data_[Ti4Al8Pb4O24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ti  1.5400  1.4000  0.8517
  Al  1.6100  1.2500  0.6750
  Pb  2.3300  1.8000  1.1225
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.8419]
_cell_length_b [11.1842]
_cell_length_c [6.1791]
_cell_angle_alpha [90.0000]
_cell_angle_beta [114.9083]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [TiAl2PbO6]
_chemical_formula_sum '[Ti4 Al8 Pb4 O24]'
_cell_volume [554.2098]
_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
[
  Ti  Ti0  4  0.0000  0.2001  0.7500  1.0
  Al  Al1  8  0.1252  0.4290  0.1633  1.0
  Pb  Pb2  4  0.0000  0.1067  0.2500  1.0
  O  O3  8  0.0896  0.2774  0.0360  1.0
  O  O4  8  0.1178  0.4554  0.4522  1.0
  O  O5  8  0.1408  0.0894  0.7064  1.0
]