data_[Li2Al4Fe2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Al  1.6100  1.2500  0.6750
  Fe  1.8300  1.4000  0.8525
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [9.3834]
_cell_length_b [2.8079]
_cell_length_c [4.3044]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.0424]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [LiAl2Fe]
_chemical_formula_sum '[Li2 Al4 Fe2]'
_cell_volume [106.5421]
_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  0.2407  0.0000  0.7734  1
  Al  Al1  2  0.2631  0.5000  0.3033  1
  Al  Al2  2  0.4997  0.5000  0.9643  1
  Fe  Fe3  2  0.4966  0.0000  0.4590  1
]