# generated using pymatgen
data_LiTi4O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.97441000
_cell_length_b   5.06662600
_cell_length_c   9.63663846
_cell_angle_alpha   88.88323504
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTi4O8
_chemical_formula_sum   'Li1 Ti4 O8'
_cell_volume   145.19870551
_cell_formula_units_Z   1
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  1  0.50000000  0.06546100  0.46488900  1
  Ti  Ti1  1  0.00000000  0.96148200  0.86140700  1
  Ti  Ti2  1  0.00000000  0.53492900  0.35648700  1
  Ti  Ti3  1  0.50000000  0.47377600  0.64425500  1
  Ti  Ti4  1  0.50000000  0.04153500  0.13291700  1
  O  O5  1  0.00000000  0.83006500  0.22879200  1
  O  O6  1  0.50000000  0.80786500  0.96468900  1
  O  O7  1  0.50000000  0.69720700  0.46756600  1
  O  O8  1  0.00000000  0.67839300  0.72642500  1
  O  O9  1  0.50000000  0.30825000  0.28247100  1
  O  O10  1  0.00000000  0.29101600  0.53232700  1
  O  O11  1  0.00000000  0.19874200  0.03541100  1
  O  O12  1  0.50000000  0.17227900  0.77186300  1
