# generated using pymatgen
data_LiTi4O6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.15500046
_cell_length_b   2.91392400
_cell_length_c   8.04677925
_cell_angle_alpha   90.00000000
_cell_angle_beta   108.45375819
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTi4O6
_chemical_formula_sum   'Li1 Ti4 O6'
_cell_volume   114.65756672
_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  0.43286200  0.25000000  0.44596900  1
  Ti  Ti1  1  0.17629500  0.25000000  0.69822900  1
  Ti  Ti2  1  0.26481200  0.25000000  0.04236400  1
  Ti  Ti3  1  0.80863200  0.75000000  0.01307600  1
  Ti  Ti4  1  0.89534500  0.75000000  0.36083700  1
  O  O5  1  0.06792400  0.75000000  0.85413100  1
  O  O6  1  0.27075100  0.75000000  0.54288100  1
  O  O7  1  0.53849000  0.25000000  0.88471900  1
  O  O8  1  0.52873200  0.75000000  0.18333500  1
  O  O9  1  0.81457000  0.25000000  0.50811800  1
  O  O10  1  0.01408800  0.25000000  0.20741100  1
