data_BaNiPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.39
_cell_length_b   5.39
_cell_length_c   5.39
_cell_angle_alpha   144.73
_cell_angle_beta   132.19
_cell_angle_gamma   60.79
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaNiPd
_chemical_formula_sum   'Ba1 Ni1 Pd1'
_cell_volume   66.51
_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
  Ba  Ba0  1  0.0  0.0  0.3  1.0
  Ni  Ni1  1  0.0  0.0  0.21  1.0
  Pd  Pd2  1  0.0  0.0  0.1  1.0

data_BaNiPd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.27
_cell_length_b   4.37
_cell_length_c   5.39
_cell_angle_alpha   113.9
_cell_angle_beta   107.64
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaNiPd
_chemical_formula_sum   'Ba1 Ni1 Pd1'
_cell_volume   66.51
_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
  Ba  Ba0  1  0.7  0.7  0.7  1.0
  Ni  Ni1  1  0.79  0.79  0.79  1.0
  Pd  Pd2  1  0.9  0.9  0.9  1.0

Ba Ni Pd
Ba Ni Pd 0 1 o o o 1 2 o o o 
BaPdNi is Cyanogen Chloride-like structured and crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one BaPdNi cluster. Ba(1) is bonded in a single-bond geometry to one Ni(1) atom. The Ba(1)-Ni(1) bond length is 0.50 Å. Pd(1) is bonded in a single-bond geometry to one Ni(1) atom. The Pd(1)-Ni(1) bond length is 0.62 Å. Ni(1) is bonded in a linear geometry to one Ba(1) and one Pd(1) atom.