3F7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAD | CAR | doub | 1.21Å | 1.23Å | |
| OAA | CAO | doub | 1.21Å | 1.23Å | |
| CAE | CAG | doub | 1.38Å | 1.39Å | Aromatic |
| CAE | CAM | sing | 1.39Å | 1.39Å | Aromatic |
| CAG | CAN | sing | 1.39Å | 1.39Å | Aromatic |
| CAR | CAL | sing | 1.48Å | 1.34Å | |
| CAR | NAT | sing | 1.34Å | 1.33Å | |
| CAO | CAI | sing | 1.48Å | 1.34Å | |
| CAO | NAS | sing | 1.34Å | 1.33Å | |
| CAL | CAK | doub | 1.34Å | 1.34Å | |
| CAI | CAJ | doub | 1.34Å | 1.35Å | |
| CAM | NAS | sing | 1.40Å | 1.33Å | |
| CAM | CAF | doub | 1.39Å | 1.39Å | Aromatic |
| CAN | NAT | sing | 1.40Å | 1.33Å | |
| CAN | CAH | doub | 1.39Å | 1.38Å | Aromatic |
| NAS | CAP | sing | 1.34Å | 1.34Å | |
| NAT | CAQ | sing | 1.34Å | 1.34Å | |
| CAK | CAQ | sing | 1.48Å | 1.34Å | |
| CAJ | CAP | sing | 1.48Å | 1.33Å | |
| CAQ | OAC | doub | 1.21Å | 1.23Å | |
| CAP | OAB | doub | 1.21Å | 1.23Å | |
| CAF | CAH | sing | 1.38Å | 1.39Å | Aromatic |
| CAI | H1 | sing | 1.08Å | 1.08Å | |
| CAJ | H2 | sing | 1.08Å | 1.08Å | |
| CAF | H3 | sing | 1.08Å | 1.08Å | |
| CAH | H4 | sing | 1.08Å | 1.08Å | |
| CAE | H5 | sing | 1.08Å | 1.08Å | |
| CAG | H6 | sing | 1.08Å | 1.08Å | |
| CAK | H7 | sing | 1.08Å | 1.08Å | |
| CAL | H8 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAD | CAR | CAL | 125.3° | 125.8° |
| OAD | CAR | NAT | 124.7° | 125.8° |
| OAA | CAO | CAI | 125.3° | 125.8° |
| OAA | CAO | NAS | 124.5° | 125.8° |
| CAG | CAE | CAM | 120.0° | 120.0° |
| CAE | CAG | CAN | 120.1° | 120.0° |
| CAG | CAE | H5 | 120.0° | 120.0° |
| CAE | CAG | H6 | 119.9° | 120.0° |
| CAE | CAM | NAS | 121.4° | 120.0° |
| CAE | CAM | CAF | 119.8° | 120.0° |
| CAM | CAE | H5 | 120.0° | 120.0° |
| CAG | CAN | NAT | 121.3° | 120.0° |
| CAG | CAN | CAH | 119.7° | 120.0° |
| CAN | CAG | H6 | 119.9° | 120.0° |
| CAL | CAR | NAT | 110.0° | 108.4° |
| CAR | CAL | CAK | 107.4° | 106.8° |
| CAR | CAL | H8 | 126.3° | 126.6° |
| CAR | NAT | CAN | 126.9° | 125.2° |
| CAR | NAT | CAQ | 105.4° | 109.6° |
| CAI | CAO | NAS | 110.1° | 108.4° |
| CAO | CAI | CAJ | 106.6° | 106.8° |
| CAO | CAI | H1 | 126.7° | 126.6° |
| CAO | NAS | CAM | 127.8° | 125.2° |
| CAO | NAS | CAP | 105.6° | 109.6° |
| CAL | CAK | CAQ | 106.9° | 106.8° |
| CAL | CAK | H7 | 126.5° | 126.6° |
