ZYN
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAA | CBA | sing | 1.53Å | 1.53Å | |
| CAB | CBA | sing | 1.53Å | 1.53Å | |
| CAC | NBB | sing | 1.47Å | 1.48Å | |
| CAD | NBB | sing | 1.46Å | 1.48Å | |
| OAE | CAQ | doub | 1.22Å | 1.25Å | |
| OAF | CAR | doub | 1.22Å | 1.24Å | |
| OAG | CAZ | doub | 1.22Å | 1.23Å | |
| OAH | CAV | sing | 1.35Å | 1.38Å | |
| FAI | CAS | sing | 1.35Å | 1.33Å | |
| CLAJ | CAU | sing | 1.74Å | 1.70Å | |
| CAK | CAL | doub | 1.38Å | 1.40Å | Aromatic |
| CAK | CAS | sing | 1.38Å | 1.37Å | Aromatic |
| CAL | CAT | sing | 1.38Å | 1.39Å | Aromatic |
| CAM | CAT | doub | 1.38Å | 1.38Å | Aromatic |
| CAM | CAU | sing | 1.38Å | 1.38Å | Aromatic |
| CAN | CAO | sing | 1.53Å | 1.50Å | |
| CAN | CAW | sing | 1.51Å | 1.50Å | |
| CAO | NBC | sing | 1.46Å | 1.44Å | |
| CAP | CAT | sing | 1.51Å | 1.51Å | |
| CAP | NBC | sing | 1.46Å | 1.43Å | |
| CAQ | CAY | sing | 1.47Å | 1.54Å | |
| CAQ | NBB | sing | 1.35Å | 1.35Å | |
| CAR | CAX | sing | 1.48Å | 1.41Å | |
| CAR | NBC | sing | 1.35Å | 1.39Å | |
| CAS | CAU | doub | 1.38Å | 1.37Å | Aromatic |
| CAV | CAX | doub | 1.38Å | 1.41Å | |
| CAV | CAZ | sing | 1.47Å | 1.41Å | |
| CAW | CAX | sing | 1.41Å | 1.40Å | |
| CAW | CAY | doub | 1.36Å | 1.40Å | |
| CAY | NBD | sing | 1.37Å | 1.39Å | |
| CAZ | NBD | sing | 1.35Å | 1.42Å | |
| CBA | NBD | sing | 1.47Å | 1.49Å | |
| CAA | HAA | sing | 1.09Å | 1.10Å | |
| CAA | HAAA | sing | 1.09Å | 1.10Å | |
| CAA | HAAB | sing | 1.09Å | 1.10Å | |
| CAB | HAB | sing | 1.09Å | 1.10Å | |
| CAB | HABA | sing | 1.09Å | 1.10Å | |
| CAB | HABB | sing | 1.09Å | 1.10Å | |
| CAC | HAC | sing | 1.09Å | 1.10Å | |
| CAC | HACA | sing | 1.09Å | 1.10Å | |
| CAC | HACB | sing | 1.09Å | 1.10Å | |
| CAD | HAD | sing | 1.09Å | 1.10Å | |
| CAD | HADA | sing | 1.09Å | 1.10Å | |
| CAD | HADB | sing | 1.09Å | 1.10Å | |
| OAH | HOAH | sing | 0.97Å | 0.95Å | |
| CAK | HAK | sing | 1.08Å | 1.08Å | |
| CAL | HAL | sing | 1.08Å | 1.08Å | |
| CAM | HAM | sing | 1.08Å | 1.08Å | |
| CAN | HAN | sing | 1.09Å | 1.10Å | |
| CAN | HANA | sing | 1.09Å | 1.10Å | |
| CAO | HAO | sing | 1.09Å | 1.10Å | |
| CAO | HAOA | sing | 1.09Å | 1.10Å | |
| CAP | HAP | sing | 1.09Å | 1.10Å | |
| CAP | HAPA | sing | 1.09Å | 1.10Å | |
| CBA | HBA | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAA | CBA | CAB | 111.1° | 109.5° |
