7F7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAA | CAS | sing | 1.51Å | 1.44Å | |
| CAS | NAO | doub | 1.32Å | 1.33Å | Aromatic |
| CAS | CAU | sing | 1.39Å | 1.38Å | Aromatic |
| NAO | CAH | sing | 1.32Å | 1.44Å | Aromatic |
| OAD | CAU | sing | 1.36Å | 1.37Å | |
| CAU | CAV | doub | 1.40Å | 1.42Å | Aromatic |
| CAH | CAT | doub | 1.38Å | 1.38Å | Aromatic |
| CAV | CAT | sing | 1.40Å | 1.42Å | Aromatic |
| CAV | CAG | sing | 1.48Å | 1.46Å | |
| CAT | CAM | sing | 1.51Å | 1.47Å | |
| CAG | N | doub | 1.29Å | 1.43Å | |
| O | C | doub | 1.21Å | 1.26Å | |
| CAM | OAQ | sing | 1.43Å | 1.47Å | |
| N | CA | sing | 1.47Å | 1.57Å | |
| OAQ | PAX | sing | 1.61Å | 1.64Å | |
| C | CA | sing | 1.51Å | 1.49Å | |
| C | NAP | sing | 1.33Å | 1.37Å | |
| CA | CB | sing | 1.53Å | 1.49Å | |
| OAF | PAX | doub | 1.48Å | 1.53Å | |
| PAX | OAC | sing | 1.61Å | 1.48Å | |
| PAX | OAE | sing | 1.61Å | 1.53Å | |
| NAP | CAK | sing | 1.47Å | 1.51Å | |
| CB | CAJ | sing | 1.52Å | 1.57Å | |
| CAK | CAI | sing | 1.53Å | 1.48Å | |
| CAJ | CAI | sing | 1.52Å | 1.50Å | |
| OAE | H1 | sing | 0.97Å | 0.95Å | |
| OAC | H2 | sing | 0.97Å | 0.95Å | |
| CAM | H3 | sing | 1.09Å | 1.10Å | |
| CAM | H4 | sing | 1.09Å | 1.10Å | |
| CAH | H5 | sing | 1.08Å | 1.08Å | |
| CAA | H6 | sing | 1.09Å | 1.10Å | |
| CAA | H7 | sing | 1.09Å | 1.10Å | |
| CAA | H8 | sing | 1.09Å | 1.10Å | |
| OAD | H9 | sing | 0.97Å | 0.95Å | |
| CAG | H10 | sing | 1.08Å | 1.08Å | |
| CA | H11 | sing | 1.09Å | 1.10Å | |
| CB | H12 | sing | 1.09Å | 1.10Å | |
| CB | H13 | sing | 1.09Å | 1.10Å | |
| CAJ | H14 | sing | 1.09Å | 1.10Å | |
| CAJ | H15 | sing | 1.09Å | 1.10Å | |
| CAI | H16 | sing | 1.09Å | 1.10Å | |
| CAI | H17 | sing | 1.09Å | 1.10Å | |
| CAK | H18 | sing | 1.09Å | 1.10Å | |
| CAK | H19 | sing | 1.09Å | 1.10Å | |
| NAP | H20 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAA | CAS | NAO | 118.5° | 119.6° |
| CAA | CAS | CAU | 120.7° | 119.6° |
| CAS | CAA | H6 | 109.5° | 109.5° |
| CAS | CAA | H7 | 109.5° | 109.5° |
| CAS | CAA | H8 | 109.5° | 109.5° |
| NAO | CAS | CAU | 120.5° | 120.9° |
| CAS | NAO | CAH | 120.2° | 122.1° |
| CAS | CAU | OAD | 121.7° | 120.6° |
| CAS | CAU | CAV | 121.5° | 118.8° |
| NAO | CAH | CAT | 121.0° | 121.0° |
| NAO | CAH | H5 | 119.5° | 119.5° |
| OAD | CAU | CAV | 116.9° | 120.6° |
| CAU | OAD | H9 | 109.5° | 114.0° |
| CAU | CAV | CAT | 118.1° | 118.1° |
| CAU | CAV | CAG | 116.6° | 120.9° |
| CAH | CAT | CAV | 118.5° | 119.1° |
| CAH | CAT | CAM | 118.4° | 120.5° |
| CAT | CAH | H5 | 119.5° | 119.5° |
| CAT | CAV | CAG | 125.2° | 121.0° |
| CAV | CAT | CAM | 122.8° | 120.5° |
| CAV | CAG | N | 115.4° | 120.0° |
| CAV | CAG | H10 | 122.3° | 120.0° |
| CAT | CAM | OAQ | 110.6° | 109.5° |
