A8D
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAL | CAA | sing | 1.43Å | 1.45Å | |
| CAA | HAA | sing | 1.09Å | 1.10Å | |
| CAA | HAAA | sing | 1.09Å | 1.10Å | |
| CAA | HAAB | sing | 1.09Å | 1.10Å | |
| SAR | CAB | sing | 1.81Å | 1.77Å | |
| CAB | HAB | sing | 1.09Å | 1.10Å | |
| CAB | HABA | sing | 1.09Å | 1.10Å | |
| CAB | HABB | sing | 1.09Å | 1.10Å | |
| CAM | OAC | doub | 1.22Å | 1.24Å | |
| SAR | OAD | doub | 1.42Å | 1.49Å | |
| SAR | OAE | doub | 1.42Å | 1.54Å | |
| CAF | CAN | doub | 1.39Å | 1.40Å | Aromatic |
| CAF | CAG | sing | 1.38Å | 1.41Å | Aromatic |
| CAF | HAF | sing | 1.08Å | 1.08Å | |
| CAG | CAQ | doub | 1.39Å | 1.33Å | Aromatic |
| CAG | HAG | sing | 1.08Å | 1.08Å | |
| CAN | CAH | sing | 1.38Å | 1.43Å | Aromatic |
| CAH | CAP | doub | 1.40Å | 1.38Å | Aromatic |
| CAH | HAH | sing | 1.08Å | 1.08Å | |
| CAP | CAI | sing | 1.42Å | 1.35Å | Aromatic |
| CAI | CAO | doub | 1.36Å | 1.35Å | Aromatic |
| CAI | HAI | sing | 1.08Å | 1.08Å | |
| CAM | NAJ | sing | 1.35Å | 1.37Å | |
| NAJ | SAR | sing | 1.66Å | 1.76Å | |
| NAJ | HNAJ | sing | 0.97Å | 1.00Å | |
| CAQ | NAK | sing | 1.38Å | 1.34Å | Aromatic |
| NAK | CAO | sing | 1.38Å | 1.36Å | Aromatic |
| OAL | CAN | sing | 1.36Å | 1.37Å | |
| CAO | CAM | sing | 1.47Å | 1.38Å | |
| CAQ | CAP | sing | 1.41Å | 1.37Å | Aromatic |
| NAK | HNAK | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAL | CAA | HAA | 109.5° | 109.5° |
| OAL | CAA | HAAA | 109.5° | 109.5° |
| OAL | CAA | HAAB | 109.5° | 109.5° |
| CAA | OAL | CAN | 125.3° | 117.0° |
| HAA | CAA | HAAA | 109.4° | 109.5° |
| HAA | CAA | HAAB | 109.4° | 109.4° |
| HAAA | CAA | HAAB | 109.5° | 109.5° |
| SAR | CAB | HAB | 109.5° | 109.5° |
| SAR | CAB | HABA | 109.4° | 109.5° |
| SAR | CAB | HABB | 109.5° | 109.5° |
| CAB | SAR | OAD | 109.5° | 110.5° |
| CAB | SAR | OAE | 116.2° | 110.6° |
| CAB | SAR | NAJ | 107.9° | 104.5° |
| HAB | CAB | HABA | 109.5° | 109.4° |
| HAB | CAB | HABB | 109.5° | 109.5° |
| HABA | CAB | HABB | 109.5° | 109.5° |
| OAC | CAM | NAJ | 122.6° | 120.0° |
| OAC | CAM | CAO | 120.6° | 120.0° |
| OAD | SAR | OAE | 108.9° | 121.0° |
| OAD | SAR | NAJ | 107.6° | 104.3° |
| OAE | SAR | NAJ | 106.4° | 104.3° |
| CAN | CAF | CAG | 120.3° | 120.6° |
| CAN | CAF | HAF | 119.9° | 119.7° |
| CAF | CAN | CAH | 117.7° | 120.3° |
| CAF | CAN | OAL | 115.7° | 119.8° |
| CAG | CAF | HAF | 119.9° | 119.7° |
| CAF | CAG | CAQ | 120.0° | 120.0° |
| CAF | CAG | HAG | 120.0° | 120.0° |