| CAA | CBA | NBD | 113.8° | 109.5° |
| CBA | CAA | HAA | 109.5° | 109.5° |
| CBA | CAA | HAAA | 109.5° | 109.5° |
| CBA | CAA | HAAB | 109.4° | 109.5° |
| CAA | CBA | HBA | 105.2° | 109.5° |
| CAB | CBA | NBD | 109.3° | 109.4° |
| CBA | CAB | HAB | 109.5° | 109.5° |
| CBA | CAB | HABA | 109.5° | 109.5° |
| CBA | CAB | HABB | 109.4° | 109.5° |
| CAB | CBA | HBA | 110.1° | 109.5° |
| CAC | NBB | CAD | 121.2° | 120.0° |
| CAC | NBB | CAQ | 118.2° | 120.0° |
| NBB | CAC | HAC | 109.5° | 109.5° |
| NBB | CAC | HACA | 109.4° | 109.5° |
| NBB | CAC | HACB | 109.5° | 109.4° |
| CAD | NBB | CAQ | 120.6° | 120.0° |
| NBB | CAD | HAD | 109.5° | 109.5° |
| NBB | CAD | HADA | 109.5° | 109.5° |
| NBB | CAD | HADB | 109.5° | 109.5° |
| OAE | CAQ | CAY | 116.9° | 120.0° |
| OAE | CAQ | NBB | 124.7° | 120.0° |
| OAF | CAR | CAX | 121.7° | 120.4° |
| OAF | CAR | NBC | 118.3° | 120.4° |
| OAG | CAZ | CAV | 119.1° | 120.4° |
| OAG | CAZ | NBD | 120.1° | 120.3° |
| OAH | CAV | CAX | 120.6° | 120.8° |
| OAH | CAV | CAZ | 119.8° | 120.8° |
| CAV | OAH | HOAH | 109.5° | 114.0° |
| FAI | CAS | CAK | 120.6° | 120.1° |
| FAI | CAS | CAU | 118.1° | 120.0° |
| CLAJ | CAU | CAM | 122.6° | 120.0° |
| CLAJ | CAU | CAS | 114.9° | 120.1° |
| CAL | CAK | CAS | 117.0° | 120.0° |
| CAK | CAL | CAT | 121.3° | 120.0° |
| CAL | CAK | HAK | 121.5° | 120.0° |
| CAK | CAL | HAL | 119.3° | 120.0° |
| CAK | CAS | CAU | 121.3° | 120.0° |
| CAS | CAK | HAK | 121.5° | 120.0° |
| CAL | CAT | CAM | 120.7° | 120.1° |
| CAL | CAT | CAP | 120.9° | 120.0° |
| CAT | CAL | HAL | 119.3° | 120.0° |
| CAT | CAM | CAU | 117.1° | 120.0° |
| CAM | CAT | CAP | 118.2° | 120.0° |
| CAT | CAM | HAM | 121.4° | 120.0° |
| CAM | CAU | CAS | 122.5° | 119.9° |
| CAU | CAM | HAM | 121.5° | 120.0° |
| CAO | CAN | CAW | 113.3° | 110.1° |
| CAN | CAO | NBC | 114.0° | 111.1° |
| CAO | CAN | HAN | 108.2° | 109.4° |
| CAO | CAN | HANA | 108.2° | 109.4° |
| CAN | CAO | HAO | 108.0° | 109.1° |
| CAN | CAO | HAOA | 108.0° | 109.2° |
| CAN | CAW | CAX | 121.8° | 119.0° |
| CAN | CAW | CAY | 118.5° | 120.7° |
| CAW | CAN | HAN | 108.2° | 109.3° |
| CAW | CAN | HANA | 108.3° | 109.4° |
| CAO | NBC | CAP | 116.0° | 119.5° |
| CAO | NBC | CAR | 123.0° | 121.1° |
| NBC | CAO | HAO | 108.0° | 109.2° |
| NBC | CAO | HAOA | 108.0° | 109.1° |
| CAT | CAP | NBC | 112.7° | 109.5° |
