data_LiBi2Te
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.58
_cell_length_b   4.58
_cell_length_c   5.53
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiBi2Te
_chemical_formula_sum   'Li1 Bi2 Te1'
_cell_volume   115.67
_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  Li2  1  0.0  0.0  0.0  1.0
  Bi  Bi0  1  0.29  0.0  0.76  1.0
  Bi  Bi1  1  0.0  0.29  0.76  1.0
  Te  Te3  1  0.29  0.29  0.0  1.0

data_LiBi2Te
_symmetry_space_group_name_H-M   Cm
_cell_length_a   6.47
_cell_length_b   6.47
_cell_length_c   5.53
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   LiBi2Te
_chemical_formula_sum   'Li2 Bi4 Te2'
_cell_volume   231.35
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.0  0.0  0.0  1.0
  Bi  Bi1  4  0.14  0.14  0.76  1.0
  Te  Te2  2  0.29  0.0  -0.0  1.0

Li Bi Bi Te
LiBi2Te is alpha Po structured and crystallizes in the monoclinic Cm space group. The structure is zero-dimensional and consists of two LiBi2Te clusters. Li(1) is bonded in a 3-coordinate geometry to two equivalent Bi(1) and one Te(1) atom. Both Li(1)-Bi(1) bond lengths are 1.86 Å. The Li(1)-Te(1) bond length is 1.86 Å. Bi(1) is bonded in a 1-coordinate geometry to one Li(1) and one Te(1) atom. The Bi(1)-Te(1) bond length is 1.86 Å. Te(1) is bonded in a 3-coordinate geometry to one Li(1) and two equivalent Bi(1) atoms.