33E
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAD | NAM | sing | 1.22Å | 1.35Å | |
| OAB | CAI | doub | 1.22Å | 1.24Å | |
| NAM | OAC | doub | 1.22Å | 1.34Å | |
| NAM | CAL | sing | 1.48Å | 1.35Å | |
| CAH | CAL | doub | 1.38Å | 1.41Å | Aromatic |
| CAH | CAK | sing | 1.40Å | 1.42Å | Aromatic |
| CAL | CAJ | sing | 1.38Å | 1.41Å | Aromatic |
| CAI | CAK | sing | 1.48Å | 1.53Å | |
| CAI | NAA | sing | 1.35Å | 1.33Å | |
| CAK | CAG | doub | 1.40Å | 1.40Å | Aromatic |
| CAJ | IAE | sing | 2.10Å | 2.12Å | |
| CAJ | CAF | doub | 1.38Å | 1.40Å | Aromatic |
| CAG | CAF | sing | 1.38Å | 1.39Å | Aromatic |
| CAH | H1 | sing | 1.08Å | 1.08Å | |
| CAF | H2 | sing | 1.08Å | 1.08Å | |
| CAG | H3 | sing | 1.08Å | 1.08Å | |
| NAA | H4 | sing | 0.97Å | 1.00Å | |
| NAA | H5 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAD | NAM | OAC | 115.4° | 120.0° |
| OAD | NAM | CAL | 123.9° | 120.0° |
| OAB | CAI | CAK | 122.1° | 120.0° |
| OAB | CAI | NAA | 124.5° | 120.0° |
| OAC | NAM | CAL | 120.6° | 120.0° |
| NAM | CAL | CAH | 120.8° | 119.9° |
| NAM | CAL | CAJ | 120.1° | 119.9° |
| CAL | CAH | CAK | 119.1° | 119.9° |
| CAH | CAL | CAJ | 119.1° | 120.1° |
| CAL | CAH | H1 | 120.4° | 120.1° |
| CAH | CAK | CAI | 122.2° | 120.2° |
| CAH | CAK | CAG | 121.1° | 119.7° |
| CAK | CAH | H1 | 120.5° | 120.0° |
| CAL | CAJ | IAE | 123.0° | 119.9° |
| CAL | CAJ | CAF | 121.0° | 120.3° |
| CAK | CAI | NAA | 113.4° | 120.0° |
| CAI | CAK | CAG | 116.6° | 120.1° |
| CAI | NAA | H4 | 120.0° | 120.0° |
| CAI | NAA | H5 | 120.0° | 120.0° |
| CAK | CAG | CAF | 119.6° | 119.9° |
| CAK | CAG | H3 | 120.2° | 120.1° |
| IAE | CAJ | CAF | 116.0° | 119.8° |
| CAJ | CAF | CAG | 120.1° | 120.1° |
| CAJ | CAF | H2 | 119.9° | 119.9° |
| CAG | CAF | H2 | 119.9° | 119.9° |
| CAF | CAG | H3 | 120.2° | 120.0° |
| H4 | NAA | H5 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAD | NAM | OAC | CAL | 178.9° | 179.7° |
| OAD | NAM | CAL | CAH | 15.8° | 180.0° |
| OAD | NAM | CAL | CAJ | 163.5° | 0.3° |
| OAB | CAI | CAK | CAH | 30.9° | 0.1° |
| OAB | CAI | CAK | NAA | 178.4° | 179.9° |
| OAB | CAI | CAK | CAG | 150.2° | 179.9° |
| OAB | CAI | NAA | H4 | 0.0° | 179.9° |
| OAB | CAI | NAA | H5 | 180.0° | 0.0° |
| OAC | NAM | CAL | CAH | 162.9° | 0.3° |
| OAC | NAM | CAL | CAJ | 17.7° | 179.9° |
| NAM | CAL | CAH | CAJ | 179.4° | 179.8° |
| NAM | CAL | CAH | CAK | 179.2° | 180.0° |
| NAM | CAL | CAJ | IAE | 2.6° | 0.0° |
| NAM | CAL | CAJ | CAF | 179.1° | 180.0° |
| NAM | CAL | CAH | H1 | 0.8° | 0.0° |
| CAL | CAH | CAK | H1 | 180.0° | 179.9° |
| CAL | CAH | CAK | CAI | 179.9° | 180.0° |
| CAL | CAH | CAK | CAG | 1.0° | 0.0° |
| CAH | CAL | CAJ | IAE | 178.1° | 179.8° |
| CAH | CAL | CAJ | CAF | 1.5° | 0.2° |
| CAK | CAH | CAL | CAJ | 0.1° | 0.2° |
| CAH | CAK | CAI | CAG | 178.9° | 180.0° |
| CAH | CAK | CAI | NAA | 150.8° | 180.0° |
| CAH | CAK | CAG | CAF | 0.2° | 0.2° |
| CAH | CAK | CAG | H3 | 179.8° | 180.0° |
| CAL | CAJ | IAE | CAF | 176.7° | 180.0° |
| CAL | CAJ | CAF | CAG | 2.3° | 0.0° |
| CAJ | CAL | CAH | H1 | 179.9° | 179.8° |
| CAL | CAJ | CAF | H2 | 177.6° | 179.9° |
| CAI | CAK | CAG | CAF | 179.2° | 179.8° |
| CAI | CAK | CAH | H1 | 0.1° | 0.0° |
| CAI | CAK | CAG | H3 | 0.8° | 0.0° |
| CAK | CAI | NAA | H4 | 178.4° | 0.0° |
| CAK | CAI | NAA | H5 | 1.7° | 179.9° |
| NAA | CAI | CAK | CAG | 28.2° | 0.0° |
| CAI | NAA | H4 | H5 | 180.0° | 179.9° |
| CAK | CAG | CAF | CAJ | 1.5° | 0.2° |
| CAK | CAG | CAF | H3 | 180.0° | 179.7° |
| CAG | CAK | CAH | H1 | 179.0° | 179.9° |
| CAK | CAG | CAF | H2 | 178.5° | 179.7° |
| IAE | CAJ | CAF | CAG | 179.1° | 180.0° |
| IAE | CAJ | CAF | H2 | 0.9° | 0.1° |
| CAJ | CAF | CAG | H2 | 180.0° | 179.9° |
| CAJ | CAF | CAG | H3 | 178.5° | 180.0° |
| H2 | CAF | CAG | H3 | 1.5° | 0.0° |