| CAT | CAP | HAP | 108.4° | 109.5° |
| CAT | CAP | HAPA | 108.4° | 109.5° |
| CAP | NBC | CAR | 120.5° | 119.4° |
| NBC | CAP | HAP | 108.4° | 109.5° |
| NBC | CAP | HAPA | 108.4° | 109.5° |
| CAY | CAQ | NBB | 118.4° | 120.0° |
| CAQ | CAY | CAW | 120.4° | 119.3° |
| CAQ | CAY | NBD | 117.8° | 119.3° |
| CAX | CAR | NBC | 120.0° | 119.2° |
| CAR | CAX | CAV | 121.0° | 121.5° |
| CAR | CAX | CAW | 119.1° | 119.0° |
| CAX | CAV | CAZ | 119.7° | 118.3° |
| CAV | CAX | CAW | 119.9° | 119.5° |
| CAV | CAZ | NBD | 120.8° | 119.3° |
| CAX | CAW | CAY | 119.7° | 120.3° |
| CAW | CAY | NBD | 121.7° | 121.4° |
| CAY | NBD | CAZ | 118.2° | 121.2° |
| CAY | NBD | CBA | 118.0° | 119.4° |
| CAZ | NBD | CBA | 123.8° | 119.4° |
| NBD | CBA | HBA | 107.1° | 109.5° |
| HAA | CAA | HAAA | 109.5° | 109.4° |
| HAA | CAA | HAAB | 109.5° | 109.5° |
| HAAA | CAA | HAAB | 109.5° | 109.5° |
| HAB | CAB | HABA | 109.5° | 109.5° |
| HAB | CAB | HABB | 109.4° | 109.4° |
| HABA | CAB | HABB | 109.5° | 109.5° |
| HAC | CAC | HACA | 109.5° | 109.5° |
| HAC | CAC | HACB | 109.4° | 109.5° |
| HACA | CAC | HACB | 109.5° | 109.5° |
| HAD | CAD | HADA | 109.4° | 109.5° |
| HAD | CAD | HADB | 109.4° | 109.5° |
| HADA | CAD | HADB | 109.5° | 109.4° |
| HAN | CAN | HANA | 110.7° | 109.2° |
| HAO | CAO | HAOA | 110.9° | 109.1° |
| HAP | CAP | HAPA | 110.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAA | CBA | CAB | NBD | 126.4° | 120.0° |
| CAA | CBA | CAB | HBA | 116.1° | 120.0° |
| CAA | CBA | NBD | CAY | 120.9° | 118.4° |
| CAA | CBA | NBD | CAZ | 60.7° | 61.6° |
| CAA | CBA | NBD | HBA | 115.8° | 120.0° |
| CBA | CAA | HAA | HAAA | 120.0° | 120.0° |
| CBA | CAA | HAA | HAAB | 120.0° | 120.1° |
| CBA | CAA | HAAA | HAAB | 120.0° | 120.0° |
| CAA | CBA | CAB | HAB | 180.0° | 60.0° |
| CAA | CBA | CAB | HABA | 60.0° | 180.0° |
| CAA | CBA | CAB | HABB | 60.0° | 60.0° |
| CAB | CBA | NBD | CAY | 114.2° | 121.6° |
| CAB | CBA | NBD | CAZ | 64.1° | 58.4° |
| CAB | CBA | NBD | HBA | 119.3° | 120.0° |
| CAB | CBA | CAA | HAA | 180.0° | 56.7° |
| CAB | CBA | CAA | HAAA | 60.0° | 176.6° |
| CAB | CBA | CAA | HAAB | 60.0° | 63.4° |
| CBA | CAB | HAB | HABA | 120.0° | 120.0° |
| CBA | CAB | HAB | HABB | 120.0° | 120.0° |
| CBA | CAB | HABA | HABB | 120.0° | 120.0° |
| CAC | NBB | CAD | CAQ | 178.1° | 180.0° |
