data_ScV2Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.83
_cell_length_b   4.83
_cell_length_c   4.83
_cell_angle_alpha   130.18
_cell_angle_beta   130.18
_cell_angle_gamma   73.11
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScV2Cl
_chemical_formula_sum   'Sc1 V2 Cl1'
_cell_volume   64.3
_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
  Sc  Sc1  1  0.04  0.0  0.94  1.0
  V  V2  1  0.0  0.0  0.88  1.0
  V  V3  1  0.0  0.04  0.94  1.0
  Cl  Cl0  1  0.0  0.0  0.0  1.0

data_ScV2Cl
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.07
_cell_length_b   4.07
_cell_length_c   4.83
_cell_angle_alpha   114.91
_cell_angle_beta   114.91
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScV2Cl
_chemical_formula_sum   'Sc1 V2 Cl1'
_cell_volume   64.3
_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
  Sc  Sc0  1  0.94  0.91  0.91  1.0
  V  V1  1  0.88  0.88  0.88  1.0
  V  V2  1  0.91  0.94  0.91  1.0
  Cl  Cl3  1  0.0  0.0  0.0  1.0

Sc V V Cl
ScV2Cl is alpha Niobium phosphide-derived structured and crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one ScV2Cl cluster. Sc(1) is bonded in a 3-coordinate geometry to one V(1), one V(2), and one Cl(1) atom. The Sc(1)-V(1) bond length is 0.22 Å. The Sc(1)-V(2) bond length is 0.20 Å. The Sc(1)-Cl(1) bond length is 0.42 Å. There are two inequivalent V sites. In the first V site, V(1) is bonded in a 2-coordinate geometry to one Sc(1) and one V(2) atom. The V(1)-V(2) bond length is 0.22 Å. In the second V site, V(2) is bonded in a 1-coordinate geometry to one Sc(1), one V(1), and one Cl(1) atom. The V(2)-Cl(1) bond length is 0.42 Å. Cl(1) is bonded in a 2-coordinate geometry to one Sc(1) and one V(2) atom.