H2W
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAF | CAE | sing | 1.46Å | 1.38Å | |
| CAF | CAG | doub | 1.36Å | 1.40Å | |
| CAE | CAO | sing | 1.40Å | 1.41Å | Aromatic |
| CAE | CAD | doub | 1.42Å | 1.41Å | Aromatic |
| CAO | FAP | sing | 1.35Å | 1.38Å | |
| CAO | CAQ | doub | 1.38Å | 1.39Å | Aromatic |
| CAQ | CAR | sing | 1.39Å | 1.40Å | Aromatic |
| CAR | CAS | doub | 1.38Å | 1.41Å | Aromatic |
| CAS | CAD | sing | 1.39Å | 1.39Å | Aromatic |
| CAD | CAB | sing | 1.47Å | 1.39Å | |
| CAB | OAC | doub | 1.22Å | 1.23Å | |
| CAB | NAA | sing | 1.35Å | 1.40Å | |
| NAA | CAG | sing | 1.37Å | 1.40Å | |
| CAG | CAH | sing | 1.48Å | 1.42Å | |
| CAH | CAI | sing | 1.40Å | 1.40Å | Aromatic |
| CAH | CAN | doub | 1.40Å | 1.39Å | Aromatic |
| CAI | CAJ | doub | 1.38Å | 1.39Å | Aromatic |
| CAJ | CAK | sing | 1.38Å | 1.38Å | Aromatic |
| CAK | CL | sing | 1.74Å | 1.78Å | |
| CAK | CAM | doub | 1.39Å | 1.39Å | Aromatic |
| CAM | CAN | sing | 1.38Å | 1.40Å | Aromatic |
| CAF | HAF | sing | 1.08Å | 1.08Å | |
| CAQ | HAQ | sing | 1.08Å | 1.08Å | |
| CAR | HAR | sing | 1.08Å | 1.08Å | |
| CAS | HAS | sing | 1.08Å | 1.08Å | |
| NAA | HAA | sing | 0.97Å | 1.00Å | |
| CAI | HAI | sing | 1.08Å | 1.08Å | |
| CAN | HAN | sing | 1.08Å | 1.08Å | |
| CAJ | HAJ | sing | 1.08Å | 1.08Å | |
| CAM | HAM | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAE | CAF | CAG | 121.6° | 119.4° |
| CAF | CAE | CAO | 119.0° | 121.9° |
| CAF | CAE | CAD | 120.9° | 118.5° |
| CAE | CAF | HAF | 119.2° | 120.3° |
| CAF | CAG | NAA | 116.7° | 122.0° |
| CAF | CAG | CAH | 123.0° | 119.0° |
| CAG | CAF | HAF | 119.2° | 120.3° |
| CAO | CAE | CAD | 120.1° | 119.6° |
| CAE | CAO | FAP | 120.5° | 120.2° |
| CAE | CAO | CAQ | 120.1° | 119.5° |
| CAE | CAD | CAS | 119.3° | 119.7° |
| CAE | CAD | CAB | 118.7° | 118.5° |
| FAP | CAO | CAQ | 119.4° | 120.3° |
| CAO | CAQ | CAR | 119.7° | 120.7° |
| CAO | CAQ | HAQ | 120.1° | 119.7° |
| CAQ | CAR | CAS | 120.3° | 120.8° |
| CAR | CAQ | HAQ | 120.1° | 119.6° |
| CAQ | CAR | HAR | 119.8° | 119.6° |
| CAR | CAS | CAD | 120.3° | 119.7° |
| CAS | CAR | HAR | 119.8° | 119.7° |
| CAR | CAS | HAS | 119.8° | 120.1° |
| CAS | CAD | CAB | 122.1° | 121.8° |
| CAD | CAS | HAS | 119.8° | 120.2° |
| CAD | CAB | OAC | 123.5° | 120.3° |
| CAD | CAB | NAA | 119.4° | 119.4° |