| CAC | NBB | CAQ | OAE | 0.1° | 4.9° |
| CAC | NBB | CAQ | CAY | 179.2° | 175.0° |
| NBB | CAC | HAC | HACA | 120.0° | 120.0° |
| NBB | CAC | HAC | HACB | 120.0° | 120.0° |
| NBB | CAC | HACA | HACB | 120.0° | 119.9° |
| CAC | NBB | CAD | HAD | 180.0° | 95.2° |
| CAC | NBB | CAD | HADA | 60.0° | 144.8° |
| CAC | NBB | CAD | HADB | 60.0° | 24.8° |
| CAD | NBB | CAQ | OAE | 178.2° | 175.1° |
| CAD | NBB | CAQ | CAY | 1.1° | 4.9° |
| CAD | NBB | CAC | HAC | 180.0° | 90.0° |
| CAD | NBB | CAC | HACA | 60.0° | 150.0° |
| CAD | NBB | CAC | HACB | 60.0° | 30.0° |
| NBB | CAD | HAD | HADA | 120.0° | 120.0° |
| NBB | CAD | HAD | HADB | 120.0° | 120.0° |
| NBB | CAD | HADA | HADB | 120.0° | 120.0° |
| OAE | CAQ | CAY | NBB | 179.4° | 180.0° |
| OAE | CAQ | CAY | CAW | 94.2° | 91.4° |
| OAE | CAQ | CAY | NBD | 82.6° | 88.6° |
| OAF | CAR | NBC | CAO | 174.3° | 172.4° |
| OAF | CAR | NBC | CAP | 2.6° | 7.6° |
| OAF | CAR | CAX | NBC | 179.0° | 180.0° |
| OAF | CAR | CAX | CAV | 6.7° | 12.3° |
| OAF | CAR | CAX | CAW | 172.2° | 166.6° |
| OAG | CAZ | CAV | OAH | 1.0° | 0.1° |
| OAG | CAZ | CAV | CAX | 179.4° | 179.9° |
| OAG | CAZ | CAV | NBD | 179.9° | 180.0° |
| OAG | CAZ | NBD | CAY | 179.3° | 178.6° |
| OAG | CAZ | NBD | CBA | 0.9° | 1.4° |
| OAH | CAV | CAX | CAR | 0.4° | 0.8° |
| OAH | CAV | CAX | CAZ | 179.5° | 180.0° |
| OAH | CAV | CAX | CAW | 178.4° | 178.1° |
| OAH | CAV | CAZ | NBD | 178.8° | 179.9° |
| FAI | CAS | CAU | CLAJ | 1.0° | 0.0° |
| FAI | CAS | CAK | CAL | 179.7° | 180.0° |
| FAI | CAS | CAK | CAU | 178.9° | 180.0° |
| FAI | CAS | CAU | CAM | 179.6° | 180.0° |
| FAI | CAS | CAK | HAK | 0.3° | 0.2° |
| CLAJ | CAU | CAS | CAK | 180.0° | 180.0° |
| CLAJ | CAU | CAM | CAT | 178.2° | 180.0° |
| CLAJ | CAU | CAM | CAS | 179.4° | 180.0° |
| CLAJ | CAU | CAM | HAM | 1.9° | 0.1° |
| CAL | CAK | CAS | HAK | 180.0° | 179.8° |
| CAK | CAL | CAT | HAL | 180.0° | 179.9° |
| CAK | CAL | CAT | CAM | 1.5° | 0.0° |
| CAK | CAL | CAT | CAP | 176.5° | 180.0° |
| CAL | CAK | CAS | CAU | 1.4° | 0.1° |
| CAS | CAK | CAL | CAT | 0.3° | 0.0° |
| CAK | CAS | CAU | CAM | 0.6° | 0.1° |
| CAS | CAK | CAL | HAL | 179.7° | 180.0° |
| CAL | CAT | CAM | CAP | 175.1° | 180.0° |
| CAL | CAT | CAM | CAU | 2.2° | 0.0° |
| CAL | CAT | CAP | NBC | 96.3° | 90.0° |
| CAT | CAL | CAK | HAK | 179.7° | 179.8° |
