data_[Li3Ta3In6O18]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ta  1.5000  1.4500  0.8200
  In  1.7800  1.5500  0.9400
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [R3]
_cell_length_a [5.4242]
_cell_length_b [5.4242]
_cell_length_c [14.8334]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [146]
_chemical_formula_structural [LiTaIn2O6]
_chemical_formula_sum '[Li3 Ta3 In6 O18]'
_cell_volume [377.9582]
_cell_formula_units_Z [3]
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
[
  Li  Li0  3  0.0000  0.0000  0.2153  1.0
  Ta  Ta1  3  0.0000  0.0000  0.6829  1.0
  In  In2  3  0.0000  0.0000  0.4774  1.0
  In  In3  3  0.0000  0.0000  0.9749  1.0
  O  O4  9  0.0046  0.3572  0.4090  1.0
  O  O5  9  0.0500  0.6707  0.2535  1.0
]