2NW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| BR | CAI | sing | 1.89Å | 1.87Å | |
| CAG | NAH | doub | 1.31Å | 1.39Å | Aromatic |
| CAG | CAI | sing | 1.39Å | 1.38Å | Aromatic |
| NAH | CAK | sing | 1.34Å | 1.34Å | Aromatic |
| CAI | CAJ | doub | 1.39Å | 1.39Å | Aromatic |
| CAK | CAE | doub | 1.40Å | 1.39Å | Aromatic |
| CAK | CAL | sing | 1.41Å | 1.39Å | Aromatic |
| CAJ | CAL | sing | 1.42Å | 1.39Å | Aromatic |
| CAJ | NAA | sing | 1.39Å | 1.33Å | |
| CAE | CAC | sing | 1.36Å | 1.39Å | Aromatic |
| CAL | CAF | doub | 1.40Å | 1.39Å | Aromatic |
| CAC | CAD | doub | 1.39Å | 1.39Å | Aromatic |
| CAF | CAD | sing | 1.36Å | 1.39Å | Aromatic |
| CAG | H1 | sing | 1.08Å | 1.08Å | |
| CAE | H2 | sing | 1.08Å | 1.08Å | |
| CAC | H3 | sing | 1.08Å | 1.08Å | |
| CAD | H4 | sing | 1.08Å | 1.08Å | |
| CAF | H5 | sing | 1.08Å | 1.08Å | |
| NAA | H6 | sing | 0.97Å | 1.00Å | |
| NAA | H7 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| BR | CAI | CAG | 119.0° | 120.1° |
| BR | CAI | CAJ | 122.6° | 120.2° |
| NAH | CAG | CAI | 119.6° | 121.9° |
| CAG | NAH | CAK | 121.6° | 121.7° |
| NAH | CAG | H1 | 120.2° | 119.1° |
| CAG | CAI | CAJ | 118.5° | 119.7° |
| CAI | CAG | H1 | 120.2° | 119.1° |
| NAH | CAK | CAE | 119.4° | 120.9° |
| NAH | CAK | CAL | 120.4° | 120.0° |
| CAI | CAJ | CAL | 121.4° | 117.9° |
| CAI | CAJ | NAA | 119.7° | 121.0° |
| CAE | CAK | CAL | 120.1° | 119.1° |
| CAK | CAE | CAC | 120.1° | 119.7° |
| CAK | CAE | H2 | 120.0° | 120.2° |
| CAK | CAL | CAJ | 118.6° | 118.9° |
| CAK | CAL | CAF | 120.1° | 119.7° |
| CAL | CAJ | NAA | 118.9° | 121.1° |
| CAJ | CAL | CAF | 121.4° | 121.3° |
| CAJ | NAA | H6 | 109.5° | 120.0° |
| CAJ | NAA | H7 | 109.5° | 120.0° |
| CAE | CAC | CAD | 119.6° | 121.0° |
| CAC | CAE | H2 | 120.0° | 120.1° |
| CAE | CAC | H3 | 120.2° | 119.5° |
| CAL | CAF | CAD | 119.7° | 119.6° |
| CAL | CAF | H5 | 120.2° | 120.2° |
| CAC | CAD | CAF | 120.5° | 120.8° |
| CAD | CAC | H3 | 120.2° | 119.5° |
| CAC | CAD | H4 | 119.8° | 119.6° |
| CAF | CAD | H4 | 119.8° | 119.6° |
| CAD | CAF | H5 | 120.2° | 120.2° |
| H6 | NAA | H7 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| BR | CAI | CAG | NAH | 179.6° | 180.0° |
| BR | CAI | CAG | CAJ | 179.8° | 179.7° |
| BR | CAI | CAJ | CAL | 179.4° | 179.8° |
| BR | CAI | CAJ | NAA | 0.3° | 0.1° |
| BR | CAI | CAG | H1 | 0.4° | 0.1° |
| NAH | CAG | CAI | H1 | 180.0° | 179.9° |
| NAH | CAG | CAI | CAJ | 0.1° | 0.3° |
| CAG | NAH | CAK | CAE | 179.9° | 180.0° |
| CAG | NAH | CAK | CAL | 0.1° | 0.0° |
| CAI | CAG | NAH | CAK | 0.0° | 0.0° |
| CAG | CAI | CAJ | CAL | 0.3° | 0.6° |
| CAG | CAI | CAJ | NAA | 179.9° | 179.7° |
| NAH | CAK | CAE | CAL | 179.8° | 179.9° |
| NAH | CAK | CAL | CAJ | 0.3° | 0.2° |
| NAH | CAK | CAE | CAC | 179.9° | 179.9° |
| NAH | CAK | CAL | CAF | 179.8° | 180.0° |
| CAK | NAH | CAG | H1 | 180.0° | 180.0° |
| NAH | CAK | CAE | H2 | 0.0° | 0.1° |
| CAI | CAJ | CAL | CAK | 0.4° | 0.5° |
| CAI | CAJ | CAL | NAA | 179.7° | 179.7° |
| CAI | CAJ | CAL | CAF | 179.7° | 179.7° |
| CAJ | CAI | CAG | H1 | 179.9° | 179.7° |
| CAI | CAJ | NAA | H6 | 180.0° | 0.0° |
| CAI | CAJ | NAA | H7 | 60.0° | 179.9° |
| CAE | CAK | CAL | CAJ | 179.9° | 179.7° |
| CAK | CAE | CAC | H2 | 180.0° | 180.0° |
| CAE | CAK | CAL | CAF | 0.0° | 0.0° |
| CAK | CAE | CAC | CAD | 0.2° | 0.0° |
| CAK | CAE | CAC | H3 | 179.8° | 180.0° |
| CAK | CAL | CAJ | CAF | 179.9° | 179.8° |
| CAK | CAL | CAJ | NAA | 179.9° | 179.8° |
| CAL | CAK | CAE | CAC | 0.1° | 0.0° |
| CAK | CAL | CAF | CAD | 0.1° | 0.1° |
| CAL | CAK | CAE | H2 | 179.8° | 180.0° |
| CAK | CAL | CAF | H5 | 179.9° | 180.0° |
| CAJ | CAL | CAF | CAD | 179.9° | 179.7° |
| CAJ | CAL | CAF | H5 | 0.1° | 0.2° |
| CAL | CAJ | NAA | H6 | 0.2° | 179.7° |
| CAL | CAJ | NAA | H7 | 120.2° | 0.2° |
| NAA | CAJ | CAL | CAF | 0.1° | 0.0° |
| CAJ | NAA | H6 | H7 | 120.0° | 179.9° |
| CAE | CAC | CAD | H3 | 180.0° | 180.0° |
| CAE | CAC | CAD | CAF | 0.1° | 0.0° |
| CAE | CAC | CAD | H4 | 179.9° | 180.0° |
| CAL | CAF | CAD | CAC | 0.0° | 0.1° |
| CAL | CAF | CAD | H5 | 180.0° | 179.9° |
| CAL | CAF | CAD | H4 | 180.0° | 180.0° |
| CAC | CAD | CAF | H4 | 180.0° | 179.9° |
| CAD | CAC | CAE | H2 | 179.8° | 180.0° |
| CAC | CAD | CAF | H5 | 180.0° | 180.0° |
| CAF | CAD | CAC | H3 | 179.9° | 179.9° |
| H2 | CAE | CAC | H3 | 0.2° | 0.0° |
| H3 | CAC | CAD | H4 | 0.1° | 0.0° |
| H4 | CAD | CAF | H5 | 0.0° | 0.1° |
