data_[Ag4Hg1Au6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ag  1.9300  1.6000  1.0867
  Hg  2.0000  1.5000  1.2450
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P-6m2]
_cell_length_a [7.7898]
_cell_length_b [7.7898]
_cell_length_c [4.3220]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [187]
_chemical_formula_structural [Ag4HgAu6]
_chemical_formula_sum '[Ag4 Hg1 Au6]'
_cell_volume [227.1268]
_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
[
  Ag  Ag0  3  0.4017  0.2009  0.5000  1
  Ag  Ag1  1  0.3333  0.6667  0.0000  1
  Hg  Hg2  1  0.0000  0.0000  0.0000  1
  Au  Au3  3  0.2027  0.4054  0.5000  1
  Au  Au4  3  0.5362  0.0723  0.0000  1
]