# generated using pymatgen
data_LiTi4O6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.21072241
_cell_length_b   2.92053100
_cell_length_c   7.69006656
_cell_angle_alpha   90.00000000
_cell_angle_beta   103.33215783
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTi4O6
_chemical_formula_sum   'Li1 Ti4 O6'
_cell_volume   113.87406816
_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  0.58846600  0.75000000  0.60026900  1
  Ti  Ti1  1  0.13287000  0.25000000  0.66635300  1
  Ti  Ti2  1  0.28246200  0.25000000  0.02222300  1
  Ti  Ti3  1  0.73622500  0.75000000  0.98549200  1
  Ti  Ti4  1  0.86878300  0.75000000  0.33875700  1
  O  O5  1  0.04957300  0.75000000  0.84732600  1
  O  O6  1  0.21982400  0.75000000  0.51493800  1
  O  O7  1  0.51086400  0.25000000  0.82616800  1
  O  O8  1  0.50612300  0.75000000  0.17052600  1
  O  O9  1  0.77072000  0.25000000  0.50405600  1
  O  O10  1  0.95908900  0.25000000  0.15782100  1
