data_LiLaAu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.51
_cell_length_b   3.67
_cell_length_c   6.82
_cell_angle_alpha   90.0
_cell_angle_beta   90.98
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiLaAu2
_chemical_formula_sum   'Li1 La1 Au2'
_cell_volume   87.81
_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  Li3  1  0.0  0.0  0.0  1.0
  La  La2  1  0.94  0.0  0.41  1.0
  Au  Au0  1  0.72  0.83  0.42  1.0
  Au  Au1  1  0.67  0.83  0.4  1.0

data_LiLaAu2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.51
_cell_length_b   3.67
_cell_length_c   6.82
_cell_angle_alpha   90.0
_cell_angle_beta   90.98
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiLaAu2
_chemical_formula_sum   'Li1 La1 Au2'
_cell_volume   87.81
_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
  La  La1  1  0.94  0.0  0.41  1.0
  Au  Au2  1  0.67  0.83  0.4  1.0
  Au  Au3  1  0.72  0.83  0.42  1.0

Li La Au Au
LiLaAu2 is Indium-like structured and crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one LiLaAu2 cluster. Li(1) is bonded in a 2-coordinate geometry to one La(1) and one Au(2) atom. The Li(1)-La(1) bond length is 2.81 Å. The Li(1)-Au(2) bond length is 3.03 Å. La(1) is bonded in a distorted single-bond geometry to one Li(1) and one Au(1) atom. The La(1)-Au(1) bond length is 1.00 Å. There are two inequivalent Au sites. In the first Au site, Au(1) is bonded in a bent 120 degrees geometry to one La(1) and one Au(2) atom. The Au(1)-Au(2) bond length is 0.21 Å. In the second Au site, Au(2) is bonded in a distorted single-bond geometry to one Li(1) and one Au(1) atom.