data_NiPdBr2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.69
_cell_length_b   4.69
_cell_length_c   3.33
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NiPdBr2
_chemical_formula_sum   'Ni1 Pd1 Br2'
_cell_volume   73.16
_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
  Ni  Ni2  1  0.0  0.0  0.0  1.0
  Pd  Pd3  1  0.34  0.34  0.0  1.0
  Br  Br0  1  0.34  0.0  0.67  1.0
  Br  Br1  1  0.0  0.34  0.67  1.0

data_NiPdBr2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   6.63
_cell_length_b   6.63
_cell_length_c   3.33
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   NiPdBr2
_chemical_formula_sum   'Ni2 Pd2 Br4'
_cell_volume   146.33
_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+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Ni  Ni0  2  0.0  0.0  0.0  1.0
  Pd  Pd1  2  0.34  0.0  0.0  1.0
  Br  Br2  4  0.17  0.17  0.67  1.0

Ni Pd Br Br
PdNiBr2 is Indium-like structured and crystallizes in the monoclinic Cm space group. The structure is zero-dimensional and consists of two PdNiBr2 clusters. Pd(1) is bonded in a 2-coordinate geometry to two equivalent Br(1) atoms. Both Pd(1)-Br(1) bond lengths are 1.96 Å. Ni(1) is bonded in a 2-coordinate geometry to two equivalent Br(1) atoms. Both Ni(1)-Br(1) bond lengths are 1.96 Å. Br(1) is bonded in a 2-coordinate geometry to one Pd(1) and one Ni(1) atom.