data_TlVFeTc
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.4
_cell_length_b   4.4
_cell_length_c   4.4
_cell_angle_alpha   60.0
_cell_angle_beta   60.0
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlVFeTc
_chemical_formula_sum   'Tl1 V1 Fe1 Tc1'
_cell_volume   60.29
_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  0.67  0.67  0.67  1.0
  V  V3  1  0.0  0.0  0.0  1.0
  Fe  Fe0  1  0.11  0.11  0.11  1.0
  Tc  Tc1  1  0.56  0.56  0.56  1.0

data_TlVFeTc
_symmetry_space_group_name_H-M   R3m
_cell_length_a   4.4
_cell_length_b   4.4
_cell_length_c   10.78
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   TlVFeTc
_chemical_formula_sum   'Tl3 V3 Fe3 Tc3'
_cell_volume   180.88
_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  0.33  1.0
  V  V1  3  0.0  0.0  0.0  1.0
  Fe  Fe2  3  0.0  0.0  0.89  1.0
  Tc  Tc3  3  0.0  0.0  0.44  1.0

Tl V Fe Tc
FeVTcTl is Cubic alpha N2-derived structured and crystallizes in the trigonal R3m space group. The structure is zero-dimensional and consists of three FeV clusters and three TcTl clusters. In each FeV cluster, V(1) is bonded in a single-bond geometry to one Fe(1) atom. The V(1)-Fe(1) bond length is 1.21 Å. Fe(1) is bonded in a single-bond geometry to one V(1) atom. In each TcTl cluster, Tc(1) is bonded in a single-bond geometry to one Tl(1) atom. The Tc(1)-Tl(1) bond length is 1.21 Å. Tl(1) is bonded in a single-bond geometry to one Tc(1) atom.