data_VHgPd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.75
_cell_length_b   4.75
_cell_length_c   5.07
_cell_angle_alpha   100.32
_cell_angle_beta   100.32
_cell_angle_gamma   35.93
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VHgPd2
_chemical_formula_sum   'V1 Hg1 Pd2'
_cell_volume   65.95
_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
  Hg  Hg0  1  0.04  0.0  0.49  1.0
  Pd  Pd1  1  0.5  0.0  0.14  1.0
  Pd  Pd2  1  0.59  0.0  0.84  1.0

data_VHgPd2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.93
_cell_length_b   4.75
_cell_length_c   5.07
_cell_angle_alpha   100.32
_cell_angle_beta   90.0
_cell_angle_gamma   107.96
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VHgPd2
_chemical_formula_sum   'V1 Hg1 Pd2'
_cell_volume   65.95
_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  V0  1  0.0  0.0  0.0  1.0
  Hg  Hg1  1  0.0  0.96  0.51  1.0
  Pd  Pd2  1  0.0  0.41  0.16  1.0
  Pd  Pd3  1  0.0  0.5  0.86  1.0

V Hg Pd Pd
V Hg Pd Pd 0 3 - o - 0 2 o o o 0 1 o o o 0 1 o o - 1 2 - o o 1 2 o o o 1 1 + - o 1 3 - o o 1 3 o o o 2 3 o o - 
VPd2Hg crystallizes in the triclinic P1 space group. V(1) is bonded in a 4-coordinate geometry to one Pd(1), one Pd(2), and two equivalent Hg(1) atoms. The V(1)-Pd(1) bond length is 2.35 Å. The V(1)-Pd(2) bond length is 1.99 Å. There is one shorter (2.45 Å) and one longer (2.64 Å) V(1)-Hg(1) bond length. There are two inequivalent Pd sites. In the first Pd site, Pd(1) is bonded in a distorted water-like geometry to one V(1), one Pd(2), and two equivalent Hg(1) atoms. The Pd(1)-Pd(2) bond length is 1.62 Å. There is one shorter (2.87 Å) and one longer (3.05 Å) Pd(1)-Hg(1) bond length. In the second Pd site, Pd(2) is bonded in a 2-coordinate geometry to one V(1), one Pd(1), and two equivalent Hg(1) atoms. There is one shorter (2.87 Å) and one longer (3.05 Å) Pd(2)-Hg(1) bond length. Hg(1) is bonded in a 8-coordinate geometry to two equivalent V(1), two equivalent Pd(1), two equivalent Pd(2), and two equivalent Hg(1) atoms. Both Hg(1)-Hg(1) bond lengths are 2.93 Å.