data_[Cs24H4Au12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  H  2.2000  0.2500  0.0000
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [14.2251]
_cell_length_b [17.3144]
_cell_length_c [8.6008]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Cs6HAu3]
_chemical_formula_sum '[Cs24 H4 Au12]'
_cell_volume [2118.3668]
_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
[
  Cs  Cs0  8  0.1497  0.2509  0.3372  1.0
  Cs  Cs1  8  0.1604  0.4786  0.8166  1.0
  Cs  Cs2  4  0.0000  0.0094  0.2488  1.0
  Cs  Cs3  4  0.0000  0.2285  0.8190  1.0
  H  H4  4  0.0000  0.1477  0.4929  1.0
  Au  Au5  8  0.1803  0.1096  0.0169  1.0
  Au  Au6  4  0.0000  0.3876  0.1127  1.0
]