data_[Li36Cd18Rh3]
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
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [R-3]
_cell_length_a [10.1590]
_cell_length_b [10.1590]
_cell_length_c [12.0925]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [148]
_chemical_formula_structural [Li12Cd6Rh]
_chemical_formula_sum '[Li36 Cd18 Rh3]'
_cell_volume [1080.8100]
_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  18  0.0373  0.8567  0.8190  1.0
  Li  Li1  18  0.0614  0.2133  0.4099  1.0
  Cd  Cd2  18  0.0272  0.5930  0.7088  1.0
  Rh  Rh3  3  0.0000  0.0000  0.0000  1.0
]