| CAK | CAL | H8 | 126.3° | 126.6° |
| CAI | CAJ | CAP | 107.4° | 106.8° |
| CAJ | CAI | H1 | 126.7° | 126.6° |
| CAI | CAJ | H2 | 126.3° | 126.6° |
| NAS | CAM | CAF | 118.7° | 120.0° |
| CAM | NAS | CAP | 126.6° | 125.2° |
| CAM | CAF | CAH | 120.2° | 120.0° |
| CAM | CAF | H3 | 119.9° | 120.0° |
| NAT | CAN | CAH | 119.0° | 120.0° |
| CAN | NAT | CAQ | 127.6° | 125.2° |
| CAN | CAH | CAF | 120.2° | 120.0° |
| CAN | CAH | H4 | 119.9° | 120.0° |
| NAS | CAP | CAJ | 110.2° | 108.4° |
| NAS | CAP | OAB | 126.0° | 125.8° |
| NAT | CAQ | CAK | 110.2° | 108.4° |
| NAT | CAQ | OAC | 125.7° | 125.8° |
| CAK | CAQ | OAC | 124.1° | 125.8° |
| CAQ | CAK | H7 | 126.5° | 126.6° |
| CAJ | CAP | OAB | 123.7° | 125.8° |
| CAP | CAJ | H2 | 126.3° | 126.6° |
| CAH | CAF | H3 | 119.9° | 120.0° |
| CAF | CAH | H4 | 119.9° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAD | CAR | CAL | NAT | 179.1° | 179.5° |
| OAD | CAR | CAL | CAK | 179.7° | 180.0° |
| OAD | CAR | NAT | CAN | 2.1° | 0.3° |
| OAD | CAR | NAT | CAQ | 179.9° | 180.0° |
| OAD | CAR | CAL | H8 | 0.3° | 0.3° |
| OAA | CAO | CAI | NAS | 179.2° | 179.7° |
| OAA | CAO | CAI | CAJ | 179.2° | 180.0° |
| OAA | CAO | NAS | CAM | 2.3° | 0.0° |
| OAA | CAO | NAS | CAP | 180.0° | 179.9° |
| OAA | CAO | CAI | H1 | 0.8° | 0.1° |
| CAG | CAE | CAM | H5 | 180.0° | 179.8° |
| CAE | CAG | CAN | H6 | 180.0° | 179.9° |
| CAG | CAE | CAM | NAS | 178.9° | 180.0° |
| CAG | CAE | CAM | CAF | 1.5° | 0.1° |
| CAE | CAG | CAN | NAT | 179.0° | 180.0° |
| CAE | CAG | CAN | CAH | 1.4° | 0.4° |
| CAM | CAE | CAG | CAN | 1.6° | 0.1° |
| CAE | CAM | NAS | CAO | 4.5° | 0.2° |
| CAE | CAM | NAS | CAF | 177.4° | 179.8° |
| CAE | CAM | NAS | CAP | 172.7° | 179.9° |
| CAE | CAM | CAF | CAH | 1.2° | 0.2° |
| CAE | CAM | CAF | H3 | 178.8° | 179.8° |
| CAM | CAE | CAG | H6 | 178.4° | 180.0° |
| CAG | CAN | NAT | CAR | 2.6° | 0.3° |
| CAG | CAN | NAT | CAH | 177.6° | 179.7° |
| CAG | CAN | NAT | CAQ | 175.0° | 180.0° |
| CAG | CAN | CAH | CAF | 1.1° | 0.3° |
| CAG | CAN | CAH | H4 | 178.9° | 179.7° |
| CAN | CAG | CAE | H5 | 178.3° | 180.0° |
| CAR | CAL | CAK | H8 | 180.0° | 179.7° |
| CAL | CAR | NAT | CAN | 178.8° | 179.8° |
| CAL | CAR | NAT | CAQ | 0.8° | 0.5° |
| CAR | CAL | CAK | CAQ | 0.1° | 0.2° |
