data_[V24Au8N8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  Au  2.5400  1.3500  1.0700
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.9924]
_cell_length_b [11.4333]
_cell_length_c [4.9321]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0659]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [V3AuN]
_chemical_formula_sum '[V24 Au8 N8]'
_cell_volume [507.0842]
_cell_formula_units_Z [8]
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
[
  V  V0  8  0.1172  0.0677  0.4163  1.0
  V  V1  8  0.1281  0.1891  0.9157  1.0
  V  V2  8  0.1385  0.3103  0.4215  1.0
  Au  Au3  8  0.1332  0.4348  0.9140  1.0
  N  N4  4  0.0000  0.0671  0.7500  1.0
  N  N5  4  0.0000  0.1991  0.2500  1.0
]