data_TiBiPd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.9
_cell_length_b   4.9
_cell_length_c   4.9
_cell_angle_alpha   127.58
_cell_angle_beta   127.58
_cell_angle_gamma   77.31
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiBiPd2
_chemical_formula_sum   'Ti1 Bi1 Pd2'
_cell_volume   71.76
_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  Ti3  1  0.0  0.0  0.0  1.0
  Bi  Bi0  1  0.0  0.16  0.91  1.0
  Pd  Pd1  1  0.0  0.0  0.83  1.0
  Pd  Pd2  1  0.16  0.0  0.91  1.0

data_TiBiPd2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.33
_cell_length_b   4.33
_cell_length_c   4.9
_cell_angle_alpha   116.21
_cell_angle_beta   116.21
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiBiPd2
_chemical_formula_sum   'Ti1 Bi1 Pd2'
_cell_volume   71.76
_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  0.0  0.0  0.0  1.0
  Bi  Bi1  1  0.25  0.16  0.25  1.0
  Pd  Pd2  1  0.09  0.0  0.25  1.0
  Pd  Pd3  1  0.17  0.0  0.17  1.0

Ti Bi Pd Pd
TiPd2Bi is Copper structured and crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one TiPd2Bi cluster. Ti(1) is bonded in a distorted single-bond geometry to one Pd(1) atom. The Ti(1)-Pd(1) bond length is 0.84 Å. There are two inequivalent Pd sites. In the first Pd site, Pd(1) is bonded in a 3-coordinate geometry to one Ti(1), one Pd(2), and one Bi(1) atom. The Pd(1)-Pd(2) bond length is 0.64 Å. The Pd(1)-Bi(1) bond length is 0.64 Å. In the second Pd site, Pd(2) is bonded in a 1-coordinate geometry to one Pd(1) atom. Bi(1) is bonded in a single-bond geometry to one Pd(1) atom.