data_LiTl2Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.26
_cell_length_b   6.26
_cell_length_c   5.68
_cell_angle_alpha   116.21
_cell_angle_beta   116.21
_cell_angle_gamma   32.3
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTl2Cl
_chemical_formula_sum   'Li1 Tl2 Cl1'
_cell_volume   105.59
_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  0.82  0.0  0.57  1.0
  Tl  Tl2  1  0.23  0.0  0.1  1.0
  Tl  Tl3  1  0.9  0.0  0.71  1.0
  Cl  Cl0  1  0.17  0.0  0.19  1.0

data_LiTl2Cl
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.48
_cell_length_b   5.68
_cell_length_c   6.26
_cell_angle_alpha   116.21
_cell_angle_beta   106.15
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTl2Cl
_chemical_formula_sum   'Li1 Tl2 Cl1'
_cell_volume   105.59
_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  0.57  0.82  1.0
  Tl  Tl1  1  0.0  0.1  0.23  1.0
  Tl  Tl2  1  0.0  0.71  0.9  1.0
  Cl  Cl3  1  0.0  0.19  0.17  1.0

Li Tl Tl Cl
LiTlTlCl is beta oxygen-derived structured and crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one thallium chloride molecule and one LiTl cluster. In the LiTl cluster, Li(1) is bonded in a single-bond geometry to one Tl(2) atom. The Li(1)-Tl(2) bond length is 0.74 Å. Tl(2) is bonded in a single-bond geometry to one Li(1) atom.