data_[Li4Ti8V4O24]
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 [P2_1/c]
_cell_length_a [9.9453]
_cell_length_b [8.9705]
_cell_length_c [5.6331]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.7159]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [LiTi2VO6]
_chemical_formula_sum '[Li4 Ti8 V4 O24]'
_cell_volume [488.2182]
_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  0.2404  0.0088  0.9631  1
  Ti  Ti1  4  0.0544  0.1576  0.3283  1
  Ti  Ti2  4  0.4519  0.1555  0.7357  1
  V  V3  4  0.2486  0.6647  0.9528  1
  O  O4  4  0.1127  0.1872  0.6599  1
  O  O5  4  0.1305  0.5095  0.7485  1
  O  O6  4  0.1378  0.6649  0.2405  1
  O  O7  4  0.3558  0.6668  0.6705  1
  O  O8  4  0.3805  0.5221  0.1432  1
  O  O9  4  0.3844  0.1981  0.0050  1
]