NF1
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAY | CAW | sing | 1.51Å | 1.51Å | |
| SAX | CAW | sing | 1.71Å | 1.75Å | Aromatic |
| SAX | CAT | sing | 1.71Å | 1.71Å | Aromatic |
| CAW | NAV | doub | 1.29Å | 1.35Å | Aromatic |
| CAT | CAS | sing | 1.51Å | 1.49Å | |
| CAT | NAU | doub | 1.29Å | 1.37Å | Aromatic |
| NAV | NAU | sing | 1.26Å | 1.36Å | Aromatic |
| NAR | CAS | sing | 1.47Å | 1.43Å | |
| NAR | CAQ | sing | 1.47Å | 1.49Å | |
| OAO | CAK | doub | 1.22Å | 1.41Å | |
| CAP | CAQ | sing | 1.53Å | 1.51Å | |
| CAP | NAL | sing | 1.47Å | 1.49Å | |
| CAK | NAL | sing | 1.35Å | 1.38Å | |
| CAK | CAJ | sing | 1.47Å | 1.49Å | |
| NAL | CAM | sing | 1.35Å | 1.37Å | |
| CAI | CAJ | doub | 1.39Å | 1.46Å | Aromatic |
| CAI | CAH | sing | 1.39Å | 1.43Å | Aromatic |
| CAJ | CAD | sing | 1.41Å | 1.45Å | Aromatic |
| CAM | OAN | doub | 1.22Å | 1.38Å | |
| CAM | CAE | sing | 1.47Å | 1.50Å | |
| CAH | CAG | doub | 1.37Å | 1.43Å | Aromatic |
| CAD | CAE | doub | 1.41Å | 1.43Å | Aromatic |
| CAD | CAC | sing | 1.41Å | 1.41Å | Aromatic |
| CAE | CAF | sing | 1.39Å | 1.46Å | Aromatic |
| CAG | CAC | sing | 1.41Å | 1.47Å | Aromatic |
| CAC | CAB | doub | 1.41Å | 1.47Å | Aromatic |
| CAF | CAA | doub | 1.39Å | 1.42Å | Aromatic |
| CAB | CAA | sing | 1.36Å | 1.42Å | Aromatic |
| CAF | H1 | sing | 1.08Å | 1.08Å | |
| CAA | H2 | sing | 1.08Å | 1.08Å | |
| CAB | H3 | sing | 1.08Å | 1.08Å | |
| CAG | H4 | sing | 1.08Å | 1.08Å | |
| CAH | H5 | sing | 1.08Å | 1.08Å | |
| CAI | H6 | sing | 1.08Å | 1.08Å | |
| CAP | H7 | sing | 1.09Å | 1.10Å | |
| CAP | H8 | sing | 1.09Å | 1.10Å | |
| CAQ | H9 | sing | 1.09Å | 1.10Å | |
| CAQ | H10 | sing | 1.09Å | 1.10Å | |
| NAR | H11 | sing | 1.01Å | 1.00Å | |
| CAS | H13 | sing | 1.09Å | 1.10Å | |
| CAS | H14 | sing | 1.09Å | 1.10Å | |
| CAY | H15 | sing | 1.09Å | 1.10Å | |
| CAY | H16 | sing | 1.09Å | 1.10Å | |
| CAY | H17 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAY | CAW | SAX | 128.1° | 125.7° |
| CAY | CAW | NAV | 126.9° | 125.7° |
| CAW | CAY | H15 | 109.5° | 109.5° |
| CAW | CAY | H16 | 109.5° | 109.5° |
| CAW | CAY | H17 | 109.5° | 109.4° |
| CAW | SAX | CAT | 96.3° | 89.8° |
| SAX | CAW | NAV | 105.0° | 108.6° |
| SAX | CAT | CAS | 128.0° | 125.7° |
| SAX | CAT | NAU | 105.4° | 108.6° |
| CAW | NAV | NAU | 116.9° | 116.5° |
| CAS | CAT | NAU | 126.6° | 125.7° |
| CAT | CAS | NAR | 115.0° | 109.4° |
| CAT | CAS | H13 | 108.1° | 109.5° |
| CAT | CAS | H14 | 108.1° | 109.4° |
| CAT | NAU | NAV | 116.5° | 116.5° |
| CAS | NAR | CAQ | 111.0° | 111.0° |
| CAS | NAR | H11 | 109.1° | 111.0° |
| NAR | CAS | H13 | 108.0° | 109.5° |
| NAR | CAS | H14 | 108.1° | 109.5° |
| NAR | CAQ | CAP | 115.7° | 109.5° |
