data_LiNbV
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.02
_cell_length_b   5.02
_cell_length_c   5.02
_cell_angle_alpha   147.95
_cell_angle_beta   136.19
_cell_angle_gamma   55.3
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNbV
_chemical_formula_sum   'Li1 Nb1 V1'
_cell_volume   46.09
_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
  Li  Li0  1  0.0  0.0  0.84  1.0
  Nb  Nb1  1  0.0  0.0  0.98  1.0
  V  V2  1  0.0  0.0  0.95  1.0

data_LiNbV
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.77
_cell_length_b   3.74
_cell_length_c   5.02
_cell_angle_alpha   111.9
_cell_angle_beta   106.02
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNbV
_chemical_formula_sum   'Li1 Nb1 V1'
_cell_volume   46.09
_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
  Li  Li0  1  0.16  0.16  0.16  1.0
  Nb  Nb1  1  0.02  0.02  0.02  1.0
  V  V2  1  0.05  0.05  0.05  1.0

Li Nb V
Li Nb V 0 2 o o o 1 2 o o o 
LiNbV is Cyanogen Chloride-like structured and crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one LiNbV cluster. Li(1) is bonded in a single-bond geometry to one V(1) atom. The Li(1)-V(1) bond length is 0.56 Å. Nb(1) is bonded in a single-bond geometry to one V(1) atom. The Nb(1)-V(1) bond length is 0.14 Å. V(1) is bonded in a linear geometry to one Li(1) and one Nb(1) atom.