data_[Ba8Li4Bi4O20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Li  0.9800  1.4500  0.9000
  Bi  2.0200  1.6000  1.0350
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [3.5202]
_cell_length_b [15.7699]
_cell_length_c [10.9248]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Ba2LiBiO5]
_chemical_formula_sum '[Ba8 Li4 Bi4 O20]'
_cell_volume [606.4632]
_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
[
  Ba  Ba0  4  0.0000  0.1100  0.7056  1.0
  Ba  Ba1  4  0.0000  0.1155  0.3057  1.0
  Li  Li2  4  0.0000  0.4415  0.4514  1.0
  Bi  Bi3  4  0.0000  0.2140  0.0137  1.0
  O  O4  4  0.0000  0.0829  0.0230  1.0
  O  O5  4  0.0000  0.2824  0.6450  1.0
  O  O6  4  0.0000  0.2960  0.3826  1.0
  O  O7  4  0.0000  0.3462  0.0041  1.0
  O  O8  4  0.0000  0.4945  0.2928  1.0
]