CB8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAV | CBB | sing | 1.50Å | 1.54Å | |
| CAV | CAU | doub | 1.30Å | 1.39Å | |
| CAV | OAQ | sing | 1.36Å | 1.38Å | |
| CBB | OAD | sing | 1.43Å | 1.44Å | |
| CBB | CBA | sing | 1.53Å | 1.53Å | |
| CBA | OAC | sing | 1.43Å | 1.43Å | |
| CBA | CAP | sing | 1.53Å | 1.53Å | |
| CAP | CBC | sing | 1.53Å | 1.54Å | |
| CBC | CAT | sing | 1.51Å | 1.52Å | |
| CBC | OAE | sing | 1.43Å | 1.70Å | |
| CBC | CAU | sing | 1.50Å | 1.54Å | |
| CAT | OAB | sing | 1.34Å | 1.25Å | |
| CAT | OAA | doub | 1.21Å | 1.24Å | |
| CAU | CAO | sing | 1.51Å | 1.54Å | |
| CAM | CAY | sing | 1.45Å | 1.35Å | Aromatic |
| CAM | CAX | doub | 1.32Å | 1.34Å | Aromatic |
| CAY | CAK | sing | 1.41Å | 1.40Å | Aromatic |
| CAY | CAZ | doub | 1.40Å | 1.41Å | Aromatic |
| CAK | CAF | doub | 1.36Å | 1.39Å | Aromatic |
| CAF | CAG | sing | 1.39Å | 1.39Å | Aromatic |
| CAG | CAL | doub | 1.37Å | 1.39Å | Aromatic |
| CAL | CAZ | sing | 1.40Å | 1.39Å | Aromatic |
| CAZ | SAS | sing | 1.76Å | 1.69Å | Aromatic |
| SAS | CAX | sing | 1.75Å | 1.68Å | Aromatic |
| CAX | CAN | sing | 1.51Å | 1.43Å | |
| CAN | OAQ | sing | 1.43Å | 1.58Å | |
| CAO | CAW | sing | 1.51Å | 1.54Å | |
| CAW | CAJ | doub | 1.33Å | 1.34Å | Aromatic |
| CAW | SAR | sing | 1.76Å | 1.69Å | Aromatic |
| CAJ | CAH | sing | 1.38Å | 1.35Å | Aromatic |
| CAH | CAI | doub | 1.33Å | 1.34Å | Aromatic |
| CAI | SAR | sing | 1.76Å | 1.69Å | Aromatic |
| CBB | HBB | sing | 1.09Å | 1.10Å | |
| OAD | HAD | sing | 0.97Å | 0.95Å | |
| CBA | HBA | sing | 1.09Å | 1.10Å | |
| OAC | HAC | sing | 0.97Å | 0.95Å | |
| CAP | HAP1 | sing | 1.09Å | 1.10Å | |
| CAP | HAP2 | sing | 1.09Å | 1.10Å | |
| OAE | HAE | sing | 0.97Å | 0.95Å | |
| OAB | HAB | sing | 0.97Å | 0.95Å | |
| CAO | HAO1 | sing | 1.09Å | 1.10Å | |
| CAO | HAO2 | sing | 1.09Å | 1.10Å | |
| CAM | HAM | sing | 1.08Å | 1.08Å | |
| CAK | HAK | sing | 1.08Å | 1.08Å | |
| CAF | HAF | sing | 1.08Å | 1.08Å | |
| CAG | HAG | sing | 1.08Å | 1.08Å | |
| CAL | HAL | sing | 1.08Å | 1.08Å | |
| CAN | HAN1 | sing | 1.09Å | 1.10Å | |
| CAN | HAN2 | sing | 1.09Å | 1.10Å | |
| CAJ | HAJ | sing | 1.08Å | 1.08Å | |
| CAH | HAH | sing | 1.08Å | 1.08Å | |
