# generated using pymatgen
data_Li2TiMnO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.36296938
_cell_length_b   6.01509355
_cell_length_c   10.34608259
_cell_angle_alpha   73.09815144
_cell_angle_beta   80.78288403
_cell_angle_gamma   89.99897516
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TiMnO4
_chemical_formula_sum   'Li8 Ti4 Mn4 O16'
_cell_volume   314.82892238
_cell_formula_units_Z   4
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  0.75000000  0.50000000  1
  Li  Li1  1  0.50000000  0.25000000  0.50000000  1
  Li  Li2  1  0.00000000  0.49999600  0.00000000  1
  Li  Li3  1  0.00000000  0.00000400  0.00000000  1
  Li  Li4  1  0.50000000  0.25000000  0.00000000  1
  Li  Li5  1  0.50000000  0.75000000  0.00000000  1
  Li  Li6  1  0.00000000  0.00000000  0.50000000  1
  Li  Li7  1  0.00000000  0.50000000  0.50000000  1
  Ti  Ti8  1  0.24999600  0.37499800  0.25000400  1
  Ti  Ti9  1  0.24999700  0.87499900  0.25000300  1
  Ti  Ti10  1  0.75000400  0.12500200  0.74999700  1
  Ti  Ti11  1  0.75000400  0.62500100  0.74999700  1
  Mn  Mn12  1  0.24997900  0.87499800  0.75000200  1
  Mn  Mn13  1  0.75001500  0.62500500  0.24998900  1
  Mn  Mn14  1  0.24999700  0.37500500  0.74999900  1
  Mn  Mn15  1  0.75000600  0.12499500  0.25000500  1
  O  O16  1  0.41265500  0.56887100  0.86222100  1
  O  O17  1  0.41265500  0.06888700  0.86222200  1
  O  O18  1  0.91266000  0.31887400  0.36221700  1
  O  O19  1  0.91266000  0.81889000  0.36221800  1
  O  O20  1  0.08734000  0.18112700  0.63778300  1
  O  O21  1  0.08733900  0.68110800  0.63778300  1
  O  O22  1  0.58734500  0.93112900  0.13777900  1
  O  O23  1  0.58734400  0.43111200  0.13777800  1
  O  O24  1  0.35631100  0.06660300  0.36675500  1
  O  O25  1  0.35629600  0.56660200  0.36675700  1
  O  O26  1  0.85629400  0.81660100  0.86675800  1
  O  O27  1  0.85631100  0.31660300  0.86675500  1
  O  O28  1  0.14370600  0.68339800  0.13324200  1
  O  O29  1  0.14368900  0.18339700  0.13324500  1
  O  O30  1  0.64368900  0.43339600  0.63324600  1
  O  O31  1  0.64370500  0.93339800  0.63324300  1