| CAT | CAM | H3 | 109.2° | 109.5° |
| CAT | CAM | H4 | 109.2° | 109.5° |
| CAG | N | CA | 142.4° | 120.0° |
| N | CAG | H10 | 122.3° | 120.0° |
| O | C | CA | 126.5° | 119.9° |
| O | C | NAP | 117.1° | 119.9° |
| CAM | OAQ | PAX | 114.9° | 123.0° |
| OAQ | CAM | H3 | 109.2° | 109.5° |
| OAQ | CAM | H4 | 109.2° | 109.4° |
| N | CA | C | 111.0° | 109.6° |
| N | CA | CB | 94.5° | 109.6° |
| N | CA | H11 | 108.7° | 109.6° |
| OAQ | PAX | OAF | 101.8° | 109.5° |
| OAQ | PAX | OAC | 108.0° | 109.5° |
| OAQ | PAX | OAE | 108.9° | 109.5° |
| CA | C | NAP | 114.9° | 120.3° |
| C | CA | CB | 122.0° | 108.5° |
| C | CA | H11 | 109.7° | 109.8° |
| C | NAP | CAK | 127.0° | 120.4° |
| C | NAP | H20 | 116.5° | 119.8° |
| CA | CB | CAJ | 118.0° | 110.8° |
| CB | CA | H11 | 109.7° | 109.6° |
| CA | CB | H12 | 107.3° | 109.2° |
| CA | CB | H13 | 107.3° | 109.2° |
| OAF | PAX | OAC | 113.0° | 109.5° |
| OAF | PAX | OAE | 110.7° | 109.4° |
| OAC | PAX | OAE | 113.7° | 109.5° |
| PAX | OAC | H2 | 109.5° | 114.0° |
| PAX | OAE | H1 | 109.5° | 114.0° |
| NAP | CAK | CAI | 110.4° | 108.7° |
| NAP | CAK | H18 | 109.3° | 109.6° |
| NAP | CAK | H19 | 109.3° | 109.7° |
| CAK | NAP | H20 | 116.5° | 119.8° |
| CB | CAJ | CAI | 113.4° | 113.8° |
| CAJ | CB | H12 | 107.3° | 109.2° |
| CAJ | CB | H13 | 107.3° | 109.2° |
| CB | CAJ | H14 | 108.5° | 108.7° |
| CB | CAJ | H15 | 108.5° | 108.6° |
| CAK | CAI | CAJ | 111.2° | 110.9° |
| CAK | CAI | H16 | 109.0° | 109.2° |
| CAK | CAI | H17 | 109.1° | 109.1° |
| CAI | CAK | H18 | 109.2° | 109.6° |
| CAI | CAK | H19 | 109.2° | 109.6° |
| CAI | CAJ | H14 | 108.5° | 108.6° |
| CAI | CAJ | H15 | 108.5° | 108.6° |
| CAJ | CAI | H16 | 109.1° | 109.2° |
| CAJ | CAI | H17 | 109.0° | 109.3° |
| H3 | CAM | H4 | 109.5° | 109.5° |
| H6 | CAA | H7 | 109.5° | 109.5° |
| H6 | CAA | H8 | 109.4° | 109.5° |
| H7 | CAA | H8 | 109.5° | 109.5° |
| H12 | CB | H13 | 109.5° | 109.2° |
| H14 | CAJ | H15 | 109.4° | 108.5° |
| H16 | CAI | H17 | 109.5° | 109.2° |
| H18 | CAK | H19 | 109.5° | 109.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAA | CAS | NAO | CAU | 174.2° | 179.9° |
| CAA | CAS | NAO | CAH | 174.6° | 180.0° |
| CAA | CAS | CAU | OAD | 0.9° | 0.0° |
| CAA | CAS | CAU | CAV | 178.9° | 179.7° |
| CAS | CAA | H6 | H7 | 120.0° | 120.0° |
| CAS | CAA | H6 | H8 | 120.0° | 120.0° |
| CAS | CAA | H7 | H8 | 120.0° | 120.0° |
| NAO | CAS | CAU | OAD | 175.0° | 179.9° |
| NAO | CAS | CAU | CAV | 4.8° | 0.2° |
| CAS | NAO | CAH | CAT | 4.7° | 0.1° |
| CAS | NAO | CAH | H5 | 175.3° | 180.0° |
| NAO | CAS | CAA | H6 | 0.0° | 90.0° |
| NAO | CAS | CAA | H7 | 120.0° | 150.1° |
| NAO | CAS | CAA | H8 | 120.0° | 30.0° |
| CAU | CAS | NAO | CAH | 0.3° | 0.1° |
| CAS | CAU | OAD | CAV | 179.8° | 179.7° |
