F8D
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O08 | C07 | sing | 1.43Å | 1.40Å | |
| C07 | C06 | sing | 1.53Å | 1.53Å | |
| O03 | C02 | doub | 1.21Å | 1.21Å | |
| C06 | C05 | sing | 1.55Å | 1.51Å | |
| C06 | C09 | sing | 1.55Å | 1.49Å | |
| C05 | N04 | sing | 1.47Å | 1.43Å | |
| C02 | N04 | sing | 1.35Å | 1.42Å | |
| C02 | C01 | sing | 1.51Å | 1.49Å | |
| N04 | C18 | sing | 1.47Å | 1.40Å | |
| C09 | C18 | sing | 1.56Å | 1.56Å | |
| C09 | O10 | sing | 1.43Å | 1.40Å | |
| C18 | C17 | sing | 1.51Å | 1.44Å | |
| O10 | C11 | sing | 1.36Å | 1.33Å | |
| C17 | C11 | doub | 1.39Å | 1.37Å | Aromatic |
| C17 | C16 | sing | 1.38Å | 1.36Å | Aromatic |
| C11 | C12 | sing | 1.39Å | 1.35Å | Aromatic |
| C16 | C14 | doub | 1.38Å | 1.35Å | Aromatic |
| C12 | C13 | doub | 1.38Å | 1.35Å | Aromatic |
| C14 | C13 | sing | 1.38Å | 1.35Å | Aromatic |
| C14 | CL15 | sing | 1.74Å | 1.74Å | |
| C13 | H131 | sing | 1.08Å | 1.08Å | |
| C01 | H012 | sing | 1.09Å | 1.10Å | |
| C01 | H013 | sing | 1.09Å | 1.10Å | |
| C01 | H011 | sing | 1.09Å | 1.10Å | |
| C05 | H051 | sing | 1.09Å | 1.10Å | |
| C05 | H052 | sing | 1.09Å | 1.10Å | |
| C06 | H061 | sing | 1.09Å | 1.10Å | |
| C07 | H072 | sing | 1.09Å | 1.10Å | |
| C07 | H071 | sing | 1.09Å | 1.10Å | |
| O08 | H081 | sing | 0.97Å | 0.95Å | |
| C09 | H091 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.08Å | 1.08Å | |
| C16 | H161 | sing | 1.08Å | 1.08Å | |
| C18 | H181 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O08 | C07 | C06 | 105.4° | 109.4° |
| O08 | C07 | H072 | 110.5° | 109.5° |
| O08 | C07 | H071 | 110.5° | 109.4° |
| C07 | O08 | H081 | 109.5° | 114.0° |
| C07 | C06 | C05 | 115.1° | 110.9° |
| C07 | C06 | C09 | 113.2° | 110.9° |
| C07 | C06 | H061 | 108.6° | 110.9° |
| C06 | C07 | H072 | 110.5° | 109.5° |
| C06 | C07 | H071 | 110.5° | 109.5° |
| O03 | C02 | N04 | 119.8° | 120.0° |
| O03 | C02 | C01 | 119.6° | 120.0° |
| C05 | C06 | C09 | 101.6° | 101.9° |
| C06 | C05 | N04 | 108.4° | 104.8° |
| C06 | C05 | H051 | 109.8° | 110.4° |
| C06 | C05 | H052 | 109.7° | 110.5° |
| C05 | C06 | H061 | 108.9° | 111.0° |
| C06 | C09 | C18 | 104.4° | 102.7° |
| C06 | C09 | O10 | 114.9° | 108.6° |
| C09 | C06 | H061 | 109.1° | 111.0° |
| C06 | C09 | H091 | 110.0° | 113.6° |
| C05 | N04 | C02 | 123.7° | 125.6° |
| C05 | N04 | C18 | 106.1° | 108.9° |
| N04 | C05 | H051 | 109.7° | 110.3° |
