data_[Li6La10Ti16O48]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  La  1.1000  1.9500  1.1720
  Ti  1.5400  1.4000  0.8517
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.6432]
_cell_length_b [7.8240]
_cell_length_c [8.7659]
_cell_angle_alpha [90.0000]
_cell_angle_beta [116.4893]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li3La5Ti8O24]
_chemical_formula_sum '[Li6 La10 Ti16 O48]'
_cell_volume [960.2507]
_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  4  0.2500  0.5000  0.9998  1
  Li  Li1  2  0.0000  0.5000  0.0000  1
  La  La2  4  0.1251  0.0000  0.5020  1
  La  La3  4  0.1253  0.5000  0.4997  1
  La  La4  2  0.0000  0.0000  0.0000  1
  Ti  Ti5  8  0.0652  0.2526  0.7562  1
  Ti  Ti6  8  0.1872  0.2525  0.2439  1
  O  O7  8  0.0649  0.2443  0.2597  1
  O  O8  8  0.1216  0.2433  1.0000  1
  O  O9  8  0.1838  0.2506  0.7353  1
  O  O10  4  0.0000  0.2487  0.5000  1
  O  O11  4  0.0573  0.0000  0.7405  1
  O  O12  4  0.0578  0.5000  0.7338  1
  O  O13  4  0.1872  0.0000  0.2603  1
  O  O14  4  0.1909  0.5000  0.2652  1
  O  O15  4  0.2500  0.2500  0.5000  1
]