data_Li2ScPb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.43
_cell_length_b   3.43
_cell_length_c   6.92
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   96.68
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2ScPb
_chemical_formula_sum   'Li2 Sc1 Pb1'
_cell_volume   80.91
_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  0.28  0.0  0.81  1.0
  Li  Li1  1  0.0  0.0  0.16  1.0
  Sc  Sc3  1  0.0  0.0  0.75  1.0
  Pb  Pb2  1  0.28  0.0  0.59  1.0

data_Li2ScPb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.43
_cell_length_b   3.43
_cell_length_c   6.92
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   96.68
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2ScPb
_chemical_formula_sum   'Li2 Sc1 Pb1'
_cell_volume   80.91
_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  0.16  1.0
  Li  Li1  1  0.28  0.0  0.81  1.0
  Sc  Sc2  1  0.0  0.0  0.75  1.0
  Pb  Pb3  1  0.28  0.0  0.59  1.0

Li Li Sc Pb
Li2ScPb is Indium-like structured and crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one Li2ScPb cluster. There are two inequivalent Li sites. In the first Li site, Li(1) is bonded in a 2-coordinate geometry to one Sc(1) and one Pb(1) atom. The Li(1)-Sc(1) bond length is 1.06 Å. The Li(1)-Pb(1) bond length is 1.54 Å. In the second Li site, Li(2) is bonded in a distorted single-bond geometry to one Pb(1) atom. The Li(2)-Pb(1) bond length is 3.12 Å. Sc(1) is bonded in a 2-coordinate geometry to one Li(1) and one Pb(1) atom. The Sc(1)-Pb(1) bond length is 1.47 Å. Pb(1) is bonded in a 2-coordinate geometry to one Li(1), one Li(2), and one Sc(1) atom.