data_[H72Au4N24Cl4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  H  2.2000  0.2500  0.0000
  Au  2.5400  1.3500  1.0700
  N  3.0400  0.6500  0.6300
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Pbcn]
_cell_length_a [11.6736]
_cell_length_b [14.4583]
_cell_length_c [7.3916]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [60]
_chemical_formula_structural [H18AuN6Cl]
_chemical_formula_sum '[H72 Au4 N24 Cl4]'
_cell_volume [1247.5461]
_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
[
  H  H0  8  0.0720  0.1641  0.3958  1
  H  H1  8  0.1004  0.4048  0.9357  1
  H  H2  8  0.1271  0.1397  0.5960  1
  H  H3  8  0.1310  0.4999  0.3248  1
  H  H4  8  0.1468  0.3991  0.7247  1
  H  H5  8  0.1619  0.2276  0.9695  1
  H  H6  8  0.1693  0.1266  0.8701  1
  H  H7  8  0.1873  0.0920  0.4154  1
  H  H8  8  0.2221  0.3003  0.3508  1
  Au  Au9  4  0.0000  0.0000  0.0000  1
  N  N10  8  0.1085  0.1114  0.4728  1
  N  N11  8  0.1565  0.4332  0.8451  1
  N  N12  8  0.2168  0.1750  0.9374  1
  Cl  Cl13  4  0.0000  0.2863  0.2500  1
]