data_V2NiPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.01
_cell_length_b   3.01
_cell_length_c   6.07
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V2NiPd
_chemical_formula_sum   'V2 Ni1 Pd1'
_cell_volume   55.04
_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
  V  V2  1  0.51  0.51  0.74  1.0
  V  V3  1  0.51  0.51  0.34  1.0
  Ni  Ni0  1  0.0  0.0  0.0  1.0
  Pd  Pd1  1  0.0  0.0  0.04  1.0

data_V2NiPd
_symmetry_space_group_name_H-M   P4mm
_cell_length_a   3.01
_cell_length_b   3.01
_cell_length_c   6.07
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   99
_chemical_formula_structural   V2NiPd
_chemical_formula_sum   'V2 Ni1 Pd1'
_cell_volume   55.04
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-y, x, z'
  3  '-x, -y, z'
  4  'y, -x, z'
  5  '-x, y, z'
  6  'y, x, z'
  7  'x, -y, z'
  8  '-y, -x, 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
  V  V0  1  0.5  0.5  0.34  1.0
  V  V1  1  0.5  0.5  0.74  1.0
  Ni  Ni2  1  0.0  0.0  0.0  1.0
  Pd  Pd3  1  0.0  0.0  0.04  1.0

V V Ni Pd
V2PdNi crystallizes in the monoclinic Cm space group. There are two inequivalent V sites. In the first V site, V(1) is bonded in a 5-coordinate geometry to one V(2) and four equivalent Ni(1) atoms. The V(1)-V(2) bond length is 2.41 Å. There are a spread of V(1)-Ni(1) bond distances ranging from 2.65-2.69 Å. In the second V site, V(2) is bonded in a 5-coordinate geometry to one V(1) and four equivalent Pd(1) atoms. There are a spread of V(2)-Pd(1) bond distances ranging from 2.79-2.83 Å. Pd(1) is bonded in a single-bond geometry to four equivalent V(2) and one Ni(1) atom. The Pd(1)-Ni(1) bond length is 0.22 Å. Ni(1) is bonded in a single-bond geometry to four equivalent V(1) and one Pd(1) atom.