data_[Rb9Hg24Bi3]
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
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [6.7130]
_cell_length_b [6.7130]
_cell_length_c [31.0041]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [Rb3Hg8Bi]
_chemical_formula_sum '[Rb9 Hg24 Bi3]'
_cell_volume [1210.0107]
_cell_formula_units_Z [3]
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  3  0.0000  0.0000  0.0083  1.0
  Rb  Rb1  3  0.0000  0.0000  0.4943  1.0
  Rb  Rb2  3  0.0000  0.0000  0.6228  1.0
  Hg  Hg3  9  0.0047  0.5024  0.5605  1.0
  Hg  Hg4  9  0.1677  0.3353  0.3946  1.0
  Hg  Hg5  3  0.0000  0.0000  0.3092  1.0
  Hg  Hg6  3  0.0000  0.0000  0.8092  1.0
  Bi  Bi7  3  0.0000  0.0000  0.1411  1.0
]