data_VCd2Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.57
_cell_length_b   7.57
_cell_length_c   7.57
_cell_angle_alpha   157.34
_cell_angle_beta   147.97
_cell_angle_gamma   39.59
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VCd2Cl
_chemical_formula_sum   'V1 Cd2 Cl1'
_cell_volume   88.33
_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  0.12  1.0
  Cd  Cd0  1  0.49  0.0  0.44  1.0
  Cd  Cd1  1  0.0  0.09  0.67  1.0
  Cl  Cl2  1  0.0  0.0  0.0  1.0

data_VCd2Cl
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.97
_cell_length_b   4.17
_cell_length_c   7.57
_cell_angle_alpha   106.01
_cell_angle_beta   101.33
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VCd2Cl
_chemical_formula_sum   'V1 Cd2 Cl1'
_cell_volume   88.33
_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  0.88  0.88  0.88  1.0
  Cd  Cd1  1  0.04  0.56  0.04  1.0
  Cd  Cd2  1  0.33  0.41  0.41  1.0
  Cl  Cl3  1  0.0  0.0  0.0  1.0

V Cd Cd Cl
V Cd Cd Cl 0 3 o o o 0 1 o o o 1 3 o o o 1 3 + o + 1 2 + o o 2 2 o + + 2 3 o o + 
VCd2Cl crystallizes in the triclinic P1 space group. V(1) is bonded in a single-bond geometry to one Cd(2) and one Cl(1) atom. The V(1)-Cd(2) bond length is 3.60 Å. The V(1)-Cl(1) bond length is 0.90 Å. There are two inequivalent Cd sites. In the first Cd site, Cd(1) is bonded in a distorted linear geometry to one Cd(2) and two equivalent Cl(1) atoms. The Cd(1)-Cd(2) bond length is 2.99 Å. There is one shorter (1.97 Å) and one longer (2.25 Å) Cd(1)-Cl(1) bond length. In the second Cd site, Cd(2) is bonded in a 5-coordinate geometry to one V(1), one Cd(1), two equivalent Cd(2), and one Cl(1) atom. Both Cd(2)-Cd(2) bond lengths are 2.97 Å. The Cd(2)-Cl(1) bond length is 3.08 Å. Cl(1) is bonded in a single-bond geometry to one V(1), one Cd(2), and two equivalent Cd(1) atoms.