# generated using pymatgen
data_Li3TiMn3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.02580936
_cell_length_b   8.53072873
_cell_length_c   6.04655353
_cell_angle_alpha   89.05386435
_cell_angle_beta   93.94350601
_cell_angle_gamma   89.48973164
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3TiMn3O8
_chemical_formula_sum   'Li6 Ti2 Mn6 O16'
_cell_volume   310.02643159
_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  0.74939300  0.75044300  0.24955300  1
  Li  Li1  1  0.25056700  0.24956400  0.75040600  1
  Li  Li2  1  0.00000700  0.49996500  0.49999200  1
  Li  Li3  1  0.49999000  0.99998600  0.99997900  1
  Li  Li4  1  0.25031000  0.24942700  0.24984600  1
  Li  Li5  1  0.74960700  0.75059200  0.75016400  1
  Ti  Ti6  1  0.99994900  0.99999400  0.99997400  1
  Ti  Ti7  1  0.49993300  0.49997700  0.50003600  1
  Mn  Mn8  1  0.74987500  0.25116700  0.24887200  1
  Mn  Mn9  1  0.25015800  0.74881900  0.75110600  1
  Mn  Mn10  1  0.00004900  0.99982700  0.49993700  1
  Mn  Mn11  1  0.50006000  0.49999100  0.00019600  1
  Mn  Mn12  1  0.24978100  0.75073000  0.25048200  1
  Mn  Mn13  1  0.75035200  0.24943200  0.74959200  1
  O  O14  1  0.50836600  0.26621200  0.01988900  1
  O  O15  1  0.00896000  0.76696200  0.52172200  1
  O  O16  1  0.99103100  0.23304600  0.47816500  1
  O  O17  1  0.49161900  0.73376000  0.98012500  1
  O  O18  1  0.25525000  0.51920000  0.27356000  1
  O  O19  1  0.75449200  0.01855600  0.77420400  1
  O  O20  1  0.24554500  0.98140600  0.22589000  1
  O  O21  1  0.74464700  0.48089200  0.72646400  1
  O  O22  1  0.52913300  0.26597600  0.48991800  1
  O  O23  1  0.02931300  0.76580200  0.99039500  1
  O  O24  1  0.97070400  0.23419100  0.00957600  1
  O  O25  1  0.47089000  0.73406100  0.51006400  1
  O  O26  1  0.79124200  0.98828800  0.23804000  1
  O  O27  1  0.29093700  0.48853600  0.73861500  1
  O  O28  1  0.70916100  0.51148300  0.26132000  1
  O  O29  1  0.20868900  0.01171700  0.76191900  1
