data_ZnCdC4(SN)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.18
_cell_length_b   8.18
_cell_length_c   8.18
_cell_angle_alpha   94.11
_cell_angle_beta   94.11
_cell_angle_gamma   148.95
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnCdC4(SN)4
_chemical_formula_sum   'Zn1 Cd1 C4 S4 N4'
_cell_volume   271.9
_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
  Zn  Zn13  1  0.0  0.0  0.0  1.0
  Cd  Cd4  1  0.57  0.0  0.09  1.0
  C  C0  1  0.12  0.54  0.76  1.0
  C  C1  1  0.04  0.7  0.43  1.0
  C  C2  1  0.54  0.88  0.62  1.0
  C  C3  1  0.45  0.04  0.57  1.0
  S  S9  1  0.61  0.87  0.96  1.0
  S  S10  1  0.7  0.19  0.23  1.0
  S  S11  1  0.87  0.39  0.42  1.0
  S  S12  1  0.96  0.7  0.77  1.0
  N  N5  1  0.47  0.56  0.32  1.0
  N  N6  1  0.02  0.04  0.87  1.0
  N  N7  1  0.56  0.53  0.06  1.0
  N  N8  1  0.1  0.02  0.13  1.0

data_ZnCdC4(SN)4
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.38
_cell_length_b   8.18
_cell_length_c   8.18
_cell_angle_alpha   85.89
_cell_angle_beta   74.48
_cell_angle_gamma   74.48
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnCdC4(SN)4
_chemical_formula_sum   'Zn1 Cd1 C4 S4 N4'
_cell_volume   271.9
_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
  Zn  Zn0  1  0.0  0.0  0.0  1.0
  Cd  Cd1  1  0.91  0.09  0.57  1.0
  C  C2  1  0.26  0.62  0.66  1.0
  C  C3  1  0.27  0.43  0.34  1.0
  C  C4  1  0.46  0.57  0.41  1.0
  C  C5  1  0.77  0.76  0.59  1.0
  S  S6  1  0.91  0.96  0.74  1.0
  S  S7  1  0.94  0.77  0.26  1.0
  S  S8  1  0.95  0.23  0.52  1.0
  S  S9  1  0.97  0.42  0.48  1.0
  N  N10  1  0.17  0.87  0.98  1.0
  N  N11  1  0.24  0.32  0.91  1.0
  N  N12  1  0.47  0.06  0.02  1.0
  N  N13  1  0.89  0.13  0.09  1.0

Zn Cd C C C C S S S S N N N N
Zn Cd C C C C S S S S N N N N 0 11 o o - 0 13 o o o 0 9 - - - 0 12 o o o 0 12 - - o 1 7 o o o 1 2 o - - 1 6 o - - 2 8 - o o 2 5 - o o 2 5 o + o 2 4 - - o 2 4 o o o 2 9 - o o 2 6 o o o 3 8 - o o 3 5 o + o 3 9 - o o 4 5 o + o 5 9 o o o 5 9 - - o 6 12 o o + 7 8 o o o 9 13 + + + 9 11 + + o 10 13 o o o 10 12 o o o 11 12 o o + 12 13 o o o 12 13 + + o 