# generated using pymatgen
data_Li2TiFeO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.32595615
_cell_length_b   9.79397019
_cell_length_c   7.81339747
_cell_angle_alpha   101.84494685
_cell_angle_beta   73.80185911
_cell_angle_gamma   89.97562211
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TiFeO4
_chemical_formula_sum   'Li8 Ti4 Fe4 O16'
_cell_volume   310.54314165
_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  0.30995600  0.43915900  0.37328900  1
  Li  Li1  1  0.05153700  0.68887000  0.87155700  1
  Li  Li2  1  0.81577000  0.93838300  0.37299500  1
  Li  Li3  1  0.56566100  0.18687400  0.87476600  1
  Li  Li4  1  0.75869800  0.22221100  0.52145700  1
  Li  Li5  1  0.50905400  0.47430200  0.01896500  1
  Li  Li6  1  0.24239500  0.72549900  0.51694200  1
  Li  Li7  1  0.98615700  0.97536100  0.01825500  1
  Ti  Ti8  1  0.92209700  0.63713000  0.25141500  1
  Ti  Ti9  1  0.57538600  0.88623600  0.75250800  1
  Ti  Ti10  1  0.41855000  0.13733200  0.25463700  1
  Ti  Ti11  1  0.17304100  0.38636500  0.75358100  1
  Fe  Fe12  1  0.68514500  0.55953200  0.62372900  1
  Fe  Fe13  1  0.43366900  0.81041900  0.12481900  1
  Fe  Fe14  1  0.18584200  0.05902500  0.62481000  1
  Fe  Fe15  1  0.93174200  0.30980300  0.12618700  1
  O  O16  1  0.17626400  0.54226900  0.63451500  1
  O  O17  1  0.92511300  0.79336700  0.13416800  1
  O  O18  1  0.68480200  0.04321100  0.63458900  1
  O  O19  1  0.42199400  0.29278400  0.13617200  1
  O  O20  1  0.81042500  0.46874300  0.35053900  1
  O  O21  1  0.58295300  0.71772700  0.85090400  1
  O  O22  1  0.31141000  0.96765600  0.35141100  1
  O  O23  1  0.06241200  0.21768700  0.85194400  1
  O  O24  1  0.35177500  0.62823900  0.24830700  1
  O  O25  1  0.14912100  0.87759300  0.74842500  1
  O  O26  1  0.84845500  0.12807900  0.25017700  1
  O  O27  1  0.60257400  0.37748800  0.74881600  1
  O  O28  1  0.00278800  0.50227100  0.99518500  1
  O  O29  1  0.75662100  0.75256900  0.49437400  1
  O  O30  1  0.50013600  0.00185500  0.99471900  1
  O  O31  1  0.24845700  0.25196000  0.49584200  1
