data_[Mn26Fe6]
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
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [7.0947]
_cell_length_b [7.0648]
_cell_length_c [7.1304]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [Mn13Fe3]
_chemical_formula_sum '[Mn26 Fe6]'
_cell_volume [357.3917]
_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  8  0.2482  0.2494  0.7494  1.0
  Mn  Mn1  4  0.0000  0.2482  0.5011  1.0
  Mn  Mn2  4  0.2468  0.0000  0.4973  1.0
  Mn  Mn3  4  0.5000  0.2464  0.5001  1.0
  Mn  Mn4  2  0.0000  0.0000  0.7540  1.0
  Mn  Mn5  2  0.5000  0.0000  0.2441  1.0
  Mn  Mn6  2  0.5000  0.0000  0.7560  1.0
  Fe  Fe7  4  0.2489  0.0000  0.0020  1.0
  Fe  Fe8  2  0.0000  0.0000  0.2471  1.0
]