| CAR | CAL | CAK | H7 | 179.9° | 179.7° |
| NAT | CAR | CAL | CAK | 0.6° | 0.4° |
| CAR | NAT | CAN | CAQ | 177.6° | 179.6° |
| CAR | NAT | CAN | CAH | 179.7° | 179.3° |
| CAR | NAT | CAQ | CAK | 0.7° | 0.3° |
| CAR | NAT | CAQ | OAC | 179.7° | 179.7° |
| NAT | CAR | CAL | H8 | 179.4° | 179.8° |
| CAO | CAI | CAJ | H1 | 180.0° | 179.9° |
| CAI | CAO | NAS | CAM | 178.4° | 179.7° |
| CAI | CAO | NAS | CAP | 0.8° | 0.4° |
| CAO | CAI | CAJ | CAP | 0.8° | 0.0° |
| CAO | CAI | CAJ | H2 | 179.2° | 180.0° |
| NAS | CAO | CAI | CAJ | 0.0° | 0.2° |
| CAO | NAS | CAM | CAP | 177.1° | 179.8° |
| CAO | NAS | CAM | CAF | 178.2° | 180.0° |
| CAO | NAS | CAP | CAJ | 1.3° | 0.4° |
| CAO | NAS | CAP | OAB | 179.6° | 179.9° |
| NAS | CAO | CAI | H1 | 180.0° | 179.8° |
| CAL | CAK | CAQ | NAT | 0.4° | 0.0° |
| CAL | CAK | CAQ | H7 | 180.0° | 180.0° |
| CAL | CAK | CAQ | OAC | 180.0° | 180.0° |
| CAI | CAJ | CAP | NAS | 1.4° | 0.2° |
| CAI | CAJ | CAP | H2 | 180.0° | 180.0° |
| CAI | CAJ | CAP | OAB | 179.6° | 180.0° |
| CAM | NAS | CAP | CAJ | 179.0° | 179.7° |
| CAM | NAS | CAP | OAB | 2.0° | 0.0° |
| NAS | CAM | CAF | CAH | 178.6° | NaN° |
| NAS | CAM | CAF | H3 | 1.4° | 0.1° |
| NAS | CAM | CAE | H5 | 1.1° | 0.1° |
| CAM | CAF | CAH | CAN | 1.0° | 0.0° |
| CAF | CAM | NAS | CAP | 4.7° | 0.1° |
| CAM | CAF | CAH | H3 | 180.0° | 179.9° |
| CAM | CAF | CAH | H4 | 179.0° | 180.0° |
| CAF | CAM | CAE | H5 | 178.4° | 179.7° |
| CAN | NAT | CAQ | CAK | 178.8° | 180.0° |
| CAN | NAT | CAQ | OAC | 1.7° | 0.1° |
| NAT | CAN | CAH | CAF | 178.8° | 180.0° |
| NAT | CAN | CAH | H4 | 1.2° | 0.1° |
| NAT | CAN | CAG | H6 | 1.0° | 0.1° |
| CAH | CAN | NAT | CAQ | 2.7° | 0.3° |
| CAN | CAH | CAF | H4 | 180.0° | 179.9° |
| CAN | CAH | CAF | H3 | 179.0° | 180.0° |
| CAH | CAN | CAG | H6 | 178.6° | 179.8° |
| NAS | CAP | CAJ | OAB | 179.1° | 179.7° |
| NAS | CAP | CAJ | H2 | 178.6° | 179.7° |
| NAT | CAQ | CAK | OAC | 179.5° | 179.9° |
| NAT | CAQ | CAK | H7 | 179.6° | 180.0° |
| CAQ | CAK | CAL | H8 | 179.9° | 180.0° |
| CAP | CAJ | CAI | H1 | 179.2° | 179.9° |
| OAC | CAQ | CAK | H7 | 0.1° | 0.1° |
| OAB | CAP | CAJ | H2 | 0.4° | 0.0° |
| H1 | CAI | CAJ | H2 | 0.8° | 0.1° |
| H3 | CAF | CAH | H4 | 1.0° | 0.1° |
| H5 | CAE | CAG | H6 | 1.6° | 0.2° |
| H7 | CAK | CAL | H8 | 0.1° | 0.0° |
