# generated using pymatgen
data_Li3Ti8O16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.98881100
_cell_length_b   8.46578600
_cell_length_c   11.97036700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Ti8O16
_chemical_formula_sum   'Li6 Ti16 O32'
_cell_volume   606.89751497
_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  0.50000000  0.12379900  0.00000000  1
  Li  Li1  1  0.00000000  0.62588000  0.24889600  1
  Li  Li2  1  0.00000000  0.62588000  0.75110400  1
  Li  Li3  1  0.50000000  0.37412000  0.25110400  1
  Li  Li4  1  0.00000000  0.87620100  0.50000000  1
  Li  Li5  1  0.50000000  0.37412000  0.74889600  1
  Ti  Ti6  1  0.00000000  0.24481300  0.12433600  1
  Ti  Ti7  1  0.24827100  0.50387800  0.00000000  1
  Ti  Ti8  1  0.50000000  0.75097900  0.12306200  1
  Ti  Ti9  1  0.50000000  0.75518700  0.37566400  1
  Ti  Ti10  1  0.75000000  0.00000000  0.25000000  1
  Ti  Ti11  1  0.00000000  0.24902100  0.37693800  1
  Ti  Ti12  1  0.00000000  0.24902100  0.62306200  1
  Ti  Ti13  1  0.25000000  0.00000000  0.25000000  1
  Ti  Ti14  1  0.25172900  0.49612200  0.50000000  1
  Ti  Ti15  1  0.50000000  0.75518700  0.62433600  1
  Ti  Ti16  1  0.50000000  0.75097900  0.87693800  1
  Ti  Ti17  1  0.74827100  0.49612200  0.50000000  1
  Ti  Ti18  1  0.75000000  0.00000000  0.75000000  1
  Ti  Ti19  1  0.00000000  0.24481300  0.87566400  1
  Ti  Ti20  1  0.25000000  0.00000000  0.75000000  1
  Ti  Ti21  1  0.75172900  0.50387800  0.00000000  1
  O  O22  1  0.00000000  0.48619700  0.11202000  1
  O  O23  1  0.28092600  0.73327600  0.00000000  1
  O  O24  1  0.27584600  0.76256400  0.25026900  1
  O  O25  1  0.50000000  0.51228500  0.11261500  1
  O  O26  1  0.50000000  0.98771800  0.13766600  1
  O  O27  1  0.50000000  0.98384700  0.35842600  1
  O  O28  1  0.71907400  0.73327600  0.00000000  1
  O  O29  1  0.72415400  0.76256400  0.25026900  1
  O  O30  1  0.77584600  0.23743600  0.24973100  1
  O  O31  1  0.78092600  0.26672400  0.50000000  1
  O  O32  1  0.00000000  0.01615300  0.14157400  1
  O  O33  1  0.00000000  0.48771500  0.61261500  1
  O  O34  1  0.00000000  0.01228200  0.36233400  1
  O  O35  1  0.00000000  0.48771500  0.38738500  1
  O  O36  1  0.22415400  0.23743600  0.24973100  1
  O  O37  1  0.21907400  0.26672400  0.50000000  1
  O  O38  1  0.27574900  0.73663600  0.50000000  1
  O  O39  1  0.27584600  0.76256400  0.74973100  1
  O  O40  1  0.50000000  0.51380300  0.38798000  1
  O  O41  1  0.50000000  0.51380300  0.61202000  1
  O  O42  1  0.50000000  0.98771800  0.86233400  1
  O  O43  1  0.50000000  0.98384700  0.64157400  1
  O  O44  1  0.72425100  0.73663600  0.50000000  1
  O  O45  1  0.72415400  0.76256400  0.74973100  1
  O  O46  1  0.77584600  0.23743600  0.75026900  1
  O  O47  1  0.77574900  0.26336400  0.00000000  1
  O  O48  1  0.00000000  0.01228200  0.63766600  1
  O  O49  1  0.00000000  0.01615300  0.85842600  1
  O  O50  1  0.00000000  0.48619700  0.88798000  1
  O  O51  1  0.22415400  0.23743600  0.75026900  1
  O  O52  1  0.22425100  0.26336400  0.00000000  1
  O  O53  1  0.50000000  0.51228500  0.88738500  1
