# generated using pymatgen
data_LiTi6O12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.60697700
_cell_length_b   5.86189700
_cell_length_c   7.80208921
_cell_angle_alpha   80.31734479
_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   433.11635471
_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  0.03645300  0.95794100  0.22928800  1
  Li  Li1  1  0.53645300  0.04205900  0.77071200  1
  Ti  Ti2  1  0.64554500  0.85753400  0.42444500  1
  Ti  Ti3  1  0.36247900  0.63600600  0.56633500  1
  Ti  Ti4  1  0.36693600  0.97121700  0.23634700  1
  Ti  Ti5  1  0.85471000  0.67436900  0.08653900  1
  Ti  Ti6  1  0.86693600  0.02878300  0.76365300  1
  Ti  Ti7  1  0.86247900  0.36399400  0.43366500  1
  Ti  Ti8  1  0.13680400  0.80738000  0.90061400  1
  Ti  Ti9  1  0.14554500  0.14246600  0.57555500  1
  Ti  Ti10  1  0.13683700  0.47809100  0.23796700  1
  Ti  Ti11  1  0.63680400  0.19262000  0.09938600  1
  Ti  Ti12  1  0.63683700  0.52190900  0.76203300  1
  Ti  Ti13  1  0.35471000  0.32563100  0.91346100  1
  O  O14  1  0.77183100  0.05454800  0.52781400  1
  O  O15  1  0.53444400  0.79511400  0.64868200  1
  O  O16  1  0.27183100  0.94545200  0.47218600  1
  O  O17  1  0.72602300  0.55175700  0.52533400  1
  O  O18  1  0.72892200  0.88365500  0.19192400  1
  O  O19  1  0.46443300  0.03817600  0.01246400  1
  O  O20  1  0.46574900  0.70182700  0.35094300  1
  O  O21  1  0.96443300  0.96182400  0.98753600  1
  O  O22  1  0.96476600  0.63764300  0.31233100  1
  O  O23  1  0.96574900  0.29817300  0.64905700  1
  O  O24  1  0.22602300  0.44824300  0.47466600  1
  O  O25  1  0.21651100  0.79354500  0.14651300  1
  O  O26  1  0.77169500  0.71897900  0.85554100  1
  O  O27  1  0.77543700  0.37845400  0.19307400  1
  O  O28  1  0.03507400  0.53390000  0.01680000  1
  O  O29  1  0.03585100  0.87187200  0.68571500  1
  O  O30  1  0.03444400  0.20488600  0.35131800  1
  O  O31  1  0.53507400  0.46610000  0.98320000  1
  O  O32  1  0.53585100  0.12812800  0.31428500  1
  O  O33  1  0.27169500  0.28102100  0.14445900  1
  O  O34  1  0.27543700  0.62154600  0.80692600  1
  O  O35  1  0.71651100  0.20645500  0.85348700  1
  O  O36  1  0.46476600  0.36235700  0.68766900  1
  O  O37  1  0.22892200  0.11634500  0.80807600  1
