3F8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAB | CAR | doub | 1.21Å | 1.21Å | |
| OAD | CAT | doub | 1.21Å | 1.21Å | |
| CAL | CAN | sing | 1.53Å | 1.52Å | |
| CAL | OAP | sing | 1.43Å | 1.39Å | |
| CAF | CAR | sing | 1.48Å | 1.31Å | |
| CAF | CAE | doub | 1.34Å | 1.31Å | |
| CAR | NAU | sing | 1.35Å | 1.31Å | |
| CAN | NAV | sing | 1.46Å | 1.43Å | |
| OAP | CAJ | sing | 1.43Å | 1.40Å | |
| CAT | NAV | sing | 1.34Å | 1.29Å | |
| CAT | CAH | sing | 1.48Å | 1.32Å | |
| CAJ | CAI | sing | 1.53Å | 1.52Å | |
| CAE | CAQ | sing | 1.48Å | 1.32Å | |
| NAV | CAS | sing | 1.34Å | 1.31Å | |
| NAU | CAQ | sing | 1.35Å | 1.29Å | |
| NAU | CAM | sing | 1.46Å | 1.43Å | |
| CAH | CAG | doub | 1.34Å | 1.31Å | |
| CAI | OAO | sing | 1.43Å | 1.40Å | |
| CAQ | OAA | doub | 1.21Å | 1.21Å | |
| OAO | CAK | sing | 1.43Å | 1.39Å | |
| CAM | CAK | sing | 1.53Å | 1.52Å | |
| CAS | CAG | sing | 1.48Å | 1.31Å | |
| CAS | OAC | doub | 1.21Å | 1.21Å | |
| CAE | H1 | sing | 1.08Å | 1.08Å | |
| CAF | H2 | sing | 1.08Å | 1.08Å | |
| CAM | H3 | sing | 1.09Å | 1.10Å | |
| CAM | H4 | sing | 1.09Å | 1.10Å | |
| CAK | H5 | sing | 1.09Å | 1.10Å | |
| CAK | H6 | sing | 1.09Å | 1.10Å | |
| CAI | H7 | sing | 1.09Å | 1.10Å | |
| CAI | H8 | sing | 1.09Å | 1.10Å | |
| CAJ | H9 | sing | 1.09Å | 1.10Å | |
| CAJ | H10 | sing | 1.09Å | 1.10Å | |
| CAL | H11 | sing | 1.09Å | 1.10Å | |
| CAL | H12 | sing | 1.09Å | 1.10Å | |
| CAN | H13 | sing | 1.09Å | 1.10Å | |
| CAN | H14 | sing | 1.09Å | 1.10Å | |
| CAG | H15 | sing | 1.08Å | 1.08Å | |
| CAH | H16 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAB | CAR | CAF | 124.3° | 125.8° |
| OAB | CAR | NAU | 125.7° | 125.8° |
| OAD | CAT | NAV | 124.9° | 125.8° |
| OAD | CAT | CAH | 124.4° | 125.8° |
| CAN | CAL | OAP | 111.1° | 109.5° |
| CAL | CAN | NAV | 114.1° | 109.4° |
| CAN | CAL | H11 | 109.0° | 109.5° |
| CAN | CAL | H12 | 109.1° | 109.5° |
| CAL | CAN | H13 | 108.3° | 109.4° |
| CAL | CAN | H14 | 108.3° | 109.5° |
| CAL | OAP | CAJ | 112.5° | 114.0° |
| OAP | CAL | H11 | 109.1° | 109.5° |
| OAP | CAL | H12 | 109.0° | 109.4° |
| CAR | CAF | CAE | 107.3° | 106.8° |
| CAF | CAR | NAU | 110.0° | 108.4° |
| CAR | CAF | H2 | 126.4° | 126.6° |
| CAF | CAE | CAQ | 106.5° | 106.8° |
| CAF | CAE | H1 | 126.7° | 126.6° |
| CAE | CAF | H2 | 126.4° | 126.6° |
| CAR | NAU | CAQ | 105.6° | 109.6° |
| CAR | NAU | CAM | 127.2° | 125.2° |