| CAI | HAI | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CBB | CAV | CAU | 124.8° | 124.0° |
| CBB | CAV | OAQ | 117.6° | 118.0° |
| CAV | CBB | OAD | 108.3° | 109.4° |
| CAV | CBB | CBA | 111.2° | 110.2° |
| CAV | CBB | HBB | 109.7° | 109.3° |
| CAU | CAV | OAQ | 117.4° | 118.0° |
| CAV | CAU | CBC | 117.7° | 124.0° |
| CAV | CAU | CAO | 121.2° | 118.0° |
| CAV | OAQ | CAN | 110.8° | 117.0° |
| OAD | CBB | CBA | 111.1° | 109.4° |
| OAD | CBB | HBB | 109.8° | 109.3° |
| CBB | OAD | HAD | 109.5° | 113.9° |
| CBB | CBA | OAC | 109.3° | 109.6° |
| CBB | CBA | CAP | 109.8° | 108.5° |
| CBA | CBB | HBB | 106.8° | 109.3° |
| CBB | CBA | HBA | 108.8° | 109.6° |
| OAC | CBA | CAP | 107.7° | 109.6° |
| OAC | CBA | HBA | 110.9° | 109.6° |
| CBA | OAC | HAC | 109.5° | 114.0° |
| CBA | CAP | CBC | 109.8° | 108.5° |
| CAP | CBA | HBA | 110.4° | 109.8° |
| CBA | CAP | HAP1 | 109.4° | 109.7° |
| CBA | CAP | HAP2 | 109.3° | 109.6° |
| CAP | CBC | CAT | 112.6° | 109.4° |
| CAP | CBC | OAE | 106.2° | 109.4° |
| CAP | CBC | CAU | 112.0° | 110.1° |
| CBC | CAP | HAP1 | 109.4° | 109.7° |
| CBC | CAP | HAP2 | 109.3° | 109.7° |
| CAT | CBC | OAE | 104.3° | 109.4° |
| CAT | CBC | CAU | 113.3° | 109.3° |
| CBC | CAT | OAB | 116.1° | 120.0° |
| CBC | CAT | OAA | 118.0° | 120.0° |
| OAE | CBC | CAU | 107.7° | 109.2° |
| CBC | OAE | HAE | 109.5° | 114.0° |
| CBC | CAU | CAO | 119.7° | 118.0° |
| OAB | CAT | OAA | 126.0° | 120.0° |
| CAT | OAB | HAB | 109.5° | 116.9° |
| CAU | CAO | CAW | 110.0° | 109.5° |
| CAU | CAO | HAO1 | 109.3° | 109.4° |
| CAU | CAO | HAO2 | 109.2° | 109.5° |
| CAY | CAM | CAX | 115.3° | 114.9° |
| CAM | CAY | CAK | 128.5° | 129.3° |
| CAM | CAY | CAZ | 113.3° | 111.8° |
| CAY | CAM | HAM | 122.4° | 122.6° |
| CAM | CAX | SAS | 109.3° | 111.4° |
| CAM | CAX | CAN | 126.2° | 124.3° |
| CAX | CAM | HAM | 122.4° | 122.5° |
| CAK | CAY | CAZ | 118.2° | 118.9° |
| CAY | CAK | CAF | 121.3° | 120.4° |
| CAY | CAK | HAK | 119.4° | 119.8° |
| CAY | CAZ | CAL | 120.6° | 119.7° |
| CAY | CAZ | SAS | 107.3° | 109.7° |
| CAK | CAF | CAG | 119.8° | 120.6° |
| CAF | CAK | HAK | 119.3° | 119.8° |
| CAK | CAF | HAF | 120.1° | 119.7° |
| CAF | CAG | CAL | 120.0° | 120.2° |
