data_[Rb6Au2Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Au  2.5400  1.3500  1.0700
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [5.1873]
_cell_length_b [8.0797]
_cell_length_c [17.9810]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.0273]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Rb3AuCl6]
_chemical_formula_sum '[Rb6 Au2 Cl12]'
_cell_volume [727.8416]
_cell_formula_units_Z [2]
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
[
  Rb  Rb0  4  0.3007  0.1501  0.7784  1
  Rb  Rb1  2  0.5000  0.0000  0.5000  1
  Au  Au2  2  0.0000  0.0000  0.0000  1
  Cl  Cl3  4  0.0811  0.7347  0.5779  1
  Cl  Cl4  4  0.2818  0.5388  0.8157  1
  Cl  Cl5  4  0.3393  0.1436  0.0871  1
]