data_Ag3Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.86
_cell_length_b   5.86
_cell_length_c   4.83
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.05
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ag3Au
_chemical_formula_sum   'Ag6 Au2'
_cell_volume   143.44
_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
  Ag  Ag0  1  0.93  0.23  0.21  1.0
  Ag  Ag1  1  0.39  0.69  0.21  1.0
  Ag  Ag2  1  0.46  0.69  0.21  1.0
  Ag  Ag3  1  0.93  0.77  0.62  1.0
  Ag  Ag4  1  0.46  0.31  0.62  1.0
  Ag  Ag5  1  0.39  0.31  0.62  1.0
  Au  Au6  1  0.93  0.15  0.21  1.0
  Au  Au7  1  0.93  0.85  0.62  1.0

data_Ag3Au
_symmetry_space_group_name_H-M   P-1
_cell_length_a   4.83
_cell_length_b   5.85
_cell_length_c   5.86
_cell_angle_alpha   119.98
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   Ag3Au
_chemical_formula_sum   'Ag6 Au2'
_cell_volume   143.44
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-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
  Ag  Ag0  2  0.21  0.23  0.73  1.0
  Ag  Ag1  2  0.21  0.69  0.66  1.0
  Ag  Ag2  2  0.21  0.69  0.73  1.0
  Au  Au3  2  0.21  0.15  0.65  1.0

Ag Ag Ag Ag Ag Ag Au Au