# generated using pymatgen
data_Li4Ti3Fe5O16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.76670354
_cell_length_b   5.76670354
_cell_length_c   9.67656768
_cell_angle_alpha   89.30429150
_cell_angle_beta   89.30429150
_cell_angle_gamma   60.77897363
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Ti3Fe5O16
_chemical_formula_sum   'Li4 Ti3 Fe5 O16'
_cell_volume   280.81475765
_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  0.67056000  0.67056000  0.89189800  1
  Li  Li1  1  0.99115700  0.99115700  0.99338800  1
  Li  Li2  1  0.99492100  0.99492100  0.49602600  1
  Li  Li3  1  0.33710500  0.33710500  0.39740400  1
  Ti  Ti4  1  0.34714500  0.83784400  0.21829300  1
  Ti  Ti5  1  0.83784400  0.34714500  0.21829300  1
  Ti  Ti6  1  0.17355300  0.17355300  0.72136200  1
  Fe  Fe7  1  0.66946000  0.66946000  0.50262400  1
  Fe  Fe8  1  0.82581800  0.82581800  0.21053800  1
  Fe  Fe9  1  0.33974900  0.33974900  0.99658100  1
  Fe  Fe10  1  0.17477100  0.65639100  0.71163300  1
  Fe  Fe11  1  0.65639100  0.17477100  0.71163300  1
  O  O12  1  0.32738200  0.83217000  0.60062700  1
  O  O13  1  0.51897200  0.51897200  0.33159700  1
  O  O14  1  0.65841600  0.65841600  0.09658800  1
  O  O15  1  0.99833200  0.99833200  0.30840300  1
  O  O16  1  0.99417400  0.99417400  0.80594600  1
  O  O17  1  0.83217000  0.32738200  0.60062700  1
  O  O18  1  0.52483000  0.96629400  0.33837400  1
  O  O19  1  0.96629400  0.52483000  0.33837400  1
  O  O20  1  0.16338300  0.16338300  0.09783800  1
  O  O21  1  0.83778400  0.83778400  0.61116700  1
  O  O22  1  0.03699000  0.48516800  0.83433300  1
  O  O23  1  0.48516800  0.03699000  0.83433300  1
  O  O24  1  0.33674300  0.33674300  0.60449800  1
  O  O25  1  0.15187100  0.67173400  0.10395000  1
  O  O26  1  0.48074500  0.48074500  0.82843700  1
  O  O27  1  0.67173400  0.15187100  0.10395000  1
