# generated using pymatgen
data_Li2TiFeO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.90037348
_cell_length_b   5.87011880
_cell_length_c   9.81212691
_cell_angle_alpha   72.65843099
_cell_angle_beta   72.53293901
_cell_angle_gamma   90.08181786
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TiFeO4
_chemical_formula_sum   'Li8 Ti4 Fe4 O16'
_cell_volume   307.89965743
_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  0.12136700  0.12379400  0.25006200  1
  Li  Li1  1  0.62148500  0.62635200  0.24982000  1
  Li  Li2  1  0.37148800  0.87624300  0.74985600  1
  Li  Li3  1  0.87142700  0.37360500  0.74999100  1
  Li  Li4  1  0.25935300  0.74753200  0.49804600  1
  Li  Li5  1  0.75798000  0.25312800  0.50099100  1
  Li  Li6  1  0.51207500  0.50080100  0.99873400  1
  Li  Li7  1  0.00532100  0.00057300  0.99869500  1
  Ti  Ti8  1  0.53429000  0.99983000  0.00001800  1
  Ti  Ti9  1  0.03310800  0.49968900  0.00004700  1
  Ti  Ti10  1  0.78344700  0.74913300  0.50119400  1
  Ti  Ti11  1  0.28455400  0.25060500  0.49898800  1
  Fe  Fe12  1  0.12028800  0.62568000  0.24679900  1
  Fe  Fe13  1  0.87089200  0.87557300  0.74672200  1
  Fe  Fe14  1  0.61712000  0.12412800  0.25358200  1
  Fe  Fe15  1  0.36698000  0.37420000  0.75352700  1
  O  O16  1  0.34066500  0.36507200  0.28304100  1
  O  O17  1  0.85586300  0.85067500  0.28361600  1
  O  O18  1  0.60619300  0.10079000  0.78197500  1
  O  O19  1  0.09082500  0.61488400  0.78426500  1
  O  O20  1  0.38780300  0.89888700  0.21838800  1
  O  O21  1  0.87518900  0.38472900  0.21606000  1
  O  O22  1  0.62365900  0.63451300  0.71766100  1
  O  O23  1  0.13916900  0.14885000  0.71711800  1
  O  O24  1  0.24388200  0.25782900  0.99929000  1
  O  O25  1  0.74219300  0.75811200  0.00228300  1
  O  O26  1  0.49386000  0.00705700  0.49931000  1
  O  O27  1  0.99274200  0.50899700  0.50249800  1
  O  O28  1  0.24342400  0.74221400  0.00073800  1
  O  O29  1  0.74466300  0.24219800  0.99784100  1
  O  O30  1  0.49536900  0.49122300  0.49780700  1
  O  O31  1  0.99332500  0.99311100  0.50103300  1
