data_[Rb14Hg6Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Hg  2.0000  1.5000  1.2450
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [12.5966]
_cell_length_b [11.9457]
_cell_length_c [8.3471]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.4791]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Rb7Hg3Au]
_chemical_formula_sum '[Rb14 Hg6 Au2]'
_cell_volume [1191.2708]
_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  0.1828  0.1679  0.2267  1
  Rb  Rb1  4  0.4037  0.2082  0.8444  1
  Rb  Rb2  2  0.0863  0.0000  0.6661  1
  Rb  Rb3  2  0.1702  0.5000  0.6726  1
  Rb  Rb4  2  0.3032  0.5000  0.2304  1
  Hg  Hg5  4  0.4786  0.2252  0.4211  1
  Hg  Hg6  2  0.4772  0.0000  0.2334  1
  Au  Au7  2  0.4580  0.5000  0.9631  1
]