| CAL | CAT | CAM | HAM | 177.8° | 180.0° |
| CAL | CAT | CAP | HAP | 23.7° | 150.0° |
| CAL | CAT | CAP | HAPA | 143.7° | 30.1° |
| CAT | CAM | CAU | HAM | 180.0° | 179.9° |
| CAM | CAT | CAP | NBC | 88.5° | 90.0° |
| CAT | CAM | CAU | CAS | 1.2° | 0.0° |
| CAM | CAT | CAL | HAL | 178.5° | 180.0° |
| CAM | CAT | CAP | HAP | 151.5° | 30.1° |
| CAM | CAT | CAP | HAPA | 31.5° | 150.0° |
| CAU | CAM | CAT | CAP | 177.4° | 180.0° |
| CAO | CAN | CAW | HAN | 120.0° | 120.2° |
| CAO | CAN | CAW | HANA | 120.0° | 120.2° |
| CAN | CAO | NBC | HAO | 120.0° | 120.4° |
| CAN | CAO | NBC | HAOA | 120.0° | 120.4° |
| CAN | CAO | NBC | CAP | 161.0° | 139.4° |
| CAN | CAO | NBC | CAR | 27.0° | 40.6° |
| CAO | CAN | CAW | CAX | 23.2° | 33.3° |
| CAO | CAN | CAW | CAY | 157.6° | 146.9° |
| CAO | CAN | HAN | HANA | 118.4° | 119.7° |
| CAN | CAO | HAO | HAOA | 118.1° | 119.2° |
| CAW | CAN | CAO | NBC | 34.1° | 51.1° |
| CAN | CAW | CAY | CAQ | 0.6° | 1.2° |
| CAN | CAW | CAX | CAR | 1.4° | 1.4° |
| CAN | CAW | CAX | CAV | 177.5° | 177.4° |
| CAN | CAW | CAX | CAY | 179.1° | 179.8° |
| CAN | CAW | CAY | NBD | 177.3° | 178.9° |
| CAW | CAN | HAN | HANA | 118.5° | 119.7° |
| CAW | CAN | CAO | HAO | 85.9° | 171.5° |
| CAW | CAN | CAO | HAOA | 154.1° | 69.3° |
| CAO | NBC | CAP | CAT | 93.8° | 90.0° |
| CAO | NBC | CAP | CAR | 172.3° | 180.0° |
| CAO | NBC | CAR | CAX | 4.7° | 7.6° |
| NBC | CAO | CAN | HAN | 85.9° | 171.3° |
| NBC | CAO | CAN | HANA | 154.1° | 69.1° |
| NBC | CAO | HAO | HAOA | 118.2° | 119.2° |
| CAO | NBC | CAP | HAP | 26.2° | 30.0° |
| CAO | NBC | CAP | HAPA | 146.2° | 150.0° |
| CAT | CAP | NBC | HAP | 120.0° | 120.0° |
| CAT | CAP | NBC | HAPA | 120.0° | 120.0° |
| CAT | CAP | NBC | CAR | 94.0° | 90.0° |
| CAP | CAT | CAL | HAL | 3.5° | 0.1° |
| CAP | CAT | CAM | HAM | 2.6° | 0.1° |
| CAT | CAP | HAP | HAPA | 118.7° | 120.0° |
| CAP | NBC | CAR | CAX | 176.4° | 172.4° |
| CAP | NBC | CAO | HAO | 79.0° | 19.0° |
| CAP | NBC | CAO | HAOA | 41.0° | 100.2° |
| NBC | CAP | HAP | HAPA | 118.7° | 120.0° |
| CAQ | CAY | CAW | CAX | 178.5° | 179.1° |
| CAQ | CAY | CAW | NBD | 176.6° | 179.9° |
| CAQ | CAY | NBD | CAZ | 178.2° | 179.0° |
| CAQ | CAY | NBD | CBA | 3.4° | 1.0° |
| NBB | CAQ | CAY | CAW | 86.4° | 88.7° |
| NBB | CAQ | CAY | NBD | 96.8° | 91.4° |
| CAQ | NBB | CAC | HAC | 1.9° | 90.0° |
