data_[Nd8Cd12Pd16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Cd  1.6900  1.5500  1.0900
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Cmce]
_cell_length_a [5.8291]
_cell_length_b [17.4984]
_cell_length_c [7.5411]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [64]
_chemical_formula_structural [Nd2Cd3Pd4]
_chemical_formula_sum '[Nd8 Cd12 Pd16]'
_cell_volume [769.1902]
_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
[
  Nd  Nd0  8  0.0000  0.1061  0.5810  1.0
  Cd  Cd1  8  0.2500  0.2350  0.2500  1.0
  Cd  Cd2  4  0.0000  0.0000  0.0000  1.0
  Pd  Pd3  8  0.0000  0.1617  0.9726  1.0
  Pd  Pd4  8  0.2500  0.0739  0.2500  1.0
]