YE6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CLAP | CAG | sing | 1.74Å | 1.73Å | |
| CAG | CAH | doub | 1.38Å | 1.39Å | Aromatic |
| CAG | CAF | sing | 1.40Å | 1.39Å | Aromatic |
| CAH | CAI | sing | 1.38Å | 1.39Å | Aromatic |
| CAH | HAH | sing | 1.08Å | 1.08Å | |
| CAI | CAJ | doub | 1.38Å | 1.39Å | Aromatic |
| CAI | HAI | sing | 1.08Å | 1.08Å | |
| CAJ | CAK | sing | 1.38Å | 1.39Å | Aromatic |
| CAJ | HAJ | sing | 1.08Å | 1.08Å | |
| CAK | CAF | doub | 1.40Å | 1.39Å | Aromatic |
| CAK | HAK | sing | 1.08Å | 1.08Å | |
| CAF | CAD | sing | 1.48Å | 1.39Å | Aromatic |
| CAD | OAN | sing | 1.34Å | 1.37Å | Aromatic |
| CAD | CAC | doub | 1.37Å | 1.33Å | Aromatic |
| OAN | CAA | sing | 1.35Å | 1.36Å | Aromatic |
| CAC | CAB | sing | 1.40Å | 1.33Å | Aromatic |
| CAC | HAC | sing | 1.08Å | 1.08Å | |
| CAB | CAA | doub | 1.38Å | 1.33Å | Aromatic |
| CAB | HAB | sing | 1.08Å | 1.08Å | |
| CAA | CAE | sing | 1.47Å | 1.53Å | |
| CAE | OAO | doub | 1.22Å | 1.23Å | |
| CAE | NAL | sing | 1.35Å | 1.33Å | |
| NAL | NAM | sing | 1.37Å | 1.23Å | |
| NAM | HNAM | sing | 1.01Å | 1.00Å | |
| NAL | H8 | sing | 0.97Å | 1.00Å | |
| NAM | H9 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CLAP | CAG | CAH | 118.2° | 120.1° |
| CLAP | CAG | CAF | 122.1° | 120.1° |
| CAH | CAG | CAF | 119.7° | 119.8° |
| CAG | CAH | CAI | 120.7° | 120.1° |
| CAG | CAH | HAH | 119.6° | 119.9° |
| CAG | CAF | CAK | 119.6° | 119.7° |
| CAG | CAF | CAD | 123.1° | 120.2° |
| CAI | CAH | HAH | 119.7° | 120.0° |
| CAH | CAI | CAJ | 119.7° | 120.4° |
| CAH | CAI | HAI | 120.1° | 119.8° |
| CAJ | CAI | HAI | 120.2° | 119.8° |
| CAI | CAJ | CAK | 119.7° | 120.2° |
| CAI | CAJ | HAJ | 120.1° | 119.9° |
| CAK | CAJ | HAJ | 120.2° | 119.9° |
| CAJ | CAK | CAF | 120.7° | 119.8° |
| CAJ | CAK | HAK | 119.7° | 120.1° |
| CAF | CAK | HAK | 119.7° | 120.1° |
| CAK | CAF | CAD | 117.3° | 120.1° |
| CAF | CAD | OAN | 120.4° | 125.7° |
| CAF | CAD | CAC | 130.7° | 125.6° |
| OAN | CAD | CAC | 108.8° | 108.7° |
| CAD | OAN | CAA | 104.9° | 109.4° |
| CAD | CAC | CAB | 108.9° | 107.1° |
| CAD | CAC | HAC | 125.5° | 126.5° |
| OAN | CAA | CAB | 109.8° | 108.1° |
| OAN | CAA | CAE | 124.0° | 126.0° |
| CAB | CAC | HAC | 125.5° | 126.4° |
| CAC | CAB | CAA | 107.5° | 106.7° |
| CAC | CAB | HAB | 126.2° | 126.6° |
| CAA | CAB | HAB | 126.2° | 126.7° |
| CAB | CAA | CAE | 126.2° | 125.9° |
| CAA | CAE | OAO | 120.7° | 120.0° |
| CAA | CAE | NAL | 115.5° | 120.0° |
| OAO | CAE | NAL | 123.8° | 120.0° |
| CAE | NAL | NAM | 119.1° | 120.0° |
| CAE | NAL | H8 | 120.5° | 120.0° |
| NAL | NAM | HNAM | 109.5° | 111.0° |
| NAM | NAL | H8 | 120.5° | 120.0° |
| NAL | NAM | H9 | 109.5° | 111.0° |
| HNAM | NAM | H9 | 109.5° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CLAP | CAG | CAH | CAF | 177.4° | 179.7° |
| CLAP | CAG | CAH | CAI | 177.1° | 180.0° |
