data_[Cd8Sn4Pd12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Sn  1.9600  1.4500  0.8300
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [14.6240]
_cell_length_b [5.5803]
_cell_length_c [5.3899]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.9588]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Cd2SnPd3]
_chemical_formula_sum '[Cd8 Sn4 Pd12]'
_cell_volume [434.4884]
_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  8  0.1736  0.3881  0.5818  1.0
  Sn  Sn1  4  0.0000  0.1514  0.7500  1.0
  Pd  Pd2  8  0.1608  0.1131  0.0717  1.0
  Pd  Pd3  4  0.0000  0.3567  0.2500  1.0
]