# generated using pymatgen
data_Li3TiMn2O6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.91530529
_cell_length_b   6.57356888
_cell_length_c   7.17238499
_cell_angle_alpha   105.84506705
_cell_angle_beta   77.90711571
_cell_angle_gamma   116.37041390
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3TiMn2O6
_chemical_formula_sum   'Li6 Ti2 Mn4 O12'
_cell_volume   239.11736273
_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  0.58339400  0.83287000  0.33211200  1
  Li  Li1  1  0.08345200  0.83298200  0.33236400  1
  Li  Li2  1  0.25648000  0.51540200  0.02271800  1
  Li  Li3  1  0.74629100  0.51150300  0.02629100  1
  Li  Li4  1  0.91006000  0.15085600  0.64373100  1
  Li  Li5  1  0.42048200  0.15482900  0.64014900  1
  Ti  Ti6  1  0.83511100  0.33604400  0.33248500  1
  Ti  Ti7  1  0.33136000  0.33080800  0.33459000  1
  Mn  Mn8  1  0.49962200  0.99342400  0.00403800  1
  Mn  Mn9  1  0.16329600  0.67124500  0.68337500  1
  Mn  Mn10  1  0.00354100  0.99556000  0.98332600  1
  Mn  Mn11  1  0.66668200  0.67334200  0.66285000  1
  O  O12  1  0.85062900  0.25023200  0.04467000  1
  O  O13  1  0.37948800  0.24652400  0.04323300  1
  O  O14  1  0.31644400  0.41660300  0.62207200  1
  O  O15  1  0.78693200  0.42041600  0.62362800  1
  O  O16  1  0.55067800  0.91002800  0.66983200  1
  O  O17  1  0.01875300  0.90800700  0.66519200  1
  O  O18  1  0.61603400  0.75707100  0.99776900  1
  O  O19  1  0.14780900  0.75889900  0.00211700  1
  O  O20  1  0.19594100  0.55548700  0.32498700  1
  O  O21  1  0.69815700  0.56336800  0.32767500  1
  O  O22  1  0.97067300  0.11105100  0.34160100  1
  O  O23  1  0.46868600  0.10344500  0.33920100  1
