data_[Li4Ti2Fe4O10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ti  1.5400  1.4000  0.8517
  Fe  1.8300  1.4000  0.8525
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [4.3840]
_cell_length_b [5.0680]
_cell_length_c [9.5617]
_cell_angle_alpha [92.4542]
_cell_angle_beta [90.0429]
_cell_angle_gamma [115.5009]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Li2TiFe2O5]
_chemical_formula_sum '[Li4 Ti2 Fe4 O10]'
_cell_volume [191.5267]
_cell_formula_units_Z [2]
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  2  0.0910  0.6966  0.2986  1.0
  Li  Li1  2  0.3151  0.1058  0.9012  1.0
  Ti  Ti2  2  0.3522  0.2887  0.1944  1.0
  Fe  Fe3  2  0.2087  0.9166  0.6039  1.0
  Fe  Fe4  1  0.0000  0.5000  0.0000  1.0
  Fe  Fe5  1  0.5000  0.5000  0.5000  1.0
  O  O6  2  0.0715  0.7025  0.8040  1.0
  O  O7  2  0.2202  0.9240  0.1013  1.0
  O  O8  2  0.3059  0.1026  0.3790  1.0
  O  O9  2  0.4016  0.3239  0.7089  1.0
  O  O10  1  0.0000  0.5000  0.5000  1.0
  O  O11  1  0.5000  0.5000  0.0000  1.0
]