# generated using pymatgen
data_Li2TiCr3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.96175270
_cell_length_b   10.28233932
_cell_length_c   5.96116906
_cell_angle_alpha   106.82616744
_cell_angle_beta   59.47603901
_cell_angle_gamma   90.24400983
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TiCr3O8
_chemical_formula_sum   'Li4 Ti2 Cr6 O16'
_cell_volume   296.75524293
_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  0.93641600  0.18770900  0.12318900  1
  Li  Li1  1  0.43540600  0.68766800  0.12421300  1
  Li  Li2  1  0.56458100  0.31233100  0.87581700  1
  Li  Li3  1  0.06358400  0.81229100  0.87680800  1
  Ti  Ti4  1  0.75438600  0.74999500  0.49565500  1
  Ti  Ti5  1  0.24557700  0.24999100  0.50446900  1
  Cr  Cr6  1  0.50002700  0.00001400  0.49998200  1
  Cr  Cr7  1  0.00000400  0.49999400  0.00001800  1
  Cr  Cr8  1  0.49999500  0.00002400  0.00000300  1
  Cr  Cr9  1  0.50000800  0.50001000  0.49996500  1
  Cr  Cr10  1  0.00004800  0.99994000  0.49989400  1
  Cr  Cr11  1  0.99997500  0.50000100  0.50001400  1
  O  O12  1  0.85650500  0.39559800  0.27102100  1
  O  O13  1  0.37548000  0.89565300  0.25200800  1
  O  O14  1  0.62455500  0.10435900  0.74798300  1
  O  O15  1  0.14348500  0.60439800  0.72894000  1
  O  O16  1  0.63622200  0.61894900  0.71286000  1
  O  O17  1  0.14310700  0.12360400  0.71300800  1
  O  O18  1  0.63442200  0.61962500  0.27227400  1
  O  O19  1  0.15260700  0.11968800  0.25414300  1
  O  O20  1  0.08938300  0.62365400  0.26671100  1
  O  O21  1  0.59384900  0.11904300  0.25527600  1
  O  O22  1  0.40615100  0.88098500  0.74472900  1
  O  O23  1  0.91059600  0.37634600  0.73330500  1
  O  O24  1  0.84735700  0.88032000  0.74588000  1
  O  O25  1  0.36556700  0.38038100  0.72773900  1
  O  O26  1  0.85693700  0.87638700  0.28696900  1
  O  O27  1  0.36376900  0.38104000  0.28712900  1
