data_[Ba3Li1Sb2O6]
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
  Sb  2.0500  1.4500  0.8300
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [6.0158]
_cell_length_b [6.0158]
_cell_length_c [7.0636]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Ba3Li(SbO3)2]
_chemical_formula_sum '[Ba3 Li1 Sb2 O6]'
_cell_volume [221.3810]
_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
[
  Ba  Ba0  2  0.3333  0.6667  0.3680  1.0
  Ba  Ba1  1  0.0000  0.0000  0.0000  1.0
  Li  Li2  1  0.0000  0.0000  0.5000  1.0
  Sb  Sb3  2  0.3333  0.6667  0.8478  1.0
  O  O4  6  0.1733  0.3466  0.6942  1.0
]