# generated using pymatgen
data_Li2TiFeO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.00007934
_cell_length_b   8.60027877
_cell_length_c   5.99964733
_cell_angle_alpha   89.95787808
_cell_angle_beta   89.95747781
_cell_angle_gamma   90.00098422
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TiFeO4
_chemical_formula_sum   'Li8 Ti4 Fe4 O16'
_cell_volume   309.59576186
_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  0.24953400  0.24804100  0.74617100  1
  Li  Li1  1  0.75015300  0.74807500  0.24599200  1
  Li  Li2  1  0.25031900  0.24790300  0.24780300  1
  Li  Li3  1  0.74981500  0.74787400  0.74758700  1
  Li  Li4  1  0.50403300  0.48883300  0.99282200  1
  Li  Li5  1  0.99489200  0.00327600  0.50037100  1
  Li  Li6  1  0.49590000  0.98846300  0.49408900  1
  Li  Li7  1  0.00515500  0.50350400  0.99846000  1
  Ti  Ti8  1  0.47643200  0.50415600  0.49265600  1
  Ti  Ti9  1  0.02362500  0.99221400  0.00051600  1
  Ti  Ti10  1  0.52345500  0.00418900  0.99314300  1
  Ti  Ti11  1  0.97625800  0.49226000  0.49916300  1
  Fe  Fe12  1  0.25007600  0.74789100  0.24621200  1
  Fe  Fe13  1  0.75026200  0.24801700  0.24626000  1
  Fe  Fe14  1  0.74973600  0.24797900  0.74632800  1
  Fe  Fe15  1  0.24996700  0.74787600  0.74636700  1
  O  O16  1  0.49022100  0.22601700  0.99620900  1
  O  O17  1  0.01689900  0.72586000  0.49651800  1
  O  O18  1  0.50962900  0.72604100  0.49578900  1
  O  O19  1  0.98307400  0.22584400  0.99638200  1
  O  O20  1  0.51679200  0.27119700  0.49604500  1
  O  O21  1  0.99045100  0.77083200  0.99685100  1
  O  O22  1  0.48334300  0.77105500  0.99620300  1
  O  O23  1  0.00938800  0.27090100  0.49663200  1
  O  O24  1  0.24234500  0.00249700  0.76757800  1
  O  O25  1  0.75746000  0.50256800  0.26673600  1
  O  O26  1  0.24209800  0.00245200  0.22931200  1
  O  O27  1  0.75787900  0.50252200  0.72860700  1
  O  O28  1  0.74187200  0.99378700  0.76387200  1
  O  O29  1  0.25783500  0.49372300  0.26348700  1
  O  O30  1  0.74237600  0.99385000  0.22589800  1
  O  O31  1  0.25764600  0.49391000  0.72556900  1