| CAN | NAV | CAT | 127.2° | 125.2° |
| CAN | NAV | CAS | 127.2° | 125.2° |
| NAV | CAN | H13 | 108.3° | 109.5° |
| NAV | CAN | H14 | 108.3° | 109.5° |
| OAP | CAJ | CAI | 110.5° | 109.5° |
| OAP | CAJ | H9 | 109.2° | 109.5° |
| OAP | CAJ | H10 | 109.2° | 109.4° |
| NAV | CAT | CAH | 110.6° | 108.4° |
| CAT | NAV | CAS | 105.6° | 109.6° |
| CAT | CAH | CAG | 106.5° | 106.8° |
| CAT | CAH | H16 | 126.7° | 126.6° |
| CAJ | CAI | OAO | 110.6° | 109.4° |
| CAJ | CAI | H7 | 109.2° | 109.5° |
| CAJ | CAI | H8 | 109.2° | 109.5° |
| CAI | CAJ | H9 | 109.2° | 109.5° |
| CAI | CAJ | H10 | 109.2° | 109.5° |
| CAE | CAQ | NAU | 110.6° | 108.4° |
| CAE | CAQ | OAA | 124.5° | 125.8° |
| CAQ | CAE | H1 | 126.8° | 126.6° |
| NAV | CAS | CAG | 110.0° | 108.4° |
| NAV | CAS | OAC | 125.7° | 125.8° |
| CAQ | NAU | CAM | 127.2° | 125.2° |
| NAU | CAQ | OAA | 124.9° | 125.8° |
| NAU | CAM | CAK | 114.1° | 109.5° |
| NAU | CAM | H3 | 108.3° | 109.5° |
| NAU | CAM | H4 | 108.3° | 109.5° |
| CAH | CAG | CAS | 107.2° | 106.8° |
| CAH | CAG | H15 | 126.4° | 126.5° |
| CAG | CAH | H16 | 126.8° | 126.6° |
| CAI | OAO | CAK | 112.6° | 114.0° |
| OAO | CAI | H7 | 109.2° | 109.4° |
| OAO | CAI | H8 | 109.2° | 109.5° |
| OAO | CAK | CAM | 111.1° | 109.5° |
| OAO | CAK | H5 | 109.0° | 109.5° |
| OAO | CAK | H6 | 109.1° | 109.5° |
| CAK | CAM | H3 | 108.3° | 109.4° |
| CAK | CAM | H4 | 108.3° | 109.4° |
| CAM | CAK | H5 | 109.1° | 109.4° |
| CAM | CAK | H6 | 109.0° | 109.5° |
| CAG | CAS | OAC | 124.3° | 125.7° |
| CAS | CAG | H15 | 126.4° | 126.7° |
| H3 | CAM | H4 | 109.4° | 109.5° |
| H5 | CAK | H6 | 109.5° | 109.4° |
| H7 | CAI | H8 | 109.5° | 109.6° |
| H9 | CAJ | H10 | 109.5° | 109.5° |
| H11 | CAL | H12 | 109.5° | 109.4° |
| H13 | CAN | H14 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAB | CAR | CAF | NAU | 180.0° | 179.8° |
| OAB | CAR | CAF | CAE | 179.9° | 180.0° |
| OAB | CAR | NAU | CAQ | 180.0° | 179.9° |
| OAB | CAR | NAU | CAM | 1.3° | 0.2° |
| OAB | CAR | CAF | H2 | 0.1° | 0.2° |
| OAD | CAT | NAV | CAN | 0.8° | 0.0° |
| OAD | CAT | NAV | CAH | 179.5° | 179.9° |
| OAD | CAT | NAV | CAS | 179.5° | 179.7° |
| OAD | CAT | CAH | CAG | 179.6° | 179.7° |
| OAD | CAT | CAH | H16 | 0.3° | 0.1° |
| CAN | CAL | OAP | H11 | 120.2° | 120.1° |
| CAN | CAL | OAP | H12 | 120.2° | 120.0° |
| CAL | CAN | NAV | H13 | 120.7° | 119.9° |
