data_TiCrSb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.96
_cell_length_b   4.96
_cell_length_c   4.96
_cell_angle_alpha   140.65
_cell_angle_beta   140.65
_cell_angle_gamma   56.87
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiCrSb
_chemical_formula_sum   'Ti1 Cr1 Sb1'
_cell_volume   48.75
_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
  Ti  Ti2  1  0.0  0.0  0.71  1.0
  Cr  Cr0  1  0.0  0.0  0.08  1.0
  Sb  Sb1  1  0.0  0.0  0.94  1.0

data_TiCrSb
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.73
_cell_length_b   4.73
_cell_length_c   4.96
_cell_angle_alpha   90.0
_cell_angle_beta   118.44
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   TiCrSb
_chemical_formula_sum   'Ti2 Cr2 Sb2'
_cell_volume   97.5
_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
  Ti  Ti0  2  0.21  0.5  0.71  1.0
  Cr  Cr1  2  0.08  0.0  0.08  1.0
  Sb  Sb2  2  0.44  0.5  0.94  1.0

Ti Cr Sb
TiCrSb is Cyanogen Chloride-like structured and crystallizes in the monoclinic Cm space group. The structure is zero-dimensional and consists of two TiCrSb clusters. Ti(1) is bonded in a single-bond geometry to one Sb(1) atom. The Ti(1)-Sb(1) bond length is 1.16 Å. Cr(1) is bonded in a single-bond geometry to one Sb(1) atom. The Cr(1)-Sb(1) bond length is 0.72 Å. Sb(1) is bonded in a linear geometry to one Ti(1) and one Cr(1) atom.