data_[Cd2Sn4Pd8]
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 [P1]
_cell_length_a [5.9683]
_cell_length_b [7.1754]
_cell_length_c [7.2398]
_cell_angle_alpha [112.5410]
_cell_angle_beta [103.8656]
_cell_angle_gamma [104.1749]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Cd(SnPd2)2]
_chemical_formula_sum '[Cd2 Sn4 Pd8]'
_cell_volume [257.6675]
_cell_formula_units_Z [2]
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  1  0.0104  0.9275  0.9653  1.0
  Cd  Cd1  1  0.3153  0.7363  0.5449  1.0
  Sn  Sn2  1  0.0701  0.4690  0.7823  1.0
  Sn  Sn3  1  0.5315  0.4141  0.6824  1.0
  Sn  Sn4  1  0.5830  0.2353  0.1392  1.0
  Sn  Sn5  1  0.7830  0.9187  0.3911  1.0
  Pd  Pd6  1  0.0556  0.2747  0.3506  1.0
  Pd  Pd7  1  0.2189  0.1139  0.7353  1.0
  Pd  Pd8  1  0.3556  0.5156  0.1569  1.0
  Pd  Pd9  1  0.3562  0.0046  0.3439  1.0
  Pd  Pd10  1  0.5242  0.8079  0.9775  1.0
  Pd  Pd11  1  0.7426  0.1293  0.7935  1.0
  Pd  Pd12  1  0.8164  0.6108  0.5202  1.0
  Pd  Pd13  1  0.8872  0.5922  0.1169  1.0
]