data_ZnH8C8(N2Cl)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.3
_cell_length_b   7.3
_cell_length_c   10.21
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   91.66
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnH8C8(N2Cl)2
_chemical_formula_sum   'Zn2 H16 C16 N8 Cl4'
_cell_volume   543.93
_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
  Zn  Zn0  1  0.0  0.0  0.0  1.0
  Zn  Zn1  1  0.09  0.0  0.1  1.0
  H  H2  1  0.51  0.5  0.64  1.0
  H  H3  1  0.67  0.5  0.64  1.0
  H  H4  1  0.67  0.5  0.56  1.0
  H  H5  1  0.51  0.5  0.56  1.0
  H  H6  1  0.76  0.5  0.46  1.0
  H  H7  1  0.42  0.5  0.46  1.0
  H  H8  1  0.42  0.5  0.75  1.0
  H  H9  1  0.76  0.5  0.75  1.0
  H  H10  1  0.42  0.7  0.66  1.0
  H  H11  1  0.75  0.3  0.66  1.0
  H  H12  1  0.75  0.7  0.54  1.0
  H  H13  1  0.42  0.3  0.54  1.0
  H  H14  1  0.75  0.54  0.44  1.0
  H  H15  1  0.42  0.46  0.44  1.0
  H  H16  1  0.42  0.54  0.77  1.0
  H  H17  1  0.75  0.46  0.77  1.0
  C  C18  1  0.56  0.83  0.5  1.0
  C  C19  1  0.61  0.17  0.5  1.0
  C  C20  1  0.61  0.83  0.71  1.0
  C  C21  1  0.56  0.17  0.71  1.0
  C  C22  1  0.7  0.17  0.6  1.0
  C  C23  1  0.48  0.83  0.6  1.0
  C  C24  1  0.48  0.17  0.6  1.0
  C  C25  1  0.7  0.83  0.6  1.0
  C  C26  1  0.67  0.15  0.61  1.0
  C  C27  1  0.5  0.85  0.61  1.0
  C  C28  1  0.5  0.15  0.59  1.0
  C  C29  1  0.67  0.85  0.59  1.0
  C  C30  1  0.59  0.85  0.49  1.0
  C  C31  1  0.59  0.15  0.49  1.0
  C  C32  1  0.59  0.85  0.71  1.0
  C  C33  1  0.59  0.15  0.71  1.0
  N  N34  1  0.6  0.99  0.56  1.0
  N  N35  1  0.57  0.01  0.56  1.0
  N  N36  1  0.57  0.99  0.64  1.0
  N  N37  1  0.6  0.01  0.64  1.0
  N  N38  1  0.66  0.01  0.54  1.0
  N  N39  1  0.52  0.99  0.54  1.0
  N  N40  1  0.52  0.01  0.66  1.0
  N  N41  1  0.66  0.99  0.66  1.0
  Cl  Cl42  1  0.09  0.19  0.0  1.0
  Cl  Cl43  1  0.09  0.81  0.0  1.0
  Cl  Cl44  1  0.09  0.57  0.1  1.0
  Cl  Cl45  1  0.09  0.43  0.1  1.0

data_ZnH8C8(N2Cl)2
_symmetry_space_group_name_H-M   P1
_cell_length_a   7.3
_cell_length_b   7.3
_cell_length_c   10.21
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   91.66
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnH8C8(N2Cl)2
_chemical_formula_sum   'Zn2 H16 C16 N8 Cl4'
_cell_volume   543.93
_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
  Zn  Zn0  1  0.0  0.0  0.0  1.0
  Zn  Zn1  1  0.09  0.0  0.1  1.0
  H  H2  1  0.42  0.5  0.75  1.0
  H  H3  1  0.42  0.5  0.46  1.0
  H  H4  1  0.42  0.3  0.54  1.0
  H  H5  1  0.42  0.46  0.44  1.0
  H  H6  1  0.42  0.54  0.77  1.0
  H  H7  1  0.42  0.7  0.66  1.0
  H  H8  1  0.51  0.5  0.56  1.0
  H  H9  1  0.51  0.5  0.64  1.0
  H  H10  1  0.67  0.5  0.64  1.0
  H  H11  1  0.67  0.5  0.56  1.0
  H  H12  1  0.75  0.3  0.66  1.0
  H  H13  1  0.75  0.46  0.77  1.0
  H  H14  1  0.75  0.54  0.44  1.0
  H  H15  1  0.75  0.7  0.54  1.0
  H  H16  1  0.76  0.5  0.46  1.0
  H  H17  1  0.76  0.5  0.75  1.0
  C  C18  1  0.48  0.17  0.6  1.0
  C  C19  1  0.48  0.83  0.6  1.0
  C  C20  1  0.5  0.15  0.59  1.0
  C  C21  1  0.5  0.85  0.61  1.0
  C  C22  1  0.56  0.17  0.71  1.0
  C  C23  1  0.56  0.83  0.5  1.0
  C  C24  1  0.59  0.15  0.49  1.0
  C  C25  1  0.59  0.85  0.71  1.0
  C  C26  1  0.59  0.15  0.71  1.0
  C  C27  1  0.59  0.85  0.49  1.0
  C  C28  1  0.61  0.17  0.5  1.0
  C  C29  1  0.61  0.83  0.71  1.0
  C  C30  1  0.67  0.15  0.61  1.0
  C  C31  1  0.67  0.85  0.59  1.0
  C  C32  1  0.7  0.17  0.6  1.0
  C  C33  1  0.7  0.83  0.6  1.0
  N  N34  1  0.52  0.01  0.66  1.0
  N  N35  1  0.52  0.99  0.54  1.0
  N  N36  1  0.57  0.01  0.56  1.0
  N  N37  1  0.57  0.99  0.64  1.0
  N  N38  1  0.6  0.01  0.64  1.0
  N  N39  1  0.6  0.99  0.56  1.0
  N  N40  1  0.66  0.01  0.54  1.0
  N  N41  1  0.66  0.99  0.66  1.0
  Cl  Cl42  1  0.09  0.19  0.0  1.0
  Cl  Cl43  1  0.09  0.43  0.1  1.0
  Cl  Cl44  1  0.09  0.57  0.1  1.0
  Cl  Cl45  1  0.09  0.81  0.0  1.0

Zn Zn H H H H H H H H H H H H H H H H C C C C C C C C C C C C C C C C N N N N N N N N Cl Cl Cl Cl