# generated using pymatgen
data_Li4Ti3Mn2Fe3O16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.96919044
_cell_length_b   5.96919044
_cell_length_c   9.59785017
_cell_angle_alpha   88.18364721
_cell_angle_beta   88.18364721
_cell_angle_gamma   59.31050974
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Ti3Mn2Fe3O16
_chemical_formula_sum   'Li4 Ti3 Mn2 Fe3 O16'
_cell_volume   293.89141770
_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  0.66776800  0.66776800  0.10742600  1
  Li  Li1  1  0.98818500  0.98818500  0.01111000  1
  Li  Li2  1  0.99747000  0.99747000  0.50170900  1
  Li  Li3  1  0.33401200  0.33401200  0.60030500  1
  Ti  Ti4  1  0.33167000  0.83134900  0.78617300  1
  Ti  Ti5  1  0.83134900  0.33167000  0.78617300  1
  Ti  Ti6  1  0.17693600  0.17693600  0.28406300  1
  Mn  Mn7  1  0.66931400  0.66931400  0.51381100  1
  Mn  Mn8  1  0.33765700  0.33765700  0.01709700  1
  Fe  Fe9  1  0.82730300  0.82730300  0.78550600  1
  Fe  Fe10  1  0.18104400  0.66263700  0.28984900  1
  Fe  Fe11  1  0.66263700  0.18104400  0.28984900  1
  O  O12  1  0.34170500  0.83729100  0.40391200  1
  O  O13  1  0.52100200  0.52100200  0.65807900  1
  O  O14  1  0.65568600  0.65568600  0.89404900  1
  O  O15  1  0.99993300  0.99993300  0.68721600  1
  O  O16  1  0.00964800  0.00964800  0.19751700  1
  O  O17  1  0.83729100  0.34170500  0.40391200  1
  O  O18  1  0.51505300  0.95453300  0.65601700  1
  O  O19  1  0.95453300  0.51505300  0.65601700  1
  O  O20  1  0.15380300  0.15380300  0.88868200  1
  O  O21  1  0.83323600  0.83323600  0.40473500  1
  O  O22  1  0.04540400  0.47817700  0.15618100  1
  O  O23  1  0.47817700  0.04540400  0.15618100  1
  O  O24  1  0.32625700  0.32625700  0.39840100  1
  O  O25  1  0.16601700  0.66683500  0.89604400  1
  O  O26  1  0.48960900  0.48960900  0.16610500  1
  O  O27  1  0.66683500  0.16601700  0.89604400  1
