data_[Cs2Hg4Sb2Au4]
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
  Sb  2.0500  1.4500  0.8300
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Pmma]
_cell_length_a [7.6801]
_cell_length_b [5.1801]
_cell_length_c [10.1278]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [51]
_chemical_formula_structural [CsHg2SbAu2]
_chemical_formula_sum '[Cs2 Hg4 Sb2 Au4]'
_cell_volume [402.9239]
_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
[
  Cs  Cs0  2  0.2500  0.0000  0.6613  1.0
  Hg  Hg1  2  0.0000  0.0000  0.0000  1.0
  Hg  Hg2  2  0.2500  0.5000  0.9570  1.0
  Sb  Sb3  2  0.2500  0.5000  0.3154  1.0
  Au  Au4  2  0.0000  0.5000  0.5000  1.0
  Au  Au5  2  0.2500  0.0000  0.2325  1.0
]