data_[Cr8Fe4N4O32]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cr  1.6600  1.4000  0.9400
  Fe  1.8300  1.4000  0.8525
  N  3.0400  0.6500  0.6300
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [14.7848]
_cell_length_b [5.5870]
_cell_length_c [8.8271]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [Cr2FeNO8]
_chemical_formula_sum '[Cr8 Fe4 N4 O32]'
_cell_volume [729.1451]
_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
[
  Cr  Cr0  4  0.0656  0.2500  0.1835  1
  Cr  Cr1  4  0.1597  0.2500  0.7421  1
  Fe  Fe2  4  0.1571  0.7500  0.9954  1
  N  N3  4  0.1263  0.7500  0.4681  1
  O  O4  8  0.1298  0.0055  0.1469  1
  O  O5  8  0.1880  0.0046  0.8449  1
  O  O6  4  0.0261  0.7500  0.9276  1
  O  O7  4  0.0380  0.2500  0.3601  1
  O  O8  4  0.0528  0.2500  0.7138  1
  O  O9  4  0.2145  0.2500  0.5744  1
]