data_CuPd2Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.82
_cell_length_b   4.82
_cell_length_c   4.79
_cell_angle_alpha   101.45
_cell_angle_beta   101.45
_cell_angle_gamma   34.38
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuPd2Au
_chemical_formula_sum   'Cu1 Pd2 Au1'
_cell_volume   61.44
_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
  Cu  Cu1  1  0.57  0.0  0.54  1.0
  Pd  Pd2  1  0.17  0.0  0.66  1.0
  Pd  Pd3  1  0.65  0.0  0.14  1.0
  Au  Au0  1  0.15  0.0  0.37  1.0

data_CuPd2Au
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.85
_cell_length_b   4.79
_cell_length_c   4.82
_cell_angle_alpha   101.45
_cell_angle_beta   107.19
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuPd2Au
_chemical_formula_sum   'Cu1 Pd2 Au1'
_cell_volume   61.44
_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
  Cu  Cu0  1  0.0  0.54  0.57  1.0
  Pd  Pd1  1  0.0  0.14  0.65  1.0
  Pd  Pd2  1  0.0  0.66  0.17  1.0
  Au  Au3  1  0.0  0.37  0.15  1.0

Cu Pd Pd Au