data_[Hg2Au10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hg  2.0000  1.5000  1.2450
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [11.1975]
_cell_length_b [3.0681]
_cell_length_c [6.9136]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.0556]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [HgAu5]
_chemical_formula_sum '[Hg2 Au10]'
_cell_volume [227.0712]
_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
[
  Hg  Hg0  2  0.2185  0.5000  0.9399  1.0
  Au  Au1  2  0.0544  0.0000  0.6044  1.0
  Au  Au2  2  0.1686  0.5000  0.3390  1.0
  Au  Au3  2  0.3388  0.0000  0.6663  1.0
  Au  Au4  2  0.3884  0.0000  0.2780  1.0
  Au  Au5  2  0.4980  0.5000  0.0057  1.0
]