1V8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAM | OAL | sing | 1.44Å | 1.46Å | |
| CAM | OAK | sing | 1.44Å | 1.51Å | |
| OAL | CAJ | sing | 1.36Å | 1.37Å | |
| OAK | CAH | sing | 1.36Å | 1.37Å | |
| CAJ | CAP | doub | 1.39Å | 1.33Å | Aromatic |
| CAJ | CAH | sing | 1.40Å | 1.37Å | Aromatic |
| CAP | CAO | sing | 1.38Å | 1.39Å | Aromatic |
| CAH | CAI | doub | 1.38Å | 1.35Å | Aromatic |
| CAI | CAG | sing | 1.40Å | 1.41Å | Aromatic |
| CAO | CAG | doub | 1.40Å | 1.40Å | Aromatic |
| CAG | CAA | sing | 1.47Å | 1.42Å | |
| CAA | OAC | sing | 1.34Å | 1.38Å | |
| CAA | CAB | doub | 1.36Å | 1.39Å | |
| OAC | CAF | sing | 1.35Å | 1.35Å | |
| CAB | CAD | sing | 1.41Å | 1.39Å | |
| CAF | CAR | doub | 1.39Å | 1.39Å | Aromatic |
| CAF | CAE | sing | 1.40Å | 1.40Å | Aromatic |
| CAD | CAE | sing | 1.48Å | 1.40Å | |
| CAD | OAN | doub | 1.22Å | 1.24Å | |
| CAR | CAT | sing | 1.38Å | 1.39Å | Aromatic |
| CAE | CAQ | doub | 1.39Å | 1.39Å | Aromatic |
| CAT | CAS | doub | 1.39Å | 1.40Å | Aromatic |
| CAQ | CAS | sing | 1.38Å | 1.39Å | Aromatic |
| CAI | H1 | sing | 1.08Å | 1.08Å | |
| CAM | H2 | sing | 1.09Å | 1.10Å | |
| CAM | H3 | sing | 1.09Å | 1.10Å | |
| CAP | H4 | sing | 1.08Å | 1.08Å | |
| CAO | H5 | sing | 1.08Å | 1.08Å | |
| CAR | H6 | sing | 1.08Å | 1.08Å | |
| CAT | H7 | sing | 1.08Å | 1.08Å | |
| CAS | H8 | sing | 1.08Å | 1.08Å | |
| CAQ | H9 | sing | 1.08Å | 1.08Å | |
| CAB | H10 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAL | CAM | OAK | 104.7° | 103.8° |
| CAM | OAL | CAJ | 100.6° | 105.5° |
| OAL | CAM | H2 | 110.6° | 110.6° |
| OAL | CAM | H3 | 110.7° | 110.6° |
| CAM | OAK | CAH | 100.7° | 105.4° |
| OAK | CAM | H2 | 110.7° | 110.6° |
| OAK | CAM | H3 | 110.6° | 110.6° |
| OAL | CAJ | CAP | 127.3° | 131.3° |
| OAL | CAJ | CAH | 112.4° | 108.5° |
| OAK | CAH | CAJ | 109.8° | 108.6° |
| OAK | CAH | CAI | 128.7° | 131.4° |
| CAP | CAJ | CAH | 120.3° | 120.1° |
| CAJ | CAP | CAO | 120.7° | 120.2° |
| CAJ | CAP | H4 | 119.6° | 119.9° |
| CAJ | CAH | CAI | 121.4° | 119.9° |
| CAP | CAO | CAG | 120.3° | 120.0° |
| CAO | CAP | H4 | 119.7° | 119.9° |
| CAP | CAO | H5 | 119.9° | 120.0° |
| CAH | CAI | CAG | 120.6° | 119.9° |
| CAH | CAI | H1 | 119.7° | 120.0° |
| CAI | CAG | CAO | 116.7° | 119.8° |
| CAI | CAG | CAA | 124.7° | 120.1° |
| CAG | CAI | H1 | 119.7° | 120.0° |
| CAO | CAG | CAA | 118.6° | 120.1° |
| CAG | CAO | H5 | 119.9° | 120.0° |
| CAG | CAA | OAC | 114.9° | 118.8° |
| CAG | CAA | CAB | 124.7° | 118.7° |
| OAC | CAA | CAB | 120.3° | 122.5° |
| CAA | OAC | CAF | 121.0° | 122.3° |