| CAL | CAN | NAV | H14 | 120.7° | 120.0° |
| CAN | CAL | OAP | CAJ | 131.5° | 180.0° |
| CAL | CAN | NAV | CAT | 95.0° | 90.3° |
| CAL | CAN | NAV | CAS | 86.5° | 90.0° |
| CAN | CAL | H11 | H12 | 119.3° | 120.0° |
| CAL | CAN | H13 | H14 | 117.9° | 120.0° |
| OAP | CAL | CAN | NAV | 35.6° | 65.0° |
| CAL | OAP | CAJ | CAI | 172.8° | 179.9° |
| CAL | OAP | CAJ | H9 | 52.6° | 59.9° |
| CAL | OAP | CAJ | H10 | 67.1° | 60.0° |
| OAP | CAL | H11 | H12 | 119.3° | 119.9° |
| OAP | CAL | CAN | H13 | 156.3° | 175.0° |
| OAP | CAL | CAN | H14 | 85.1° | 55.0° |
| CAR | CAF | CAE | H2 | 180.0° | 179.8° |
| CAR | CAF | CAE | CAQ | 0.1° | 0.1° |
| CAF | CAR | NAU | CAQ | 0.0° | 0.4° |
| CAF | CAR | NAU | CAM | 178.7° | 180.0° |
| CAR | CAF | CAE | H1 | 179.9° | 180.0° |
| CAE | CAF | CAR | NAU | 0.1° | 0.2° |
| CAF | CAE | CAQ | H1 | 180.0° | 179.9° |
| CAF | CAE | CAQ | NAU | 0.1° | 0.3° |
| CAF | CAE | CAQ | OAA | 179.6° | 180.0° |
| CAR | NAU | CAQ | CAE | 0.0° | 0.4° |
| CAR | NAU | CAQ | CAM | 178.7° | 179.6° |
| CAR | NAU | CAQ | OAA | 179.5° | 179.9° |
| CAR | NAU | CAM | CAK | 86.5° | 90.0° |
| NAU | CAR | CAF | H2 | 179.9° | 180.0° |
| CAR | NAU | CAM | H3 | 34.1° | 150.0° |
| CAR | NAU | CAM | H4 | 152.8° | 30.0° |
| CAN | NAV | CAT | CAS | 178.7° | 179.7° |
| CAN | NAV | CAT | CAH | 178.7° | 179.9° |
| CAN | NAV | CAS | CAG | 178.8° | 180.0° |
| CAN | NAV | CAS | OAC | 1.3° | 0.0° |
| NAV | CAN | CAL | H11 | 155.9° | 55.0° |
| NAV | CAN | CAL | H12 | 84.6° | 175.0° |
| NAV | CAN | H13 | H14 | 117.9° | 120.1° |
| OAP | CAJ | CAI | H9 | 120.1° | 120.0° |
| OAP | CAJ | CAI | H10 | 120.2° | 120.0° |
| OAP | CAJ | CAI | OAO | 20.5° | 65.0° |
| OAP | CAJ | CAI | H7 | 99.7° | 55.0° |
| OAP | CAJ | CAI | H8 | 140.6° | 175.1° |
| OAP | CAJ | H9 | H10 | 119.5° | 119.9° |
| CAJ | OAP | CAL | H11 | 11.3° | 59.9° |
| CAJ | OAP | CAL | H12 | 108.2° | 60.0° |
| NAV | CAT | CAH | CAG | 0.2° | 0.4° |
| CAT | NAV | CAS | CAG | 0.1° | 0.3° |
| CAT | NAV | CAS | OAC | 180.0° | 179.7° |
| CAT | NAV | CAN | H13 | 25.7° | 149.7° |
| CAT | NAV | CAN | H14 | 144.3° | 29.7° |
| NAV | CAT | CAH | H16 | 179.8° | 179.9° |
| CAH | CAT | NAV | CAS | 0.0° | 0.4° |
| CAT | CAH | CAG | H16 | 180.0° | 179.8° |
| CAT | CAH | CAG | CAS | 0.2° | 0.2° |
| CAT | CAH | CAG | H15 | 179.8° | 179.8° |
| CAJ | CAI | OAO | H7 | 120.2° | 120.0° |
| CAJ | CAI | OAO | H8 | 120.1° | 119.9° |
