# generated using pymatgen
data_Li5Ti2Fe5O12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.25683809
_cell_length_b   5.25683809
_cell_length_c   10.03032960
_cell_angle_alpha   84.38751432
_cell_angle_beta   84.38751432
_cell_angle_gamma   121.16062706
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Ti2Fe5O12
_chemical_formula_sum   'Li5 Ti2 Fe5 O12'
_cell_volume   232.44099709
_cell_formula_units_Z   1
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  0.83426100  0.66997800  0.75357600  1
  Li  Li1  1  0.67259000  0.83300600  0.24481100  1
  Li  Li2  1  0.33002200  0.16573900  0.24642400  1
  Li  Li3  1  0.16699400  0.32741000  0.75518900  1
  Li  Li4  1  0.07953100  0.92046900  0.00000000  1
  Ti  Ti5  1  0.74774900  0.25225100  0.00000000  1
  Ti  Ti6  1  0.25356200  0.74643800  0.50000000  1
  Fe  Fe7  1  0.92250800  0.07749200  0.50000000  1
  Fe  Fe8  1  0.99609600  0.50485300  0.24811200  1
  Fe  Fe9  1  0.49514700  0.00390400  0.75188800  1
  Fe  Fe10  1  0.58076000  0.41924000  0.50000000  1
  Fe  Fe11  1  0.41879300  0.58120700  0.00000000  1
  O  O12  1  0.03073800  0.22532900  0.11419300  1
  O  O13  1  0.77467100  0.96926200  0.88580700  1
  O  O14  1  0.88308500  0.38074100  0.61791400  1
  O  O15  1  0.61925900  0.11691500  0.38208600  1
  O  O16  1  0.69266900  0.51727500  0.11375500  1
  O  O17  1  0.48272500  0.30733100  0.88624500  1
  O  O18  1  0.50910600  0.69951200  0.61845700  1
  O  O19  1  0.30048800  0.49089400  0.38154300  1
  O  O20  1  0.39529100  0.87901700  0.11443700  1
  O  O21  1  0.12098300  0.60470900  0.88556300  1
  O  O22  1  0.19989100  0.00692200  0.62020500  1
  O  O23  1  0.99307800  0.80010900  0.37979500  1