| CAQ | CAG | HAG | 120.0° | 120.0° |
| CAG | CAQ | NAK | 129.5° | 133.0° |
| CAG | CAQ | CAP | 121.8° | 119.7° |
| CAN | CAH | CAP | 119.7° | 119.7° |
| CAN | CAH | HAH | 120.1° | 120.2° |
| CAH | CAN | OAL | 126.6° | 119.8° |
| CAP | CAH | HAH | 120.2° | 120.1° |
| CAH | CAP | CAI | 132.3° | 133.3° |
| CAH | CAP | CAQ | 120.6° | 119.7° |
| CAP | CAI | CAO | 108.4° | 107.7° |
| CAP | CAI | HAI | 125.8° | 126.1° |
| CAI | CAP | CAQ | 107.0° | 107.0° |
| CAO | CAI | HAI | 125.8° | 126.1° |
| CAI | CAO | NAK | 108.5° | 109.2° |
| CAI | CAO | CAM | 128.2° | 125.4° |
| CAM | NAJ | SAR | 119.5° | 120.0° |
| CAM | NAJ | HNAJ | 120.2° | 119.9° |
| NAJ | CAM | CAO | 116.8° | 120.0° |
| SAR | NAJ | HNAJ | 120.2° | 120.1° |
| CAQ | NAK | CAO | 107.4° | 108.8° |
| NAK | CAQ | CAP | 108.7° | 107.3° |
| CAQ | NAK | HNAK | 126.3° | 125.6° |
| NAK | CAO | CAM | 123.3° | 125.4° |
| CAO | NAK | HNAK | 126.3° | 125.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAL | CAA | HAA | HAAA | 120.0° | 120.0° |
| OAL | CAA | HAA | HAAB | 120.0° | 120.0° |
| OAL | CAA | HAAA | HAAB | 120.0° | 120.0° |
| CAA | OAL | CAN | CAF | 166.4° | 0.0° |
| CAA | OAL | CAN | CAH | 16.5° | 180.0° |
| HAA | CAA | HAAA | HAAB | 119.9° | 119.9° |
| HAA | CAA | OAL | CAN | 180.0° | 59.9° |
| HAAA | CAA | OAL | CAN | 60.0° | 180.0° |
| HAAB | CAA | OAL | CAN | 60.0° | 60.0° |
| SAR | CAB | HAB | HABA | 120.0° | 120.0° |
| SAR | CAB | HAB | HABB | 120.0° | 120.0° |
| SAR | CAB | HABA | HABB | 120.0° | 120.0° |
| CAB | SAR | OAD | OAE | 128.0° | 131.5° |
| CAB | SAR | OAD | NAJ | 117.1° | 111.7° |
| CAB | SAR | OAE | NAJ | 120.1° | 111.8° |
| CAB | SAR | NAJ | CAM | 168.1° | 65.0° |
| CAB | SAR | NAJ | HNAJ | 11.9° | 115.0° |
| HAB | CAB | HABA | HABB | 120.0° | 120.0° |
| HAB | CAB | SAR | OAD | 180.0° | 171.7° |
| HAB | CAB | SAR | OAE | 56.2° | 51.6° |
| HAB | CAB | SAR | NAJ | 63.1° | 60.0° |
| HABA | CAB | SAR | OAD | 60.0° | 68.4° |
| HABA | CAB | SAR | OAE | 176.1° | 68.3° |
| HABA | CAB | SAR | NAJ | 56.9° | 180.0° |
| HABB | CAB | SAR | OAD | 60.0° | 51.7° |
| HABB | CAB | SAR | OAE | 63.8° | 171.6° |
| HABB | CAB | SAR | NAJ | 176.9° | 60.0° |
| OAC | CAM | CAO | CAI | 173.2° | 0.0° |
| OAC | CAM | NAJ | CAO | 177.8° | 180.0° |
| OAC | CAM | NAJ | SAR | 0.4° | 0.0° |
| OAC | CAM | NAJ | HNAJ | 179.6° | 180.0° |
| OAC | CAM | CAO | NAK | 5.2° | 180.0° |
| OAD | SAR | OAE | NAJ | 115.7° | 116.7° |
| OAD | SAR | NAJ | CAM | 50.1° | 51.1° |
