36P
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAO | CAS | sing | 1.54Å | 1.50Å | |
| CAO | NAE | sing | 1.47Å | 1.52Å | |
| CAS | CAN | sing | 1.51Å | 1.39Å | |
| CAN | CAM | sing | 1.38Å | 1.33Å | Aromatic |
| CAN | CAD | doub | 1.39Å | 1.36Å | Aromatic |
| CAM | CAL | doub | 1.38Å | 1.38Å | Aromatic |
| CAL | CAB | sing | 1.38Å | 1.38Å | Aromatic |
| CAB | CAC | doub | 1.38Å | 1.39Å | Aromatic |
| CAC | CAD | sing | 1.40Å | 1.32Å | Aromatic |
| CAD | NAE | sing | 1.40Å | 1.35Å | |
| NAE | CAF | sing | 1.35Å | 1.37Å | |
| CAF | OAA | doub | 1.22Å | 1.24Å | |
| CAF | CAG | sing | 1.47Å | 1.35Å | |
| CAG | NAH | sing | 1.33Å | 1.35Å | Aromatic |
| CAG | CAP | doub | 1.35Å | 1.35Å | Aromatic |
| NAH | CAI | doub | 1.30Å | 1.33Å | Aromatic |
| CAP | SAQ | sing | 1.71Å | 1.71Å | Aromatic |
| SAQ | CAI | sing | 1.76Å | 1.59Å | Aromatic |
| CAI | CAJ | sing | 1.48Å | 1.32Å | |
| CAJ | CAK | sing | 1.40Å | 1.35Å | Aromatic |
| CAJ | CAT | doub | 1.35Å | 1.35Å | Aromatic |
| CAK | CAR | doub | 1.33Å | 1.34Å | Aromatic |
| CAR | SAU | sing | 1.76Å | 1.68Å | Aromatic |
| SAU | CAT | sing | 1.71Å | 1.64Å | Aromatic |
| CAO | HAO1 | sing | 1.09Å | 1.10Å | |
| CAO | HAO2 | sing | 1.09Å | 1.10Å | |
| CAS | HAS1 | sing | 1.09Å | 1.10Å | |
| CAS | HAS2 | sing | 1.09Å | 1.10Å | |
| CAM | HAM | sing | 1.08Å | 1.08Å | |
| CAL | HAL | sing | 1.08Å | 1.08Å | |
| CAB | HAB | sing | 1.08Å | 1.08Å | |
| CAC | HAC | sing | 1.08Å | 1.08Å | |
| CAP | HAP | sing | 1.08Å | 1.08Å | |
| CAK | HAK | sing | 1.08Å | 1.08Å | |
| CAT | HAT | 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) |
| CAS | CAO | NAE | 102.2° | 105.1° |
| CAO | CAS | CAN | 106.9° | 104.6° |
| CAS | CAO | HAO1 | 111.2° | 110.3° |
| CAS | CAO | HAO2 | 111.3° | 110.3° |
| CAO | CAS | HAS1 | 110.1° | 110.4° |
| CAO | CAS | HAS2 | 110.1° | 110.4° |
| CAO | NAE | CAD | 108.4° | 110.0° |
| CAO | NAE | CAF | 125.7° | 124.9° |
| NAE | CAO | HAO1 | 111.3° | 110.3° |
| NAE | CAO | HAO2 | 111.3° | 110.3° |
| CAS | CAN | CAM | 125.9° | 131.0° |
| CAS | CAN | CAD | 111.3° | 108.5° |
| CAN | CAS | HAS1 | 110.1° | 110.4° |
| CAN | CAS | HAS2 | 110.1° | 110.5° |
| CAM | CAN | CAD | 122.8° | 120.5° |
| CAN | CAM | CAL | 120.9° | 120.1° |
| CAN | CAM | HAM | 119.5° | 119.9° |
| CAN | CAD | CAC | 118.9° | 119.0° |
| CAN | CAD | NAE | 111.1° | 111.7° |
| CAM | CAL | CAB | 115.5° | 119.8° |
| CAL | CAM | HAM | 119.5° | 119.9° |
| CAM | CAL | HAL | 122.3° | 120.0° |
| CAL | CAB | CAC | 122.2° | 120.2° |
| CAB | CAL | HAL | 122.2° | 120.1° |
| CAL | CAB | HAB | 118.9° | 119.8° |
| CAB | CAC | CAD | 119.7° | 120.3° |
| CAC | CAB | HAB | 118.9° | 120.0° |
| CAB | CAC | HAC | 120.1° | 119.8° |
| CAC | CAD | NAE | 130.0° | 129.3° |
| CAD | CAC | HAC | 120.2° | 119.8° |
| CAD | NAE | CAF | 125.8° | 125.0° |
| NAE | CAF | OAA | 119.9° | 120.0° |
| NAE | CAF | CAG | 121.8° | 120.0° |
| OAA | CAF | CAG | 118.1° | 120.0° |
