6EX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAB | CAG | doub | 1.21Å | 1.23Å | |
| CAG | CAA | sing | 1.51Å | 1.50Å | |
| CAG | NAH | sing | 1.35Å | 1.32Å | |
| CAD | NAH | sing | 1.38Å | 1.32Å | Aromatic |
| CAD | CAC | doub | 1.34Å | 1.33Å | Aromatic |
| NAH | CAE | sing | 1.36Å | 1.33Å | Aromatic |
| CAC | NAF | sing | 1.34Å | 1.34Å | Aromatic |
| CAE | NAF | doub | 1.30Å | 1.33Å | Aromatic |
| CAA | H1 | sing | 1.09Å | 1.10Å | |
| CAA | H2 | sing | 1.09Å | 1.10Å | |
| CAA | H3 | sing | 1.09Å | 1.10Å | |
| CAD | H4 | sing | 1.08Å | 1.08Å | |
| CAC | H5 | sing | 1.08Å | 1.08Å | |
| CAE | H6 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAB | CAG | CAA | 124.3° | 120.1° |
| OAB | CAG | NAH | 120.0° | 120.0° |
| CAA | CAG | NAH | 115.6° | 120.0° |
| CAG | CAA | H1 | 109.5° | 109.5° |
| CAG | CAA | H2 | 109.5° | 109.4° |
| CAG | CAA | H3 | 109.5° | 109.4° |
| CAG | NAH | CAD | 107.2° | 126.6° |
| CAG | NAH | CAE | 142.5° | 126.6° |
| NAH | CAD | CAC | 104.3° | 106.8° |
| CAD | NAH | CAE | 110.3° | 106.9° |
| NAH | CAD | H4 | 127.9° | 126.6° |
| CAD | CAC | NAF | 112.6° | 108.3° |
| CAC | CAD | H4 | 127.9° | 126.6° |
| CAD | CAC | H5 | 123.7° | 125.8° |
| NAH | CAE | NAF | 108.6° | 108.5° |
| NAH | CAE | H6 | 125.7° | 125.7° |
| CAC | NAF | CAE | 104.2° | 109.5° |
| NAF | CAC | H5 | 123.7° | 125.9° |
| NAF | CAE | H6 | 125.7° | 125.8° |
| H1 | CAA | H2 | 109.5° | 109.5° |
| H1 | CAA | H3 | 109.5° | 109.5° |
| H2 | CAA | H3 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAB | CAG | CAA | NAH | 176.7° | 179.9° |
| OAB | CAG | NAH | CAD | 36.8° | 0.3° |
| OAB | CAG | NAH | CAE | 140.5° | 180.0° |
| OAB | CAG | CAA | H1 | 0.0° | 120.0° |
| OAB | CAG | CAA | H2 | 120.0° | 0.1° |
| OAB | CAG | CAA | H3 | 120.0° | 120.0° |
| CAA | CAG | NAH | CAD | 146.3° | 179.7° |
| CAA | CAG | NAH | CAE | 36.3° | 0.0° |
| CAG | CAA | H1 | H2 | 120.0° | 120.0° |
| CAG | CAA | H1 | H3 | 120.0° | 120.0° |
| CAG | CAA | H2 | H3 | 120.0° | 120.0° |
| CAG | NAH | CAD | CAE | 178.3° | 179.7° |
| CAG | NAH | CAD | CAC | 179.5° | 180.0° |
| CAG | NAH | CAE | NAF | 178.1° | 179.8° |
| NAH | CAG | CAA | H1 | 176.7° | 60.0° |
| NAH | CAG | CAA | H2 | 63.3° | 180.0° |
| NAH | CAG | CAA | H3 | 56.7° | 60.0° |
| CAG | NAH | CAD | H4 | 0.5° | 0.0° |
| CAG | NAH | CAE | H6 | 1.9° | 0.1° |
| NAH | CAD | CAC | H4 | 180.0° | 179.9° |
| NAH | CAD | CAC | NAF | 1.2° | 0.0° |
| CAD | NAH | CAE | NAF | 0.8° | 0.5° |
| NAH | CAD | CAC | H5 | 178.7° | 180.0° |
| CAD | NAH | CAE | H6 | 179.2° | 179.7° |
| CAC | CAD | NAH | CAE | 1.2° | 0.3° |
| CAD | CAC | NAF | H5 | 180.0° | 180.0° |
| CAD | CAC | NAF | CAE | 0.8° | 0.3° |
| NAH | CAE | NAF | CAC | 0.0° | 0.5° |
| NAH | CAE | NAF | H6 | 180.0° | 179.9° |
| CAE | NAH | CAD | H4 | 178.8° | 179.8° |
| NAF | CAC | CAD | H4 | 178.8° | 179.9° |
| CAC | NAF | CAE | H6 | 180.0° | 179.7° |
| CAE | NAF | CAC | H5 | 179.2° | 179.7° |
| H1 | CAA | H2 | H3 | 120.0° | 120.0° |
| H4 | CAD | CAC | H5 | 1.3° | 0.1° |
