data_ZrNbPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.68
_cell_length_b   6.66
_cell_length_c   2.96
_cell_angle_alpha   77.51
_cell_angle_beta   76.82
_cell_angle_gamma   25.68
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrNbPd
_chemical_formula_sum   'Zr1 Nb1 Pd1'
_cell_volume   55.57
_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
  Zr  Zr2  1  0.07  0.12  0.18  1.0
  Nb  Nb0  1  0.07  0.12  0.11  1.0
  Pd  Pd1  1  0.07  0.12  0.38  1.0

data_ZrNbPd
_symmetry_space_group_name_H-M   Imm2
_cell_length_a   2.96
_cell_length_b   12.66
_cell_length_c   2.96
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   44
_chemical_formula_structural   ZrNbPd
_chemical_formula_sum   'Zr2 Nb2 Pd2'
_cell_volume   111.18
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-x, -y, z'
  3  '-x, y, z'
  4  'x, -y, z'
  5  'x+1/2, y+1/2, z+1/2'
  6  '-x+1/2, -y+1/2, z+1/2'
  7  '-x+1/2, y+1/2, z+1/2'
  8  'x+1/2, -y+1/2, z+1/2'
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
  Zr  Zr0  2  0.0  0.5  0.3  1.0
  Nb  Nb1  2  0.0  0.5  0.23  1.0
  Pd  Pd2  2  0.0  0.5  0.5  1.0

Zr Nb Pd
Zr Nb Pd 0 1 o o o 0 2 o o o 
ZrNbPd crystallizes in the monoclinic Cm space group. The structure is zero-dimensional and consists of two ZrNbPd clusters. Zr(1) is bonded in a linear geometry to one Nb(1) and one Pd(1) atom. The Zr(1)-Nb(1) bond length is 0.20 Å. The Zr(1)-Pd(1) bond length is 0.59 Å. Nb(1) is bonded in a distorted single-bond geometry to one Zr(1) atom. Pd(1) is bonded in a distorted single-bond geometry to one Zr(1) atom.