data_[Li8Ti8Si16O48]
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
  Si  1.9000  1.1000  0.5400
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Pbca]
_cell_length_a [5.2726]
_cell_length_b [18.6477]
_cell_length_c [8.7258]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [61]
_chemical_formula_structural [LiTi(SiO3)2]
_chemical_formula_sum '[Li8 Ti8 Si16 O48]'
_cell_volume [857.9431]
_cell_formula_units_Z [8]
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  8  0.1220  0.1252  0.0127  1
  Ti  Ti1  8  0.1231  0.1248  0.6608  1
  Si  Si2  8  0.0438  0.7251  0.1576  1
  Si  Si3  8  0.2257  0.0254  0.3414  1
  O  O4  8  0.0383  0.6883  0.9903  1
  O  O5  8  0.0408  0.6864  0.6588  1
  O  O6  8  0.0558  0.5520  0.2183  1
  O  O7  8  0.1866  0.1961  0.2317  1
  O  O8  8  0.2104  0.5646  0.5023  1
  O  O9  8  0.2180  0.5634  0.8414  1
]