data_[Cd4H4Pd12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  H  2.2000  0.2500  0.0000
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [9.9044]
_cell_length_b [5.8855]
_cell_length_c [4.9470]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.8645]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [CdHPd3]
_chemical_formula_sum '[Cd4 H4 Pd12]'
_cell_volume [277.3843]
_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  2  0.1435  0.5000  0.0558  1.0
  Cd  Cd1  2  0.3820  0.0000  0.5343  1.0
  Pd  Pd2  4  0.1377  0.2546  0.5514  1.0
  Pd  Pd3  4  0.3881  0.2426  0.0402  1.0
  H  H4  2  0.0417  0.0000  0.3997  1.0
  Pd  Pd5  2  0.1435  0.0000  0.0471  1.0
  Pd  Pd6  2  0.3840  0.5000  0.5343  1.0
  H  H7  2  0.4531  0.5000  0.9139  1.0
]