| CLAP | CAG | CAH | HAH | 2.9° | 0.1° |
| CLAP | CAG | CAF | CAK | 176.9° | 179.7° |
| CLAP | CAG | CAF | CAD | 4.1° | 0.0° |
| CAG | CAH | CAI | HAH | 180.0° | 179.9° |
| CAG | CAH | CAI | CAJ | 0.0° | 0.0° |
| CAG | CAH | CAI | HAI | 180.0° | 180.0° |
| CAH | CAG | CAF | CAK | 0.3° | 0.6° |
| CAH | CAG | CAF | CAD | 178.6° | 179.7° |
| CAF | CAG | CAH | CAI | 0.3° | 0.3° |
| CAF | CAG | CAH | HAH | 179.7° | 179.8° |
| CAG | CAF | CAK | CAJ | 0.2° | 0.5° |
| CAG | CAF | CAK | CAD | 179.0° | 179.8° |
| CAG | CAF | CAK | HAK | 179.8° | 179.7° |
| CAG | CAF | CAD | OAN | 158.7° | 50.0° |
| CAG | CAF | CAD | CAC | 20.4° | 129.7° |
| CAH | CAI | CAJ | HAI | 180.0° | 180.0° |
| CAH | CAI | CAJ | CAK | 0.2° | 0.0° |
| CAH | CAI | CAJ | HAJ | 179.8° | 180.0° |
| HAH | CAH | CAI | CAJ | 180.0° | 179.9° |
| HAH | CAH | CAI | HAI | 0.0° | 0.1° |
| CAI | CAJ | CAK | HAJ | 180.0° | 180.0° |
| CAI | CAJ | CAK | CAF | 0.1° | 0.2° |
| CAI | CAJ | CAK | HAK | 179.9° | 180.0° |
| HAI | CAI | CAJ | CAK | 179.8° | 180.0° |
| HAI | CAI | CAJ | HAJ | 0.2° | 0.1° |
| CAJ | CAK | CAF | HAK | 180.0° | 179.8° |
| CAJ | CAK | CAF | CAD | 178.8° | 179.7° |
| HAJ | CAJ | CAK | CAF | 179.9° | 179.8° |
| HAJ | CAJ | CAK | HAK | 0.1° | 0.0° |
| CAK | CAF | CAD | OAN | 22.4° | 130.3° |
| CAK | CAF | CAD | CAC | 158.6° | 50.1° |
| HAK | CAK | CAF | CAD | 1.2° | 0.1° |
| CAF | CAD | OAN | CAC | 179.2° | 179.7° |
| CAF | CAD | OAN | CAA | 179.2° | 179.9° |
| CAF | CAD | CAC | CAB | 179.1° | 180.0° |
| CAF | CAD | CAC | HAC | 0.9° | 0.1° |
| OAN | CAD | CAC | CAB | 0.0° | 0.3° |
| OAN | CAD | CAC | HAC | 180.0° | 179.8° |
| CAD | OAN | CAA | CAB | 0.1° | 0.1° |
| CAD | OAN | CAA | CAE | 179.1° | 180.0° |
| CAC | CAD | OAN | CAA | 0.1° | 0.2° |
| CAD | CAC | CAB | HAC | 180.0° | 180.0° |
| CAD | CAC | CAB | CAA | 0.0° | 0.2° |
| CAD | CAC | CAB | HAB | 179.9° | 180.0° |
| OAN | CAA | CAB | CAC | 0.1° | 0.0° |
| OAN | CAA | CAB | CAE | 179.2° | 179.9° |
| OAN | CAA | CAB | HAB | 179.9° | 179.8° |
| OAN | CAA | CAE | OAO | 22.7° | 179.9° |
| OAN | CAA | CAE | NAL | 156.8° | 0.0° |
| CAC | CAB | CAA | HAB | 180.0° | 179.8° |
| CAC | CAB | CAA | CAE | 179.1° | 179.8° |
| HAC | CAC | CAB | CAA | 179.9° | 179.8° |
| HAC | CAC | CAB | HAB | 0.1° | 0.1° |
| CAB | CAA | CAE | OAO | 156.4° | 0.2° |
| CAB | CAA | CAE | NAL | 24.1° | 179.8° |
| HAB | CAB | CAA | CAE | 0.9° | 0.0° |
| CAA | CAE | OAO | NAL | 179.5° | 179.9° |
| CAA | CAE | NAL | NAM | 179.8° | 180.0° |
| CAA | CAE | NAL | H8 | 0.2° | 0.0° |
| OAO | CAE | NAL | NAM | 0.7° | 0.1° |
| OAO | CAE | NAL | H8 | 179.3° | 179.9° |
| CAE | NAL | NAM | H8 | 180.0° | 180.0° |
| CAE | NAL | NAM | HNAM | 2.6° | 180.0° |
| CAE | NAL | NAM | H9 | 122.6° | 56.0° |
| NAL | NAM | HNAM | H9 | 120.0° | 124.0° |
| HNAM | NAM | NAL | H8 | 177.4° | 0.0° |
| H8 | NAL | NAM | H9 | 57.4° | 124.0° |