| CAF | CAG | NAH | 124.2° | 122.5° |
| CAF | CAG | CAP | 122.7° | 122.4° |
| NAH | CAG | CAP | 113.1° | 115.1° |
| CAG | NAH | CAI | 114.7° | 115.8° |
| CAG | CAP | SAQ | 106.9° | 109.1° |
| CAG | CAP | HAP | 126.5° | 125.4° |
| NAH | CAI | SAQ | 110.7° | 109.3° |
| NAH | CAI | CAJ | 125.5° | 125.3° |
| CAP | SAQ | CAI | 94.6° | 90.6° |
| SAQ | CAP | HAP | 126.6° | 125.4° |
| SAQ | CAI | CAJ | 123.8° | 125.4° |
| CAI | CAJ | CAK | 122.0° | 122.9° |
| CAI | CAJ | CAT | 121.0° | 122.9° |
| CAK | CAJ | CAT | 117.1° | 114.2° |
| CAJ | CAK | CAR | 113.2° | 113.7° |
| CAJ | CAK | HAK | 123.4° | 123.1° |
| CAJ | CAT | SAU | 105.6° | 110.6° |
| CAJ | CAT | HAT | 127.2° | 124.7° |
| CAK | CAR | SAU | 106.6° | 109.8° |
| CAR | CAK | HAK | 123.4° | 123.2° |
| CAK | CAR | HAR | 126.7° | 125.0° |
| CAR | SAU | CAT | 97.5° | 91.7° |
| SAU | CAR | HAR | 126.7° | 125.1° |
| SAU | CAT | HAT | 127.2° | 124.7° |
| HAO1 | CAO | HAO2 | 109.4° | 110.4° |
| HAS1 | CAS | HAS2 | 109.5° | 110.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAS | CAO | NAE | HAO1 | 118.8° | 118.9° |
| CAS | CAO | NAE | HAO2 | 118.8° | 118.9° |
| CAO | CAS | CAN | HAS1 | 119.6° | 118.7° |
| CAO | CAS | CAN | HAS2 | 119.6° | 118.8° |
| CAO | CAS | CAN | CAM | 179.3° | 180.0° |
| CAO | CAS | CAN | CAD | 1.3° | 0.1° |
| CAS | CAO | NAE | CAD | 1.5° | 0.0° |
| CAS | CAO | NAE | CAF | 177.0° | 180.0° |
| CAS | CAO | HAO1 | HAO2 | 123.4° | 122.2° |
| CAO | CAS | HAS1 | HAS2 | 121.2° | 122.3° |
| NAE | CAO | CAS | CAN | 1.6° | 0.0° |
| CAO | NAE | CAD | CAN | 0.8° | 0.0° |
| CAO | NAE | CAD | CAC | 178.9° | 180.0° |
| CAO | NAE | CAD | CAF | 178.5° | 180.0° |
| CAO | NAE | CAF | OAA | 176.5° | 174.9° |
| CAO | NAE | CAF | CAG | 2.1° | 5.1° |
| NAE | CAO | HAO1 | HAO2 | 123.4° | 122.1° |
| NAE | CAO | CAS | HAS1 | 121.2° | 118.8° |
| NAE | CAO | CAS | HAS2 | 118.0° | 118.8° |
| CAS | CAN | CAM | CAD | 179.3° | 179.9° |
| CAS | CAN | CAM | CAL | 178.6° | 179.9° |
| CAS | CAN | CAD | CAC | 179.9° | 180.0° |
| CAS | CAN | CAD | NAE | 0.3° | 0.1° |
| CAN | CAS | CAO | HAO1 | 120.5° | 118.9° |
| CAN | CAS | CAO | HAO2 | 117.2° | 118.8° |
| CAN | CAS | HAS1 | HAS2 | 121.2° | 122.5° |
| CAS | CAN | CAM | HAM | 1.4° | 0.1° |
| CAN | CAM | CAL | HAM | 180.0° | 180.0° |
| CAN | CAM | CAL | CAB | 1.5° | 0.1° |
| CAM | CAN | CAD | CAC | 0.5° | 0.1° |
| CAM | CAN | CAD | NAE | 179.7° | 180.0° |
| CAM | CAN | CAS | HAS1 | 59.7° | 61.3° |
| CAM | CAN | CAS | HAS2 | 61.0° | 61.2° |
| CAN | CAM | CAL | HAL | 178.5° | 180.0° |
| CAD | CAN | CAM | CAL | 0.7° | 0.0° |
| CAN | CAD | CAC | CAB | 0.9° | 0.1° |
| CAN | CAD | CAC | NAE | 179.7° | 180.0° |
| CAN | CAD | NAE | CAF | 177.7° | 180.0° |
| CAD | CAN | CAS | HAS1 | 120.9° | 118.8° |
| CAD | CAN | CAS | HAS2 | 118.4° | 118.7° |
| CAD | CAN | CAM | HAM | 179.3° | 180.0° |
| CAN | CAD | CAC | HAC | 179.1° | 180.0° |
| CAM | CAL | CAB | HAL | 180.0° | 179.9° |
| CAM | CAL | CAB | CAC | 1.1° | 0.1° |
