data_[Al2Bi4B2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Al  1.6100  1.2500  0.6750
  Bi  2.0200  1.6000  1.0350
  B  2.0400  0.8500  0.4100
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.5950]
_cell_length_b [5.5808]
_cell_length_c [10.0125]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.7265]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [AlBi2BO6]
_chemical_formula_sum '[Al2 Bi4 B2 O12]'
_cell_volume [337.3627]
_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  0.0000  0.0000  0.5000  1
  Bi  Bi1  4  0.1693  0.0361  0.1944  1
  B  B2  2  0.5000  0.0000  0.0000  1
  O  O3  4  0.0249  0.1028  0.6778  1
  O  O4  4  0.0783  0.2028  0.9684  1
  O  O5  4  0.4584  0.6422  0.5854  1
]