data_VRe2Sb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.16
_cell_length_b   3.16
_cell_length_c   6.35
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VRe2Sb
_chemical_formula_sum   'V1 Re2 Sb1'
_cell_volume   63.44
_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
  V  V3  1  0.0  0.0  0.0  1.0
  Re  Re0  1  0.58  0.58  0.48  1.0
  Re  Re1  1  0.58  0.58  0.87  1.0
  Sb  Sb2  1  0.0  0.0  0.18  1.0

data_VRe2Sb
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.47
_cell_length_b   4.47
_cell_length_c   6.35
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   VRe2Sb
_chemical_formula_sum   'V2 Re4 Sb2'
_cell_volume   126.88
_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
  V  V0  2  0.0  0.0  0.0  1.0
  Re  Re1  2  0.08  0.5  0.48  1.0
  Re  Re2  2  0.08  0.5  0.87  1.0
  Sb  Sb3  2  0.0  0.0  0.18  1.0

V Re Re Sb
V Re Re Sb 0 3 o o o 0 2 o o - 0 2 o - - 0 2 - o - 0 2 - - - 1 3 o o o 1 3 o + o 1 3 + o o 1 3 + + o 1 1 + o o 1 1 o + o 1 2 o o o 2 3 + + + 
VRe2Sb crystallizes in the monoclinic Cm space group. V(1) is bonded in a distorted single-bond geometry to four equivalent Re(2) and one Sb(1) atom. There are a spread of V(1)-Re(2) bond distances ranging from 2.04-2.72 Å. The V(1)-Sb(1) bond length is 1.11 Å. There are three inequivalent Re sites. In the first Re site, Re(1) is bonded in a 9-coordinate geometry to one Re(2), four equivalent Re(1), and four equivalent Sb(1) atoms. The Re(1)-Re(2) bond length is 2.50 Å. All Re(1)-Re(1) bond lengths are 3.16 Å. There are a spread of Re(1)-Sb(1) bond distances ranging from 2.69-3.23 Å. In the second Re site, Re(2) is bonded in a 5-coordinate geometry to four equivalent V(1) and one Re(1) atom. In the third Re site, Re(1) is bonded in a 9-coordinate geometry to one Re(2), four equivalent Re(1), and four equivalent Sb(1) atoms. The Re(1)-Re(2) bond length is 2.50 Å. There are a spread of Re(1)-Sb(1) bond distances ranging from 2.69-3.23 Å. Sb(1) is bonded in a single-bond geometry to one V(1) and four Re(1,1) atoms.