H5J
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAB | NAL | doub | 1.22Å | 1.42Å | |
| OAA | NAL | doub | 1.22Å | 1.46Å | |
| NAL | CAI | sing | 1.48Å | 1.32Å | |
| CAI | CAF | doub | 1.37Å | 1.38Å | Aromatic |
| CAI | CAC | sing | 1.39Å | 1.38Å | Aromatic |
| CAF | CAJ | sing | 1.40Å | 1.33Å | Aromatic |
| CAC | CAD | doub | 1.38Å | 1.38Å | Aromatic |
| CAJ | CAE | sing | 1.46Å | 1.33Å | Aromatic |
| CAJ | CAK | doub | 1.40Å | 1.34Å | Aromatic |
| CAE | NAG | doub | 1.30Å | 1.33Å | Aromatic |
| CAD | CAK | sing | 1.39Å | 1.33Å | Aromatic |
| CAK | OAH | sing | 1.35Å | 1.33Å | Aromatic |
| NAG | OAH | sing | 1.41Å | 1.35Å | Aromatic |
| CAF | H1 | sing | 1.08Å | 1.08Å | |
| CAE | H2 | sing | 1.08Å | 1.08Å | |
| CAD | H3 | sing | 1.08Å | 1.08Å | |
| CAC | H4 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAB | NAL | OAA | 125.0° | 120.0° |
| OAB | NAL | CAI | 117.0° | 120.0° |
| OAA | NAL | CAI | 117.9° | 120.0° |
| NAL | CAI | CAF | 120.2° | 119.7° |
| NAL | CAI | CAC | 120.1° | 119.7° |
| CAF | CAI | CAC | 119.7° | 120.5° |
| CAI | CAF | CAJ | 119.7° | 119.8° |
| CAI | CAF | H1 | 120.1° | 120.1° |
| CAI | CAC | CAD | 117.9° | 120.6° |
| CAI | CAC | H4 | 121.0° | 119.7° |
| CAF | CAJ | CAE | 130.4° | 133.7° |
| CAF | CAJ | CAK | 120.9° | 119.8° |
| CAJ | CAF | H1 | 120.2° | 120.1° |
| CAC | CAD | CAK | 120.2° | 119.8° |
| CAC | CAD | H3 | 119.9° | 120.1° |
| CAD | CAC | H4 | 121.0° | 119.7° |
| CAE | CAJ | CAK | 108.6° | 106.4° |
| CAJ | CAE | NAG | 108.4° | 107.4° |
| CAJ | CAE | H2 | 125.8° | 126.3° |
| CAJ | CAK | CAD | 121.6° | 119.5° |
| CAJ | CAK | OAH | 107.5° | 107.1° |
| CAE | NAG | OAH | 107.3° | 109.7° |
| NAG | CAE | H2 | 125.8° | 126.3° |
| CAD | CAK | OAH | 130.9° | 133.4° |
| CAK | CAD | H3 | 119.9° | 120.1° |
| CAK | OAH | NAG | 108.2° | 109.3° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAB | NAL | OAA | CAI | 176.2° | 179.7° |
| OAB | NAL | CAI | CAF | 23.3° | 0.0° |
| OAB | NAL | CAI | CAC | 155.8° | 179.7° |
| OAA | NAL | CAI | CAF | 160.2° | 179.7° |
| OAA | NAL | CAI | CAC | 20.7° | 0.6° |
| NAL | CAI | CAF | CAC | 179.1° | 179.7° |
| NAL | CAI | CAF | CAJ | 179.3° | 180.0° |
| NAL | CAI | CAC | CAD | 179.1° | 179.8° |
| NAL | CAI | CAF | H1 | 0.6° | 0.0° |
| NAL | CAI | CAC | H4 | 0.9° | 0.0° |
| CAI | CAF | CAJ | H1 | 180.0° | 180.0° |
| CAF | CAI | CAC | CAD | 0.0° | 0.5° |
| CAI | CAF | CAJ | CAE | 179.8° | 180.0° |
| CAI | CAF | CAJ | CAK | 0.0° | 0.0° |
| CAF | CAI | CAC | H4 | 180.0° | 179.8° |
| CAC | CAI | CAF | CAJ | 0.2° | 0.2° |
| CAI | CAC | CAD | H4 | 180.0° | 179.7° |
| CAI | CAC | CAD | CAK | 0.5° | 0.6° |
| CAC | CAI | CAF | H1 | 179.7° | 179.8° |
| CAI | CAC | CAD | H3 | 179.5° | 179.8° |
| CAF | CAJ | CAE | CAK | 179.8° | 180.0° |
| CAF | CAJ | CAE | NAG | 179.9° | 180.0° |
| CAF | CAJ | CAK | CAD | 0.4° | 0.0° |
| CAF | CAJ | CAK | OAH | 180.0° | 180.0° |
| CAF | CAJ | CAE | H2 | 0.2° | 0.0° |
| CAC | CAD | CAK | CAJ | 0.7° | 0.3° |
| CAC | CAD | CAK | H3 | 180.0° | 179.7° |
| CAC | CAD | CAK | OAH | 179.9° | 179.8° |
| CAJ | CAE | NAG | H2 | 180.0° | 180.0° |
| CAE | CAJ | CAK | CAD | 179.7° | 180.0° |
| CAE | CAJ | CAK | OAH | 0.2° | 0.0° |
| CAJ | CAE | NAG | OAH | 0.1° | 0.0° |
| CAE | CAJ | CAF | H1 | 0.2° | 0.0° |
| CAK | CAJ | CAE | NAG | 0.0° | 0.0° |
| CAJ | CAK | CAD | OAH | 179.4° | 179.9° |
| CAJ | CAK | OAH | NAG | 0.2° | 0.0° |
| CAK | CAJ | CAF | H1 | 179.9° | 180.0° |
| CAK | CAJ | CAE | H2 | 180.0° | 180.0° |
| CAJ | CAK | CAD | H3 | 179.3° | 180.0° |
| CAE | NAG | OAH | CAK | 0.2° | 0.0° |
| CAD | CAK | OAH | NAG | 179.7° | 179.9° |
| CAK | CAD | CAC | H4 | 179.6° | 179.7° |
| OAH | CAK | CAD | H3 | 0.1° | 0.1° |
| OAH | NAG | CAE | H2 | 179.9° | 180.0° |
| H3 | CAD | CAC | H4 | 0.4° | 0.0° |
