data_[Hg4Pd4Au14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hg  2.0000  1.5000  1.2450
  Pd  2.2000  1.4000  0.8462
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.3926]
_cell_length_b [10.1167]
_cell_length_c [6.7877]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.2668]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Hg2Pd2Au7]
_chemical_formula_sum '[Hg4 Pd4 Au14]'
_cell_volume [502.3683]
_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  0.2470  0.0000  0.2213  1
  Pd  Pd1  4  0.0000  0.3656  0.0000  1
  Au  Au2  8  0.1291  0.1452  0.8519  1
  Au  Au3  4  0.1261  0.5000  0.3638  1
  Au  Au4  2  0.0000  0.0000  0.5000  1
]