F6A
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | C8 | sing | 1.35Å | 1.33Å | |
| N | C9 | sing | 1.40Å | 1.35Å | |
| O | C8 | doub | 1.22Å | 1.22Å | |
| C1 | F1 | sing | 1.40Å | 1.32Å | |
| C1 | C2 | sing | 1.51Å | 1.50Å | |
| C1 | F2 | sing | 1.40Å | 1.32Å | |
| C1 | F3 | sing | 1.40Å | 1.32Å | |
| C2 | C3 | doub | 1.40Å | 1.49Å | Aromatic |
| C2 | C7 | sing | 1.38Å | 1.39Å | Aromatic |
| C3 | C4 | sing | 1.40Å | 1.39Å | Aromatic |
| C3 | C8 | sing | 1.48Å | 1.50Å | |
| C4 | C5 | doub | 1.38Å | 1.39Å | Aromatic |
| C5 | C6 | sing | 1.38Å | 1.40Å | Aromatic |
| C6 | C7 | doub | 1.38Å | 1.39Å | Aromatic |
| C9 | C10 | doub | 1.39Å | 1.39Å | Aromatic |
| C9 | C14 | sing | 1.39Å | 1.40Å | Aromatic |
| C10 | C11 | sing | 1.39Å | 1.39Å | Aromatic |
| C11 | C12 | doub | 1.39Å | 1.40Å | Aromatic |
| C11 | C15 | sing | 1.48Å | 1.49Å | Aromatic |
| C12 | C13 | sing | 1.38Å | 1.39Å | Aromatic |
| C13 | C14 | doub | 1.38Å | 1.39Å | Aromatic |
| C15 | C16 | doub | 1.39Å | 1.40Å | Aromatic |
| C15 | C20 | sing | 1.39Å | 1.40Å | Aromatic |
| C16 | C17 | sing | 1.38Å | 1.40Å | Aromatic |
| C17 | C18 | doub | 1.38Å | 1.40Å | Aromatic |
| C18 | C19 | sing | 1.38Å | 1.40Å | Aromatic |
| C19 | C20 | doub | 1.38Å | 1.40Å | Aromatic |
| N | HN | sing | 0.97Å | 1.00Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| C17 | H17 | sing | 1.08Å | 1.08Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C20 | H20 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C8 | N | C9 | 125.7° | 120.0° |
| N | C8 | O | 123.1° | 120.0° |
| N | C8 | C3 | 116.7° | 120.0° |
| C8 | N | HN | 117.2° | 120.0° |
| N | C9 | C10 | 117.5° | 120.0° |
| N | C9 | C14 | 122.9° | 120.0° |
| C9 | N | HN | 117.1° | 120.0° |
| O | C8 | C3 | 120.1° | 120.0° |
| F1 | C1 | C2 | 111.4° | 109.4° |
| F1 | C1 | F2 | 109.9° | 109.5° |
| F1 | C1 | F3 | 108.0° | 109.4° |
| C2 | C1 | F2 | 107.2° | 109.5° |
| C2 | C1 | F3 | 109.9° | 109.4° |
| C1 | C2 | C3 | 122.4° | 120.1° |
| C1 | C2 | C7 | 118.6° | 120.1° |
| F2 | C1 | F3 | 110.6° | 109.5° |
| C3 | C2 | C7 | 119.1° | 119.8° |
| C2 | C3 | C4 | 118.6° | 119.7° |
| C2 | C3 | C8 | 122.5° | 120.1° |
| C2 | C7 | C6 | 120.0° | 120.1° |
| C2 | C7 | H7 | 120.0° | 119.9° |
| C4 | C3 | C8 | 118.9° | 120.2° |
| C3 | C4 | C5 | 120.1° | 119.8° |
| C3 | C4 | H4 | 119.9° | 120.1° |
| C4 | C5 | C6 | 121.3° | 120.2° |
| C5 | C4 | H4 | 120.0° | 120.1° |
| C4 | C5 | H5 | 119.3° | 119.9° |
| C5 | C6 | C7 | 120.9° | 120.3° |
| C6 | C5 | H5 | 119.3° | 119.9° |
| C5 | C6 | H6 | 119.5° | 119.9° |
| C7 | C6 | H6 | 119.6° | 119.8° |
| C6 | C7 | H7 | 120.0° | 120.0° |
| C10 | C9 | C14 | 119.6° | 120.0° |
| C9 | C10 | C11 | 120.6° | 119.8° |
