4EG
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| NAN | CAM | trip | 1.14Å | 1.19Å | |
| CAC | CAD | doub | 1.38Å | 1.39Å | Aromatic |
| CAC | CAB | sing | 1.38Å | 1.39Å | Aromatic |
| CAD | CAE | sing | 1.40Å | 1.39Å | Aromatic |
| CAB | CAA | doub | 1.38Å | 1.39Å | Aromatic |
| CAM | CAG | sing | 1.43Å | 1.45Å | |
| CAE | CAG | sing | 1.48Å | 1.39Å | |
| CAE | CAF | doub | 1.40Å | 1.39Å | Aromatic |
| CAA | CAF | sing | 1.38Å | 1.38Å | Aromatic |
| CAG | CAH | doub | 1.36Å | 1.52Å | |
| OAK | CAI | doub | 1.22Å | 1.23Å | |
| CAH | CAI | sing | 1.46Å | 1.52Å | |
| CAI | OAJ | sing | 1.35Å | 1.35Å | |
| OAJ | CAL | sing | 1.43Å | 1.42Å | |
| CAL | HAL | sing | 1.09Å | 1.10Å | |
| CAL | HAN | sing | 1.09Å | 1.10Å | |
| CAL | HAM | sing | 1.09Å | 1.10Å | |
| CAH | HAH | sing | 1.08Å | 1.08Å | |
| CAD | HAD | sing | 1.08Å | 1.08Å | |
| CAC | HAC | sing | 1.08Å | 1.08Å | |
| CAB | HAB | sing | 1.08Å | 1.08Å | |
| CAA | HAA | sing | 1.08Å | 1.08Å | |
| CAF | HAF | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| NAN | CAM | CAG | 179.1° | 179.9° |
| CAD | CAC | CAB | 119.7° | 120.1° |
| CAC | CAD | CAE | 119.6° | 119.9° |
| CAC | CAD | HAD | 120.2° | 120.1° |
| CAD | CAC | HAC | 120.1° | 120.0° |
| CAC | CAB | CAA | 120.6° | 120.3° |
| CAB | CAC | HAC | 120.2° | 119.9° |
| CAC | CAB | HAB | 119.7° | 119.8° |
| CAD | CAE | CAG | 119.9° | 120.2° |
| CAD | CAE | CAF | 120.5° | 119.7° |
| CAE | CAD | HAD | 120.2° | 120.1° |
| CAB | CAA | CAF | 119.7° | 120.1° |
| CAA | CAB | HAB | 119.7° | 119.8° |
| CAB | CAA | HAA | 120.1° | 119.9° |
| CAM | CAG | CAE | 119.5° | 120.0° |
| CAM | CAG | CAH | 120.9° | 120.0° |
| CAG | CAE | CAF | 119.6° | 120.1° |
| CAE | CAG | CAH | 119.6° | 120.0° |
| CAE | CAF | CAA | 119.9° | 119.9° |
| CAE | CAF | HAF | 120.0° | 120.1° |
| CAF | CAA | HAA | 120.2° | 119.9° |
| CAA | CAF | HAF | 120.1° | 120.1° |
| CAG | CAH | CAI | 121.4° | 120.0° |
| CAG | CAH | HAH | 119.3° | 120.0° |
| OAK | CAI | CAH | 122.6° | 120.0° |
| OAK | CAI | OAJ | 124.8° | 120.0° |
| CAH | CAI | OAJ | 112.6° | 120.0° |
| CAI | CAH | HAH | 119.3° | 120.0° |
| CAI | OAJ | CAL | 111.3° | 117.0° |
| OAJ | CAL | HAL | 109.5° | 109.5° |
| OAJ | CAL | HAN | 109.5° | 109.5° |
| OAJ | CAL | HAM | 109.5° | 109.5° |
| HAL | CAL | HAN | 109.5° | 109.4° |
| HAL | CAL | HAM | 109.4° | 109.5° |
| HAN | CAL | HAM | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| NAN | CAM | CAG | CAE | 28.0° | 5.4° |
