# generated using pymatgen
data_Li2TiCrO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.96581467
_cell_length_b   10.38738796
_cell_length_c   5.96601937
_cell_angle_alpha   106.67036927
_cell_angle_beta   118.94744997
_cell_angle_gamma   90.53768561
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TiCrO4
_chemical_formula_sum   'Li8 Ti4 Cr4 O16'
_cell_volume   305.03877274
_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  0.50896200  0.99866900  0.00236500  1
  Li  Li1  1  0.99112900  0.50132100  0.99762300  1
  Li  Li2  1  0.99625500  0.99865600  0.48982800  1
  Li  Li3  1  0.50361700  0.50135800  0.50998400  1
  Li  Li4  1  0.50002000  0.99897400  0.49911700  1
  Li  Li5  1  0.99993100  0.50104500  0.50101900  1
  Li  Li6  1  0.25005000  0.75000200  0.49993800  1
  Li  Li7  1  0.75002400  0.24999500  0.50011500  1
  Ti  Ti8  1  0.24999900  0.25001200  0.00016000  1
  Ti  Ti9  1  0.74996400  0.74997700  0.99978500  1
  Ti  Ti10  1  0.00857500  0.99728000  0.98862200  1
  Ti  Ti11  1  0.49139900  0.50271800  0.01129600  1
  Cr  Cr12  1  0.75003500  0.25000500  0.00010700  1
  Cr  Cr13  1  0.25000000  0.25000500  0.50014000  1
  Cr  Cr14  1  0.25008600  0.74995700  0.99995400  1
  Cr  Cr15  1  0.75002400  0.74997000  0.49986600  1
  O  O16  1  0.36968500  0.60023900  0.23063200  1
  O  O17  1  0.88996500  0.12986600  0.24000300  1
  O  O18  1  0.62952600  0.86427200  0.23507500  1
  O  O19  1  0.11892900  0.35928400  0.24054000  1
  O  O20  1  0.38108500  0.14072400  0.75967200  1
  O  O21  1  0.87051300  0.63573300  0.76469200  1
  O  O22  1  0.60998800  0.37014400  0.76013500  1
  O  O23  1  0.13030100  0.89979800  0.76937300  1
  O  O24  1  0.35875400  0.13114000  0.24723100  1
  O  O25  1  0.85549000  0.62519700  0.23573800  1
  O  O26  1  0.38911400  0.62531400  0.76996200  1
  O  O27  1  0.88388900  0.13110500  0.77240600  1
  O  O28  1  0.61607700  0.36894000  0.22770000  1
  O  O29  1  0.11084900  0.87472200  0.23007800  1
  O  O30  1  0.64451900  0.87468900  0.76384800  1
  O  O31  1  0.14124800  0.36889000  0.75299200  1
