data_Li2RuPb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.13
_cell_length_b   4.74
_cell_length_c   4.69
_cell_angle_alpha   90.0
_cell_angle_beta   93.94
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2RuPb
_chemical_formula_sum   'Li2 Ru1 Pb1'
_cell_volume   69.43
_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  0.5  0.37  0.66  1.0
  Li  Li1  1  0.31  0.37  0.02  1.0
  Ru  Ru3  1  0.0  0.0  0.0  1.0
  Pb  Pb2  1  0.4  0.0  0.34  1.0

data_Li2RuPb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.13
_cell_length_b   4.69
_cell_length_c   4.74
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   93.94
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2RuPb
_chemical_formula_sum   'Li2 Ru1 Pb1'
_cell_volume   69.43
_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  0.5  0.34  0.63  1.0
  Li  Li1  1  0.69  0.98  0.63  1.0
  Ru  Ru2  1  0.0  0.0  0.0  1.0
  Pb  Pb3  1  0.6  0.66  0.0  1.0

Li Li Ru Pb
Li2RuPb crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one Li2RuPb cluster. There are two inequivalent Li sites. In the first Li site, Li(1) is bonded in a 1-coordinate geometry to one Pb(1) atom. The Li(1)-Pb(1) bond length is 2.32 Å. In the second Li site, Li(2) is bonded in a 1-coordinate geometry to one Ru(1) and one Pb(1) atom. The Li(2)-Ru(1) bond length is 2.00 Å. The Li(2)-Pb(1) bond length is 2.32 Å. Ru(1) is bonded in a 1-coordinate geometry to one Li(2) and one Pb(1) atom. The Ru(1)-Pb(1) bond length is 1.96 Å. Pb(1) is bonded in a 3-coordinate geometry to one Li(1), one Li(2), and one Ru(1) atom.