data_[Li6Cd3Fe3Cl18]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Cd  1.6900  1.5500  1.0900
  Fe  1.8300  1.4000  0.8525
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [R3]
_cell_length_a [6.4339]
_cell_length_b [6.4339]
_cell_length_c [17.6099]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [146]
_chemical_formula_structural [Li2CdFeCl6]
_chemical_formula_sum '[Li6 Cd3 Fe3 Cl18]'
_cell_volume [631.3003]
_cell_formula_units_Z [3]
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  3  0.0000  0.0000  0.4831  1
  Li  Li1  3  0.0000  0.0000  0.9886  1
  Cd  Cd2  3  0.0000  0.0000  0.1831  1
  Fe  Fe3  3  0.0000  0.0000  0.6784  1
  Cl  Cl4  9  0.0102  0.7021  0.5867  1
  Cl  Cl5  9  0.0158  0.3373  0.7482  1
]