| CAM | CAL | CAB | HAB | 178.9° | 179.9° |
| CAL | CAB | CAC | HAB | 180.0° | 180.0° |
| CAL | CAB | CAC | CAD | 0.1° | 0.0° |
| CAB | CAL | CAM | HAM | 178.5° | 180.0° |
| CAL | CAB | CAC | HAC | 179.9° | 180.0° |
| CAB | CAC | CAD | HAC | 180.0° | 180.0° |
| CAB | CAC | CAD | NAE | 179.4° | 180.0° |
| CAC | CAB | CAL | HAL | 178.9° | 180.0° |
| CAC | CAD | NAE | CAF | 2.6° | 0.0° |
| CAD | CAC | CAB | HAB | 179.9° | 180.0° |
| CAD | NAE | CAF | OAA | 5.2° | 5.2° |
| CAD | NAE | CAF | CAG | 179.6° | 174.9° |
| CAD | NAE | CAO | HAO1 | 120.3° | 118.9° |
| CAD | NAE | CAO | HAO2 | 117.4° | 118.9° |
| NAE | CAD | CAC | HAC | 0.6° | 0.0° |
| NAE | CAF | OAA | CAG | 174.6° | 180.0° |
| NAE | CAF | CAG | NAH | 3.7° | 5.1° |
| NAE | CAF | CAG | CAP | 174.9° | 175.2° |
| CAF | NAE | CAO | HAO1 | 58.2° | 61.0° |
| CAF | NAE | CAO | HAO2 | 64.1° | 61.1° |
| OAA | CAF | CAG | NAH | 178.1° | 174.9° |
| OAA | CAF | CAG | CAP | 0.4° | 4.8° |
| CAF | CAG | NAH | CAP | 178.7° | 179.7° |
| CAF | CAG | NAH | CAI | 177.9° | 179.9° |
| CAF | CAG | CAP | SAQ | 178.4° | 179.9° |
| CAF | CAG | CAP | HAP | 1.6° | 0.0° |
| NAH | CAG | CAP | SAQ | 0.3° | 0.2° |
| CAG | NAH | CAI | SAQ | 0.9° | 0.1° |
| CAG | NAH | CAI | CAJ | 179.3° | 179.9° |
| NAH | CAG | CAP | HAP | 179.8° | 179.7° |
| CAP | CAG | NAH | CAI | 0.7° | 0.2° |
| CAG | CAP | SAQ | HAP | 180.0° | 179.9° |
| CAG | CAP | SAQ | CAI | 0.2° | 0.1° |
| NAH | CAI | SAQ | CAP | 0.6° | 0.0° |
| NAH | CAI | SAQ | CAJ | 179.8° | 180.0° |
| NAH | CAI | CAJ | CAK | 4.4° | 175.0° |
| NAH | CAI | CAJ | CAT | 176.0° | 4.8° |
| CAP | SAQ | CAI | CAJ | 179.6° | 179.9° |
| SAQ | CAI | CAJ | CAK | 175.9° | 5.1° |
| SAQ | CAI | CAJ | CAT | 3.8° | 175.1° |
| CAI | SAQ | CAP | HAP | 179.8° | 179.8° |
| CAI | CAJ | CAK | CAT | 179.7° | 179.8° |
| CAI | CAJ | CAK | CAR | 178.8° | 179.9° |
| CAI | CAJ | CAT | SAU | 179.7° | 179.8° |
| CAI | CAJ | CAK | HAK | 1.3° | 0.0° |
| CAI | CAJ | CAT | HAT | 0.3° | 0.1° |
| CAJ | CAK | CAR | HAK | 180.0° | 180.0° |
| CAJ | CAK | CAR | SAU | 1.6° | 0.0° |
| CAK | CAJ | CAT | SAU | 0.6° | 0.4° |
| CAK | CAJ | CAT | HAT | 179.4° | 179.7° |
| CAJ | CAK | CAR | HAR | 178.4° | 180.0° |
| CAT | CAJ | CAK | CAR | 1.6° | 0.3° |
| CAJ | CAT | SAU | CAR | 0.3° | 0.3° |
| CAJ | CAT | SAU | HAT | 180.0° | 180.0° |
| CAT | CAJ | CAK | HAK | 178.4° | 179.8° |
| CAK | CAR | SAU | HAR | 180.0° | 180.0° |
| CAK | CAR | SAU | CAT | 1.2° | 0.1° |
| SAU | CAR | CAK | HAK | 178.3° | 180.0° |
| CAR | SAU | CAT | HAT | 179.7° | 179.8° |
| CAT | SAU | CAR | HAR | 178.9° | 179.8° |
| HAO1 | CAO | CAS | HAS1 | 119.9° | 122.3° |
| HAO1 | CAO | CAS | HAS2 | 0.8° | 0.1° |
| HAO2 | CAO | CAS | HAS1 | 2.4° | 0.1° |
| HAO2 | CAO | CAS | HAS2 | 123.2° | 122.3° |
| HAM | CAM | CAL | HAL | 1.5° | 0.1° |
| HAL | CAL | CAB | HAB | 1.1° | 0.0° |
| HAB | CAB | CAC | HAC | 0.0° | 0.0° |
| HAK | CAK | CAR | HAR | 1.6° | 0.0° |
