data_[Cd4Ag5Pd1]
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
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.0157]
_cell_length_b [5.8935]
_cell_length_c [6.8683]
_cell_angle_alpha [76.5553]
_cell_angle_beta [73.7511]
_cell_angle_gamma [77.1117]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Cd4Ag5Pd]
_chemical_formula_sum '[Cd4 Ag5 Pd1]'
_cell_volume [186.8436]
_cell_formula_units_Z [1]
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  0.1049  0.8964  0.8082  1
  Cd  Cd1  2  0.3065  0.7040  0.3875  1
  Ag  Ag2  2  0.1012  0.4036  0.7985  1
  Ag  Ag3  2  0.2965  0.2003  0.3968  1
  Ag  Ag4  1  0.5000  0.5000  0.0000  1
  Pd  Pd5  1  0.5000  0.0000  0.0000  1
]