The structure described by Pd5B crystallizes in the tetragonal I4/mmm space group. There are three inequivalent Pd sites. In the first Pd site, Pd(1) is bonded in a single-bond geometry to four equivalent Pd(3) and one B(1) atom. In the second Pd site, Pd(2) is bonded in a square co-planar geometry to four equivalent B(1) atoms. In the third Pd site, Pd(3) is bonded in a distorted body-centered cubic geometry to four equivalent Pd(1) and four equivalent Pd(3) atoms. B(1) is bonded to two equivalent Pd(1) and four equivalent Pd(2) atoms to form a mixture of edge and corner-sharing BPd6 octahedra. The corner-sharing octahedra are not tilted. is represented by the CIF file [CIF]
data_BPd5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.102
_cell_length_b   9.102
_cell_length_c   9.102
_cell_angle_alpha   160.210
_cell_angle_beta   160.210
_cell_angle_gamma   28.130
_symmetry_Int_Tables_number   1
_cell_volume   86.391
_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  0.000  0.000  0.000  1.0
  Pd  Pd1  1  0.113  0.113  0.000  1.0
  Pd  Pd2  1  0.500  0.500  0.000  1.0
  Pd  Pd3  1  0.887  0.887  0.000  1.0
  Pd  Pd4  1  0.296  0.296  0.000  1.0
  Pd  Pd5  1  0.704  0.704  0.000  1.0
[/CIF]
.
The structure described by Pd5B crystallizes in the tetragonal I4/mmm space group. There are three inequivalent Pd sites. In the first Pd site, Pd(1) is bonded in a single-bond geometry to four equivalent Pd(3) and one B(1) atom. In the second Pd site, Pd(2) is bonded in a square co-planar geometry to four equivalent B(1) atoms. In the third Pd site, Pd(3) is bonded in a distorted body-centered cubic geometry to four equivalent Pd(1) and four equivalent Pd(3) atoms. B(1) is bonded to two equivalent Pd(1) and four equivalent Pd(2) atoms to form a mixture of edge and corner-sharing BPd6 octahedra. The corner-sharing octahedra are not tilted. is represented by the CIF file [CIF]
data_BPd5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.102
_cell_length_b   9.102
_cell_length_c   9.102
_cell_angle_alpha   160.210
_cell_angle_beta   160.210
_cell_angle_gamma   28.130
_symmetry_Int_Tables_number   1
_cell_volume   86.391
_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  0.000  0.000  0.000  1.0
  Pd  Pd1  1  0.113  0.113  0.000  1.0
  Pd  Pd2  1  0.500  0.500  0.000  1.0
  Pd  Pd3  1  0.887  0.887  0.000  1.0
  Pd  Pd4  1  0.296  0.296  0.000  1.0
  Pd  Pd5  1  0.704  0.704  0.000  1.0
[/CIF]
.