data_Zn2MoAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.73
_cell_length_b   4.33
_cell_length_c   5.42
_cell_angle_alpha   90.0
_cell_angle_beta   93.22
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zn2MoAu
_chemical_formula_sum   'Zn2 Mo1 Au1'
_cell_volume   63.82
_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  Zn2  1  0.51  0.16  0.23  1.0
  Zn  Zn3  1  0.91  0.16  0.19  1.0
  Mo  Mo1  1  0.0  0.0  0.0  1.0
  Au  Au0  1  0.21  0.0  0.71  1.0

data_Zn2MoAu
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.73
_cell_length_b   4.33
_cell_length_c   5.42
_cell_angle_alpha   90.0
_cell_angle_beta   93.22
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zn2MoAu
_chemical_formula_sum   'Zn2 Mo1 Au1'
_cell_volume   63.82
_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  0.51  0.16  0.23  1.0
  Zn  Zn1  1  0.91  0.16  0.19  1.0
  Mo  Mo2  1  0.0  0.0  0.0  1.0
  Au  Au3  1  0.21  0.0  0.71  1.0

Zn Zn Mo Au