| CAG | CAF | HAF | 120.1° | 119.7° |
| CAF | CAG | HAG | 120.0° | 119.9° |
| CAG | CAL | CAZ | 120.0° | 120.2° |
| CAL | CAG | HAG | 120.0° | 119.9° |
| CAG | CAL | HAL | 120.0° | 119.9° |
| CAL | CAZ | SAS | 132.1° | 130.6° |
| CAZ | CAL | HAL | 120.0° | 119.9° |
| CAZ | SAS | CAX | 94.8° | 92.2° |
| SAS | CAX | CAN | 124.5° | 124.3° |
| CAX | CAN | OAQ | 117.8° | 109.4° |
| CAX | CAN | HAN1 | 106.7° | 109.5° |
| CAX | CAN | HAN2 | 104.8° | 109.5° |
| OAQ | CAN | HAN1 | 106.8° | 109.5° |
| OAQ | CAN | HAN2 | 104.9° | 109.5° |
| CAO | CAW | CAJ | 128.1° | 125.2° |
| CAO | CAW | SAR | 124.7° | 125.2° |
| CAW | CAO | HAO1 | 109.3° | 109.5° |
| CAW | CAO | HAO2 | 109.2° | 109.5° |
| CAJ | CAW | SAR | 107.2° | 109.5° |
| CAW | CAJ | CAH | 114.7° | 114.9° |
| CAW | CAJ | HAJ | 122.6° | 122.5° |
| CAW | SAR | CAI | 95.9° | 91.0° |
| CAJ | CAH | CAI | 116.3° | 114.9° |
| CAH | CAJ | HAJ | 122.7° | 122.6° |
| CAJ | CAH | HAH | 121.8° | 122.5° |
| CAH | CAI | SAR | 105.9° | 109.6° |
| CAI | CAH | HAH | 121.9° | 122.6° |
| CAH | CAI | HAI | 127.0° | 125.2° |
| SAR | CAI | HAI | 127.0° | 125.2° |
| HAP1 | CAP | HAP2 | 109.7° | 109.7° |
| HAO1 | CAO | HAO2 | 109.9° | 109.5° |
| HAN1 | CAN | HAN2 | 116.3° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CBB | CAV | CAU | OAQ | 174.9° | 179.7° |
| CAV | CBB | OAD | CBA | 122.3° | 120.7° |
| CAV | CBB | OAD | HBB | 119.8° | 119.7° |
| CAV | CBB | CBA | HBB | 119.6° | 120.1° |
| CAV | CBB | CBA | OAC | 164.9° | 169.2° |
| CAV | CBB | CBA | CAP | 47.0° | 49.5° |
| CBB | CAV | CAU | CBC | 14.4° | 0.4° |
| CBB | CAV | CAU | CAO | 179.3° | 179.6° |
| CBB | CAV | OAQ | CAN | 78.6° | 66.1° |
| CAV | CBB | OAD | HAD | 146.1° | 59.9° |
| CAV | CBB | CBA | HBA | 73.9° | 70.4° |
| CAU | CAV | CBB | OAD | 145.5° | 137.4° |
| CAU | CAV | CBB | CBA | 23.2° | 17.1° |
| CAV | CAU | CBC | CAP | 29.6° | 17.1° |
| CAV | CAU | CBC | CAT | 158.4° | 137.4° |
| CAV | CAU | CBC | OAE | 86.8° | 103.0° |
| CAV | CAU | CBC | CAO | 166.5° | 180.0° |
| CAU | CAV | OAQ | CAN | 96.7° | 114.2° |
| CAV | CAU | CAO | CAW | 108.5° | 94.0° |
| CAU | CAV | CBB | HBB | 94.7° | 103.0° |
| CAV | CAU | CAO | HAO1 | 131.5° | 26.0° |
