data_[Nd16Ga4Pd4]
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 [Cmc2_1]
_cell_length_a [5.3601]
_cell_length_b [21.5916]
_cell_length_c [6.4266]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Nd4GaPd]
_chemical_formula_sum '[Nd16 Ga4 Pd4]'
_cell_volume [743.7676]
_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  4  0.0000  0.1125  0.2046  1
  Nd  Nd1  4  0.0000  0.2863  0.9452  1
  Nd  Nd2  4  0.0000  0.3085  0.4268  1
  Nd  Nd3  4  0.0000  0.4435  0.1514  1
  Ga  Ga4  4  0.0000  0.1581  0.6805  1
  Pd  Pd5  4  0.0000  0.4249  0.6581  1
]