data_V3Pd5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.5
_cell_length_b   7.5
_cell_length_c   5.11
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V3Pd5
_chemical_formula_sum   'V6 Pd10'
_cell_volume   249.05
_cell_formula_units_Z   2
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  V10  1  0.49  0.62  0.28  1.0
  V  V11  1  0.76  0.88  0.83  1.0
  V  V12  1  0.02  0.0  0.28  1.0
  V  V13  1  0.51  0.62  0.83  1.0
  V  V14  1  0.48  0.0  0.83  1.0
  V  V15  1  0.24  0.88  0.28  1.0
  Pd  Pd0  1  0.13  0.51  0.83  1.0
  Pd  Pd1  1  0.12  0.99  0.28  1.0
  Pd  Pd2  1  0.75  0.0  0.83  1.0
  Pd  Pd3  1  0.87  0.51  0.28  1.0
  Pd  Pd4  1  0.0  0.33  0.55  1.0
  Pd  Pd5  1  0.0  0.33  0.0  1.0
  Pd  Pd6  1  0.75  0.17  0.55  1.0
  Pd  Pd7  1  0.75  0.17  0.0  1.0
  Pd  Pd8  1  0.76  0.0  0.28  1.0
  Pd  Pd9  1  0.88  0.99  0.83  1.0

data_V3Pd5
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.11
_cell_length_b   7.5
_cell_length_c   7.5
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V3Pd5
_chemical_formula_sum   'V6 Pd10'
_cell_volume   249.05
_cell_formula_units_Z   2
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  V0  1  0.28  0.02  0.0  1.0
  V  V1  1  0.28  0.24  0.88  1.0
  V  V2  1  0.28  0.49  0.62  1.0
  V  V3  1  0.83  0.48  0.0  1.0
  V  V4  1  0.83  0.51  0.62  1.0
  V  V5  1  0.83  0.76  0.88  1.0
  Pd  Pd6  1  -0.0  0.75  0.17  1.0
  Pd  Pd7  1  -0.0  0.0  0.33  1.0
  Pd  Pd8  1  0.28  0.12  0.99  1.0
  Pd  Pd9  1  0.28  0.76  0.0  1.0
  Pd  Pd10  1  0.28  0.87  0.51  1.0
  Pd  Pd11  1  0.55  0.0  0.33  1.0
  Pd  Pd12  1  0.55  0.75  0.17  1.0
  Pd  Pd13  1  0.83  0.13  0.51  1.0
  Pd  Pd14  1  0.83  0.75  0.0  1.0
  Pd  Pd15  1  0.83  0.88  0.99  1.0

V V V V V V Pd Pd Pd Pd Pd Pd Pd Pd Pd Pd
V3Pd5 crystallizes in the triclinic P1 space group. There are six inequivalent V sites. In the first V site, V(1) is bonded in a 1-coordinate geometry to one V(4), one Pd(4), and one Pd(9) atom. The V(1)-V(4) bond length is 2.28 Å. The V(1)-Pd(4) bond length is 3.33 Å. The V(1)-Pd(9) bond length is 2.56 Å. In the second V site, V(2) is bonded in a 2-coordinate geometry to one V(4), one Pd(10), and one Pd(3) atom. The V(2)-V(4) bond length is 1.94 Å. The V(2)-Pd(10) bond length is 0.84 Å. The V(2)-Pd(3) bond length is 0.93 Å. In the third V site, V(3) is bonded in a 1-coordinate geometry to one Pd(2) and one Pd(9) atom. The V(3)-Pd(2) bond length is 0.83 Å. The V(3)-Pd(9) bond length is 1.98 Å. In the fourth V site, V(4) is bonded in a 3-coordinate geometry to one V(1), one V(2), and one Pd(1) atom. The V(4)-Pd(1) bond length is 2.58 Å. In the fifth V site, V(5) is bonded in a 3-coordinate geometry to one Pd(3), one Pd(7), and one Pd(8) atom. The V(5)-Pd(3) bond length is 1.98 Å. The V(5)-Pd(7) bond length is 2.26 Å. The V(5)-Pd(8) bond length is 1.96 Å. In the sixth V site, V(6) is bonded in a distorted single-bond geometry to one Pd(2) and one Pd(4) atom. The V(6)-Pd(2) bond length is 1.45 Å. The V(6)-Pd(4) bond length is 2.77 Å. There are ten inequivalent Pd sites. In the first Pd site, Pd(1) is bonded in a 3-coordinate geometry to one V(4), one Pd(5), and one Pd(6) atom. The Pd(1)-Pd(5) bond length is 1.86 Å. The Pd(1)-Pd(6) bond length is 1.48 Å. In the second Pd site, Pd(2) is bonded in a distorted bent 150 degrees geometry to one V(3) and one V(6) atom. In the third Pd site, Pd(3) is bonded in a distorted single-bond geometry to one V(2), one V(5), one Pd(7), and one Pd(8) atom. The Pd(3)-Pd(7) bond length is 1.87 Å. The Pd(3)-Pd(8) bond length is 1.50 Å. In the fourth Pd site, Pd(4) is bonded in a 4-coordinate geometry to one V(1), one V(6), one Pd(5), and one Pd(6) atom. The Pd(4)-Pd(5) bond length is 2.46 Å. The Pd(4)-Pd(6) bond length is 2.46 Å. In the fifth Pd site, Pd(5) is bonded in a 2-coordinate geometry to one Pd(1), one Pd(4), and one Pd(7) atom. The Pd(5)-Pd(7) bond length is 1.65 Å. In the sixth Pd site, Pd(6) is bonded in a 2-coordinate geometry to one Pd(1), one Pd(4), and one Pd(8) atom. The Pd(6)-Pd(8) bond length is 1.65 Å. In the seventh Pd site, Pd(7) is bonded in a 4-coordinate geometry to one V(5), one Pd(3), one Pd(5), and one Pd(9) atom. The Pd(7)-Pd(9) bond length is 1.90 Å. In the eighth Pd site, Pd(8) is bonded in a 4-coordinate geometry to one V(5), one Pd(3), one Pd(6), and one Pd(9) atom. The Pd(8)-Pd(9) bond length is 1.90 Å. In the ninth Pd site, Pd(9) is bonded in a 1-coordinate geometry to one V(1), one V(3), one Pd(7), and one Pd(8) atom. In the tenth Pd site, Pd(10) is bonded in a distorted single-bond geometry to one V(2) atom.