W8L
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAH | CAG | sing | 1.46Å | 1.40Å | |
| CAH | CAI | doub | 1.36Å | 1.40Å | |
| CAG | CAB | sing | 1.40Å | 1.42Å | Aromatic |
| CAG | CAF | doub | 1.42Å | 1.41Å | Aromatic |
| CAB | CAA | sing | 1.51Å | 1.43Å | |
| CAB | CAC | doub | 1.37Å | 1.38Å | Aromatic |
| CAC | CAD | sing | 1.39Å | 1.39Å | Aromatic |
| CAD | CAE | doub | 1.38Å | 1.39Å | Aromatic |
| CAE | CAF | sing | 1.39Å | 1.39Å | Aromatic |
| CAF | CAK | sing | 1.47Å | 1.42Å | |
| CAK | OAL | doub | 1.22Å | 1.24Å | |
| CAK | NAJ | sing | 1.35Å | 1.36Å | |
| NAJ | CAI | sing | 1.37Å | 1.42Å | |
| CAI | CAM | sing | 1.48Å | 1.39Å | |
| CAM | CAN | sing | 1.40Å | 1.40Å | Aromatic |
| CAM | CAS | doub | 1.40Å | 1.41Å | Aromatic |
| CAN | CAO | doub | 1.38Å | 1.39Å | Aromatic |
| CAO | CAP | sing | 1.38Å | 1.39Å | Aromatic |
| CAP | CL | sing | 1.74Å | 1.77Å | |
| CAP | CAR | doub | 1.39Å | 1.38Å | Aromatic |
| CAR | CAS | sing | 1.38Å | 1.38Å | Aromatic |
| CAH | HAH | sing | 1.08Å | 1.08Å | |
| CAA | HAA1 | sing | 1.09Å | 1.10Å | |
| CAA | HAA2 | sing | 1.09Å | 1.10Å | |
| CAA | HAA3 | sing | 1.09Å | 1.10Å | |
| CAC | HAC | sing | 1.08Å | 1.08Å | |
| CAD | HAD | sing | 1.08Å | 1.08Å | |
| CAE | HAE | sing | 1.08Å | 1.08Å | |
| NAJ | HAJ | sing | 0.97Å | 1.00Å | |
| CAN | HAN | sing | 1.08Å | 1.08Å | |
| CAS | HAS | sing | 1.08Å | 1.08Å | |
| CAO | HAO | sing | 1.08Å | 1.08Å | |
| CAR | HAR | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAG | CAH | CAI | 119.2° | 119.3° |
| CAH | CAG | CAB | 119.2° | 121.9° |
| CAH | CAG | CAF | 120.2° | 118.4° |
| CAG | CAH | HAH | 120.4° | 120.3° |
| CAH | CAI | NAJ | 119.1° | 122.1° |
| CAH | CAI | CAM | 121.4° | 118.9° |
| CAI | CAH | HAH | 120.4° | 120.3° |
| CAB | CAG | CAF | 120.6° | 119.7° |
| CAG | CAB | CAA | 123.1° | 120.2° |
| CAG | CAB | CAC | 119.1° | 119.6° |
| CAG | CAF | CAE | 119.1° | 119.6° |
| CAG | CAF | CAK | 120.9° | 118.5° |
| CAA | CAB | CAC | 117.8° | 120.2° |
| CAB | CAA | HAA1 | 109.5° | 109.5° |
| CAB | CAA | HAA2 | 109.5° | 109.5° |
| CAB | CAA | HAA3 | 109.5° | 109.5° |
| CAB | CAC | CAD | 120.3° | 120.9° |
| CAB | CAC | HAC | 119.9° | 119.6° |
| CAC | CAD | CAE | 121.0° | 120.7° |
| CAD | CAC | HAC | 119.9° | 119.5° |
| CAC | CAD | HAD | 119.5° | 119.7° |
| CAD | CAE | CAF | 120.0° | 119.4° |
| CAE | CAD | HAD | 119.5° | 119.6° |
| CAD | CAE | HAE | 120.0° | 120.3° |
| CAE | CAF | CAK | 120.1° | 121.9° |
| CAF | CAE | HAE | 120.0° | 120.3° |
| CAF | CAK | OAL | 125.0° | 120.3° |
| CAF | CAK | NAJ | 117.5° | 119.5° |
| OAL | CAK | NAJ | 117.5° | 120.3° |
