data_[Nd24Cd4Ni8]
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
  Ni  1.9100  1.3500  0.7400
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [9.4774]
_cell_length_b [10.1071]
_cell_length_c [10.4282]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Nd6CdNi2]
_chemical_formula_sum '[Nd24 Cd4 Ni8]'
_cell_volume [998.9031]
_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  0.2013  0.2297  1.0
  Nd  Nd1  8  0.1916  0.5000  0.1769  1.0
  Nd  Nd2  8  0.2059  0.3185  0.5000  1.0
  Cd  Cd3  2  0.0000  0.0000  0.0000  1.0
  Cd  Cd4  2  0.0000  0.0000  0.5000  1.0
  Ni  Ni5  4  0.0000  0.3579  0.0000  1.0
  Ni  Ni6  4  0.0000  0.5000  0.3798  1.0
]