| N04 | C05 | H052 | 109.7° | 110.3° |
| N04 | C02 | C01 | 120.6° | 120.0° |
| C02 | N04 | C18 | 130.1° | 125.6° |
| C02 | C01 | H012 | 109.5° | 109.5° |
| C02 | C01 | H013 | 109.5° | 109.5° |
| C02 | C01 | H011 | 109.5° | 109.5° |
| N04 | C18 | C09 | 108.5° | 107.2° |
| N04 | C18 | C17 | 116.8° | 109.9° |
| N04 | C18 | H181 | 110.4° | 111.9° |
| C18 | C09 | O10 | 106.6° | 102.7° |
| C09 | C18 | C17 | 102.5° | 102.0° |
| C18 | C09 | H091 | 109.1° | 113.9° |
| C09 | C18 | H181 | 108.3° | 112.2° |
| C09 | O10 | C11 | 107.8° | 109.7° |
| O10 | C09 | H091 | 111.4° | 114.2° |
| C18 | C17 | C11 | 107.5° | 107.3° |
| C18 | C17 | C16 | 129.7° | 132.0° |
| C17 | C18 | H181 | 109.8° | 113.2° |
| O10 | C11 | C17 | 115.0° | 111.2° |
| O10 | C11 | C12 | 128.0° | 129.8° |
| C11 | C17 | C16 | 122.8° | 120.7° |
| C17 | C11 | C12 | 117.0° | 118.9° |
| C17 | C16 | C14 | 118.3° | 120.0° |
| C17 | C16 | H161 | 120.8° | 120.0° |
| C11 | C12 | C13 | 120.6° | 120.3° |
| C11 | C12 | H121 | 119.7° | 119.8° |
| C16 | C14 | C13 | 120.0° | 119.7° |
| C16 | C14 | CL15 | 120.2° | 120.1° |
| C14 | C16 | H161 | 120.8° | 120.0° |
| C12 | C13 | C14 | 121.2° | 120.3° |
| C12 | C13 | H131 | 119.4° | 119.9° |
| C13 | C12 | H121 | 119.7° | 119.9° |
| C13 | C14 | CL15 | 119.8° | 120.1° |
| C14 | C13 | H131 | 119.4° | 119.8° |
| H012 | C01 | H013 | 109.5° | 109.4° |
| H012 | C01 | H011 | 109.5° | 109.4° |
| H013 | C01 | H011 | 109.5° | 109.5° |
| H051 | C05 | H052 | 109.5° | 110.4° |
| H072 | C07 | H071 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O08 | C07 | C06 | H072 | 119.4° | 120.0° |
| O08 | C07 | C06 | H071 | 119.3° | 119.9° |
| O08 | C07 | C06 | C05 | 29.2° | 66.5° |
| O08 | C07 | C06 | C09 | 145.4° | 178.9° |
| O08 | C07 | C06 | H061 | 93.2° | 57.3° |
| O08 | C07 | H072 | H071 | 121.9° | 120.0° |
| C07 | C06 | C05 | C09 | 122.7° | 118.1° |
| C07 | C06 | C05 | H061 | 122.2° | 123.7° |
| C07 | C06 | C09 | H061 | 121.1° | 123.7° |
| C07 | C06 | C05 | N04 | 88.9° | 80.9° |
| C07 | C06 | C09 | C18 | 101.1° | 83.1° |
| C07 | C06 | C09 | O10 | 142.6° | 168.6° |
| C07 | C06 | C05 | H051 | 30.9° | 160.3° |
| C07 | C06 | C05 | H052 | 151.3° | 37.9° |
| C06 | C07 | H072 | H071 | 121.9° | 120.0° |
| C06 | C07 | O08 | H081 | 180.0° | 180.0° |
| C07 | C06 | C09 | H091 | 15.9° | 40.4° |
| O03 | C02 | N04 | C05 | 1.3° | 180.0° |
| O03 | C02 | N04 | C01 | 178.4° | 180.0° |
