data_[Zn4Ga2Au16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  Ga  1.8100  1.3000  0.7600
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.6260]
_cell_length_b [3.6013]
_cell_length_c [6.5847]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.0845]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Zn2GaAu8]
_chemical_formula_sum '[Zn4 Ga2 Au16]'
_cell_volume [397.3307]
_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
[
  Zn  Zn0  4  0.1903  0.0000  0.7328  1.0
  Ga  Ga1  2  0.0000  0.5000  0.0000  1.0
  Au  Au2  4  0.0375  0.0000  0.7334  1.0
  Au  Au3  4  0.0924  0.5000  0.4319  1.0
  Au  Au4  4  0.1555  0.5000  0.9960  1.0
  Au  Au5  4  0.2048  0.0000  0.3360  1.0
]