data_Sb2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.9
_cell_length_b   6.9
_cell_length_c   7.58
_cell_angle_alpha   122.77
_cell_angle_beta   122.77
_cell_angle_gamma   29.36
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sb2Pd
_chemical_formula_sum   'Sb4 Pd2'
_cell_volume   146.41
_cell_formula_units_Z   2
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
  Sb  Sb2  1  0.43  0.0  0.28  1.0
  Sb  Sb3  1  0.66  0.0  0.05  1.0
  Sb  Sb4  1  0.87  0.0  0.78  1.0
  Sb  Sb5  1  0.58  0.0  0.87  1.0
  Pd  Pd0  1  0.08  0.0  0.18  1.0
  Pd  Pd1  1  0.79  0.0  0.83  1.0

data_Sb2Pd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.49
_cell_length_b   6.9
_cell_length_c   6.96
_cell_angle_alpha   66.31
_cell_angle_beta   75.45
_cell_angle_gamma   75.32
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sb2Pd
_chemical_formula_sum   'Sb4 Pd2'
_cell_volume   146.41
_cell_formula_units_Z   2
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
  Sb  Sb0  1  0.0  0.1  0.78  1.0
  Sb  Sb1  1  0.0  0.16  0.28  1.0
  Sb  Sb2  1  0.0  0.61  0.05  1.0
  Sb  Sb3  1  0.0  0.71  0.87  1.0
  Pd  Pd4  1  0.0  0.89  0.18  1.0
  Pd  Pd5  1  0.0  0.97  0.83  1.0

Sb Sb Sb Sb Pd Pd
Sb Sb Sb Sb Pd Pd 0 4 o o o 1 3 o o - 1 4 + o o 2 5 o o o 2 4 + o + 4 5 - o - 