data_[Mn8Fe4O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  Fe  1.8300  1.4000  0.8525
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [10.8949]
_cell_length_b [5.8902]
_cell_length_c [5.9798]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.4481]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Mn2FeO4]
_chemical_formula_sum '[Mn8 Fe4 O16]'
_cell_volume [323.8350]
_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  0.3801  0.2475  0.3793  1.0
  Mn  Mn1  2  0.1229  0.5000  0.8725  1.0
  Mn  Mn2  2  0.1276  0.5000  0.3754  1.0
  Fe  Fe3  2  0.0016  0.0000  0.9890  1.0
  Fe  Fe4  2  0.2471  0.0000  0.7594  1.0
  O  O5  4  0.1199  0.2716  0.6379  1.0
  O  O6  4  0.1215  0.2638  0.1059  1.0
  O  O7  2  0.3713  0.5000  0.5975  1.0
  O  O8  2  0.3716  0.0000  0.5913  1.0
  O  O9  2  0.3815  0.5000  0.1549  1.0
  O  O10  2  0.3832  0.0000  0.1637  1.0
]