data_LiV2As
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.67
_cell_length_b   4.67
_cell_length_c   4.67
_cell_angle_alpha   133.16
_cell_angle_beta   133.16
_cell_angle_gamma   68.4
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiV2As
_chemical_formula_sum   'Li1 V2 As1'
_cell_volume   53.12
_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  Li1  1  0.0  0.0  0.0  1.0
  V  V2  1  0.85  0.0  0.93  1.0
  V  V3  1  0.0  0.0  0.86  1.0
  As  As0  1  0.0  0.85  0.93  1.0

data_LiV2As
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.71
_cell_length_b   3.71
_cell_length_c   4.67
_cell_angle_alpha   113.42
_cell_angle_beta   113.42
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiV2As
_chemical_formula_sum   'Li1 V2 As1'
_cell_volume   53.12
_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  0.0  1.0
  V  V1  1  0.86  0.86  0.86  1.0
  V  V2  1  0.93  0.08  0.08  1.0
  As  As3  1  0.08  0.93  0.08  1.0

Li V V As
LiV2As is Indium-like structured and crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one LiV2As cluster. Li(1) is bonded in a distorted trigonal non-coplanar geometry to one V(1), one V(2), and one As(1) atom. The Li(1)-V(1) bond length is 0.51 Å. The Li(1)-V(2) bond length is 0.65 Å. The Li(1)-As(1) bond length is 0.51 Å. There are two inequivalent V sites. In the first V site, V(1) is bonded in a single-bond geometry to one Li(1) atom. In the second V site, V(2) is bonded in a single-bond geometry to one Li(1) atom. As(1) is bonded in a single-bond geometry to one Li(1) atom.