data_ZnAg2Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.07
_cell_length_b   5.07
_cell_length_c   4.89
_cell_angle_alpha   102.67
_cell_angle_beta   102.67
_cell_angle_gamma   34.01
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnAg2Au
_chemical_formula_sum   'Zn1 Ag2 Au1'
_cell_volume   68.45
_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  Zn3  1  0.0  0.0  0.0  1.0
  Ag  Ag0  1  0.92  0.0  0.15  1.0
  Ag  Ag1  1  0.66  0.0  0.6  1.0
  Au  Au2  1  0.29  0.0  0.38  1.0

data_ZnAg2Au
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.97
_cell_length_b   4.89
_cell_length_c   5.07
_cell_angle_alpha   102.67
_cell_angle_beta   107.01
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnAg2Au
_chemical_formula_sum   'Zn1 Ag2 Au1'
_cell_volume   68.45
_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  1  0.0  0.0  0.0  1.0
  Ag  Ag1  1  0.0  0.15  0.92  1.0
  Ag  Ag2  1  0.0  0.6  0.66  1.0
  Au  Au3  1  0.0  0.38  0.29  1.0

Zn Ag Ag Au
Zn Ag Ag Au 0 1 - o o 0 2 - o - 0 3 o o o 1 3 + o o 2 3 o o o 