data_[Li4Zn4Fe28O48]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Zn  1.6500  1.3500  0.8800
  Fe  1.8300  1.4000  0.8525
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [10.1705]
_cell_length_b [5.9180]
_cell_length_c [14.3677]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.7011]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [LiZnFe7O12]
_chemical_formula_sum '[Li4 Zn4 Fe28 O48]'
_cell_volume [864.7073]
_cell_formula_units_Z [4]
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  0.1681  0.5000  0.5834  1
  Li  Li1  2  0.4992  0.5000  0.2492  1
  Zn  Zn2  2  0.1677  0.5000  0.9588  1
  Zn  Zn3  2  0.3321  0.5000  0.7881  1
  Fe  Fe4  4  0.0836  0.2516  0.7888  1
  Fe  Fe5  4  0.2526  0.2469  0.1293  1
  Fe  Fe6  4  0.4160  0.2538  0.4585  1
  Fe  Fe7  2  0.0008  0.5000  0.1287  1
  Fe  Fe8  2  0.0031  0.0000  0.0019  1
  Fe  Fe9  2  0.0031  0.0000  0.6191  1
  Fe  Fe10  2  0.1619  0.5000  0.3340  1
  Fe  Fe11  2  0.1624  0.0000  0.4580  1
  Fe  Fe12  2  0.3309  0.0000  0.9161  1
  Fe  Fe13  2  0.3311  0.0000  0.2920  1
  Fe  Fe14  2  0.3374  0.0000  0.6650  1
  O  O15  4  0.0767  0.2217  0.5340  1
  O  O16  4  0.0913  0.2579  0.0499  1
  O  O17  4  0.2397  0.2538  0.8702  1
  O  O18  4  0.2532  0.2218  0.3817  1
  O  O19  4  0.4034  0.2265  0.2103  1
  O  O20  4  0.4317  0.2644  0.7027  1
  O  O21  2  0.0044  0.5000  0.8646  1
  O  O22  2  0.0071  0.0000  0.8649  1
  O  O23  2  0.1565  0.0000  0.7092  1
  O  O24  2  0.1565  0.5000  0.7209  1
  O  O25  2  0.1673  0.5000  0.1970  1
  O  O26  2  0.1846  0.0000  0.2025  1
  O  O27  2  0.3281  0.5000  0.0534  1
  O  O28  2  0.3311  0.0000  0.5309  1
  O  O29  2  0.3379  0.0000  0.0531  1
  O  O30  2  0.3520  0.5000  0.5352  1
  O  O31  2  0.4805  0.0000  0.3842  1
  O  O32  2  0.4998  0.5000  0.3888  1
]