5570  0.5821  0.6359  1.0
  F  F8  1  0.1144  0.1056  0.7019  1.0
  F  F9  1  0.2338  0.2218  0.9734  1.0
  F  F10  1  0.3678  0.9985  0.3182  1.0
  F  F11  1  0.4256  0.4396  0.3674  1.0
  F  F12  1  0.6370  0.0358  0.6674  1.0
  F  F13  1  0.7104  0.2758  0.0045  1.0
  F  F14  1  0.7579  0.7544  0.0297  1.0
  F  F15  1  0.9095  0.8949  0.2925  1.0
  F  F16  1  0.9737  0.3693  0.3276  1.0
  F  F17  1  0.9997  0.6394  0.6784  1.0
]