data_[Ac16Cd20Au24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Cd  1.6900  1.5500  1.0900
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.4490]
_cell_length_b [22.4463]
_cell_length_c [16.5745]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Ac4Cd5Au6]
_chemical_formula_sum '[Ac16 Cd20 Au24]'
_cell_volume [1655.1855]
_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
[
  Ac  Ac0  4  0.0000  0.0093  0.5125  1
  Ac  Ac1  4  0.0000  0.0377  0.7735  1
  Ac  Ac2  4  0.0000  0.1577  0.3039  1
  Ac  Ac3  4  0.0000  0.1859  0.9397  1
  Cd  Cd4  4  0.0000  0.1571  0.6300  1
  Cd  Cd5  4  0.0000  0.3029  0.6140  1
  Cd  Cd6  4  0.0000  0.3371  0.2689  1
  Cd  Cd7  4  0.0000  0.3605  0.9828  1
  Cd  Cd8  4  0.0000  0.4435  0.6747  1
  Au  Au9  4  0.0000  0.1166  0.1104  1
  Au  Au10  4  0.0000  0.2191  0.4811  1
  Au  Au11  4  0.0000  0.2434  0.7633  1
  Au  Au12  4  0.0000  0.4231  0.4113  1
  Au  Au13  4  0.0000  0.4279  0.1329  1
  Au  Au14  4  0.0000  0.4480  0.8565  1
]