| NAR | CAQ | H9 | 107.9° | 109.5° |
| NAR | CAQ | H10 | 107.9° | 109.5° |
| CAQ | NAR | H11 | 109.1° | 111.0° |
| OAO | CAK | NAL | 120.3° | 119.8° |
| OAO | CAK | CAJ | 120.9° | 119.8° |
| CAQ | CAP | NAL | 120.7° | 109.5° |
| CAQ | CAP | H7 | 106.6° | 109.5° |
| CAQ | CAP | H8 | 106.6° | 109.5° |
| CAP | CAQ | H9 | 107.9° | 109.4° |
| CAP | CAQ | H10 | 107.9° | 109.4° |
| CAP | NAL | CAK | 119.5° | 118.8° |
| CAP | NAL | CAM | 118.4° | 118.8° |
| NAL | CAP | H7 | 106.6° | 109.5° |
| NAL | CAP | H8 | 106.6° | 109.4° |
| NAL | CAK | CAJ | 118.7° | 120.3° |
| CAK | NAL | CAM | 122.0° | 122.4° |
| CAK | CAJ | CAI | 120.0° | 122.3° |
| CAK | CAJ | CAD | 120.6° | 118.7° |
| NAL | CAM | OAN | 119.0° | 119.8° |
| NAL | CAM | CAE | 121.8° | 120.4° |
| CAJ | CAI | CAH | 119.8° | 120.2° |
| CAI | CAJ | CAD | 119.4° | 119.0° |
| CAJ | CAI | H6 | 120.1° | 119.9° |
| CAI | CAH | CAG | 120.7° | 121.6° |
| CAI | CAH | H5 | 119.6° | 119.2° |
| CAH | CAI | H6 | 120.1° | 119.9° |
| CAJ | CAD | CAE | 119.1° | 119.5° |
| CAJ | CAD | CAC | 120.6° | 120.3° |
| OAN | CAM | CAE | 119.2° | 119.8° |
| CAM | CAE | CAD | 117.7° | 118.7° |
| CAM | CAE | CAF | 122.6° | 122.3° |
| CAH | CAG | CAC | 119.6° | 120.0° |
| CAH | CAG | H4 | 120.2° | 120.0° |
| CAG | CAH | H5 | 119.7° | 119.2° |
| CAE | CAD | CAC | 120.3° | 120.3° |
| CAD | CAE | CAF | 119.7° | 119.0° |
| CAD | CAC | CAG | 119.9° | 118.9° |
| CAD | CAC | CAB | 120.1° | 118.9° |
| CAE | CAF | CAA | 120.0° | 120.1° |
| CAE | CAF | H1 | 120.0° | 119.9° |
| CAG | CAC | CAB | 120.0° | 122.2° |
| CAC | CAG | H4 | 120.2° | 120.0° |
| CAC | CAB | CAA | 119.7° | 120.1° |
| CAC | CAB | H3 | 120.2° | 119.9° |
| CAF | CAA | CAB | 120.2° | 121.6° |
| CAA | CAF | H1 | 120.0° | 119.9° |
| CAF | CAA | H2 | 119.9° | 119.2° |
| CAB | CAA | H2 | 119.8° | 119.2° |
| CAA | CAB | H3 | 120.1° | 120.0° |
| H7 | CAP | H8 | 109.5° | 109.5° |
| H9 | CAQ | H10 | 109.5° | 109.5° |
| H13 | CAS | H14 | 109.5° | 109.5° |
| H15 | CAY | H16 | 109.4° | 109.5° |
| H15 | CAY | H17 | 109.5° | 109.5° |
| H16 | CAY | H17 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAY | CAW | SAX | NAV | 179.9° | 179.8° |
| CAY | CAW | SAX | CAT | 179.8° | 180.0° |
| CAY | CAW | NAV | NAU | 179.8° | 179.9° |
| CAW | CAY | H15 | H16 | 120.0° | 120.0° |
| CAW | CAY | H15 | H17 | 120.0° | 120.0° |
| CAW | CAY | H16 | H17 | 120.0° | 120.0° |
| CAW | SAX | CAT | CAS | 179.3° | 180.0° |
| CAW | SAX | CAT | NAU | 0.2° | 0.2° |
| SAX | CAW | NAV | NAU | 0.3° | 0.1° |
| SAX | CAW | CAY | H15 | 0.0° | 90.0° |
| SAX | CAW | CAY | H16 | 120.0° | 150.0° |
| SAX | CAW | CAY | H17 | 120.0° | 30.0° |
| CAT | SAX | CAW | NAV | 0.3° | 0.2° |
