data_ZnPd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.41
_cell_length_b   4.2
_cell_length_c   7.84
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnPd2
_chemical_formula_sum   'Zn4 Pd8'
_cell_volume   177.89
_cell_formula_units_Z   4
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
  Zn  Zn8  1  0.01  0.05  0.06  1.0
  Zn  Zn9  1  0.7  0.15  0.14  1.0
  Zn  Zn10  1  0.71  0.05  0.7  1.0
  Zn  Zn11  1  0.4  0.15  0.78  1.0
  Pd  Pd0  1  0.22  0.05  0.76  1.0
  Pd  Pd1  1  0.93  0.05  0.46  1.0
  Pd  Pd2  1  0.77  0.15  0.54  1.0
  Pd  Pd3  1  0.48  0.15  0.68  1.0
  Pd  Pd4  1  0.93  0.05  0.16  1.0
  Pd  Pd5  1  0.64  0.05  0.29  1.0
  Pd  Pd6  1  0.48  0.15  0.37  1.0
  Pd  Pd7  1  0.19  0.15  0.08  1.0

data_ZnPd2
_symmetry_space_group_name_H-M   P-1
_cell_length_a   4.2
_cell_length_b   5.41
_cell_length_c   7.84
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   ZnPd2
_chemical_formula_sum   'Zn4 Pd8'
_cell_volume   177.89
_cell_formula_units_Z   4
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-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
  Zn  Zn0  2  0.45  0.01  0.78  1.0
  Zn  Zn1  2  0.45  0.3  0.14  1.0
  Pd  Pd2  2  0.45  0.22  0.24  1.0
  Pd  Pd3  2  0.45  0.93  0.37  1.0
  Pd  Pd4  2  0.45  0.23  0.54  1.0
  Pd  Pd5  2  0.45  0.52  0.84  1.0

Zn Zn Zn Zn Pd Pd Pd Pd Pd Pd Pd Pd