data_[Nd16Cu2Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Cu  1.9000  1.3500  0.8200
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.4829]
_cell_length_b [5.2287]
_cell_length_c [6.8668]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.7664]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Nd8CuPd2]
_chemical_formula_sum '[Nd16 Cu2 Pd4]'
_cell_volume [628.3353]
_cell_formula_units_Z [2]
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  4  0.0274  0.0000  0.7894  1.0
  Nd  Nd1  4  0.0917  0.5000  0.4665  1.0
  Nd  Nd2  4  0.1723  0.5000  0.0036  1.0
  Nd  Nd3  4  0.2013  0.0000  0.3401  1.0
  Cu  Cu4  2  0.0000  0.5000  0.0000  1.0
  Pd  Pd5  4  0.1717  0.0000  0.7358  1.0
]