# generated using pymatgen
data_Li2TiFeO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.34908141
_cell_length_b   5.87102424
_cell_length_c   9.90744095
_cell_angle_alpha   92.13690977
_cell_angle_beta   96.83492712
_cell_angle_gamma   88.63013202
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TiFeO4
_chemical_formula_sum   'Li8 Ti4 Fe4 O16'
_cell_volume   308.65359715
_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  0.25421400  0.75617300  0.24849300  1
  Li  Li1  1  0.00076800  0.25245300  0.49828700  1
  Li  Li2  1  0.75292400  0.74704700  0.74962000  1
  Li  Li3  1  0.50430900  0.24790700  0.99858300  1
  Li  Li4  1  0.70897000  0.49595600  0.24321400  1
  Li  Li5  1  0.43993600  0.99503200  0.48612600  1
  Li  Li6  1  0.19600700  0.49381300  0.73914300  1
  Li  Li7  1  0.97976200  0.99835900  0.99651100  1
  Ti  Ti8  1  0.49473800  0.48998200  0.52152700  1
  Ti  Ti9  1  0.24450700  0.98797700  0.77020600  1
  Ti  Ti10  1  0.99165900  0.49273600  0.01771100  1
  Ti  Ti11  1  0.74317100  0.99430100  0.27038300  1
  Fe  Fe12  1  0.74636600  0.24283500  0.74450800  1
  Fe  Fe13  1  0.50992700  0.74684400  0.00072900  1
  Fe  Fe14  1  0.99535600  0.75329700  0.49551200  1
  Fe  Fe15  1  0.24986400  0.25929700  0.24602100  1
  O  O16  1  0.08846600  0.00517100  0.35750500  1
  O  O17  1  0.83917600  0.50074200  0.60776600  1
  O  O18  1  0.58801400  0.99105900  0.86038000  1
  O  O19  1  0.34291800  0.51003300  0.10434600  1
  O  O20  1  0.19026100  0.50695400  0.38990300  1
  O  O21  1  0.93774800  0.99998400  0.64014900  1
  O  O22  1  0.69822900  0.49412100  0.88636200  1
  O  O23  1  0.43769300  0.01261200  0.14260200  1
  O  O24  1  0.63223400  0.76219700  0.37044000  1
  O  O25  1  0.38158000  0.25847400  0.62173200  1
  O  O26  1  0.13474600  0.75889300  0.87156100  1
  O  O27  1  0.88600100  0.26335300  0.12207300  1
  O  O28  1  0.63256800  0.24856800  0.37566400  1
  O  O29  1  0.37996000  0.74404600  0.62429200  1
  O  O30  1  0.13557800  0.24122000  0.87497400  1
  O  O31  1  0.88235100  0.74857000  0.12367600  1
