# generated using pymatgen
data_LiTi2O4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.93692474
_cell_length_b   5.93691552
_cell_length_c   5.93689500
_cell_angle_alpha   59.99713731
_cell_angle_beta   59.99711996
_cell_angle_gamma   59.99702320
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTi2O4
_chemical_formula_sum   'Li2 Ti4 O8'
_cell_volume   147.95790138
_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  0.12497984  0.12498084  0.12498084  1
  Li  Li1  1  0.87502016  0.87501916  0.87501916  1
  Ti  Ti2  1  0.50000000  0.50000000  0.50000000  1
  Ti  Ti3  1  0.50000000  0.00000000  0.50000000  1
  Ti  Ti4  1  -0.00000000  0.50000000  0.50000000  1
  Ti  Ti5  1  0.50000000  0.50000000  0.00000000  1
  O  O6  1  0.26221616  0.26221316  0.71331573  1
  O  O7  1  0.73776383  0.73776683  0.73776383  1
  O  O8  1  0.73778384  0.73778684  0.28668427  1
  O  O9  1  0.26221616  0.71331673  0.26221416  1
  O  O10  1  0.26223617  0.26223317  0.26223617  1
  O  O11  1  0.28668427  0.73778384  0.73778484  1
  O  O12  1  0.73778384  0.28668327  0.73778584  1
  O  O13  1  0.71331573  0.26221616  0.26221516  1
