data_[Al8Fe4B4O24]
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
  B  2.0400  0.8500  0.4100
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.5579]
_cell_length_b [9.9851]
_cell_length_c [5.0985]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.5835]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Al2FeBO6]
_chemical_formula_sum '[Al8 Fe4 B4 O24]'
_cell_volume [399.2906]
_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
[
  Al  Al0  8  0.1312  0.4104  0.6539  1
  Fe  Fe1  4  0.0000  0.1029  0.7500  1
  B  B2  4  0.0000  0.1714  0.2500  1
  O  O3  8  0.0881  0.2374  0.5291  1
  O  O4  8  0.1220  0.4301  0.9928  1
  O  O5  8  0.1224  0.0791  0.1904  1
]