# generated using pymatgen
data_Li2Ti3CrO8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.89554411
_cell_length_b   5.89554411
_cell_length_c   9.64688900
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000123
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Ti3CrO8
_chemical_formula_sum   'Li4 Ti6 Cr2 O16'
_cell_volume   290.37932666
_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  0.33333300  0.66666700  0.89218500  1
  Li  Li1  1  0.00000000  0.00000000  0.99660000  1
  Li  Li2  1  0.00000000  0.00000000  0.49660000  1
  Li  Li3  1  0.66666700  0.33333300  0.39218500  1
  Ti  Ti4  1  0.16905600  0.83094400  0.21348100  1
  Ti  Ti5  1  0.16905600  0.33811100  0.21348100  1
  Ti  Ti6  1  0.66188900  0.83094400  0.21348100  1
  Ti  Ti7  1  0.33811100  0.16905600  0.71348100  1
  Ti  Ti8  1  0.83094400  0.66188900  0.71348100  1
  Ti  Ti9  1  0.83094400  0.16905600  0.71348100  1
  Cr  Cr10  1  0.33333300  0.66666700  0.48403900  1
  Cr  Cr11  1  0.66666700  0.33333300  0.98403900  1
  O  O12  1  0.16353800  0.83646200  0.60351200  1
  O  O13  1  0.03991000  0.51995500  0.33835800  1
  O  O14  1  0.33333300  0.66666700  0.10290100  1
  O  O15  1  0.00000000  0.00000000  0.31220700  1
  O  O16  1  0.00000000  0.00000000  0.81220700  1
  O  O17  1  0.16353800  0.32707500  0.60351200  1
  O  O18  1  0.48004500  0.96009000  0.33835800  1
  O  O19  1  0.48004500  0.51995500  0.33835800  1
  O  O20  1  0.32707500  0.16353800  0.10351200  1
  O  O21  1  0.67292500  0.83646200  0.60351200  1
  O  O22  1  0.51995500  0.48004500  0.83835800  1
  O  O23  1  0.51995500  0.03991000  0.83835800  1
  O  O24  1  0.66666700  0.33333300  0.60290100  1
  O  O25  1  0.83646200  0.67292500  0.10351200  1
  O  O26  1  0.96009000  0.48004500  0.83835800  1
  O  O27  1  0.83646200  0.16353800  0.10351200  1