| CAQ | NBB | CAC | HACA | 121.8° | 30.0° |
| CAQ | NBB | CAC | HACB | 118.1° | 150.0° |
| CAQ | NBB | CAD | HAD | 1.9° | 84.8° |
| CAQ | NBB | CAD | HADA | 118.1° | 35.2° |
| CAQ | NBB | CAD | HADB | 121.9° | 155.2° |
| CAR | CAX | CAV | CAW | 178.9° | 178.8° |
| CAR | CAX | CAV | CAZ | 180.0° | 179.2° |
| CAR | CAX | CAW | CAY | 179.4° | 178.8° |
| NBC | CAR | CAX | CAV | 172.3° | 167.7° |
| NBC | CAR | CAX | CAW | 8.8° | 13.5° |
| CAR | NBC | CAO | HAO | 93.0° | 161.0° |
| CAR | NBC | CAO | HAOA | 147.0° | 79.9° |
| CAR | NBC | CAP | HAP | 146.0° | 150.0° |
| CAR | NBC | CAP | HAPA | 26.0° | 30.0° |
| CAU | CAS | CAK | HAK | 178.6° | 179.8° |
| CAS | CAU | CAM | HAM | 178.8° | 180.0° |
| CAV | CAX | CAW | CAY | 1.7° | 2.3° |
| CAX | CAV | CAZ | NBD | 0.7° | 0.1° |
| CAX | CAV | OAH | HOAH | 2.4° | 180.0° |
| CAZ | CAV | CAX | CAW | 1.1° | 1.9° |
| CAV | CAZ | NBD | CAY | 0.9° | 1.4° |
| CAV | CAZ | NBD | CBA | 179.2° | 178.6° |
| CAZ | CAV | OAH | HOAH | 177.1° | 0.0° |
| CAX | CAW | CAY | NBD | 1.9° | 0.8° |
| CAX | CAW | CAN | HAN | 96.8° | 153.5° |
| CAX | CAW | CAN | HANA | 143.2° | 86.9° |
| CAW | CAY | NBD | CAZ | 1.5° | 1.0° |
| CAW | CAY | NBD | CBA | 179.9° | 179.0° |
| CAY | CAW | CAN | HAN | 82.4° | 26.7° |
| CAY | CAW | CAN | HANA | 37.6° | 92.8° |
| CAY | NBD | CAZ | CBA | 178.3° | 180.0° |
| CAY | NBD | CBA | HBA | 5.1° | 1.6° |
| CAZ | NBD | CBA | HBA | 176.6° | 178.4° |
| NBD | CBA | CAA | HAA | 56.1° | 176.7° |
| NBD | CBA | CAA | HAAA | 176.1° | 63.4° |
| NBD | CBA | CAA | HAAB | 63.9° | 56.6° |
| NBD | CBA | CAB | HAB | 53.6° | 60.0° |
| NBD | CBA | CAB | HABA | 66.4° | 60.0° |
| NBD | CBA | CAB | HABB | 173.6° | 180.0° |
| HAA | CAA | HAAA | HAAB | 120.0° | 120.0° |
| HAA | CAA | CBA | HBA | 60.9° | 63.3° |
| HAAA | CAA | CBA | HBA | 59.1° | 56.6° |
| HAAB | CAA | CBA | HBA | 179.1° | 176.6° |
| HAB | CAB | HABA | HABB | 120.0° | 119.9° |
| HAB | CAB | CBA | HBA | 63.8° | 180.0° |
| HABA | CAB | CBA | HBA | 176.1° | 60.0° |
| HABB | CAB | CBA | HBA | 56.1° | 60.0° |
| HAC | CAC | HACA | HACB | 120.0° | 120.1° |
| HAD | CAD | HADA | HADB | 120.0° | 120.0° |
| HAK | CAK | CAL | HAL | 0.3° | 0.3° |
| HAN | CAN | CAO | HAO | 154.1° | 68.3° |
| HAN | CAN | CAO | HAOA | 34.1° | 50.8° |
| HANA | CAN | CAO | HAO | 34.2° | 51.3° |
| HANA | CAN | CAO | HAOA | 85.8° | 170.5° |
