data_BiPdAu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.39
_cell_length_b   5.18
_cell_length_c   4.67
_cell_angle_alpha   90.0
_cell_angle_beta   92.06
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BiPdAu2
_chemical_formula_sum   'Bi1 Pd1 Au2'
_cell_volume   81.93
_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
  Bi  Bi2  1  0.61  0.0  0.33  1.0
  Pd  Pd3  1  0.0  0.0  0.0  1.0
  Au  Au0  1  0.69  0.59  0.54  1.0
  Au  Au1  1  0.54  0.59  0.13  1.0

data_BiPdAu2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.39
_cell_length_b   4.67
_cell_length_c   5.18
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   92.06
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BiPdAu2
_chemical_formula_sum   'Bi1 Pd1 Au2'
_cell_volume   81.93
_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
  Bi  Bi0  1  0.39  0.67  0.0  1.0
  Pd  Pd1  1  0.0  0.0  0.0  1.0
  Au  Au2  1  0.31  0.46  0.41  1.0
  Au  Au3  1  0.46  0.87  0.41  1.0

Bi Pd Au Au
PdAu2Bi crystallizes in the triclinic P1 space group. Pd(1) is bonded in a 1-coordinate geometry to one Au(1), two equivalent Au(2), and two equivalent Bi(1) atoms. The Pd(1)-Au(1) bond length is 3.18 Å. There is one shorter (2.71 Å) and one longer (2.83 Å) Pd(1)-Au(2) bond length. There is one shorter (2.07 Å) and one longer (2.54 Å) Pd(1)-Bi(1) bond length. There are two inequivalent Au sites. In the first Au site, Au(1) is bonded in a 5-coordinate geometry to one Pd(1), two equivalent Au(2), and two equivalent Bi(1) atoms. There is one shorter (1.97 Å) and one longer (2.81 Å) Au(1)-Au(2) bond length. There is one shorter (2.33 Å) and one longer (3.22 Å) Au(1)-Bi(1) bond length. In the second Au site, Au(2) is bonded in a 6-coordinate geometry to two equivalent Pd(1), two equivalent Au(1), and two equivalent Bi(1) atoms. There is one shorter (2.33 Å) and one longer (3.22 Å) Au(2)-Bi(1) bond length. Bi(1) is bonded in a 4-coordinate geometry to two equivalent Pd(1), two equivalent Au(1), and two equivalent Au(2) atoms.