data_[Li5Fe5O10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  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 [5.1369]
_cell_length_b [5.1589]
_cell_length_c [7.9194]
_cell_angle_alpha [108.7206]
_cell_angle_beta [101.8760]
_cell_angle_gamma [100.1805]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [LiFeO2]
_chemical_formula_sum '[Li5 Fe5 O10]'
_cell_volume [187.7181]
_cell_formula_units_Z [5]
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  0.2164  0.9180  0.4191  1.0
  Li  Li1  2  0.3937  0.2872  0.7793  1.0
  Li  Li2  1  0.5000  0.5000  0.5000  1.0
  Fe  Fe3  2  0.0984  0.6928  0.6854  1.0
  Fe  Fe4  2  0.3102  0.1081  0.1111  1.0
  Fe  Fe5  1  0.0000  0.5000  0.0000  1.0
  O  O6  2  0.0476  0.1025  0.8611  1.0
  O  O7  2  0.1367  0.3112  0.5460  1.0
  O  O8  2  0.2306  0.4798  0.2322  1.0
  O  O9  2  0.3395  0.7113  0.9463  1.0
  O  O10  2  0.4507  0.8974  0.6636  1.0
]