data_[Li2Mn4Fe6O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Mn  1.5500  1.4000  0.6483
  Fe  1.8300  1.4000  0.8525
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [6.0332]
_cell_length_b [6.0620]
_cell_length_c [8.4281]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [44]
_chemical_formula_structural [LiMn2Fe3O8]
_chemical_formula_sum '[Li2 Mn4 Fe6 O16]'
_cell_volume [308.2410]
_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  0.0000  0.5000  0.1323  1.0
  Mn  Mn1  4  0.0000  0.2464  0.4979  1.0
  Fe  Fe2  4  0.2474  0.0000  0.2514  1.0
  Fe  Fe3  2  0.0000  0.0000  0.8708  1.0
  O  O4  4  0.0000  0.2283  0.2690  1.0
  O  O5  4  0.0000  0.2720  0.7307  1.0
  O  O6  4  0.2249  0.5000  0.5081  1.0
  O  O7  4  0.2253  0.0000  0.4914  1.0
]