data_[Li1Al2Fe1Rh4]
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
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.2172]
_cell_length_b [4.2172]
_cell_length_c [5.9559]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [123]
_chemical_formula_structural [LiAl2FeRh4]
_chemical_formula_sum '[Li1 Al2 Fe1 Rh4]'
_cell_volume [105.9250]
_cell_formula_units_Z [1]
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  1  0.5000  0.5000  0.5000  1
  Al  Al1  1  0.0000  0.0000  0.5000  1
  Al  Al2  1  0.5000  0.5000  0.0000  1
  Fe  Fe3  1  0.0000  0.0000  0.0000  1
  Rh  Rh4  4  0.0000  0.5000  0.2486  1
]