| OAD | SAR | NAJ | HNAJ | 130.0° | 128.9° |
| OAE | SAR | NAJ | CAM | 66.5° | 178.9° |
| OAE | SAR | NAJ | HNAJ | 113.4° | 1.1° |
| CAN | CAF | CAG | HAF | 180.0° | 179.7° |
| CAN | CAF | CAG | CAQ | 0.3° | 0.0° |
| CAN | CAF | CAG | HAG | 179.7° | 180.0° |
| CAF | CAN | CAH | OAL | 177.1° | 179.9° |
| CAF | CAN | CAH | CAP | 0.5° | 0.1° |
| CAF | CAN | CAH | HAH | 179.5° | 180.0° |
| CAF | CAG | CAQ | HAG | 180.0° | 180.0° |
| CAG | CAF | CAN | CAH | 0.4° | 0.0° |
| CAF | CAG | CAQ | NAK | 179.0° | 179.9° |
| CAG | CAF | CAN | OAL | 177.8° | 180.0° |
| CAF | CAG | CAQ | CAP | 0.7° | 0.1° |
| HAF | CAF | CAG | CAQ | 179.7° | 179.7° |
| HAF | CAF | CAG | HAG | 0.3° | 0.3° |
| HAF | CAF | CAN | CAH | 179.6° | 179.7° |
| HAF | CAF | CAN | OAL | 2.2° | 0.3° |
| CAG | CAQ | CAP | CAH | 1.7° | 0.1° |
| CAG | CAQ | CAP | CAI | 178.8° | 180.0° |
| CAG | CAQ | NAK | CAP | 179.7° | 179.9° |
| CAG | CAQ | NAK | CAO | 179.2° | 179.9° |
| CAG | CAQ | NAK | HNAK | 0.8° | 0.1° |
| HAG | CAG | CAQ | NAK | 1.0° | 0.1° |
| HAG | CAG | CAQ | CAP | 179.3° | 180.0° |
| CAN | CAH | CAP | HAH | 180.0° | 180.0° |
| CAN | CAH | CAP | CAI | 177.8° | 180.0° |
| CAN | CAH | CAP | CAQ | 1.6° | 0.1° |
| CAH | CAP | CAI | CAQ | 176.6° | 180.0° |
| CAH | CAP | CAI | CAO | 177.7° | 180.0° |
| CAH | CAP | CAI | HAI | 2.3° | 0.0° |
| CAH | CAP | CAQ | NAK | 178.1° | 180.0° |
| CAP | CAH | CAN | OAL | 176.5° | 180.0° |
| HAH | CAH | CAP | CAI | 2.2° | 0.0° |
| HAH | CAH | CAN | OAL | 3.4° | 0.0° |
| HAH | CAH | CAP | CAQ | 178.5° | 179.9° |
| CAP | CAI | CAO | HAI | 180.0° | 180.0° |
| CAI | CAP | CAQ | NAK | 1.0° | 0.1° |
| CAP | CAI | CAO | NAK | 0.7° | 0.0° |
| CAP | CAI | CAO | CAM | 179.3° | 180.0° |
| CAI | CAO | CAM | NAJ | 4.7° | 180.0° |
| CAI | CAO | NAK | CAQ | 0.1° | 0.0° |
| CAI | CAO | NAK | CAM | 178.6° | 180.0° |
| CAO | CAI | CAP | CAQ | 1.1° | 0.0° |
| CAI | CAO | NAK | HNAK | 179.9° | 180.0° |
| HAI | CAI | CAO | NAK | 179.2° | 180.0° |
| HAI | CAI | CAO | CAM | 0.7° | 0.0° |
| HAI | CAI | CAP | CAQ | 178.9° | 180.0° |
| CAM | NAJ | SAR | HNAJ | 180.0° | 180.0° |
| NAJ | CAM | CAO | NAK | 176.9° | 0.0° |
| SAR | NAJ | CAM | CAO | 177.4° | 180.0° |
| HNAJ | NAJ | CAM | CAO | 2.6° | 0.0° |
| CAQ | NAK | CAO | HNAK | 180.0° | 179.9° |
| CAQ | NAK | CAO | CAM | 178.7° | 180.0° |
| CAO | NAK | CAQ | CAP | 0.5° | 0.0° |
| CAM | CAO | NAK | HNAK | 1.3° | 0.0° |
| CAP | CAQ | NAK | HNAK | 179.4° | 180.0° |