| SAX | CAT | CAS | NAU | 178.9° | 179.8° |
| SAX | CAT | NAU | NAV | 0.1° | 0.2° |
| SAX | CAT | CAS | NAR | 105.7° | 89.7° |
| SAX | CAT | CAS | H13 | 15.1° | 150.2° |
| SAX | CAT | CAS | H14 | 133.5° | 30.2° |
| CAW | NAV | NAU | CAT | 0.2° | 0.0° |
| NAV | CAW | CAY | H15 | 179.9° | 89.7° |
| NAV | CAW | CAY | H16 | 59.9° | 30.3° |
| NAV | CAW | CAY | H17 | 60.1° | 150.2° |
| CAS | CAT | NAU | NAV | 179.2° | 180.0° |
| CAT | CAS | NAR | H13 | 120.8° | 120.0° |
| CAT | CAS | NAR | H14 | 120.8° | 120.0° |
| CAT | CAS | NAR | CAQ | 135.5° | 180.0° |
| CAT | CAS | NAR | H11 | 15.3° | 56.1° |
| CAT | CAS | H13 | H14 | 117.5° | 120.0° |
| NAU | CAT | CAS | NAR | 73.3° | 90.0° |
| NAU | CAT | CAS | H13 | 165.9° | 30.0° |
| NAU | CAT | CAS | H14 | 47.6° | 150.0° |
| CAS | NAR | CAQ | H11 | 120.3° | 124.0° |
| CAS | NAR | CAQ | CAP | 143.3° | 180.0° |
| CAS | NAR | CAQ | H9 | 22.4° | 60.0° |
| CAS | NAR | CAQ | H10 | 95.8° | 60.0° |
| NAR | CAS | H13 | H14 | 117.5° | 120.0° |
| NAR | CAQ | CAP | H9 | 120.9° | 120.0° |
| NAR | CAQ | CAP | H10 | 120.9° | 120.1° |
| NAR | CAQ | CAP | NAL | 125.7° | 180.0° |
| NAR | CAQ | CAP | H7 | 4.1° | 60.0° |
| NAR | CAQ | CAP | H8 | 112.8° | 60.0° |
| NAR | CAQ | H9 | H10 | 117.2° | 120.1° |
| CAQ | NAR | CAS | H13 | 103.6° | 60.0° |
| CAQ | NAR | CAS | H14 | 14.7° | 60.0° |
| OAO | CAK | NAL | CAP | 0.7° | 0.5° |
| OAO | CAK | NAL | CAJ | 179.7° | 179.5° |
| OAO | CAK | NAL | CAM | 179.7° | 180.0° |
| OAO | CAK | CAJ | CAI | 0.1° | 0.4° |
| OAO | CAK | CAJ | CAD | 180.0° | 179.8° |
| CAQ | CAP | NAL | H7 | 121.6° | 120.0° |
| CAQ | CAP | NAL | H8 | 121.6° | 120.0° |
| CAQ | CAP | NAL | CAK | 57.9° | 90.0° |
| CAQ | CAP | NAL | CAM | 123.0° | 90.5° |
| CAQ | CAP | H7 | H8 | 114.9° | 120.0° |
| CAP | CAQ | H9 | H10 | 117.2° | 119.9° |
| CAP | CAQ | NAR | H11 | 96.4° | 56.0° |
| CAP | NAL | CAK | CAM | 179.0° | 179.5° |
| CAP | NAL | CAK | CAJ | 179.5° | 180.0° |
| CAP | NAL | CAM | OAN | 0.7° | 0.3° |
| CAP | NAL | CAM | CAE | 179.4° | 180.0° |
| NAL | CAP | H7 | H8 | 114.9° | 120.0° |
| NAL | CAP | CAQ | H9 | 113.4° | 60.0° |
| NAL | CAP | CAQ | H10 | 4.8° | 60.0° |
| NAL | CAK | CAJ | CAI | 179.8° | 179.8° |
| NAL | CAK | CAJ | CAD | 0.3° | 0.3° |
| CAK | NAL | CAM | OAN | 179.8° | 179.7° |
| CAK | NAL | CAM | CAE | 0.4° | 0.5° |
| CAK | NAL | CAP | H7 | 63.6° | 150.0° |
| CAK | NAL | CAP | H8 | 179.5° | 30.0° |
| CAJ | CAK | NAL | CAM | 0.5° | 0.6° |
| CAK | CAJ | CAI | CAD | 179.9° | 179.9° |
| CAK | CAJ | CAI | CAH | 180.0° | 180.0° |
| CAK | CAJ | CAD | CAE | 0.1° | 0.0° |
| CAK | CAJ | CAD | CAC | 180.0° | 180.0° |
| CAK | CAJ | CAI | H6 | 0.0° | 0.1° |
| NAL | CAM | OAN | CAE | 179.8° | 179.7° |