| O03 | C02 | N04 | C18 | 179.8° | 0.0° |
| O03 | C02 | C01 | H012 | 0.0° | 120.0° |
| O03 | C02 | C01 | H013 | 120.0° | 0.0° |
| O03 | C02 | C01 | H011 | 120.0° | 120.0° |
| C05 | C06 | C09 | H061 | 114.9° | 118.2° |
| C06 | C05 | N04 | H051 | 119.8° | 118.9° |
| C06 | C05 | N04 | H052 | 119.8° | 119.0° |
| C06 | C05 | N04 | C02 | 150.0° | 155.2° |
| C06 | C05 | N04 | C18 | 30.9° | 24.8° |
| C05 | C06 | C09 | C18 | 22.8° | 35.0° |
| C05 | C06 | C09 | O10 | 93.5° | 73.3° |
| C06 | C05 | H051 | H052 | 120.5° | 122.5° |
| C05 | C06 | C07 | H072 | 148.6° | 53.5° |
| C05 | C06 | C07 | H071 | 90.1° | 173.6° |
| C05 | C06 | C09 | H091 | 139.8° | 158.5° |
| C09 | C06 | C05 | N04 | 33.8° | 37.2° |
| C06 | C09 | C18 | N04 | 6.0° | 21.3° |
| C06 | C09 | C18 | O10 | 122.0° | 112.7° |
| C06 | C09 | C18 | H091 | 117.5° | 123.3° |
| C06 | C09 | O10 | H091 | 126.0° | 127.9° |
| C06 | C09 | C18 | C17 | 130.1° | 136.7° |
| C06 | C09 | O10 | C11 | 123.0° | 134.8° |
| C09 | C06 | C05 | H051 | 153.6° | 81.6° |
| C09 | C06 | C05 | H052 | 86.1° | 156.0° |
| C09 | C06 | C07 | H072 | 95.2° | 59.0° |
| C09 | C06 | C07 | H071 | 26.1° | 61.1° |
| C06 | C09 | C18 | H181 | 113.8° | 101.9° |
| C05 | N04 | C02 | C18 | 178.9° | 179.9° |
| C05 | N04 | C02 | C01 | 179.7° | 0.0° |
| C05 | N04 | C18 | C09 | 14.9° | 2.0° |
| C05 | N04 | C18 | C17 | 100.2° | 108.0° |
| N04 | C05 | H051 | H052 | 120.5° | 122.2° |
| N04 | C05 | C06 | H061 | 148.8° | 155.3° |
| C05 | N04 | C18 | H181 | 133.4° | 125.4° |
| C02 | N04 | C18 | C09 | 166.0° | 177.9° |
| C02 | N04 | C18 | C17 | 78.9° | 72.0° |
| N04 | C02 | C01 | H012 | 178.4° | 60.0° |
| N04 | C02 | C01 | H013 | 61.6° | 180.0° |
| N04 | C02 | C01 | H011 | 58.4° | 60.0° |
| C02 | N04 | C05 | H051 | 30.1° | 85.9° |
| C02 | N04 | C05 | H052 | 90.2° | 36.2° |
| C02 | N04 | C18 | H181 | 47.5° | 54.6° |
| C01 | C02 | N04 | C18 | 1.4° | 180.0° |
| C02 | C01 | H012 | H013 | 120.0° | 120.0° |
| C02 | C01 | H012 | H011 | 120.0° | 120.0° |
| C02 | C01 | H013 | H011 | 120.0° | 120.1° |
| N04 | C18 | C09 | C17 | 124.1° | 115.4° |
| N04 | C18 | C09 | H181 | 119.8° | 123.1° |
| N04 | C18 | C09 | O10 | 116.0° | 91.4° |
| N04 | C18 | C17 | H181 | 126.6° | 125.9° |
| N04 | C18 | C17 | C11 | 113.1° | 98.9° |
| N04 | C18 | C17 | C16 | 64.8° | 81.5° |
| C18 | N04 | C05 | H051 | 150.7° | 94.1° |
| C18 | N04 | C05 | H052 | 89.0° | 143.7° |