| CAV | CAU | CAO | HAO2 | 11.3° | 146.0° |
| OAQ | CAV | CBB | OAD | 39.6° | 42.3° |
| OAQ | CAV | CBB | CBA | 161.9° | 162.6° |
| OAQ | CAV | CAU | CBC | 170.7° | 179.3° |
| OAQ | CAV | CAU | CAO | 4.4° | 0.7° |
| CAV | OAQ | CAN | CAX | 103.8° | 175.0° |
| OAQ | CAV | CBB | HBB | 80.2° | 77.4° |
| CAV | OAQ | CAN | HAN1 | 16.2° | 54.9° |
| CAV | OAQ | CAN | HAN2 | 140.1° | 65.1° |
| OAD | CBB | CBA | HBB | 119.7° | 119.6° |
| OAD | CBB | CBA | OAC | 74.5° | 70.5° |
| OAD | CBB | CBA | CAP | 167.6° | 169.8° |
| OAD | CBB | CBA | HBA | 46.7° | 49.9° |
| CBB | CBA | OAC | CAP | 119.2° | 119.0° |
| CBB | CBA | OAC | HBA | 120.0° | 120.4° |
| CBB | CBA | CAP | HBA | 120.0° | 119.8° |
| CBB | CBA | CAP | CBC | 65.1° | 67.6° |
| CBA | CBB | OAD | HAD | 91.6° | 179.3° |
| CBB | CBA | OAC | HAC | 92.6° | 60.0° |
| CBB | CBA | CAP | HAP1 | 54.9° | 52.1° |
| CBB | CBA | CAP | HAP2 | 175.0° | 172.6° |
| OAC | CBA | CAP | HBA | 121.2° | 120.5° |
| OAC | CBA | CAP | CBC | 176.1° | 172.7° |
| OAC | CBA | CBB | HBB | 45.2° | 49.1° |
| OAC | CBA | CAP | HAP1 | 63.9° | 67.6° |
| OAC | CBA | CAP | HAP2 | 56.2° | 53.0° |
| CBA | CAP | CBC | HAP1 | 120.0° | 119.7° |
| CBA | CAP | CBC | HAP2 | 119.9° | 119.7° |
| CBA | CAP | CBC | CAT | 175.8° | 169.8° |
| CBA | CAP | CBC | OAE | 62.2° | 70.5° |
| CBA | CAP | CBC | CAU | 55.1° | 49.6° |
| CAP | CBA | CBB | HBB | 72.6° | 70.6° |
| CAP | CBA | OAC | HAC | 26.6° | 179.0° |
| CBA | CAP | HAP1 | HAP2 | 119.9° | 120.5° |
| CAP | CBC | CAT | OAE | 114.7° | 119.7° |
| CAP | CBC | CAT | CAU | 128.4° | 120.7° |
| CAP | CBC | OAE | CAU | 120.1° | 120.6° |
| CAP | CBC | CAT | OAB | 157.3° | 87.0° |
| CAP | CBC | CAT | OAA | 22.7° | 93.1° |
| CAP | CBC | CAU | CAO | 163.9° | 162.9° |
| CBC | CAP | CBA | HBA | 54.9° | 52.2° |
| CBC | CAP | HAP1 | HAP2 | 119.9° | 120.5° |
| CAP | CBC | OAE | HAE | 30.1° | 60.0° |
| CAT | CBC | OAE | CAU | 120.7° | 119.6° |
| CBC | CAT | OAB | OAA | 180.0° | 180.0° |
| CAT | CBC | CAU | CAO | 35.1° | 42.7° |
| CAT | CBC | CAP | HAP1 | 64.2° | 50.0° |
| CAT | CBC | CAP | HAP2 | 55.9° | 70.5° |
| CAT | CBC | OAE | HAE | 149.3° | 59.8° |
| CBC | CAT | OAB | HAB | 179.9° | 180.0° |
| OAE | CBC | CAT | OAB | 42.6° | 32.8° |
