data_TlVReAg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.6
_cell_length_b   4.6
_cell_length_c   4.6
_cell_angle_alpha   60.0
_cell_angle_beta   60.0
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlVReAg
_chemical_formula_sum   'Tl1 V1 Re1 Ag1'
_cell_volume   68.78
_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  0.25  0.25  0.25  1.0
  V  V3  1  0.0  0.0  0.0  1.0
  Re  Re1  1  0.88  0.88  0.88  1.0
  Ag  Ag0  1  0.63  0.63  0.63  1.0

data_TlVReAg
_symmetry_space_group_name_H-M   R3m
_cell_length_a   4.6
_cell_length_b   4.6
_cell_length_c   11.26
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   TlVReAg
_chemical_formula_sum   'Tl3 V3 Re3 Ag3'
_cell_volume   206.33
_cell_formula_units_Z   3
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-y, x-y, z'
  3  '-x+y, -x, z'
  4  '-y, -x, z'
  5  '-x+y, y, z'
  6  'x, x-y, z'
  7  'x+1/3, y+2/3, z+2/3'
  8  '-y+1/3, x-y+2/3, z+2/3'
  9  '-x+y+1/3, -x+2/3, z+2/3'
  10  '-y+1/3, -x+2/3, z+2/3'
  11  '-x+y+1/3, y+2/3, z+2/3'
  12  'x+1/3, x-y+2/3, z+2/3'
  13  'x+2/3, y+1/3, z+1/3'
  14  '-y+2/3, x-y+1/3, z+1/3'
  15  '-x+y+2/3, -x+1/3, z+1/3'
  16  '-y+2/3, -x+1/3, z+1/3'
  17  '-x+y+2/3, y+1/3, z+1/3'
  18  'x+2/3, x-y+1/3, z+1/3'
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  3  0.0  0.0  0.75  1.0
  V  V1  3  0.0  0.0  0.0  1.0
  Re  Re2  3  0.0  0.0  0.12  1.0
  Ag  Ag3  3  0.0  0.0  0.37  1.0

Tl V Re Ag
VReAgTl crystallizes in the trigonal R3m space group. V(1) is bonded in a single-bond geometry to one Re(1), three equivalent Ag(1), and four equivalent Tl(1) atoms. The V(1)-Re(1) bond length is 1.38 Å. All V(1)-Ag(1) bond lengths are 2.69 Å. There are three shorter (2.81 Å) and one longer (2.84 Å) V(1)-Tl(1) bond length. Re(1) is bonded in a single-bond geometry to one V(1), four equivalent Ag(1), and three equivalent Tl(1) atoms. There are three shorter (2.81 Å) and one longer (2.84 Å) Re(1)-Ag(1) bond length. All Re(1)-Tl(1) bond lengths are 2.69 Å. Ag(1) is bonded in a 10-coordinate geometry to three equivalent V(1), four equivalent Re(1), and three equivalent Tl(1) atoms. All Ag(1)-Tl(1) bond lengths are 2.69 Å. Tl(1) is bonded in a 10-coordinate geometry to four equivalent V(1), three equivalent Re(1), and three equivalent Ag(1) atoms.