data_[Nb16V8Cd12N12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nb  1.6000  1.4500  0.8200
  V  1.6300  1.3500  0.7775
  Cd  1.6900  1.5500  1.0900
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.3276]
_cell_length_b [5.3845]
_cell_length_c [14.4825]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.6082]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Nb4V2(CdN)3]
_chemical_formula_sum '[Nb16 V8 Cd12 N12]'
_cell_volume [709.8365]
_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
[
  Nb  Nb0  8  0.1115  0.0795  0.5822  1
  Nb  Nb1  8  0.2208  0.0857  0.9178  1
  V  V2  8  0.0611  0.4156  0.4293  1
  Cd  Cd3  8  0.1571  0.4254  0.7484  1
  Cd  Cd4  4  0.0000  0.1018  0.2500  1
  N  N5  8  0.0784  0.2625  0.9998  1
  N  N6  4  0.2500  0.2500  0.5000  1
]