BWZ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| NAB | NAA | sing | 1.29Å | 1.30Å | Aromatic |
| NAB | NAD | sing | 1.29Å | 1.28Å | Aromatic |
| OAM | CAL | doub | 1.22Å | 1.23Å | |
| NAA | NAC | doub | 1.29Å | 1.30Å | Aromatic |
| NAD | CAE | doub | 1.32Å | 1.33Å | Aromatic |
| CAL | CAJ | sing | 1.48Å | 1.42Å | |
| CAL | NAN | sing | 1.35Å | 1.33Å | |
| CAK | CAJ | doub | 1.39Å | 1.38Å | Aromatic |
| CAK | CAF | sing | 1.39Å | 1.40Å | Aromatic |
| NAC | CAE | sing | 1.34Å | 1.30Å | Aromatic |
| CAE | CAF | sing | 1.49Å | 1.33Å | |
| NAO | NAN | sing | 1.37Å | 1.33Å | |
| CAJ | CAH | sing | 1.40Å | 1.37Å | Aromatic |
| CAF | CAI | doub | 1.39Å | 1.37Å | Aromatic |
| CAH | CAG | doub | 1.38Å | 1.38Å | Aromatic |
| CAI | CAG | sing | 1.38Å | 1.37Å | Aromatic |
| NAB | HAB | sing | 0.97Å | 1.00Å | |
| CAK | HAK | sing | 1.08Å | 1.08Å | |
| CAI | HAI | sing | 1.08Å | 1.08Å | |
| CAG | HAG | sing | 1.08Å | 1.08Å | |
| CAH | HAH | sing | 1.08Å | 1.08Å | |
| NAN | HAN | sing | 0.97Å | 1.00Å | |
| NAO | HAO | sing | 1.01Å | 1.00Å | |
| NAO | HAP | sing | 1.01Å | 1.00Å | |
| NAO | HAQ | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| NAA | NAB | NAD | 110.1° | 109.3° |
| NAB | NAA | NAC | 106.6° | 109.0° |
| NAA | NAB | HAB | 124.9° | 125.3° |
| NAB | NAD | CAE | 107.2° | 107.8° |
| NAD | NAB | HAB | 124.9° | 125.4° |
| OAM | CAL | CAJ | 122.8° | 120.0° |
| OAM | CAL | NAN | 121.0° | 120.0° |
| NAA | NAC | CAE | 109.3° | 107.2° |
| NAD | CAE | NAC | 106.7° | 106.7° |
| NAD | CAE | CAF | 125.4° | 126.7° |
| CAJ | CAL | NAN | 116.2° | 120.0° |
| CAL | CAJ | CAK | 123.2° | 120.1° |
| CAL | CAJ | CAH | 121.1° | 120.1° |
| CAL | NAN | NAO | 117.2° | 120.0° |
| CAL | NAN | HAN | 121.4° | 120.0° |
| CAJ | CAK | CAF | 123.9° | 119.7° |
| CAK | CAJ | CAH | 115.6° | 119.8° |
| CAJ | CAK | HAK | 118.1° | 120.2° |
| CAK | CAF | CAE | 123.4° | 120.0° |
| CAK | CAF | CAI | 119.3° | 119.9° |
| CAF | CAK | HAK | 118.1° | 120.1° |
| NAC | CAE | CAF | 127.9° | 126.7° |
| CAE | CAF | CAI | 117.1° | 120.1° |
| NAO | NAN | HAN | 121.4° | 120.0° |
| NAN | NAO | HAO | 109.5° | 109.4° |
| NAN | NAO | HAP | 109.4° | 109.5° |
| NAN | NAO | HAQ | 109.5° | 109.5° |
| CAJ | CAH | CAG | 120.6° | 120.1° |
| CAJ | CAH | HAH | 119.7° | 120.0° |
| CAF | CAI | CAG | 116.5° | 120.2° |
| CAF | CAI | HAI | 121.7° | 119.9° |
| CAH | CAG | CAI | 124.1° | 120.3° |
| CAH | CAG | HAG | 118.0° | 119.8° |
| CAG | CAH | HAH | 119.7° | 120.0° |
| CAG | CAI | HAI | 121.8° | 119.9° |
| CAI | CAG | HAG | 118.0° | 119.9° |
| HAO | NAO | HAP | 109.5° | 109.5° |
| HAO | NAO | HAQ | 109.5° | 109.5° |
| HAP | NAO | HAQ | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| NAA | NAB | NAD | HAB | 180.0° | 180.0° |