| CAS | CAU | CAV | CAT | 4.3° | 0.5° |
| CAS | CAU | CAV | CAG | 179.0° | 180.0° |
| CAU | CAS | CAA | H6 | 174.2° | 89.9° |
| CAU | CAS | CAA | H7 | 65.8° | 30.0° |
| CAU | CAS | CAA | H8 | 54.2° | 150.1° |
| CAS | CAU | OAD | H9 | 180.0° | 90.0° |
| NAO | CAH | CAT | H5 | 180.0° | 180.0° |
| NAO | CAH | CAT | CAV | 5.1° | 0.3° |
| NAO | CAH | CAT | CAM | 178.1° | 179.9° |
| OAD | CAU | CAV | CAT | 175.5° | 179.8° |
| OAD | CAU | CAV | CAG | 1.2° | 0.3° |
| CAU | CAV | CAT | CAH | 0.7° | 0.5° |
| CAU | CAV | CAT | CAG | 176.4° | 179.5° |
| CAU | CAV | CAT | CAM | 173.4° | 179.8° |
| CAU | CAV | CAG | N | 64.4° | 0.0° |
| CAV | CAU | OAD | H9 | 0.2° | 89.7° |
| CAU | CAV | CAG | H10 | 115.6° | 180.0° |
| CAH | CAT | CAV | CAM | 172.7° | 179.7° |
| CAH | CAT | CAV | CAG | 175.7° | 180.0° |
| CAH | CAT | CAM | OAQ | 109.0° | 0.0° |
| CAH | CAT | CAM | H3 | 11.1° | 120.0° |
| CAH | CAT | CAM | H4 | 130.8° | 120.0° |
| CAT | CAV | CAG | N | 112.1° | 179.5° |
| CAV | CAT | CAM | OAQ | 78.3° | 179.7° |
| CAV | CAT | CAM | H3 | 161.6° | 59.7° |
| CAV | CAT | CAM | H4 | 41.9° | 60.3° |
| CAV | CAT | CAH | H5 | 174.9° | 179.7° |
| CAT | CAV | CAG | H10 | 67.9° | 0.5° |
| CAG | CAV | CAT | CAM | 3.0° | 0.3° |
| CAV | CAG | N | H10 | 180.0° | 180.0° |
| CAV | CAG | N | CA | 165.2° | 180.0° |
| CAT | CAM | OAQ | H3 | 120.2° | 120.1° |
| CAT | CAM | OAQ | H4 | 120.2° | 120.0° |
| CAT | CAM | OAQ | PAX | 158.2° | 180.0° |
| CAT | CAM | H3 | H4 | 119.5° | 120.0° |
| CAM | CAT | CAH | H5 | 1.9° | 0.0° |
| CAG | N | CA | C | 91.0° | 121.0° |
| CAG | N | CA | CB | 35.8° | 120.0° |
| CAG | N | CA | H11 | 148.3° | 0.4° |
| O | C | CA | N | 0.2° | 10.9° |
| O | C | CA | NAP | 165.3° | 180.0° |
| O | C | CA | CB | 109.6° | 108.8° |
| O | C | NAP | CAK | 173.4° | 179.7° |
| O | C | CA | H11 | 120.3° | 131.4° |
| O | C | NAP | H20 | 6.7° | 0.3° |
| CAM | OAQ | PAX | OAF | 176.5° | 55.0° |
| CAM | OAQ | PAX | OAC | 64.3° | 65.0° |
| CAM | OAQ | PAX | OAE | 59.6° | 175.0° |
| OAQ | CAM | H3 | H4 | 119.5° | 120.0° |
| N | CA | C | CB | 109.8° | 119.7° |
| N | CA | C | H11 | 120.1° | 120.5° |
| N | CA | C | NAP | 165.5° | 169.0° |
| N | CA | CB | H11 | 111.7° | 120.4° |
| N | CA | CB | CAJ | 171.4° | 155.4° |
| CA | N | CAG | H10 | 14.9° | 0.0° |
| N | CA | CB | H12 | 67.3° | 84.3° |
| N | CA | CB | H13 | 50.2° | 35.0° |
| OAQ | PAX | OAF | OAC | 115.6° | 120.0° |
| OAQ | PAX | OAF | OAE | 115.6° | 120.0° |
| OAQ | PAX | OAC | OAE | 121.0° | 120.0° |
| OAQ | PAX | OAE | H1 | 111.1° | 180.0° |
| OAQ | PAX | OAC | H2 | 111.8° | 60.0° |
| PAX | OAQ | CAM | H3 | 81.7° | 60.0° |
| PAX | OAQ | CAM | H4 | 38.0° | 60.0° |
| C | CA | CB | H11 | 130.1° | 119.9° |
| CA | C | NAP | CAK | 6.6° | 0.3° |
