# generated using pymatgen
data_Li2TiFeO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.03475306
_cell_length_b   10.35864732
_cell_length_c   6.03671680
_cell_angle_alpha   90.67416979
_cell_angle_beta   59.90555486
_cell_angle_gamma   73.91856289
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TiFeO4
_chemical_formula_sum   'Li8 Ti4 Fe4 O16'
_cell_volume   308.52642351
_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  0.00942900  0.24833500  0.74398000  1
  Li  Li1  1  0.00951100  0.74894300  0.24486300  1
  Li  Li2  1  0.50481700  0.24797700  0.24815500  1
  Li  Li3  1  0.50347300  0.74973500  0.75022300  1
  Li  Li4  1  0.51002700  0.49560100  0.99815300  1
  Li  Li5  1  0.50979600  0.99562200  0.49816800  1
  Li  Li6  1  0.51080900  0.24812100  0.75086100  1
  Li  Li7  1  0.50999300  0.74713000  0.25075300  1
  Ti  Ti8  1  0.00475100  0.49914800  0.49673000  1
  Ti  Ti9  1  0.00469300  0.99914100  0.99678800  1
  Ti  Ti10  1  0.00560300  0.24887000  0.24502300  1
  Ti  Ti11  1  0.00349000  0.74898300  0.74842100  1
  Fe  Fe12  1  0.00560300  0.99922600  0.49713000  1
  Fe  Fe13  1  0.50487600  0.99913700  0.99798800  1
  Fe  Fe14  1  0.00563100  0.49916600  0.99718900  1
  Fe  Fe15  1  0.50476200  0.49904100  0.49810100  1
  O  O16  1  0.77443100  0.36883800  0.13624800  1
  O  O17  1  0.77419700  0.87009200  0.63700300  1
  O  O18  1  0.77607200  0.11453600  0.88405000  1
  O  O19  1  0.77429600  0.61451100  0.38598300  1
  O  O20  1  0.23407300  0.38484400  0.60807200  1
  O  O21  1  0.23227800  0.88492000  0.11003000  1
  O  O22  1  0.23446500  0.12919100  0.35736700  1
  O  O23  1  0.23428100  0.63045400  0.85808800  1
  O  O24  1  0.22742500  0.12746400  0.89486100  1
  O  O25  1  0.22633100  0.62722100  0.39588900  1
  O  O26  1  0.77539300  0.12714200  0.34676300  1
  O  O27  1  0.77475500  0.62705500  0.84799400  1
  O  O28  1  0.23544400  0.37162600  0.14636700  1
  O  O29  1  0.23485200  0.87155400  0.64752700  1
  O  O30  1  0.78311000  0.37145400  0.59931300  1
  O  O31  1  0.78210300  0.87118800  0.10020300  1