| OAC | CAB | NAA | 117.1° | 120.3° |
| CAB | NAA | CAG | 122.8° | 122.2° |
| CAB | NAA | HAA | 118.6° | 118.9° |
| NAA | CAG | CAH | 120.4° | 118.9° |
| CAG | NAA | HAA | 118.6° | 118.9° |
| CAG | CAH | CAI | 120.0° | 120.2° |
| CAG | CAH | CAN | 123.7° | 120.1° |
| CAI | CAH | CAN | 116.3° | 119.7° |
| CAH | CAI | CAJ | 122.3° | 119.8° |
| CAH | CAI | HAI | 118.9° | 120.1° |
| CAH | CAN | CAM | 121.9° | 119.9° |
| CAH | CAN | HAN | 119.0° | 120.1° |
| CAI | CAJ | CAK | 120.3° | 120.2° |
| CAJ | CAI | HAI | 118.8° | 120.1° |
| CAI | CAJ | HAJ | 119.8° | 119.9° |
| CAJ | CAK | CL | 119.0° | 119.9° |
| CAJ | CAK | CAM | 118.9° | 120.2° |
| CAK | CAJ | HAJ | 119.9° | 119.9° |
| CL | CAK | CAM | 122.1° | 119.9° |
| CAK | CAM | CAN | 120.3° | 120.1° |
| CAK | CAM | HAM | 119.9° | 119.9° |
| CAM | CAN | HAN | 119.1° | 120.1° |
| CAN | CAM | HAM | 119.9° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAE | CAF | CAG | HAF | 180.0° | 179.6° |
| CAF | CAE | CAO | CAD | 179.0° | 180.0° |
| CAF | CAE | CAO | FAP | 1.4° | 0.0° |
| CAF | CAE | CAO | CAQ | 179.1° | 180.0° |
| CAF | CAE | CAD | CAS | 178.0° | 180.0° |
| CAF | CAE | CAD | CAB | 2.1° | 0.0° |
| CAE | CAF | CAG | NAA | 0.2° | 0.1° |
| CAE | CAF | CAG | CAH | 178.9° | 180.0° |
| CAG | CAF | CAE | CAO | 179.5° | 180.0° |
| CAG | CAF | CAE | CAD | 1.5° | 0.0° |
| CAF | CAG | NAA | CAB | 0.6° | 0.0° |
| CAF | CAG | NAA | CAH | 178.8° | 180.0° |
| CAF | CAG | CAH | CAI | 158.5° | 180.0° |
| CAF | CAG | CAH | CAN | 17.8° | 0.3° |
| CAF | CAG | NAA | HAA | 179.4° | 180.0° |
| CAE | CAO | FAP | CAQ | 179.5° | 179.9° |
| CAE | CAO | CAQ | CAR | 1.9° | 0.0° |
| CAO | CAE | CAD | CAS | 0.9° | 0.1° |
| CAO | CAE | CAD | CAB | 178.9° | 180.0° |
| CAO | CAE | CAF | HAF | 0.5° | 0.3° |
| CAE | CAO | CAQ | HAQ | 178.1° | 180.0° |
| CAD | CAE | CAO | FAP | 179.6° | 179.9° |
| CAD | CAE | CAO | CAQ | 0.1° | 0.0° |
| CAE | CAD | CAS | CAR | 0.3° | 0.1° |
| CAE | CAD | CAS | CAB | 179.9° | 179.9° |
| CAE | CAD | CAB | OAC | 179.5° | 180.0° |
| CAE | CAD | CAB | NAA | 1.4° | 0.0° |
| CAD | CAE | CAF | HAF | 178.5° | 179.6° |
| CAE | CAD | CAS | HAS | 179.7° | 180.0° |
| FAP | CAO | CAQ | CAR | 178.7° | 180.0° |
| FAP | CAO | CAQ | HAQ | 1.4° | 0.1° |
| CAO | CAQ | CAR | HAQ | 180.0° | 180.0° |
| CAO | CAQ | CAR | CAS | 2.6° | 0.0° |