| CAK | NAJ | CAI | 123.1° | 122.1° |
| CAK | NAJ | HAJ | 118.4° | 118.9° |
| NAJ | CAI | CAM | 119.4° | 119.0° |
| CAI | NAJ | HAJ | 118.5° | 119.0° |
| CAI | CAM | CAN | 123.4° | 120.1° |
| CAI | CAM | CAS | 117.9° | 120.2° |
| CAN | CAM | CAS | 118.5° | 119.7° |
| CAM | CAN | CAO | 120.2° | 119.8° |
| CAM | CAN | HAN | 119.9° | 120.0° |
| CAM | CAS | CAR | 120.7° | 119.9° |
| CAM | CAS | HAS | 119.6° | 120.0° |
| CAN | CAO | CAP | 120.4° | 120.2° |
| CAO | CAN | HAN | 119.9° | 120.1° |
| CAN | CAO | HAO | 119.8° | 119.9° |
| CAO | CAP | CL | 119.6° | 120.0° |
| CAO | CAP | CAR | 120.1° | 120.2° |
| CAP | CAO | HAO | 119.9° | 119.9° |
| CL | CAP | CAR | 120.3° | 119.8° |
| CAP | CAR | CAS | 120.0° | 120.1° |
| CAP | CAR | HAR | 120.0° | 120.0° |
| CAR | CAS | HAS | 119.7° | 120.1° |
| CAS | CAR | HAR | 120.0° | 119.9° |
| HAA1 | CAA | HAA2 | 109.4° | 109.5° |
| HAA1 | CAA | HAA3 | 109.4° | 109.5° |
| HAA2 | CAA | HAA3 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAG | CAH | CAI | HAH | 180.0° | 179.6° |
| CAH | CAG | CAB | CAF | 178.8° | 180.0° |
| CAH | CAG | CAB | CAA | 0.6° | 0.0° |
| CAH | CAG | CAB | CAC | 178.7° | 180.0° |
| CAH | CAG | CAF | CAE | 176.6° | 180.0° |
| CAH | CAG | CAF | CAK | 2.7° | 0.0° |
| CAG | CAH | CAI | NAJ | 1.4° | 0.1° |
| CAG | CAH | CAI | CAM | 177.2° | 180.0° |
| CAI | CAH | CAG | CAB | 179.5° | 180.0° |
| CAI | CAH | CAG | CAF | 1.8° | 0.0° |
| CAH | CAI | NAJ | CAK | 2.1° | 0.0° |
| CAH | CAI | NAJ | CAM | 175.9° | 180.0° |
| CAH | CAI | CAM | CAN | 18.8° | 180.0° |
| CAH | CAI | CAM | CAS | 154.9° | 0.3° |
| CAH | CAI | NAJ | HAJ | 177.9° | 180.0° |
| CAG | CAB | CAA | CAC | 179.4° | 179.9° |
| CAG | CAB | CAC | CAD | 0.9° | 0.0° |
| CAB | CAG | CAF | CAE | 2.1° | 0.0° |
| CAB | CAG | CAF | CAK | 178.5° | 180.0° |
| CAB | CAG | CAH | HAH | 0.5° | 0.3° |
| CAG | CAB | CAA | HAA1 | 90.4° | 90.0° |
| CAG | CAB | CAA | HAA2 | 149.6° | 150.0° |
| CAG | CAB | CAA | HAA3 | 29.6° | 30.1° |
| CAG | CAB | CAC | HAC | 179.1° | 180.0° |
| CAF | CAG | CAB | CAA | 179.4° | 179.9° |
| CAF | CAG | CAB | CAC | 0.0° | 0.0° |
| CAG | CAF | CAE | CAD | 3.3° | 0.0° |
| CAG | CAF | CAE | CAK | 179.3° | 180.0° |
| CAG | CAF | CAK | OAL | 178.3° | 180.0° |
| CAG | CAF | CAK | NAJ | 3.2° | 0.0° |
| CAF | CAG | CAH | HAH | 178.3° | 179.6° |
| CAG | CAF | CAE | HAE | 176.7° | 180.0° |
| CAA | CAB | CAC | CAD | 178.5° | 180.0° |
| CAB | CAA | HAA1 | HAA2 | 120.0° | 120.0° |
| CAB | CAA | HAA1 | HAA3 | 120.0° | 120.0° |
| CAB | CAA | HAA2 | HAA3 | 120.0° | 120.0° |
| CAA | CAB | CAC | HAC | 1.5° | 0.1° |
