data_Tl2ReBi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.25
_cell_length_b   3.25
_cell_length_c   10.66
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   114.48
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tl2ReBi
_chemical_formula_sum   'Tl2 Re1 Bi1'
_cell_volume   102.48
_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
  Tl  Tl2  1  0.76  0.0  0.39  1.0
  Tl  Tl3  1  0.0  0.0  0.13  1.0
  Re  Re1  1  0.0  0.0  0.68  1.0
  Bi  Bi0  1  0.76  0.0  0.8  1.0

data_Tl2ReBi
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.25
_cell_length_b   3.25
_cell_length_c   10.66
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   114.48
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tl2ReBi
_chemical_formula_sum   'Tl2 Re1 Bi1'
_cell_volume   102.48
_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
  Tl  Tl0  1  0.0  0.0  0.13  1.0
  Tl  Tl1  1  0.76  0.0  0.39  1.0
  Re  Re2  1  0.0  0.0  0.68  1.0
  Bi  Bi3  1  0.76  0.0  0.8  1.0

Tl Tl Re Bi
ReTl2Bi crystallizes in the triclinic P1 space group. Re(1) is bonded in a single-bond geometry to one Tl(1) and one Bi(1) atom. The Re(1)-Tl(1) bond length is 3.20 Å. The Re(1)-Bi(1) bond length is 1.49 Å. There are two inequivalent Tl sites. In the first Tl site, Tl(1) is bonded in a 2-coordinate geometry to one Re(1) and one Tl(2) atom. The Tl(1)-Tl(2) bond length is 2.80 Å. In the second Tl site, Tl(2) is bonded in a 8-coordinate geometry to one Tl(1), six equivalent Tl(2), and one Bi(1) atom. There are four shorter (3.25 Å) and two longer (3.52 Å) Tl(2)-Tl(2) bond lengths. The Tl(2)-Bi(1) bond length is 3.68 Å. Bi(1) is bonded in a single-bond geometry to one Re(1) and one Tl(2) atom.