data_BaLi2La
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.93
_cell_length_b   3.93
_cell_length_c   8.82
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   91.69
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaLi2La
_chemical_formula_sum   'Ba1 Li2 La1'
_cell_volume   136.35
_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
  Ba  Ba0  1  0.0  0.0  0.0  1.0
  Li  Li2  1  0.74  0.0  0.34  1.0
  Li  Li3  1  0.74  0.0  0.48  1.0
  La  La1  1  0.0  0.0  0.41  1.0

data_BaLi2La
_symmetry_space_group_name_H-M   Pm
_cell_length_a   3.93
_cell_length_b   3.93
_cell_length_c   8.82
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   BaLi2La
_chemical_formula_sum   'Ba1 Li2 La1'
_cell_volume   136.41
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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
  Ba  Ba0  1  0.0  0.0  0.0  1.0
  Li  Li1  1  0.74  0.0  0.34  1.0
  Li  Li2  1  0.74  0.0  0.48  1.0
  La  La3  1  0.0  0.0  0.41  1.0

Ba Li Li La
Li2BaLa crystallizes in the monoclinic Pm space group. The structure is zero-dimensional and consists of one Li2BaLa cluster. There are two inequivalent Li sites. In the first Li site, Li(1) is bonded in a 2-coordinate geometry to one Li(2), one Ba(1), and one La(1) atom. The Li(1)-Li(2) bond length is 1.23 Å. The Li(1)-Ba(1) bond length is 3.17 Å. The Li(1)-La(1) bond length is 1.19 Å. In the second Li site, Li(2) is bonded in a 2-coordinate geometry to one Li(1) and one La(1) atom. The Li(2)-La(1) bond length is 1.19 Å. Ba(1) is bonded in a distorted single-bond geometry to one Li(1) atom. La(1) is bonded in a 2-coordinate geometry to one Li(1) and one Li(2) atom.