data_TlRe3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.33
_cell_length_b   5.33
_cell_length_c   5.33
_cell_angle_alpha   116.99
_cell_angle_beta   116.99
_cell_angle_gamma   116.99
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlRe3
_chemical_formula_sum   'Tl1 Re3'
_cell_volume   66.82
_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  Tl3  1  0.0  0.0  0.0  1.0
  Re  Re0  1  0.0  0.62  0.93  1.0
  Re  Re1  1  0.27  0.69  0.93  1.0
  Re  Re2  1  0.73  0.69  0.93  1.0

data_TlRe3
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.8
_cell_length_b   5.33
_cell_length_c   5.33
_cell_angle_alpha   116.99
_cell_angle_beta   100.1
_cell_angle_gamma   100.1
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlRe3
_chemical_formula_sum   'Tl1 Re3'
_cell_volume   66.82
_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  0.0  1.0
  Re  Re1  1  0.93  0.21  0.25  1.0
  Re  Re2  1  0.93  0.66  0.25  1.0
  Re  Re3  1  0.93  0.93  0.31  1.0

Tl Re Re Re
Re3Tl crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one Re3Tl cluster. There are three inequivalent Re sites. In the first Re site, Re(1) is bonded in a 3-coordinate geometry to one Re(2), one Re(3), and one Tl(1) atom. The Re(1)-Re(2) bond length is 1.33 Å. The Re(1)-Re(3) bond length is 1.64 Å. The Re(1)-Tl(1) bond length is 1.88 Å. In the second Re site, Re(2) is bonded in a distorted single-bond geometry to one Re(1) atom. In the third Re site, Re(3) is bonded in a single-bond geometry to one Re(1) and one Tl(1) atom. The Re(3)-Tl(1) bond length is 1.34 Å. Tl(1) is bonded in a distorted single-bond geometry to one Re(1) and one Re(3) atom.