data_[Sc4Cd8Pd8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  Cd  1.6900  1.5500  1.0900
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [9.6881]
_cell_length_b [6.4525]
_cell_length_c [6.7660]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.2558]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Sc(CdPd)2]
_chemical_formula_sum '[Sc4 Cd8 Pd8]'
_cell_volume [399.2969]
_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
[
  Sc  Sc0  4  0.3247  0.2359  0.9249  1.0
  Cd  Cd1  4  0.0037  0.6580  0.3308  1.0
  Cd  Cd2  4  0.3192  0.7419  0.9018  1.0
  Pd  Pd3  4  0.1588  0.0157  0.5800  1.0
  Pd  Pd4  4  0.4941  0.5109  0.2420  1.0
]