data_[Hg10Ge2Au8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hg  2.0000  1.5000  1.2450
  Ge  2.0100  1.2500  0.7700
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.5870]
_cell_length_b [4.0633]
_cell_length_c [7.5627]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.6796]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Hg5GeAu4]
_chemical_formula_sum '[Hg10 Ge2 Au8]'
_cell_volume [477.3877]
_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  4  0.1672  0.0000  0.8305  1
  Hg  Hg1  4  0.1861  0.0000  0.4133  1
  Hg  Hg2  2  0.0000  0.5000  0.5000  1
  Ge  Ge3  2  0.0000  0.5000  0.0000  1
  Au  Au4  4  0.0113  0.0000  0.2351  1
  Au  Au5  4  0.1568  0.5000  0.1258  1
]