data_TiBiPd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.87
_cell_length_b   4.87
_cell_length_c   5.0
_cell_angle_alpha   100.57
_cell_angle_beta   100.57
_cell_angle_gamma   40.9
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiBiPd2
_chemical_formula_sum   'Ti1 Bi1 Pd2'
_cell_volume   76.24
_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  0.01  0.0  0.1  1.0
  Bi  Bi0  1  0.56  0.0  0.76  1.0
  Pd  Pd1  1  0.05  0.0  0.15  1.0
  Pd  Pd2  1  0.61  0.0  0.36  1.0

data_TiBiPd2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.4
_cell_length_b   4.87
_cell_length_c   5.0
_cell_angle_alpha   100.57
_cell_angle_beta   90.0
_cell_angle_gamma   110.45
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiBiPd2
_chemical_formula_sum   'Ti1 Bi1 Pd2'
_cell_volume   76.24
_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  0.99  0.9  1.0
  Bi  Bi1  1  0.0  0.44  0.24  1.0
  Pd  Pd2  1  0.0  0.39  0.64  1.0
  Pd  Pd3  1  0.0  0.95  0.85  1.0

Ti Bi Pd Pd
TiPd2Bi crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one TiPd2Bi cluster. Ti(1) is bonded in a single-bond geometry to one Pd(1) and one Bi(1) atom. The Ti(1)-Pd(1) bond length is 0.32 Å. The Ti(1)-Bi(1) bond length is 2.50 Å. There are two inequivalent Pd sites. In the first Pd site, Pd(1) is bonded in a single-bond geometry to one Ti(1) atom. In the second Pd site, Pd(2) is bonded in a 1-coordinate geometry to one Bi(1) atom. The Pd(2)-Bi(1) bond length is 2.06 Å. Bi(1) is bonded in a distorted bent 120 degrees geometry to one Ti(1) and one Pd(2) atom.