| CAA | CAB | CAD | 120.0° | 119.5° |
| CAA | CAB | H10 | 120.0° | 120.2° |
| OAC | CAF | CAR | 118.3° | 120.8° |
| OAC | CAF | CAE | 119.2° | 119.8° |
| CAB | CAD | CAE | 118.5° | 117.4° |
| CAB | CAD | OAN | 119.0° | 121.3° |
| CAD | CAB | H10 | 120.0° | 120.2° |
| CAR | CAF | CAE | 122.6° | 119.4° |
| CAF | CAR | CAT | 119.6° | 119.9° |
| CAF | CAR | H6 | 120.2° | 120.1° |
| CAF | CAE | CAD | 120.7° | 118.5° |
| CAF | CAE | CAQ | 117.7° | 120.2° |
| CAE | CAD | OAN | 122.4° | 121.3° |
| CAD | CAE | CAQ | 121.5° | 121.3° |
| CAR | CAT | CAS | 118.0° | 120.6° |
| CAT | CAR | H6 | 120.2° | 120.0° |
| CAR | CAT | H7 | 121.0° | 119.7° |
| CAE | CAQ | CAS | 120.1° | 119.5° |
| CAE | CAQ | H9 | 120.0° | 120.2° |
| CAT | CAS | CAQ | 122.0° | 120.3° |
| CAS | CAT | H7 | 121.0° | 119.7° |
| CAT | CAS | H8 | 119.0° | 119.8° |
| CAQ | CAS | H8 | 119.0° | 119.8° |
| CAS | CAQ | H9 | 120.0° | 120.3° |
| H2 | CAM | H3 | 109.4° | 110.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAL | CAM | OAK | H2 | 119.2° | 118.6° |
| OAL | CAM | OAK | H3 | 119.3° | 118.6° |
| OAL | CAM | OAK | CAH | 32.9° | 27.2° |
| CAM | OAL | CAJ | CAP | 157.5° | 162.7° |
| CAM | OAL | CAJ | CAH | 20.6° | 17.3° |
| OAL | CAM | H2 | H3 | 122.2° | 122.8° |
| OAK | CAM | OAL | CAJ | 32.2° | 27.2° |
| CAM | OAK | CAH | CAJ | 20.7° | 17.3° |
| CAM | OAK | CAH | CAI | 158.7° | 162.7° |
| OAK | CAM | H2 | H3 | 122.2° | 122.8° |
| OAL | CAJ | CAH | OAK | 0.5° | 0.0° |
| OAL | CAJ | CAP | CAH | 178.0° | 180.0° |
| OAL | CAJ | CAP | CAO | 179.4° | 180.0° |
| OAL | CAJ | CAH | CAI | 178.9° | 180.0° |
| CAJ | OAL | CAM | H2 | 87.0° | 91.4° |
| CAJ | OAL | CAM | H3 | 151.5° | 145.8° |
| OAL | CAJ | CAP | H4 | 0.6° | 0.0° |
| OAK | CAH | CAJ | CAP | 178.8° | 180.0° |
| OAK | CAH | CAJ | CAI | 179.4° | 180.0° |
| OAK | CAH | CAI | CAG | 180.0° | 180.0° |
| OAK | CAH | CAI | H1 | 0.0° | 0.3° |
| CAH | OAK | CAM | H2 | 86.4° | 91.4° |
| CAH | OAK | CAM | H3 | 152.2° | 145.8° |
| CAJ | CAP | CAO | H4 | 180.0° | 180.0° |
| CAP | CAJ | CAH | CAI | 0.7° | 0.0° |
| CAJ | CAP | CAO | CAG | 0.9° | 0.1° |
| CAJ | CAP | CAO | H5 | 179.1° | 180.0° |
| CAH | CAJ | CAP | CAO | 1.4° | 0.0° |
| CAJ | CAH | CAI | CAG | 0.6° | 0.0° |
| CAJ | CAH | CAI | H1 | 179.4° | 179.7° |
| CAH | CAJ | CAP | H4 | 178.6° | 180.0° |
| CAP | CAO | CAG | CAI | 0.3° | 0.1° |
| CAP | CAO | CAG | H5 | 180.0° | 179.9° |
| CAP | CAO | CAG | CAA | 179.1° | 179.7° |
| CAH | CAI | CAG | H1 | 180.0° | 179.7° |
| CAH | CAI | CAG | CAO | 1.1° | 0.1° |
