data_ZnGaAu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.14
_cell_length_b   4.95
_cell_length_c   4.59
_cell_angle_alpha   90.0
_cell_angle_beta   94.36
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnGaAu2
_chemical_formula_sum   'Zn1 Ga1 Au2'
_cell_volume   71.09
_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  0.25  0.0  0.48  1.0
  Ga  Ga2  1  0.2  0.47  0.27  1.0
  Au  Au0  1  0.68  0.47  0.46  1.0
  Au  Au1  1  0.84  0.0  0.25  1.0

data_ZnGaAu2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.14
_cell_length_b   4.59
_cell_length_c   4.95
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   94.36
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnGaAu2
_chemical_formula_sum   'Zn1 Ga1 Au2'
_cell_volume   71.09
_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  0.75  0.52  0.0  1.0
  Ga  Ga1  1  0.8  0.73  0.53  1.0
  Au  Au2  1  0.16  0.75  0.0  1.0
  Au  Au3  1  0.32  0.54  0.53  1.0

Zn Ga Au Au