data_[La36Cd18Ag3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Cd  1.6900  1.5500  1.0900
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [R-3]
_cell_length_a [11.6797]
_cell_length_b [11.6797]
_cell_length_c [14.8581]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [148]
_chemical_formula_structural [La12Cd6Ag]
_chemical_formula_sum '[La36 Cd18 Ag3]'
_cell_volume [1755.3400]
_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
[
  La  La0  18  0.0366  0.8411  0.8153  1.0
  La  La1  18  0.0680  0.2154  0.4036  1.0
  Cd  Cd2  18  0.0438  0.5945  0.7024  1.0
  Ag  Ag3  3  0.0000  0.0000  0.0000  1.0
]