data_[Ge8Pt4Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ge  2.0100  1.2500  0.7700
  Pt  2.2800  1.3500  0.8050
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.3010]
_cell_length_b [4.1073]
_cell_length_c [9.3896]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.4649]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ge4Pt2Au]
_chemical_formula_sum '[Ge8 Pt4 Au2]'
_cell_volume [268.5900]
_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
[
  Ge  Ge0  4  0.1270  0.0000  0.3297  1.0
  Ge  Ge1  4  0.2051  0.5000  0.0967  1.0
  Pt  Pt2  4  0.0846  0.5000  0.8071  1.0
  Au  Au3  2  0.0000  0.5000  0.5000  1.0
]