| CAH | CAI | CAG | CAA | 179.7° | 179.7° |
| CAI | CAG | CAO | CAA | 178.7° | 179.6° |
| CAI | CAG | CAA | OAC | 171.4° | 0.1° |
| CAI | CAG | CAA | CAB | 5.0° | 179.7° |
| CAI | CAG | CAO | H5 | 179.7° | 180.0° |
| CAO | CAG | CAA | OAC | 7.2° | 179.7° |
| CAO | CAG | CAA | CAB | 176.4° | 0.7° |
| CAO | CAG | CAI | H1 | 178.9° | 179.7° |
| CAG | CAO | CAP | H4 | 179.1° | 179.9° |
| CAG | CAA | OAC | CAB | 176.6° | 179.6° |
| CAG | CAA | OAC | CAF | 176.1° | 180.0° |
| CAG | CAA | CAB | CAD | 179.5° | 179.8° |
| CAA | CAG | CAI | H1 | 0.3° | 0.1° |
| CAA | CAG | CAO | H5 | 0.9° | 0.4° |
| CAG | CAA | CAB | H10 | 0.5° | 0.1° |
| OAC | CAA | CAB | CAD | 3.3° | 0.6° |
| CAA | OAC | CAF | CAR | 174.8° | 180.0° |
| CAA | OAC | CAF | CAE | 6.0° | 0.1° |
| OAC | CAA | CAB | H10 | 176.8° | 179.7° |
| CAB | CAA | OAC | CAF | 7.3° | 0.4° |
| CAA | CAB | CAD | H10 | 180.0° | 179.7° |
| CAA | CAB | CAD | CAE | 1.7° | 0.6° |
| CAA | CAB | CAD | OAN | 176.2° | 179.7° |
| OAC | CAF | CAR | CAE | 179.2° | 179.9° |
| OAC | CAF | CAE | CAD | 0.8° | 0.1° |
| OAC | CAF | CAR | CAT | 178.7° | 179.9° |
| OAC | CAF | CAE | CAQ | 177.3° | 180.0° |
| OAC | CAF | CAR | H6 | 1.3° | 0.1° |
| CAB | CAD | CAE | CAF | 3.0° | 0.3° |
| CAB | CAD | CAE | OAN | 177.8° | 179.7° |
| CAB | CAD | CAE | CAQ | 173.4° | 179.7° |
| CAR | CAF | CAE | CAD | 179.9° | 180.0° |
| CAF | CAR | CAT | H6 | 180.0° | 180.0° |
| CAR | CAF | CAE | CAQ | 3.5° | 0.1° |
| CAF | CAR | CAT | CAS | 0.3° | 0.0° |
| CAF | CAR | CAT | H7 | 179.7° | 180.0° |
| CAF | CAE | CAD | CAQ | 176.3° | 179.9° |
| CAF | CAE | CAD | OAN | 174.8° | 180.0° |
| CAE | CAF | CAR | CAT | 2.0° | 0.0° |
| CAF | CAE | CAQ | CAS | 2.6° | 0.1° |
| CAE | CAF | CAR | H6 | 178.0° | 180.0° |
| CAF | CAE | CAQ | H9 | 177.5° | 179.9° |
| CAD | CAE | CAQ | CAS | 179.0° | 180.0° |
| CAD | CAE | CAQ | H9 | 1.0° | 0.0° |
| CAE | CAD | CAB | H10 | 178.3° | 179.7° |
| OAN | CAD | CAE | CAQ | 8.8° | 0.1° |
| OAN | CAD | CAB | H10 | 3.9° | 0.0° |
| CAR | CAT | CAS | H7 | 180.0° | 180.0° |
| CAR | CAT | CAS | CAQ | 1.1° | 0.0° |
| CAR | CAT | CAS | H8 | 178.9° | 179.9° |
| CAE | CAQ | CAS | CAT | 0.4° | 0.1° |
| CAE | CAQ | CAS | H9 | 180.0° | 180.0° |
| CAE | CAQ | CAS | H8 | 179.6° | 180.0° |
| CAT | CAS | CAQ | H8 | 180.0° | 179.9° |
| CAS | CAT | CAR | H6 | 179.7° | 180.0° |
| CAT | CAS | CAQ | H9 | 179.7° | 180.0° |
| CAQ | CAS | CAT | H7 | 178.9° | 180.0° |
| H4 | CAP | CAO | H5 | 0.9° | 0.0° |
| H6 | CAR | CAT | H7 | 0.3° | 0.0° |
| H7 | CAT | CAS | H8 | 1.1° | 0.0° |
| H8 | CAS | CAQ | H9 | 0.3° | 0.0° |
