data_VPd2Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.15
_cell_length_b   9.15
_cell_length_c   9.15
_cell_angle_alpha   17.12
_cell_angle_beta   17.12
_cell_angle_gamma   17.12
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VPd2Ru
_chemical_formula_sum   'V1 Pd2 Ru1'
_cell_volume   57.95
_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  V3  1  0.0  0.0  0.0  1.0
  Pd  Pd0  1  0.0  0.0  0.82  1.0
  Pd  Pd1  1  0.0  0.0  0.23  1.0
  Ru  Ru2  1  0.0  0.0  0.52  1.0

data_VPd2Ru
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.72
_cell_length_b   2.72
_cell_length_c   9.15
_cell_angle_alpha   90.0
_cell_angle_beta   99.9
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   VPd2Ru
_chemical_formula_sum   'V2 Pd4 Ru2'
_cell_volume   115.9
_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
  V  V0  2  0.0  0.0  0.0  1.0
  Ru  Ru1  2  -0.0  0.0  0.48  1.0
  Pd  Pd2  2  -0.0  0.0  0.18  1.0
  Pd  Pd3  2  0.0  0.0  0.77  1.0

V Pd Pd Ru
VRuPd2 crystallizes in the monoclinic Cm space group. V(1) is bonded in a linear geometry to one Pd(1) and one Pd(2) atom. The V(1)-Pd(1) bond length is 1.62 Å. The V(1)-Pd(2) bond length is 2.08 Å. There are two inequivalent Ru sites. In the first Ru site, Ru(1) is bonded to six Ru(1,1); one Pd(1); and one Pd(2) atom to form a mixture of edge and corner-sharing RuPd2Ru6 hexagonal bipyramids. All Ru(1)-Ru(1,1) bond lengths are 2.72 Å. The Ru(1)-Pd(1) bond length is 2.73 Å. The Ru(1)-Pd(2) bond length is 2.73 Å. In the second Ru site, Ru(1) is bonded to six Ru(1,1); one Pd(1); and one Pd(2) atom to form a mixture of edge and corner-sharing RuPd2Ru6 hexagonal bipyramids. Both Ru(1)-Ru(1) bond lengths are 2.72 Å. The Ru(1)-Pd(1) bond length is 2.73 Å. The Ru(1)-Pd(2) bond length is 2.73 Å. There are two inequivalent Pd sites. In the first Pd site, Pd(1) is bonded in a single-bond geometry to one V(1) and one Ru(1) atom. In the second Pd site, Pd(2) is bonded in a single-bond geometry to one V(1) and one Ru(1) atom.