# generated using pymatgen
data_LiTi6O12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.94244400
_cell_length_b   4.93399900
_cell_length_c   14.24322429
_cell_angle_alpha   87.90258655
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTi6O12
_chemical_formula_sum   'Li2 Ti12 O24'
_cell_volume   417.33173777
_cell_formula_units_Z   2
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  0.12477100  0.93164600  0.21904000  1
  Li  Li1  1  0.87522900  0.93164600  0.71904000  1
  Ti  Ti2  1  0.87112200  0.47388300  0.15446200  1
  Ti  Ti3  1  0.37873500  0.47492800  0.15377700  1
  Ti  Ti4  1  0.62126500  0.47492800  0.65377700  1
  Ti  Ti5  1  0.12887800  0.47388300  0.65446200  1
  Ti  Ti6  1  0.62458700  0.53916400  0.34000400  1
  Ti  Ti7  1  0.12603900  0.50114600  0.35074500  1
  Ti  Ti8  1  0.87396100  0.50114600  0.85074500  1
  Ti  Ti9  1  0.37541300  0.53916400  0.84000400  1
  Ti  Ti10  1  0.87469600  0.99847900  0.49652600  1
  Ti  Ti11  1  0.37555900  0.00043700  0.50061000  1
  Ti  Ti12  1  0.62444100  0.00043700  0.00061000  1
  Ti  Ti13  1  0.12530400  0.99847900  0.99652600  1
  O  O14  1  0.37236900  0.18304700  0.06699400  1
  O  O15  1  0.87776100  0.18501400  0.06601200  1
  O  O16  1  0.62763100  0.18304700  0.56699400  1
  O  O17  1  0.12223900  0.18501400  0.56601200  1
  O  O18  1  0.62482200  0.30922200  0.22529100  1
  O  O19  1  0.12516000  0.30088900  0.22691400  1
  O  O20  1  0.86993200  0.31096400  0.40289800  1
  O  O21  1  0.38000100  0.31070600  0.40316700  1
  O  O22  1  0.37517800  0.30922200  0.72529100  1
  O  O23  1  0.87484000  0.30088900  0.72691400  1
  O  O24  1  0.61999900  0.31070600  0.90316700  1
  O  O25  1  0.13006800  0.31096400  0.90289800  1
  O  O26  1  0.62542000  0.68777000  0.09556900  1
  O  O27  1  0.12484900  0.70473000  0.10285600  1
  O  O28  1  0.88215200  0.69969000  0.27345100  1
  O  O29  1  0.36756400  0.69995200  0.27341900  1
  O  O30  1  0.87515100  0.70473000  0.60285600  1
  O  O31  1  0.37458000  0.68777000  0.59556900  1
  O  O32  1  0.63243600  0.69995200  0.77341900  1
  O  O33  1  0.11784800  0.69969000  0.77345100  1
  O  O34  1  0.62484100  0.81468600  0.43453500  1
  O  O35  1  0.12489500  0.81264700  0.43413000  1
  O  O36  1  0.87510500  0.81264700  0.93413000  1
  O  O37  1  0.37515900  0.81468600  0.93453500  1
