data_[Li8Ti4O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ti  1.5400  1.4000  0.8517
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [5.2179]
_cell_length_b [8.6423]
_cell_length_c [5.0813]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.2490]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Li2TiO3]
_chemical_formula_sum '[Li8 Ti4 O12]'
_cell_volume [212.0793]
_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
[
  Li  Li0  4  0.0000  0.0812  0.2500  1.0
  Li  Li1  4  0.0000  0.2438  0.7500  1.0
  Ti  Ti2  4  0.0000  0.4109  0.2500  1.0
  O  O3  8  0.2220  0.4261  0.0127  1.0
  O  O4  4  0.2500  0.2500  0.5000  1.0
]