| C | CA | CB | CAJ | 70.4° | 84.9° |
| C | CA | CB | H12 | 50.9° | 35.4° |
| C | CA | CB | H13 | 168.4° | 154.7° |
| CA | C | NAP | H20 | 173.4° | 179.7° |
| NAP | C | CA | CB | 55.7° | 71.2° |
| C | NAP | CAK | H20 | 180.0° | 180.0° |
| C | NAP | CAK | CAI | 71.3° | 71.9° |
| NAP | C | CA | H11 | 74.4° | 48.6° |
| C | NAP | CAK | H18 | 48.8° | 168.3° |
| C | NAP | CAK | H19 | 168.6° | 47.9° |
| CA | CB | CAJ | H12 | 121.2° | 120.3° |
| CA | CB | CAJ | H13 | 121.2° | 120.4° |
| CA | CB | CAJ | CAI | 55.8° | 66.8° |
| CA | CB | H12 | H13 | 116.1° | 119.4° |
| CA | CB | CAJ | H14 | 176.4° | 172.1° |
| CA | CB | CAJ | H15 | 64.8° | 54.3° |
| OAF | PAX | OAC | OAE | 127.2° | 119.9° |
| OAF | PAX | OAE | H1 | 0.0° | 60.0° |
| OAF | PAX | OAC | H2 | 0.0° | 180.0° |
| OAC | PAX | OAE | H1 | 128.4° | 59.9° |
| OAE | PAX | OAC | H2 | 127.2° | 60.0° |
| NAP | CAK | CAI | H18 | 120.1° | 119.7° |
| NAP | CAK | CAI | H19 | 120.1° | 119.9° |
| NAP | CAK | CAI | CAJ | 87.3° | 86.5° |
| NAP | CAK | CAI | H16 | 152.4° | 33.9° |
| NAP | CAK | CAI | H17 | 32.9° | 153.2° |
| NAP | CAK | H18 | H19 | 119.6° | 120.5° |
| CB | CAJ | CAI | CAK | 66.6° | 67.0° |
| CB | CAJ | CAI | H14 | 120.6° | 121.1° |
| CB | CAJ | CAI | H15 | 120.6° | 121.1° |
| CAJ | CB | CA | H11 | 59.8° | 35.0° |
| CAJ | CB | H12 | H13 | 116.2° | 119.4° |
| CB | CAJ | H14 | H15 | 118.2° | 117.9° |
| CB | CAJ | CAI | H16 | 173.2° | 53.4° |
| CB | CAJ | CAI | H17 | 53.7° | 172.7° |
| CAK | CAI | CAJ | H16 | 120.3° | 120.4° |
| CAK | CAI | CAJ | H17 | 120.3° | 120.3° |
| CAK | CAI | CAJ | H14 | 172.8° | 171.9° |
| CAK | CAI | CAJ | H15 | 54.0° | 54.1° |
| CAK | CAI | H16 | H17 | 119.2° | 119.2° |
| CAI | CAK | H18 | H19 | 119.6° | 120.4° |
| CAI | CAK | NAP | H20 | 108.7° | 108.1° |
| CAI | CAJ | CB | H12 | 65.4° | 53.5° |
| CAI | CAJ | CB | H13 | 177.0° | 172.9° |
| CAI | CAJ | H14 | H15 | 118.2° | 117.8° |
| CAJ | CAI | H16 | H17 | 119.2° | 119.4° |
| CAJ | CAI | CAK | H18 | 32.8° | 153.8° |
| CAJ | CAI | CAK | H19 | 152.5° | 33.4° |
| H6 | CAA | H7 | H8 | 119.9° | 120.0° |
| H11 | CA | CB | H12 | 179.0° | 155.3° |
| H11 | CA | CB | H13 | 61.5° | 85.4° |
| H12 | CB | CAJ | H14 | 55.2° | 67.6° |
| H12 | CB | CAJ | H15 | 174.0° | 174.6° |
| H13 | CB | CAJ | H14 | 62.4° | 51.8° |
| H13 | CB | CAJ | H15 | 56.4° | 66.1° |
| H14 | CAJ | CAI | H16 | 52.6° | 67.8° |
| H14 | CAJ | CAI | H17 | 66.9° | 51.5° |
| H15 | CAJ | CAI | H16 | 66.2° | 174.5° |
| H15 | CAJ | CAI | H17 | 174.3° | 66.2° |
| H16 | CAI | CAK | H18 | 87.4° | 85.8° |
| H16 | CAI | CAK | H19 | 32.3° | 153.8° |
| H17 | CAI | CAK | H18 | 153.1° | 33.4° |
| H17 | CAI | CAK | H19 | 87.2° | 87.0° |
| H18 | CAK | NAP | H20 | 131.1° | 11.7° |
| H19 | CAK | NAP | H20 | 11.4° | 132.1° |
