8BD
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAL | CAA | sing | 1.43Å | 1.42Å | |
| CAA | HAA | sing | 1.09Å | 1.10Å | |
| CAA | HAAA | sing | 1.09Å | 1.10Å | |
| CAA | HAAB | sing | 1.09Å | 1.10Å | |
| OAL | CAP | sing | 1.36Å | 1.38Å | |
| CAH | CAP | doub | 1.39Å | 1.44Å | Aromatic |
| CAP | CAO | sing | 1.40Å | 1.39Å | Aromatic |
| CAH | CAF | sing | 1.38Å | 1.40Å | Aromatic |
| CAH | HAH | sing | 1.08Å | 1.08Å | |
| CAF | CAE | doub | 1.38Å | 1.38Å | Aromatic |
| CAF | HAF | sing | 1.08Å | 1.08Å | |
| CAE | CAG | sing | 1.38Å | 1.42Å | Aromatic |
| CAE | HAE | sing | 1.08Å | 1.08Å | |
| CAO | CAG | doub | 1.40Å | 1.41Å | Aromatic |
| CAG | HAG | sing | 1.08Å | 1.08Å | |
| CAO | CAD | sing | 1.48Å | 1.42Å | |
| CAD | NAK | doub | 1.29Å | 1.31Å | |
| CAD | HAD | sing | 1.08Å | 1.08Å | |
| NAK | OAM | sing | 1.42Å | 1.34Å | |
| OAM | CAI | sing | 1.43Å | 1.42Å | |
| CAI | CAJ | sing | 1.53Å | 1.52Å | |
| CAI | HAI | sing | 1.09Å | 1.10Å | |
| CAI | HAIA | sing | 1.09Å | 1.10Å | |
| CAJ | CAN | sing | 1.51Å | 1.51Å | |
| CAJ | HAJ | sing | 1.09Å | 1.10Å | |
| CAJ | HAJA | sing | 1.09Å | 1.10Å | |
| CAN | OAB | doub | 1.21Å | 1.23Å | |
| CAN | OAC | sing | 1.34Å | 1.28Å | |
| OAC | HOAC | sing | 0.97Å | 0.95Å |
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° | 109.4° |
| CAA | OAL | CAP | 119.8° | 117.0° |
| HAA | CAA | HAAA | 109.5° | 109.5° |
| HAA | CAA | HAAB | 109.4° | 109.4° |
| HAAA | CAA | HAAB | 109.5° | 109.5° |
| OAL | CAP | CAH | 123.1° | 120.1° |
| OAL | CAP | CAO | 116.9° | 120.2° |
| CAH | CAP | CAO | 120.0° | 119.7° |
| CAP | CAH | CAF | 121.2° | 120.1° |
| CAP | CAH | HAH | 119.4° | 120.0° |
| CAP | CAO | CAG | 118.0° | 119.7° |
| CAP | CAO | CAD | 118.9° | 120.2° |
| CAF | CAH | HAH | 119.4° | 120.0° |
| CAH | CAF | CAE | 118.8° | 120.4° |
| CAH | CAF | HAF | 120.6° | 119.8° |
| CAE | CAF | HAF | 120.6° | 119.8° |
| CAF | CAE | CAG | 120.3° | 120.3° |
| CAF | CAE | HAE | 119.9° | 119.8° |
| CAG | CAE | HAE | 119.8° | 119.9° |
| CAE | CAG | CAO | 121.7° | 119.9° |
| CAE | CAG | HAG | 119.2° | 120.0° |
| CAO | CAG | HAG | 119.2° | 120.0° |
| CAG | CAO | CAD | 123.1° | 120.2° |
| CAO | CAD | NAK | 131.7° | 120.0° |
| CAO | CAD | HAD | 114.2° | 120.0° |
| NAK | CAD | HAD | 114.2° | 120.0° |
| CAD | NAK | OAM | 124.5° | 120.0° |
| NAK | OAM | CAI | 106.7° | 114.0° |
| OAM | CAI | CAJ | 108.1° | 109.5° |
| OAM | CAI | HAI | 109.9° | 109.5° |
| OAM | CAI | HAIA | 110.2° | 109.5° |
| CAJ | CAI | HAI | 109.9° | 109.5° |
| CAJ | CAI | HAIA | 110.2° | 109.5° |
| CAI | CAJ | CAN | 110.3° | 109.5° |
| CAI | CAJ | HAJ | 109.2° | 109.5° |
| CAI | CAJ | HAJA | 109.0° | 109.5° |
| HAI | CAI | HAIA | 108.4° | 109.5° |
| CAN | CAJ | HAJ | 109.2° | 109.5° |
| CAN | CAJ | HAJA | 109.1° | 109.5° |
| CAJ | CAN | OAB | 114.7° | 120.0° |
| CAJ | CAN | OAC | 119.6° | 120.0° |
| HAJ | CAJ | HAJA | 110.1° | 109.5° |
| OAB | CAN | OAC | 125.7° | 120.0° |
| CAN | OAC | HOAC | 109.5° | 117.1° |
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° | 119.9° |
| OAL | CAA | HAAA | HAAB | 120.0° | 120.0° |
| CAA | OAL | CAP | CAH | 173.8° | 2.6° |
