data_NbPd2W
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.86
_cell_length_b   4.86
_cell_length_c   4.86
_cell_angle_alpha   130.73
_cell_angle_beta   130.73
_cell_angle_gamma   72.24
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbPd2W
_chemical_formula_sum   'Nb1 Pd2 W1'
_cell_volume   64.44
_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
  Nb  Nb0  1  0.0  0.0  0.0  1.0
  Pd  Pd1  1  0.03  0.0  0.96  1.0
  Pd  Pd2  1  0.0  0.0  0.93  1.0
  W  W3  1  0.0  0.03  0.96  1.0

data_NbPd2W
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.05
_cell_length_b   4.05
_cell_length_c   4.86
_cell_angle_alpha   114.63
_cell_angle_beta   114.63
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbPd2W
_chemical_formula_sum   'Nb1 Pd2 W1'
_cell_volume   64.44
_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
  Nb  Nb0  1  0.0  0.0  0.0  1.0
  Pd  Pd1  1  0.04  0.0  0.06  1.0
  Pd  Pd2  1  0.07  0.0  0.07  1.0
  W  W3  1  0.06  0.03  0.06  1.0

Nb Pd Pd W
Nb Pd Pd W 0 3 o o - 0 1 o o - 1 2 o o o 1 3 o o o 2 3 o o o 
NbWPd2 crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one NbWPd2 cluster. Nb(1) is bonded in a 2-coordinate geometry to one W(1) and one Pd(1) atom. The Nb(1)-W(1) bond length is 0.28 Å. The Nb(1)-Pd(1) bond length is 0.28 Å. W(1) is bonded in a 3-coordinate geometry to one Nb(1), one Pd(1), and one Pd(2) atom. The W(1)-Pd(1) bond length is 0.15 Å. The W(1)-Pd(2) bond length is 0.14 Å. There are two inequivalent Pd sites. In the first Pd site, Pd(1) is bonded in a 3-coordinate geometry to one Nb(1), one W(1), and one Pd(2) atom. The Pd(1)-Pd(2) bond length is 0.14 Å. In the second Pd site, Pd(2) is bonded in a 2-coordinate geometry to one W(1) and one Pd(1) atom.