data_[Cd36Ag21Sn3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Ag  1.9300  1.6000  1.0867
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [R-3]
_cell_length_a [12.5153]
_cell_length_b [12.5153]
_cell_length_c [9.5608]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [148]
_chemical_formula_structural [Cd12Ag7Sn]
_chemical_formula_sum '[Cd36 Ag21 Sn3]'
_cell_volume [1296.8956]
_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
[
  Cd  Cd0  18  0.0356  0.2614  0.9054  1
  Cd  Cd1  18  0.0630  0.5674  0.1498  1
  Ag  Ag2  18  0.0076  0.1412  0.2480  1
  Ag  Ag3  3  0.0000  0.0000  0.5000  1
  Sn  Sn4  3  0.0000  0.0000  0.0000  1
]