| CAO | CAQ | CAR | HAR | 177.5° | 180.0° |
| CAQ | CAR | CAS | HAR | 180.0° | 180.0° |
| CAQ | CAR | CAS | CAD | 1.5° | 0.1° |
| CAQ | CAR | CAS | HAS | 178.5° | 180.0° |
| CAR | CAS | CAD | HAS | 180.0° | 179.9° |
| CAR | CAS | CAD | CAB | 179.6° | 180.0° |
| CAS | CAR | CAQ | HAQ | 177.4° | 180.0° |
| CAS | CAD | CAB | OAC | 0.4° | 0.1° |
| CAS | CAD | CAB | NAA | 178.8° | 180.0° |
| CAD | CAS | CAR | HAR | 178.5° | 180.0° |
| CAD | CAB | OAC | NAA | 179.2° | 179.9° |
| CAD | CAB | NAA | CAG | 0.0° | 0.0° |
| CAB | CAD | CAS | HAS | 0.4° | 0.0° |
| CAD | CAB | NAA | HAA | 180.0° | 180.0° |
| OAC | CAB | NAA | CAG | 179.3° | 179.9° |
| OAC | CAB | NAA | HAA | 0.8° | 0.1° |
| CAB | NAA | CAG | HAA | 180.0° | 180.0° |
| CAB | NAA | CAG | CAH | 178.2° | 180.0° |
| NAA | CAG | CAH | CAI | 20.2° | 0.0° |
| NAA | CAG | CAH | CAN | 163.5° | 179.8° |
| NAA | CAG | CAF | HAF | 179.8° | 179.7° |
| CAG | CAH | CAI | CAN | 176.6° | 179.8° |
| CAG | CAH | CAI | CAJ | 178.7° | 180.0° |
| CAG | CAH | CAN | CAM | 178.3° | 179.7° |
| CAH | CAG | CAF | HAF | 1.1° | 0.4° |
| CAH | CAG | NAA | HAA | 1.8° | 0.0° |
| CAG | CAH | CAI | HAI | 1.3° | 0.0° |
| CAG | CAH | CAN | HAN | 1.8° | 0.1° |
| CAH | CAI | CAJ | HAI | 180.0° | 180.0° |
| CAH | CAI | CAJ | CAK | 1.3° | 0.0° |
| CAI | CAH | CAN | CAM | 1.8° | 0.5° |
| CAI | CAH | CAN | HAN | 178.3° | 179.7° |
| CAH | CAI | CAJ | HAJ | 178.7° | 180.0° |
| CAN | CAH | CAI | CAJ | 2.0° | 0.2° |
| CAH | CAN | CAM | CAK | 0.8° | 0.5° |
| CAH | CAN | CAM | HAN | 180.0° | 179.8° |
| CAN | CAH | CAI | HAI | 178.0° | 179.8° |
| CAH | CAN | CAM | HAM | 179.2° | 179.7° |
| CAI | CAJ | CAK | HAJ | 180.0° | 180.0° |
| CAI | CAJ | CAK | CL | 179.8° | 180.0° |
| CAI | CAJ | CAK | CAM | 0.2° | 0.0° |
| CAJ | CAK | CL | CAM | 179.6° | 180.0° |
| CAJ | CAK | CAM | CAN | 0.1° | 0.2° |
| CAK | CAJ | CAI | HAI | 178.7° | 180.0° |
| CAJ | CAK | CAM | HAM | 179.9° | 180.0° |
| CL | CAK | CAM | CAN | 179.5° | 179.7° |
| CL | CAK | CAJ | HAJ | 0.2° | 0.0° |
| CL | CAK | CAM | HAM | 0.4° | 0.1° |
| CAK | CAM | CAN | HAM | 180.0° | 179.8° |
| CAK | CAM | CAN | HAN | 179.3° | 179.7° |
| CAM | CAK | CAJ | HAJ | 179.8° | 180.0° |
| HAQ | CAQ | CAR | HAR | 2.5° | 0.0° |
| HAR | CAR | CAS | HAS | 1.5° | 0.0° |
| HAI | CAI | CAJ | HAJ | 1.3° | 0.0° |
| HAN | CAN | CAM | HAM | 0.8° | 0.1° |