| CAJ | CAI | OAO | CAK | 172.8° | 180.0° |
| CAJ | CAI | H7 | H8 | 119.5° | 120.1° |
| CAI | CAJ | H9 | H10 | 119.5° | 120.1° |
| CAE | CAQ | NAU | OAA | 179.5° | 179.7° |
| CAE | CAQ | NAU | CAM | 178.7° | 180.0° |
| CAQ | CAE | CAF | H2 | 179.9° | 179.8° |
| NAV | CAS | CAG | CAH | 0.2° | 0.0° |
| NAV | CAS | CAG | OAC | 180.0° | 180.0° |
| CAS | NAV | CAN | H13 | 152.8° | 29.9° |
| CAS | NAV | CAN | H14 | 34.1° | 150.0° |
| NAV | CAS | CAG | H15 | 179.8° | 180.0° |
| CAQ | NAU | CAM | CAK | 95.0° | 90.5° |
| NAU | CAQ | CAE | H1 | 179.9° | 179.8° |
| CAQ | NAU | CAM | H3 | 144.3° | 29.5° |
| CAQ | NAU | CAM | H4 | 25.7° | 149.6° |
| CAM | NAU | CAQ | OAA | 0.8° | 0.3° |
| NAU | CAM | CAK | OAO | 35.6° | 65.0° |
| NAU | CAM | CAK | H3 | 120.7° | 120.0° |
| NAU | CAM | CAK | H4 | 120.7° | 120.0° |
| NAU | CAM | H3 | H4 | 117.9° | 120.1° |
| NAU | CAM | CAK | H5 | 84.6° | 175.0° |
| NAU | CAM | CAK | H6 | 155.9° | 55.0° |
| CAH | CAG | CAS | H15 | 180.0° | 180.0° |
| CAH | CAG | CAS | OAC | 179.9° | 180.0° |
| CAI | OAO | CAK | CAM | 131.5° | 180.0° |
| CAI | OAO | CAK | H5 | 108.3° | 60.0° |
| CAI | OAO | CAK | H6 | 11.3° | 60.0° |
| OAO | CAI | H7 | H8 | 119.5° | 120.0° |
| OAO | CAI | CAJ | H9 | 140.6° | 175.0° |
| OAO | CAI | CAJ | H10 | 99.7° | 55.0° |
| OAA | CAQ | CAE | H1 | 0.4° | 0.1° |
| OAO | CAK | CAM | H5 | 120.2° | 120.0° |
| OAO | CAK | CAM | H6 | 120.3° | 120.0° |
| OAO | CAK | CAM | H3 | 85.1° | 55.0° |
| OAO | CAK | CAM | H4 | 156.3° | 175.0° |
| OAO | CAK | H5 | H6 | 119.3° | 120.0° |
| CAK | OAO | CAI | H7 | 67.1° | 60.0° |
| CAK | OAO | CAI | H8 | 52.6° | 60.0° |
| CAK | CAM | H3 | H4 | 117.9° | 119.9° |
| CAM | CAK | H5 | H6 | 119.2° | 120.0° |
| CAS | CAG | CAH | H16 | 179.8° | 180.0° |
| OAC | CAS | CAG | H15 | 0.1° | 0.0° |
| H1 | CAE | CAF | H2 | 0.1° | 0.1° |
| H3 | CAM | CAK | H5 | 154.7° | 65.0° |
| H3 | CAM | CAK | H6 | 35.2° | 175.1° |
| H4 | CAM | CAK | H5 | 36.1° | 55.0° |
| H4 | CAM | CAK | H6 | 83.4° | 65.0° |
| H7 | CAI | CAJ | H9 | 20.5° | 65.0° |
| H7 | CAI | CAJ | H10 | 140.1° | 174.9° |
| H8 | CAI | CAJ | H9 | 99.2° | 55.1° |
| H8 | CAI | CAJ | H10 | 20.5° | 65.0° |
| H11 | CAL | CAN | H13 | 83.4° | 65.0° |
| H11 | CAL | CAN | H14 | 35.2° | 175.1° |
| H12 | CAL | CAN | H13 | 36.1° | 55.0° |
| H12 | CAL | CAN | H14 | 154.7° | 65.0° |
| H15 | CAG | CAH | H16 | 0.2° | 0.0° |