| NAN | CAM | CAG | CAH | 155.1° | 174.6° |
| CAD | CAC | CAB | HAC | 180.0° | 180.0° |
| CAC | CAD | CAE | HAD | 180.0° | 179.9° |
| CAD | CAC | CAB | CAA | 0.6° | 0.0° |
| CAC | CAD | CAE | CAG | 179.2° | 180.0° |
| CAC | CAD | CAE | CAF | 0.8° | 0.3° |
| CAD | CAC | CAB | HAB | 179.4° | 179.9° |
| CAB | CAC | CAD | CAE | 0.8° | 0.0° |
| CAC | CAB | CAA | HAB | 180.0° | 179.9° |
| CAC | CAB | CAA | CAF | 0.3° | 0.2° |
| CAB | CAC | CAD | HAD | 179.2° | 179.9° |
| CAC | CAB | CAA | HAA | 179.7° | 180.0° |
| CAD | CAE | CAG | CAM | 27.3° | 115.3° |
| CAD | CAE | CAG | CAF | 178.4° | 179.8° |
| CAD | CAE | CAF | CAA | 0.5° | 0.5° |
| CAD | CAE | CAG | CAH | 155.8° | 64.7° |
| CAE | CAD | CAC | HAC | 179.2° | 180.0° |
| CAD | CAE | CAF | HAF | 179.5° | 179.7° |
| CAB | CAA | CAF | CAE | 0.2° | 0.4° |
| CAB | CAA | CAF | HAA | 180.0° | 179.9° |
| CAA | CAB | CAC | HAC | 179.4° | 180.0° |
| CAB | CAA | CAF | HAF | 179.8° | 179.7° |
| CAM | CAG | CAE | CAH | 176.9° | 180.0° |
| CAM | CAG | CAE | CAF | 151.1° | 65.0° |
| CAM | CAG | CAH | CAI | 2.0° | 0.0° |
| CAM | CAG | CAH | HAH | 178.0° | 180.0° |
| CAG | CAE | CAF | CAA | 178.9° | 179.8° |
| CAE | CAG | CAH | CAI | 178.9° | 180.0° |
| CAE | CAG | CAH | HAH | 1.1° | 0.0° |
| CAG | CAE | CAD | HAD | 0.8° | 0.1° |
| CAG | CAE | CAF | HAF | 1.1° | 0.1° |
| CAE | CAF | CAA | HAF | 180.0° | 179.8° |
| CAF | CAE | CAG | CAH | 25.8° | 115.1° |
| CAF | CAE | CAD | HAD | 179.2° | 179.8° |
| CAE | CAF | CAA | HAA | 179.8° | 179.7° |
| CAF | CAA | CAB | HAB | 179.7° | 179.7° |
| CAG | CAH | CAI | OAK | 2.1° | 0.1° |
| CAG | CAH | CAI | HAH | 180.0° | 180.0° |
| CAG | CAH | CAI | OAJ | 177.8° | 180.0° |
| OAK | CAI | CAH | OAJ | 179.8° | 179.9° |
| OAK | CAI | OAJ | CAL | 7.0° | 0.1° |
| OAK | CAI | CAH | HAH | 177.9° | 179.9° |
| CAH | CAI | OAJ | CAL | 172.8° | 180.0° |
| CAI | OAJ | CAL | HAL | 180.0° | 180.0° |
| CAI | OAJ | CAL | HAN | 60.0° | 60.0° |
| CAI | OAJ | CAL | HAM | 60.0° | 60.0° |
| OAJ | CAI | CAH | HAH | 2.3° | 0.0° |
| OAJ | CAL | HAL | HAN | 120.0° | 120.0° |
| OAJ | CAL | HAL | HAM | 120.0° | 120.1° |
| OAJ | CAL | HAN | HAM | 120.0° | 120.0° |
| HAL | CAL | HAN | HAM | 120.0° | 120.0° |
| HAD | CAD | CAC | HAC | 0.8° | 0.1° |
| HAC | CAC | CAB | HAB | 0.6° | 0.1° |
| HAB | CAB | CAA | HAA | 0.3° | 0.2° |
| HAA | CAA | CAF | HAF | 0.2° | 0.1° |
