data_[Al2Fe4Sb2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Al  1.6100  1.2500  0.6750
  Fe  1.8300  1.4000  0.8525
  Sb  2.0500  1.4500  0.8300
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [5.2443]
_cell_length_b [5.2843]
_cell_length_c [9.1545]
_cell_angle_alpha [90.0000]
_cell_angle_beta [125.0900]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [AlFe2SbO6]
_chemical_formula_sum '[Al2 Fe4 Sb2 O12]'
_cell_volume [207.5865]
_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
[
  Al  Al0  2  0.5000  0.0000  0.0000  1.0
  Fe  Fe1  4  0.2580  0.0393  0.2553  1.0
  Sb  Sb2  2  0.0000  0.0000  0.5000  1.0
  O  O3  4  0.1237  0.1797  0.9388  1.0
  O  O4  4  0.2762  0.6887  0.9499  1.0
  O  O5  4  0.3630  0.0583  0.7552  1.0
]