data_[Li4Ti2Te2O12]
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
  Te  2.1000  1.4000  1.2933
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Pnn2]
_cell_length_a [4.9771]
_cell_length_b [5.1291]
_cell_length_c [8.5016]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [34]
_chemical_formula_structural [Li2TiTeO6]
_chemical_formula_sum '[Li4 Ti2 Te2 O12]'
_cell_volume [217.0285]
_cell_formula_units_Z [2]
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  2  0.0000  0.0000  0.3033  1.0
  Li  Li1  2  0.0000  0.5000  0.6762  1.0
  Ti  Ti2  2  0.0000  0.0000  0.8912  1.0
  Te  Te3  2  0.0000  0.5000  0.0862  1.0
  O  O4  4  0.2000  0.1797  0.0750  1.0
  O  O5  4  0.2033  0.6753  0.9174  1.0
  O  O6  4  0.2429  0.6467  0.2440  1.0
]