# generated using pymatgen
data_Li2TiMn3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.92921068
_cell_length_b   5.92921068
_cell_length_c   5.92921070
_cell_angle_alpha   60.86246935
_cell_angle_beta   60.86246935
_cell_angle_gamma   60.86246365
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TiMn3O8
_chemical_formula_sum   'Li2 Ti1 Mn3 O8'
_cell_volume   150.25863532
_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
  Li  Li0  1  0.87594400  0.87594400  0.87594400  1
  Li  Li1  1  0.12405600  0.12405600  0.12405600  1
  Ti  Ti2  1  0.50000000  0.50000000  0.50000000  1
  Mn  Mn3  1  0.50000000  0.00000000  0.50000000  1
  Mn  Mn4  1  0.00000000  0.50000000  0.50000000  1
  Mn  Mn5  1  0.50000000  0.50000000  0.00000000  1
  O  O6  1  0.70823100  0.26511100  0.26511100  1
  O  O7  1  0.26511100  0.26511100  0.70823100  1
  O  O8  1  0.26511100  0.70823100  0.26511100  1
  O  O9  1  0.25966000  0.25966000  0.25966000  1
  O  O10  1  0.74034000  0.74034000  0.74034000  1
  O  O11  1  0.73488900  0.29176900  0.73488900  1
  O  O12  1  0.29176900  0.73488900  0.73488900  1
  O  O13  1  0.73488900  0.73488900  0.29176900  1
