data_[Na4Cd4Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Cd  1.6900  1.5500  1.0900
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.7887]
_cell_length_b [4.1340]
_cell_length_c [6.1808]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.5108]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [NaCdPd]
_chemical_formula_sum '[Na4 Cd4 Pd4]'
_cell_volume [234.2605]
_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
[
  Na  Na0  4  0.1687  0.5000  0.8336  1.0
  Cd  Cd1  4  0.1476  0.5000  0.3320  1.0
  Pd  Pd2  2  0.0000  0.0000  0.0000  1.0
  Pd  Pd3  2  0.0000  0.0000  0.5000  1.0
]