| OAE | CBC | CAT | OAA | 137.4° | 147.2° |
| OAE | CBC | CAU | CAO | 79.7° | 77.0° |
| OAE | CBC | CAP | HAP1 | 177.8° | 169.7° |
| OAE | CBC | CAP | HAP2 | 57.7° | 49.2° |
| CAU | CBC | CAT | OAB | 74.3° | 152.3° |
| CAU | CBC | CAT | OAA | 105.7° | 27.6° |
| CBC | CAU | CAO | CAW | 85.5° | 86.0° |
| CAU | CBC | CAP | HAP1 | 64.9° | 70.2° |
| CAU | CBC | CAP | HAP2 | 175.0° | 169.3° |
| CAU | CBC | OAE | HAE | 90.0° | 179.4° |
| CBC | CAU | CAO | HAO1 | 34.5° | 154.0° |
| CBC | CAU | CAO | HAO2 | 154.7° | 34.0° |
| OAA | CAT | OAB | HAB | 0.0° | 0.1° |
| CAU | CAO | CAW | HAO1 | 120.0° | 119.9° |
| CAU | CAO | CAW | HAO2 | 119.8° | 120.0° |
| CAU | CAO | CAW | CAJ | 175.7° | 94.4° |
| CAU | CAO | CAW | SAR | 5.3° | 85.9° |
| CAU | CAO | HAO1 | HAO2 | 119.8° | 120.0° |
| CAY | CAM | CAX | HAM | 180.0° | 179.7° |
| CAM | CAY | CAK | CAZ | 179.8° | 180.0° |
| CAM | CAY | CAK | CAF | 179.9° | 180.0° |
| CAM | CAY | CAZ | CAL | 179.9° | 180.0° |
| CAM | CAY | CAZ | SAS | 0.2° | 0.0° |
| CAY | CAM | CAX | SAS | 0.2° | 0.0° |
| CAY | CAM | CAX | CAN | 178.6° | 180.0° |
| CAM | CAY | CAK | HAK | 0.1° | 0.0° |
| CAX | CAM | CAY | CAK | 179.5° | 180.0° |
| CAX | CAM | CAY | CAZ | 0.3° | 0.0° |
| CAM | CAX | SAS | CAZ | 0.1° | 0.0° |
| CAM | CAX | SAS | CAN | 178.5° | 179.9° |
| CAM | CAX | CAN | OAQ | 136.1° | 90.0° |
| CAM | CAX | CAN | HAN1 | 16.1° | 149.9° |
| CAM | CAX | CAN | HAN2 | 107.8° | 29.9° |
| CAY | CAK | CAF | HAK | 180.0° | 180.0° |
| CAY | CAK | CAF | CAG | 0.2° | 0.0° |
| CAK | CAY | CAZ | CAL | 0.1° | 0.0° |
| CAK | CAY | CAZ | SAS | 179.6° | 180.0° |
| CAK | CAY | CAM | HAM | 0.5° | 0.3° |
| CAY | CAK | CAF | HAF | 179.8° | 179.9° |
| CAZ | CAY | CAK | CAF | 0.2° | 0.0° |
| CAY | CAZ | CAL | CAG | 0.1° | 0.1° |
| CAY | CAZ | CAL | SAS | 179.6° | 180.0° |
| CAY | CAZ | SAS | CAX | 0.1° | 0.0° |
| CAZ | CAY | CAM | HAM | 179.7° | 179.7° |
| CAZ | CAY | CAK | HAK | 179.8° | 180.0° |
| CAY | CAZ | CAL | HAL | 179.9° | 180.0° |
| CAK | CAF | CAG | HAF | 180.0° | 179.9° |
| CAK | CAF | CAG | CAL | 0.2° | 0.0° |
| CAK | CAF | CAG | HAG | 179.8° | 180.0° |
| CAF | CAG | CAL | HAG | 180.0° | 180.0° |
| CAF | CAG | CAL | CAZ | 0.2° | 0.1° |
