data_[Nd16Ga2Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Ga  1.8100  1.3000  0.7600
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [8.7249]
_cell_length_b [13.7047]
_cell_length_c [5.8213]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.7545]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Nd8GaPd2]
_chemical_formula_sum '[Nd16 Ga2 Pd4]'
_cell_volume [669.9098]
_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  0.0020  0.2306  0.0084  1
  Nd  Nd1  4  0.2072  0.1258  0.6197  1
  Nd  Nd2  4  0.2914  0.3761  0.4143  1
  Nd  Nd3  2  0.1153  0.5000  0.8154  1
  Nd  Nd4  2  0.3640  0.0000  0.1883  1
  Ga  Ga5  2  0.4919  0.5000  0.9056  1
  Pd  Pd6  4  0.4968  0.1947  0.5031  1
]