| CAA | OAL | CAP | CAO | 8.4° | 177.6° |
| HAA | CAA | HAAA | HAAB | 120.0° | 120.0° |
| HAA | CAA | OAL | CAP | 177.4° | 179.8° |
| HAAA | CAA | OAL | CAP | 57.4° | 59.8° |
| HAAB | CAA | OAL | CAP | 62.6° | 60.3° |
| OAL | CAP | CAH | CAO | 177.8° | 179.8° |
| OAL | CAP | CAH | CAF | 178.0° | 180.0° |
| OAL | CAP | CAH | HAH | 2.1° | 0.1° |
| OAL | CAP | CAO | CAG | 177.9° | 179.7° |
| OAL | CAP | CAO | CAD | 1.7° | 0.1° |
| CAP | CAH | CAF | HAH | 180.0° | 180.0° |
| CAP | CAH | CAF | CAE | 0.2° | 0.0° |
| CAP | CAH | CAF | HAF | 179.8° | 180.0° |
| CAH | CAP | CAO | CAG | 0.0° | 0.5° |
| CAH | CAP | CAO | CAD | 179.5° | 179.8° |
| CAO | CAP | CAH | CAF | 0.2° | 0.2° |
| CAO | CAP | CAH | HAH | 179.8° | 179.8° |
| CAP | CAO | CAG | CAE | 0.2° | 0.5° |
| CAP | CAO | CAG | CAD | 179.5° | 179.8° |
| CAP | CAO | CAG | HAG | 179.8° | 179.8° |
| CAP | CAO | CAD | NAK | 175.2° | 158.8° |
| CAP | CAO | CAD | HAD | 4.7° | 21.2° |
| CAH | CAF | CAE | HAF | 180.0° | 179.9° |
| CAH | CAF | CAE | CAG | 0.0° | 0.0° |
| CAH | CAF | CAE | HAE | 180.0° | 180.0° |
| HAH | CAH | CAF | CAE | 179.8° | 180.0° |
| HAH | CAH | CAF | HAF | 0.2° | 0.0° |
| CAF | CAE | CAG | HAE | 180.0° | 180.0° |
| CAF | CAE | CAG | CAO | 0.2° | 0.3° |
| CAF | CAE | CAG | HAG | 179.8° | 180.0° |
| HAF | CAF | CAE | CAG | 180.0° | 180.0° |
| HAF | CAF | CAE | HAE | 0.0° | 0.0° |
| CAE | CAG | CAO | HAG | 180.0° | 179.8° |
| CAE | CAG | CAO | CAD | 179.7° | 179.7° |
| HAE | CAE | CAG | CAO | 179.8° | 179.8° |
| HAE | CAE | CAG | HAG | 0.2° | 0.0° |
| CAG | CAO | CAD | NAK | 4.3° | 21.4° |
| CAG | CAO | CAD | HAD | 175.8° | 158.6° |
| HAG | CAG | CAO | CAD | 0.3° | 0.0° |
| CAO | CAD | NAK | HAD | 180.0° | 180.0° |
| CAO | CAD | NAK | OAM | 0.5° | 0.6° |
| CAD | NAK | OAM | CAI | 177.4° | 178.5° |
| HAD | CAD | NAK | OAM | 179.5° | 179.4° |
| NAK | OAM | CAI | CAJ | 86.2° | 176.9° |
| NAK | OAM | CAI | HAI | 153.8° | 56.9° |
| NAK | OAM | CAI | HAIA | 34.4° | 63.0° |
| OAM | CAI | CAJ | HAI | 120.0° | 120.0° |
| OAM | CAI | CAJ | HAIA | 120.5° | 120.0° |
| OAM | CAI | HAI | HAIA | 120.5° | 120.0° |
| OAM | CAI | CAJ | CAN | 178.9° | 173.8° |
| OAM | CAI | CAJ | HAJ | 58.9° | 53.8° |
| OAM | CAI | CAJ | HAJA | 61.5° | 66.2° |
| CAJ | CAI | HAI | HAIA | 120.5° | 120.0° |
| CAI | CAJ | CAN | HAJ | 120.0° | 120.0° |
| CAI | CAJ | CAN | HAJA | 119.7° | 120.0° |
| CAI | CAJ | HAJ | HAJA | 119.7° | 120.0° |
| CAI | CAJ | CAN | OAB | 20.9° | 0.0° |
| CAI | CAJ | CAN | OAC | 159.6° | 180.0° |
| HAI | CAI | CAJ | CAN | 61.1° | 66.2° |
| HAI | CAI | CAJ | HAJ | 178.9° | 173.8° |
| HAI | CAI | CAJ | HAJA | 58.5° | 53.8° |
| HAIA | CAI | CAJ | CAN | 58.3° | 53.8° |
| HAIA | CAI | CAJ | HAJ | 61.7° | 66.2° |
| HAIA | CAI | CAJ | HAJA | 178.0° | 173.8° |
| CAN | CAJ | HAJ | HAJA | 119.7° | 120.0° |
| CAJ | CAN | OAB | OAC | 179.4° | 180.0° |
| CAJ | CAN | OAC | HOAC | 179.4° | 180.0° |
| HAJ | CAJ | CAN | OAB | 140.9° | 120.0° |
| HAJ | CAJ | CAN | OAC | 39.6° | 60.0° |
| HAJA | CAJ | CAN | OAB | 98.7° | 120.0° |
| HAJA | CAJ | CAN | OAC | 80.7° | 60.0° |
| OAB | CAN | OAC | HOAC | 0.0° | 0.0° |
