data_[Pr4Nd24Pd12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Nd  1.1400  1.8500  1.2765
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [11.9332]
_cell_length_b [13.5554]
_cell_length_c [7.4119]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Pr(Nd2Pd)3]
_chemical_formula_sum '[Pr4 Nd24 Pd12]'
_cell_volume [1198.9477]
_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
[
  Pr  Pr0  4  0.0000  0.3223  0.9637  1
  Nd  Nd1  8  0.1714  0.4578  0.3314  1
  Nd  Nd2  8  0.2259  0.1944  0.1772  1
  Nd  Nd3  4  0.0000  0.0357  0.8413  1
  Nd  Nd4  4  0.0000  0.2332  0.4835  1
  Pd  Pd5  8  0.1830  0.0946  0.5422  1
  Pd  Pd6  4  0.0000  0.4321  0.6245  1
]