| CAG | CAF | CAK | HAK | 179.8° | 180.0° |
| CAF | CAG | CAL | HAL | 179.8° | 180.0° |
| CAG | CAL | CAZ | HAL | 180.0° | 179.9° |
| CAG | CAL | CAZ | SAS | 179.5° | 180.0° |
| CAL | CAG | CAF | HAF | 179.8° | 180.0° |
| CAL | CAZ | SAS | CAX | 179.7° | 180.0° |
| CAZ | CAL | CAG | HAG | 179.9° | 179.9° |
| CAZ | SAS | CAX | CAN | 178.5° | 180.0° |
| SAS | CAZ | CAL | HAL | 0.5° | 0.1° |
| SAS | CAX | CAN | OAQ | 42.1° | 90.0° |
| SAS | CAX | CAM | HAM | 179.8° | 179.7° |
| SAS | CAX | CAN | HAN1 | 162.1° | 30.0° |
| SAS | CAX | CAN | HAN2 | 74.0° | 150.0° |
| CAX | CAN | OAQ | HAN1 | 120.0° | 120.0° |
| CAX | CAN | OAQ | HAN2 | 116.1° | 119.9° |
| CAN | CAX | CAM | HAM | 1.4° | 0.2° |
| CAX | CAN | HAN1 | HAN2 | 116.5° | 120.0° |
| OAQ | CAN | HAN1 | HAN2 | 116.6° | 120.0° |
| CAO | CAW | CAJ | SAR | 179.1° | 179.7° |
| CAO | CAW | CAJ | CAH | 179.4° | 180.0° |
| CAO | CAW | SAR | CAI | 179.7° | 180.0° |
| CAW | CAO | HAO1 | HAO2 | 119.8° | 120.0° |
| CAO | CAW | CAJ | HAJ | 0.6° | 0.1° |
| CAW | CAJ | CAH | HAJ | 180.0° | 180.0° |
| CAW | CAJ | CAH | CAI | 0.2° | 0.0° |
| CAJ | CAW | SAR | CAI | 0.5° | 0.3° |
| CAJ | CAW | CAO | HAO1 | 55.7° | 25.5° |
| CAJ | CAW | CAO | HAO2 | 64.5° | 145.5° |
| CAW | CAJ | CAH | HAH | 179.8° | 180.0° |
| SAR | CAW | CAJ | CAH | 0.2° | 0.3° |
| CAW | SAR | CAI | CAH | 0.6° | 0.3° |
| SAR | CAW | CAO | HAO1 | 125.3° | 154.1° |
| SAR | CAW | CAO | HAO2 | 114.5° | 34.1° |
| SAR | CAW | CAJ | HAJ | 179.8° | 179.8° |
| CAW | SAR | CAI | HAI | 179.4° | 179.9° |
| CAJ | CAH | CAI | HAH | 180.0° | 180.0° |
| CAJ | CAH | CAI | SAR | 0.6° | 0.2° |
| CAJ | CAH | CAI | HAI | 179.5° | 179.9° |
| CAH | CAI | SAR | HAI | 180.0° | 179.8° |
| CAI | CAH | CAJ | HAJ | 179.7° | 180.0° |
| SAR | CAI | CAH | HAH | 179.4° | 179.8° |
| HBB | CBB | OAD | HAD | 26.3° | 59.7° |
| HBB | CBB | CBA | HBA | 166.5° | 169.5° |
| HBA | CBA | OAC | HAC | 147.4° | 60.4° |
| HBA | CBA | CAP | HAP1 | 174.9° | 171.9° |
| HBA | CBA | CAP | HAP2 | 65.0° | 67.6° |
| HAK | CAK | CAF | HAF | 0.2° | 0.0° |
| HAF | CAF | CAG | HAG | 0.2° | 0.0° |
| HAG | CAG | CAL | HAL | 0.1° | 0.0° |
| HAJ | CAJ | CAH | HAH | 0.2° | 0.0° |
| HAH | CAH | CAI | HAI | 0.5° | 0.1° |
