# generated using pymatgen
data_Ba3LiTi3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.82542092
_cell_length_b   5.91198103
_cell_length_c   7.71586451
_cell_angle_alpha   76.71422645
_cell_angle_beta   92.54123485
_cell_angle_gamma   120.14087206
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba3LiTi3O8
_chemical_formula_sum   'Ba3 Li1 Ti3 O8'
_cell_volume   222.85493899
_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
  Ba  Ba0  1  0.05482224  0.11072403  0.05331241  1
  Ba  Ba1  1  0.29343887  0.59186794  0.62137199  1
  Ba  Ba2  1  0.67306515  0.34970041  0.31298443  1
  Li  Li3  1  0.80390475  0.63908547  0.88997947  1
  Ti  Ti4  1  0.96938436  0.96286748  0.49756246  1
  Ti  Ti5  1  0.35507340  0.70806270  0.16035824  1
  Ti  Ti6  1  0.59919214  0.18328606  0.76529866  1
  O  O7  1  0.06316657  0.64677379  0.04178934  1
  O  O8  1  0.17669957  0.36555474  0.34065754  1
  O  O9  1  0.55759007  0.11253485  0.01167625  1
  O  O10  1  0.68800323  0.85532786  0.34397665  1
  O  O11  1  0.29353033  0.05496371  0.65141750  1
  O  O12  1  0.53512717  0.61579573  0.02719842  1
  O  O13  1  0.77770371  0.55017763  0.66753099  1
  O  O14  1  0.81554544  0.07619760  0.68899366  1