| N04 | C18 | C09 | H091 | 123.6° | 144.6° |
| C18 | C09 | O10 | H091 | 118.9° | 123.8° |
| C09 | C18 | C17 | H181 | 115.0° | 120.7° |
| C18 | C09 | O10 | C11 | 7.9° | 26.5° |
| C09 | C18 | C17 | C11 | 5.3° | 14.5° |
| C09 | C18 | C17 | C16 | 176.8° | 165.1° |
| C18 | C09 | C06 | H061 | 137.8° | 153.2° |
| O10 | C09 | C18 | C17 | 8.1° | 24.0° |
| C09 | O10 | C11 | C17 | 4.9° | 18.4° |
| C09 | O10 | C11 | C12 | 174.2° | 161.6° |
| O10 | C09 | C06 | H061 | 21.4° | 44.8° |
| O10 | C09 | C18 | H181 | 124.1° | 145.4° |
| C18 | C17 | C11 | O10 | 0.7° | 1.2° |
| C18 | C17 | C11 | C16 | 178.1° | 179.6° |
| C18 | C17 | C11 | C12 | 179.9° | 178.8° |
| C18 | C17 | C16 | C14 | 179.0° | 178.9° |
| C17 | C18 | C09 | H091 | 112.4° | 100.0° |
| C18 | C17 | C16 | H161 | 1.0° | 0.9° |
| O10 | C11 | C17 | C12 | 179.2° | 180.0° |
| O10 | C11 | C17 | C16 | 178.8° | 179.2° |
| O10 | C11 | C12 | C13 | 179.5° | 179.7° |
| C11 | O10 | C09 | H091 | 111.0° | 97.3° |
| O10 | C11 | C12 | H121 | 0.5° | 0.4° |
| C11 | C17 | C16 | C14 | 1.3° | 0.6° |
| C17 | C11 | C12 | C13 | 1.5° | 0.4° |
| C17 | C11 | C12 | H121 | 178.5° | 179.6° |
| C11 | C17 | C16 | H161 | 178.6° | 179.6° |
| C11 | C17 | C18 | H181 | 120.2° | 135.2° |
| C16 | C17 | C11 | C12 | 2.0° | 0.9° |
| C17 | C16 | C14 | H161 | 180.0° | 179.8° |
| C17 | C16 | C14 | C13 | 0.1° | 0.1° |
| C17 | C16 | C14 | CL15 | 179.7° | 179.9° |
| C16 | C17 | C18 | H181 | 61.8° | 44.4° |
| C11 | C12 | C13 | H121 | 180.0° | 180.0° |
| C11 | C12 | C13 | C14 | 0.4° | 0.3° |
| C11 | C12 | C13 | H131 | 179.6° | 180.0° |
| C16 | C14 | C13 | C12 | 0.3° | 0.5° |
| C16 | C14 | C13 | CL15 | 179.8° | 179.9° |
| C16 | C14 | C13 | H131 | 179.6° | 179.8° |
| C12 | C13 | C14 | H131 | 180.0° | 179.7° |
| C12 | C13 | C14 | CL15 | 179.9° | 179.6° |
| C14 | C13 | C12 | H121 | 179.6° | 179.7° |
| C13 | C14 | C16 | H161 | 179.9° | 179.7° |
| CL15 | C14 | C13 | H131 | 0.2° | 0.1° |
| CL15 | C14 | C16 | H161 | 0.4° | 0.2° |
| H131 | C13 | C12 | H121 | 0.3° | 0.0° |
| H012 | C01 | H013 | H011 | 120.0° | 119.9° |
| H051 | C05 | C06 | H061 | 91.3° | 36.6° |
| H052 | C05 | C06 | H061 | 29.0° | 85.8° |
| H061 | C06 | C07 | H072 | 26.2° | 177.3° |
| H061 | C06 | C07 | H071 | 147.5° | 62.6° |
| H061 | C06 | C09 | H091 | 105.3° | 83.4° |
| H072 | C07 | O08 | H081 | 60.6° | 60.0° |
| H071 | C07 | O08 | H081 | 60.7° | 60.0° |
| H091 | C09 | C18 | H181 | 3.7° | 21.4° |
