data_B2PdAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.85
_cell_length_b   5.85
_cell_length_c   5.85
_cell_angle_alpha   152.33
_cell_angle_beta   146.62
_cell_angle_gamma   43.89
_symmetry_Int_Tables_number   1
_chemical_formula_structural   B2PdAu
_chemical_formula_sum   'B2 Pd1 Au1'
_cell_volume   50.89
_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
  B  B1  1  0.0  0.0  0.75  1.0
  B  B2  1  0.4  0.0  0.28  1.0
  Pd  Pd3  1  0.0  0.0  0.16  1.0
  Au  Au0  1  0.0  0.68  0.49  1.0

data_B2PdAu
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.8
_cell_length_b   3.36
_cell_length_c   5.85
_cell_angle_alpha   106.69
_cell_angle_beta   103.84
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   B2PdAu
_chemical_formula_sum   'B2 Pd1 Au1'
_cell_volume   50.89
_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
  B  B0  1  0.0  0.28  0.88  1.0
  B  B1  1  0.0  0.75  0.75  1.0
  Pd  Pd2  1  0.0  0.16  0.16  1.0
  Au  Au3  1  0.32  0.82  0.82  1.0

B B Pd Au
PdAuB2 is Indium-like structured and crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one PdAuB2 cluster. Pd(1) is bonded in a distorted single-bond geometry to one B(2) atom. The Pd(1)-B(2) bond length is 1.76 Å. Au(1) is bonded in a single-bond geometry to one B(1) and one B(2) atom. The Au(1)-B(1) bond length is 0.89 Å. The Au(1)-B(2) bond length is 1.80 Å. There are two inequivalent B sites. In the first B site, B(1) is bonded in a single-bond geometry to one Au(1) atom. In the second B site, B(2) is bonded in a 2-coordinate geometry to one Pd(1) and one Au(1) atom.