data_[La2Bi4O9]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Bi  2.0200  1.6000  1.0350
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [4.0409]
_cell_length_b [7.0092]
_cell_length_c [9.4334]
_cell_angle_alpha [96.8040]
_cell_angle_beta [101.2002]
_cell_angle_gamma [90.2396]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [La2Bi4O9]
_chemical_formula_sum '[La2 Bi4 O9]'
_cell_volume [260.1486]
_cell_formula_units_Z [1]
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  1  0.4952  0.4945  0.0177  1.0
  La  La1  1  0.9777  0.9977  0.9906  1.0
  Bi  Bi2  1  0.1741  0.3622  0.3452  1.0
  Bi  Bi3  1  0.3506  0.1220  0.6573  1.0
  Bi  Bi4  1  0.6271  0.8950  0.3271  1.0
  Bi  Bi5  1  0.8365  0.5998  0.6760  1.0
  O  O6  1  0.0359  0.3330  0.1073  1.0
  O  O7  1  0.1110  0.0281  0.2807  1.0
  O  O8  1  0.3656  0.4548  0.7097  1.0
  O  O9  1  0.4386  0.1598  0.8954  1.0
  O  O10  1  0.5276  0.8541  0.0926  1.0
  O  O11  1  0.5842  0.5554  0.2967  1.0
  O  O12  1  0.6561  0.2248  0.4855  1.0
  O  O13  1  0.7963  0.9259  0.7031  1.0
  O  O14  1  0.9525  0.6360  0.9069  1.0
]