data_ZrScPd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.76
_cell_length_b   4.76
_cell_length_c   3.29
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrScPd2
_chemical_formula_sum   'Zr1 Sc1 Pd2'
_cell_volume   74.72
_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
  Zr  Zr3  1  0.38  0.38  0.0  1.0
  Sc  Sc2  1  0.0  0.0  0.0  1.0
  Pd  Pd0  1  0.38  0.0  0.65  1.0
  Pd  Pd1  1  0.0  0.38  0.65  1.0

data_ZrScPd2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   6.73
_cell_length_b   6.73
_cell_length_c   3.29
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   ZrScPd2
_chemical_formula_sum   'Zr2 Sc2 Pd4'
_cell_volume   149.43
_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
  Zr  Zr0  2  0.38  0.0  -0.0  1.0
  Sc  Sc1  2  0.0  0.0  0.0  1.0
  Pd  Pd2  4  0.19  0.19  0.65  1.0

Zr Sc Pd Pd
Zr Sc Pd Pd 0 1 o o o 0 3 o o - 0 2 o o - 1 3 o o - 1 2 o o - 2 3 o o o 
ScZrPd2 crystallizes in the monoclinic Cm space group. The structure is zero-dimensional and consists of two ScZrPd2 clusters. Sc(1) is bonded in a 2-coordinate geometry to two equivalent Pd(1) atoms. Both Sc(1)-Pd(1) bond lengths are 2.16 Å. Zr(1) is bonded in a 2-coordinate geometry to two equivalent Pd(1) atoms. Both Zr(1)-Pd(1) bond lengths are 2.16 Å. Pd(1) is bonded in a 2-coordinate geometry to one Sc(1) and one Zr(1) atom.