data_[Cs8Hg1Au2F1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Hg  2.0000  1.5000  1.2450
  Au  2.5400  1.3500  1.0700
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [8.4683]
_cell_length_b [10.4078]
_cell_length_c [8.6448]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.0339]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Cs8HgAu2F]
_chemical_formula_sum '[Cs8 Hg1 Au2 F1]'
_cell_volume [760.8448]
_cell_formula_units_Z [1]
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  4  0.2179  0.2092  0.1667  1.0
  Cs  Cs1  2  0.2518  0.0000  0.7052  1.0
  Cs  Cs2  2  0.2861  0.5000  0.6475  1.0
  Hg  Hg3  1  0.0000  0.5000  0.0000  1.0
  Au  Au4  2  0.5000  0.2200  0.5000  1.0
  F  F5  1  0.0000  0.0000  0.0000  1.0
]