| CAB | CAC | CAD | HAC | 180.0° | 180.0° |
| CAB | CAC | CAD | CAE | 0.3° | 0.0° |
| CAC | CAB | CAA | HAA1 | 90.3° | 89.9° |
| CAC | CAB | CAA | HAA2 | 29.7° | 30.1° |
| CAC | CAB | CAA | HAA3 | 149.7° | 150.0° |
| CAB | CAC | CAD | HAD | 179.7° | 179.9° |
| CAC | CAD | CAE | HAD | 180.0° | 179.9° |
| CAC | CAD | CAE | CAF | 2.5° | 0.0° |
| CAC | CAD | CAE | HAE | 177.5° | 180.0° |
| CAD | CAE | CAF | HAE | 180.0° | 180.0° |
| CAD | CAE | CAF | CAK | 177.3° | 180.0° |
| CAE | CAD | CAC | HAC | 179.7° | 180.0° |
| CAE | CAF | CAK | OAL | 2.3° | 0.1° |
| CAE | CAF | CAK | NAJ | 176.1° | 180.0° |
| CAF | CAE | CAD | HAD | 177.5° | 179.9° |
| CAF | CAK | OAL | NAJ | 178.4° | 179.9° |
| CAF | CAK | NAJ | CAI | 3.0° | 0.0° |
| CAK | CAF | CAE | HAE | 2.7° | 0.0° |
| CAF | CAK | NAJ | HAJ | 177.0° | 180.0° |
| OAL | CAK | NAJ | CAI | 178.5° | 179.9° |
| OAL | CAK | NAJ | HAJ | 1.5° | 0.1° |
| CAK | NAJ | CAI | HAJ | 180.0° | 180.0° |
| CAK | NAJ | CAI | CAM | 178.0° | 180.0° |
| NAJ | CAI | CAM | CAN | 165.3° | 0.0° |
| NAJ | CAI | CAM | CAS | 20.9° | 179.8° |
| NAJ | CAI | CAH | HAH | 178.6° | 179.7° |
| CAI | CAM | CAN | CAS | 173.7° | 179.8° |
| CAI | CAM | CAN | CAO | 178.0° | 180.0° |
| CAI | CAM | CAS | CAR | 178.3° | 179.8° |
| CAM | CAI | CAH | HAH | 2.8° | 0.4° |
| CAM | CAI | NAJ | HAJ | 1.9° | 0.0° |
| CAI | CAM | CAN | HAN | 2.0° | 0.0° |
| CAI | CAM | CAS | HAS | 1.7° | 0.1° |
| CAM | CAN | CAO | HAN | 180.0° | 180.0° |
| CAM | CAN | CAO | CAP | 2.3° | 0.0° |
| CAN | CAM | CAS | CAR | 4.2° | 0.5° |
| CAN | CAM | CAS | HAS | 175.8° | 179.7° |
| CAM | CAN | CAO | HAO | 177.7° | 180.0° |
| CAS | CAM | CAN | CAO | 4.3° | 0.2° |
| CAM | CAS | CAR | CAP | 2.2° | 0.4° |
| CAM | CAS | CAR | HAS | 180.0° | 179.8° |
| CAS | CAM | CAN | HAN | 175.7° | 179.8° |
| CAM | CAS | CAR | HAR | 177.8° | 179.7° |
| CAN | CAO | CAP | HAO | 180.0° | 180.0° |
| CAN | CAO | CAP | CL | 179.4° | 180.0° |
| CAN | CAO | CAP | CAR | 0.3° | 0.1° |
| CAO | CAP | CL | CAR | 179.1° | 179.9° |
| CAO | CAP | CAR | CAS | 0.2° | 0.1° |
| CAP | CAO | CAN | HAN | 177.6° | 180.0° |
| CAO | CAP | CAR | HAR | 179.9° | 180.0° |
| CL | CAP | CAR | CAS | 179.3° | 179.8° |
| CL | CAP | CAO | HAO | 0.6° | 0.0° |
| CL | CAP | CAR | HAR | 0.8° | 0.1° |
| CAP | CAR | CAS | HAR | 180.0° | 179.9° |
| CAP | CAR | CAS | HAS | 177.8° | 179.7° |
| CAR | CAP | CAO | HAO | 179.8° | 180.0° |
| HAA1 | CAA | HAA2 | HAA3 | 119.9° | 119.9° |
| HAC | CAC | CAD | HAD | 0.3° | 0.1° |
| HAD | CAD | CAE | HAE | 2.5° | 0.1° |
| HAN | CAN | CAO | HAO | 2.3° | 0.0° |
| HAS | CAS | CAR | HAR | 2.2° | 0.1° |
