# generated using pymatgen
data_Li2TiFeO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.98139627
_cell_length_b   6.03568018
_cell_length_c   10.46779528
_cell_angle_alpha   106.86973111
_cell_angle_beta   90.01318685
_cell_angle_gamma   119.74778951
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TiFeO4
_chemical_formula_sum   'Li8 Ti4 Fe4 O16'
_cell_volume   309.21918720
_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  0.74667800  0.99317100  0.24862700  1
  Li  Li1  1  0.24605600  0.99282300  0.74848800  1
  Li  Li2  1  0.99620500  0.49444300  0.50003400  1
  Li  Li3  1  0.50019700  0.49840300  0.00096000  1
  Li  Li4  1  0.24436300  0.49015300  0.25138300  1
  Li  Li5  1  0.74474300  0.49146400  0.75061100  1
  Li  Li6  1  0.74663300  0.49131300  0.25058300  1
  Li  Li7  1  0.24575100  0.49028000  0.75135900  1
  Ti  Ti8  1  0.47908700  0.98129600  0.48904700  1
  Ti  Ti9  1  0.01632300  0.00930200  0.00845000  1
  Ti  Ti10  1  0.99161200  0.00639100  0.50855300  1
  Ti  Ti11  1  0.50342000  0.98392100  0.98899000  1
  Fe  Fe12  1  0.74629300  0.99310000  0.74857500  1
  Fe  Fe13  1  0.99880200  0.49728400  0.99995700  1
  Fe  Fe14  1  0.24646300  0.99278300  0.24848800  1
  Fe  Fe15  1  0.49699200  0.49404000  0.49972400  1
  O  O16  1  0.12160300  0.21662700  0.38105300  1
  O  O17  1  0.61479200  0.23105100  0.88729000  1
  O  O18  1  0.61561200  0.22637800  0.38662900  1
  O  O19  1  0.09591700  0.21654400  0.88026100  1
  O  O20  1  0.87829600  0.76479500  0.11117800  1
  O  O21  1  0.39824300  0.77286900  0.61693800  1
  O  O22  1  0.37362300  0.77289100  0.11608900  1
  O  O23  1  0.88235500  0.76048200  0.61065800  1
  O  O24  1  0.63882500  0.77397700  0.38515700  1
  O  O25  1  0.13723300  0.77672700  0.88530400  1
  O  O26  1  0.35702100  0.23398000  0.11281500  1
  O  O27  1  0.87596300  0.23154600  0.61252800  1
  O  O28  1  0.13753400  0.75497400  0.38502000  1
  O  O29  1  0.61822100  0.75723400  0.88532200  1
  O  O30  1  0.85562700  0.21588900  0.11304500  1
  O  O31  1  0.35805300  0.21309800  0.61289000  1
