data_TiB2W
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.73
_cell_length_b   4.73
_cell_length_c   4.73
_cell_angle_alpha   139.3
_cell_angle_beta   139.3
_cell_angle_gamma   58.92
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiB2W
_chemical_formula_sum   'Ti1 B2 W1'
_cell_volume   44.48
_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  0.12  1.0
  B  B0  1  0.0  0.0  0.0  1.0
  B  B1  1  0.64  0.0  0.06  1.0
  W  W3  1  0.0  0.64  0.06  1.0

data_TiB2W
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.29
_cell_length_b   3.29
_cell_length_c   4.73
_cell_angle_alpha   110.35
_cell_angle_beta   110.35
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiB2W
_chemical_formula_sum   'Ti1 B2 W1'
_cell_volume   44.48
_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  Ti0  1  0.88  0.0  0.88  1.0
  B  B1  1  0.0  0.0  0.0  1.0
  B  B2  1  0.94  0.0  0.59  1.0
  W  W3  1  0.59  0.64  0.59  1.0

Ti B B W
TiWB2 crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one TiWB2 cluster. Ti(1) is bonded in a 3-coordinate geometry to one W(1), one B(1), and one B(2) atom. The Ti(1)-W(1) bond length is 1.49 Å. The Ti(1)-B(1) bond length is 0.54 Å. The Ti(1)-B(2) bond length is 1.49 Å. W(1) is bonded in a 1-coordinate geometry to one Ti(1) atom. There are two inequivalent B sites. In the first B site, B(1) is bonded in a single-bond geometry to one Ti(1) atom. In the second B site, B(2) is bonded in a 1-coordinate geometry to one Ti(1) atom.