| NAA | NAB | NAD | CAE | 0.6° | 0.0° |
| NAB | NAA | NAC | CAE | 1.3° | 0.0° |
| NAD | NAB | NAA | NAC | 1.2° | 0.0° |
| NAB | NAD | CAE | NAC | 0.2° | 0.0° |
| NAB | NAD | CAE | CAF | 177.2° | 180.0° |
| OAM | CAL | CAJ | NAN | 178.3° | 180.0° |
| OAM | CAL | CAJ | CAK | 2.2° | 0.0° |
| OAM | CAL | NAN | NAO | 1.5° | 0.0° |
| OAM | CAL | CAJ | CAH | 177.2° | 179.9° |
| OAM | CAL | NAN | HAN | 178.6° | 179.9° |
| NAA | NAC | CAE | NAD | 0.9° | 0.0° |
| NAA | NAC | CAE | CAF | 177.9° | 180.0° |
| NAC | NAA | NAB | HAB | 178.8° | 179.9° |
| NAD | CAE | CAF | CAK | 134.0° | 179.7° |
| NAD | CAE | NAC | CAF | 177.0° | 180.0° |
| NAD | CAE | CAF | CAI | 40.2° | 0.0° |
| CAE | NAD | NAB | HAB | 179.4° | 180.0° |
| CAL | CAJ | CAK | CAH | 175.2° | 180.0° |
| CAL | CAJ | CAK | CAF | 176.7° | 180.0° |
| CAJ | CAL | NAN | NAO | 176.9° | 180.0° |
| CAL | CAJ | CAH | CAG | 178.2° | 179.7° |
| CAL | CAJ | CAK | HAK | 3.3° | 0.0° |
| CAL | CAJ | CAH | HAH | 1.8° | 0.0° |
| CAJ | CAL | NAN | HAN | 3.1° | 0.1° |
| NAN | CAL | CAJ | CAK | 176.1° | 180.0° |
| CAL | NAN | NAO | HAN | 180.0° | 179.9° |
| NAN | CAL | CAJ | CAH | 1.1° | 0.0° |
| CAL | NAN | NAO | HAO | 180.0° | 60.0° |
| CAL | NAN | NAO | HAP | 60.0° | 60.0° |
| CAL | NAN | NAO | HAQ | 60.0° | 180.0° |
| CAJ | CAK | CAF | HAK | 180.0° | 180.0° |
| CAJ | CAK | CAF | CAE | 176.2° | 180.0° |
| CAJ | CAK | CAF | CAI | 2.1° | 0.3° |
| CAK | CAJ | CAH | CAG | 2.9° | 0.3° |
| CAK | CAJ | CAH | HAH | 177.1° | 180.0° |
| CAK | CAF | CAE | NAC | 42.5° | 0.3° |
| CAK | CAF | CAE | CAI | 174.2° | 179.7° |
| CAF | CAK | CAJ | CAH | 1.4° | 0.0° |
| CAK | CAF | CAI | CAG | 4.0° | 0.3° |
| CAK | CAF | CAI | HAI | 176.0° | 179.8° |
| NAC | CAE | CAF | CAI | 143.3° | 180.0° |
| CAE | CAF | CAI | CAG | 178.5° | 180.0° |
| CAE | CAF | CAK | HAK | 3.8° | 0.0° |
| CAE | CAF | CAI | HAI | 1.6° | 0.1° |
| NAN | NAO | HAO | HAP | 120.0° | 120.0° |
| NAN | NAO | HAO | HAQ | 120.0° | 120.0° |
| NAN | NAO | HAP | HAQ | 120.0° | 120.0° |
| CAJ | CAH | CAG | HAH | 180.0° | 179.7° |
| CAJ | CAH | CAG | CAI | 0.9° | 0.3° |
| CAH | CAJ | CAK | HAK | 178.5° | 180.0° |
| CAJ | CAH | CAG | HAG | 179.1° | 179.7° |
| CAF | CAI | CAG | CAH | 2.7° | 0.0° |
| CAF | CAI | CAG | HAI | 180.0° | 179.9° |
| CAI | CAF | CAK | HAK | 177.9° | 179.7° |
| CAF | CAI | CAG | HAG | 177.3° | 180.0° |
| CAH | CAG | CAI | HAG | 180.0° | 180.0° |
| CAH | CAG | CAI | HAI | 177.3° | 179.9° |
| CAI | CAG | CAH | HAH | 179.1° | 180.0° |
| HAI | CAI | CAG | HAG | 2.7° | 0.0° |
| HAG | CAG | CAH | HAH | 0.9° | 0.1° |
| HAN | NAN | NAO | HAO | 0.0° | 120.1° |
| HAN | NAN | NAO | HAP | 120.0° | 119.9° |
| HAN | NAN | NAO | HAQ | 120.0° | 0.1° |
| HAO | NAO | HAP | HAQ | 120.0° | 120.0° |
