data_TaIn2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.84
_cell_length_b   4.84
_cell_length_c   4.84
_cell_angle_alpha   122.18
_cell_angle_beta   122.18
_cell_angle_gamma   86.26
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaIn2Pd
_chemical_formula_sum   'Ta1 In2 Pd1'
_cell_volume   77.37
_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
  Ta  Ta3  1  0.0  0.0  0.53  1.0
  In  In0  1  0.0  0.34  0.77  1.0
  In  In1  1  0.34  0.0  0.77  1.0
  Pd  Pd2  1  0.0  0.0  0.0  1.0

data_TaIn2Pd
_symmetry_space_group_name_H-M   Cm
_cell_length_a   6.62
_cell_length_b   6.62
_cell_length_c   4.84
_cell_angle_alpha   90.0
_cell_angle_beta   133.13
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   TaIn2Pd
_chemical_formula_sum   'Ta2 In4 Pd2'
_cell_volume   154.75
_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
  Ta  Ta0  2  0.0  0.0  0.53  1.0
  In  In1  4  0.33  0.33  0.43  1.0
  Pd  Pd2  2  0.0  0.0  0.0  1.0

Ta In In Pd
Ta In In Pd 0 1 o o o 0 2 o o o 0 3 o o + 0 3 o o o 1 3 o o + 1 3 o + + 2 3 + o + 2 3 o o + 
TaPdIn2 crystallizes in the monoclinic Cm space group. Ta(1) is bonded in a distorted water-like geometry to two equivalent Pd(1) and two equivalent In(1) atoms. There is one shorter (2.26 Å) and one longer (2.58 Å) Ta(1)-Pd(1) bond length. Both Ta(1)-In(1) bond lengths are 1.42 Å. Pd(1) is bonded in a 6-coordinate geometry to two equivalent Ta(1) and four equivalent In(1) atoms. There are two shorter (2.44 Å) and two longer (2.76 Å) Pd(1)-In(1) bond lengths. In(1) is bonded in a distorted single-bond geometry to one Ta(1) and two equivalent Pd(1) atoms.