| NAL | CAM | CAE | CAD | 0.0° | 0.2° |
| NAL | CAM | CAE | CAF | 179.5° | 179.8° |
| CAM | NAL | CAP | H7 | 115.4° | 29.5° |
| CAM | NAL | CAP | H8 | 1.4° | 149.5° |
| CAJ | CAI | CAH | H6 | 180.0° | 180.0° |
| CAJ | CAI | CAH | CAG | 0.1° | 0.1° |
| CAI | CAJ | CAD | CAE | 179.8° | 179.9° |
| CAI | CAJ | CAD | CAC | 0.1° | 0.1° |
| CAJ | CAI | CAH | H5 | 180.0° | 180.0° |
| CAH | CAI | CAJ | CAD | 0.0° | 0.1° |
| CAI | CAH | CAG | H5 | 180.0° | 179.9° |
| CAI | CAH | CAG | CAC | 0.2° | 0.1° |
| CAI | CAH | CAG | H4 | 179.8° | 180.0° |
| CAJ | CAD | CAE | CAM | 0.2° | 0.0° |
| CAJ | CAD | CAE | CAC | 180.0° | 180.0° |
| CAJ | CAD | CAE | CAF | 179.8° | 180.0° |
| CAJ | CAD | CAC | CAG | 0.2° | 0.1° |
| CAJ | CAD | CAC | CAB | 179.9° | 180.0° |
| CAD | CAJ | CAI | H6 | 180.0° | 180.0° |
| OAN | CAM | CAE | CAD | 179.8° | 180.0° |
| OAN | CAM | CAE | CAF | 0.3° | 0.0° |
| CAM | CAE | CAD | CAF | 179.6° | 180.0° |
| CAM | CAE | CAD | CAC | 179.8° | 180.0° |
| CAM | CAE | CAF | CAA | 179.8° | 180.0° |
| CAM | CAE | CAF | H1 | 0.2° | 0.0° |
| CAH | CAG | CAC | CAD | 0.3° | 0.1° |
| CAH | CAG | CAC | H4 | 180.0° | 179.9° |
| CAH | CAG | CAC | CAB | 179.8° | 180.0° |
| CAG | CAH | CAI | H6 | 179.9° | 180.0° |
| CAE | CAD | CAC | CAG | 179.7° | 179.9° |
| CAE | CAD | CAC | CAB | 0.2° | 0.0° |
| CAD | CAE | CAF | CAA | 0.2° | 0.1° |
| CAD | CAE | CAF | H1 | 179.7° | 180.0° |
| CAC | CAD | CAE | CAF | 0.3° | 0.0° |
| CAD | CAC | CAG | CAB | 179.9° | 179.9° |
| CAD | CAC | CAB | CAA | 0.0° | 0.0° |
| CAD | CAC | CAB | H3 | 180.0° | 180.0° |
| CAD | CAC | CAG | H4 | 179.8° | 180.0° |
| CAE | CAF | CAA | H1 | 180.0° | 179.9° |
| CAE | CAF | CAA | CAB | 0.1° | 0.1° |
| CAE | CAF | CAA | H2 | 179.9° | 180.0° |
| CAG | CAC | CAB | CAA | 179.9° | 179.9° |
| CAG | CAC | CAB | H3 | 0.1° | 0.0° |
| CAC | CAG | CAH | H5 | 179.8° | 180.0° |
| CAC | CAB | CAA | CAF | 0.1° | 0.0° |
| CAC | CAB | CAA | H3 | 180.0° | 179.9° |
| CAC | CAB | CAA | H2 | 180.0° | 180.0° |
| CAB | CAC | CAG | H4 | 0.1° | 0.1° |
| CAF | CAA | CAB | H2 | 180.0° | 180.0° |
| CAF | CAA | CAB | H3 | 179.9° | 180.0° |
| CAB | CAA | CAF | H1 | 179.9° | 180.0° |
| H1 | CAF | CAA | H2 | 0.1° | 0.0° |
| H2 | CAA | CAB | H3 | 0.0° | 0.0° |
| H4 | CAG | CAH | H5 | 0.1° | 0.1° |
| H5 | CAH | CAI | H6 | 0.0° | 0.0° |
| H7 | CAP | CAQ | H9 | 125.0° | 180.0° |
| H7 | CAP | CAQ | H10 | 116.8° | 60.1° |
| H8 | CAP | CAQ | H9 | 8.1° | 60.0° |
| H8 | CAP | CAQ | H10 | 126.3° | 180.0° |
| H9 | CAQ | NAR | H11 | 142.7° | 64.0° |
| H10 | CAQ | NAR | H11 | 24.5° | 176.0° |
| H11 | NAR | CAS | H13 | 136.1° | 64.0° |
| H11 | NAR | CAS | H14 | 105.6° | 176.0° |
| H15 | CAY | H16 | H17 | 120.0° | 120.0° |
