# generated using pymatgen
data_Li4Ti3Fe2Ni3O16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.87625537
_cell_length_b   5.87625537
_cell_length_c   9.54771771
_cell_angle_alpha   87.31808621
_cell_angle_beta   87.31808621
_cell_angle_gamma   59.01569364
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Ti3Fe2Ni3O16
_chemical_formula_sum   'Li4 Ti3 Fe2 Ni3 O16'
_cell_volume   282.23399831
_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  0.66921800  0.66921800  0.10417900  1
  Li  Li1  1  0.98373100  0.98373100  0.00842500  1
  Li  Li2  1  0.99259500  0.99259500  0.50442800  1
  Li  Li3  1  0.34045000  0.34045000  0.60112400  1
  Ti  Ti4  1  0.34080600  0.83823200  0.78259400  1
  Ti  Ti5  1  0.83823200  0.34080600  0.78259400  1
  Ti  Ti6  1  0.16783100  0.16783100  0.29000800  1
  Fe  Fe7  1  0.66947300  0.66947300  0.50525800  1
  Fe  Fe8  1  0.33424600  0.33424600  0.01652800  1
  Ni  Ni9  1  0.82718200  0.82718200  0.79191700  1
  Ni  Ni10  1  0.16992800  0.66392600  0.28598300  1
  Ni  Ni11  1  0.66392600  0.16992800  0.28598300  1
  O  O12  1  0.33536600  0.85265600  0.40161700  1
  O  O13  1  0.51939300  0.51939300  0.66497000  1
  O  O14  1  0.65791500  0.65791500  0.89658700  1
  O  O15  1  0.99562400  0.99562400  0.69405200  1
  O  O16  1  0.00157200  0.00157200  0.19281000  1
  O  O17  1  0.85265600  0.33536600  0.40161700  1
  O  O18  1  0.50692900  0.96643500  0.65908100  1
  O  O19  1  0.96643500  0.50692900  0.65908100  1
  O  O20  1  0.15677500  0.15677500  0.89680900  1
  O  O21  1  0.84246300  0.84246300  0.39672700  1
  O  O22  1  0.04237800  0.47384000  0.15094500  1
  O  O23  1  0.47384000  0.04237800  0.15094500  1
  O  O24  1  0.33684800  0.33684800  0.38793000  1
  O  O25  1  0.17312500  0.65986000  0.90558500  1
  O  O26  1  0.48401500  0.48401500  0.16883700  1
  O  O27  1  0.65986000  0.17312500  0.90558500  1
