data_[Zn6Cd1Au5]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  Cd  1.6900  1.5500  1.0900
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [4.5477]
_cell_length_b [6.3004]
_cell_length_c [7.2420]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.3459]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Zn6CdAu5]
_chemical_formula_sum '[Zn6 Cd1 Au5]'
_cell_volume [199.1127]
_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
[
  Zn  Zn0  4  0.1725  0.2447  0.8508  1
  Zn  Zn1  2  0.5000  0.2749  0.5000  1
  Cd  Cd2  1  0.0000  0.0000  0.5000  1
  Au  Au3  2  0.3317  0.5000  0.1617  1
  Au  Au4  2  0.3529  0.0000  0.1974  1
  Au  Au5  1  0.0000  0.5000  0.5000  1
]