data_[Cd12Ag20Sn4]
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 [C2/m]
_cell_length_a [8.6301]
_cell_length_b [7.7172]
_cell_length_c [12.5078]
_cell_angle_alpha [90.0000]
_cell_angle_beta [95.0194]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cd3Ag5Sn]
_chemical_formula_sum '[Cd12 Ag20 Sn4]'
_cell_volume [829.8268]
_cell_formula_units_Z [4]
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  4  0.1666  0.5000  0.5119  1
  Cd  Cd1  4  0.2390  0.5000  0.1325  1
  Cd  Cd2  2  0.0000  0.0000  0.0000  1
  Cd  Cd3  2  0.0000  0.0000  0.5000  1
  Ag  Ag4  8  0.1997  0.2006  0.6732  1
  Ag  Ag5  4  0.0000  0.3304  0.0000  1
  Ag  Ag6  4  0.0102  0.5000  0.2983  1
  Ag  Ag7  4  0.2113  0.5000  0.8806  1
  Sn  Sn8  4  0.0914  0.0000  0.2789  1
]