data_[Nd16Cd4Bi2]
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
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.9376]
_cell_length_b [5.5067]
_cell_length_c [8.9279]
_cell_angle_alpha [90.0000]
_cell_angle_beta [121.1838]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Nd8Cd2Bi]
_chemical_formula_sum '[Nd16 Cd4 Bi2]'
_cell_volume [712.3935]
_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  0.0699  0.0000  0.7175  1
  Nd  Nd1  4  0.0937  0.5000  0.4549  1
  Nd  Nd2  4  0.1418  0.0000  0.1893  1
  Nd  Nd3  4  0.1821  0.5000  0.9532  1
  Cd  Cd4  4  0.2213  0.0000  0.6060  1
  Bi  Bi5  2  0.0000  0.5000  0.0000  1
]