data_[Li4Ti4V4O20]
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
  V  1.6300  1.3500  0.7775
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [6.4117]
_cell_length_b [9.1703]
_cell_length_c [7.1931]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.5526]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [LiTiVO5]
_chemical_formula_sum '[Li4 Ti4 V4 O20]'
_cell_volume [387.7000]
_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  0.2818  0.7500  1.0
  Ti  Ti1  4  0.0000  0.0000  0.0000  1.0
  V  V2  4  0.0000  0.3029  0.2500  1.0
  O  O3  8  0.1389  0.1930  0.1338  1.0
  O  O4  8  0.1935  0.4150  0.4304  1.0
  O  O5  4  0.0000  0.0692  0.7500  1.0
]