data_[La8Ti12Bi8O48]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ti  1.5400  1.4000  0.8517
  Bi  2.0200  1.6000  1.0350
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Fmm2]
_cell_length_a [5.4698]
_cell_length_b [33.6047]
_cell_length_c [5.4856]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [42]
_chemical_formula_structural [La2Ti3(BiO6)2]
_chemical_formula_sum '[La8 Ti12 Bi8 O48]'
_cell_volume [1008.3170]
_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
[
  La  La0  8  0.0000  0.0649  0.4730  1.0
  Ti  Ti1  8  0.0000  0.1262  0.9816  1.0
  Ti  Ti2  4  0.0000  0.0000  0.9788  1.0
  Bi  Bi3  8  0.0000  0.2116  0.5727  1.0
  O  O4  16  0.2491  0.1138  0.7290  1.0
  O  O5  8  0.0000  0.0579  0.9863  1.0
  O  O6  8  0.0000  0.1796  0.9698  1.0
  O  O7  8  0.2425  0.0000  0.2474  1.0
  O  O8  8  0.2500  0.2500  0.2903  1.0
]