| C9 | C10 | H10 | 119.7° | 120.1° |
| C9 | C14 | C13 | 120.1° | 120.2° |
| C9 | C14 | H14 | 119.9° | 120.0° |
| C10 | C11 | C12 | 119.5° | 119.8° |
| C10 | C11 | C15 | 118.9° | 120.1° |
| C11 | C10 | H10 | 119.7° | 120.1° |
| C12 | C11 | C15 | 121.6° | 120.1° |
| C11 | C12 | C13 | 120.3° | 120.0° |
| C11 | C12 | H12 | 119.9° | 120.0° |
| C11 | C15 | C16 | 120.2° | 120.1° |
| C11 | C15 | C20 | 120.3° | 120.1° |
| C12 | C13 | C14 | 119.9° | 120.2° |
| C13 | C12 | H12 | 119.8° | 120.0° |
| C12 | C13 | H13 | 120.1° | 119.9° |
| C14 | C13 | H13 | 120.0° | 119.9° |
| C13 | C14 | H14 | 119.9° | 119.8° |
| C16 | C15 | C20 | 119.5° | 119.8° |
| C15 | C16 | C17 | 120.5° | 119.8° |
| C15 | C16 | H16 | 119.8° | 120.1° |
| C15 | C20 | C19 | 120.1° | 119.9° |
| C15 | C20 | H20 | 120.0° | 120.0° |
| C16 | C17 | C18 | 119.7° | 120.2° |
| C17 | C16 | H16 | 119.8° | 120.1° |
| C16 | C17 | H17 | 120.2° | 119.9° |
| C17 | C18 | C19 | 120.2° | 120.2° |
| C18 | C17 | H17 | 120.2° | 119.9° |
| C17 | C18 | H18 | 119.9° | 119.9° |
| C18 | C19 | C20 | 120.0° | 120.1° |
| C19 | C18 | H18 | 119.9° | 119.9° |
| C18 | C19 | H19 | 120.0° | 119.9° |
| C20 | C19 | H19 | 120.0° | 119.9° |
| C19 | C20 | H20 | 119.9° | 120.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C8 | N | C9 | HN | 180.0° | 179.8° |
| N | C8 | O | C3 | 178.2° | 180.0° |
| N | C8 | C3 | C2 | 125.4° | 180.0° |
| N | C8 | C3 | C4 | 53.2° | 0.1° |
| C8 | N | C9 | C10 | 169.7° | 146.7° |
| C8 | N | C9 | C14 | 10.7° | 33.5° |
| C9 | N | C8 | O | 36.7° | 5.3° |
| C9 | N | C8 | C3 | 145.1° | 174.7° |
| N | C9 | C10 | C14 | 179.6° | 179.8° |
| N | C9 | C10 | C11 | 179.8° | 180.0° |
| N | C9 | C14 | C13 | 179.8° | 179.7° |
| N | C9 | C10 | H10 | 0.2° | 0.0° |
| N | C9 | C14 | H14 | 0.2° | 0.1° |
| O | C8 | C3 | C2 | 52.9° | 0.0° |
| O | C8 | C3 | C4 | 128.5° | 179.9° |
| O | C8 | N | HN | 143.3° | 174.5° |
| F1 | C1 | C2 | F2 | 120.2° | 120.0° |
| F1 | C1 | C2 | F3 | 119.6° | 119.9° |
| F1 | C1 | F2 | F3 | 119.1° | 120.0° |
| F1 | C1 | C2 | C3 | 32.7° | 180.0° |
| F1 | C1 | C2 | C7 | 148.1° | 0.2° |
| C2 | C1 | F2 | F3 | 119.8° | 120.0° |
| C1 | C2 | C3 | C7 | 179.3° | 179.7° |
| C1 | C2 | C3 | C4 | 179.8° | 180.0° |
| C1 | C2 | C3 | C8 | 1.3° | 0.0° |
| C1 | C2 | C7 | C6 | 179.8° | 179.7° |
| C1 | C2 | C7 | H7 | 0.2° | 0.0° |
| F2 | C1 | C2 | C3 | 87.6° | 60.0° |
| F2 | C1 | C2 | C7 | 91.7° | 120.3° |
| F3 | C1 | C2 | C3 | 152.3° | 60.1° |
| F3 | C1 | C2 | C7 | 28.5° | 119.7° |
| C2 | C3 | C4 | C8 | 178.6° | 179.9° |
| C2 | C3 | C4 | C5 | 0.6° | 0.1° |
| C3 | C2 | C7 | C6 | 0.5° | 0.5° |
| C2 | C3 | C4 | H4 | 179.3° | 180.0° |
| C3 | C2 | C7 | H7 | 179.5° | 179.7° |
| C7 | C2 | C3 | C4 | 0.9° | 0.3° |
| C7 | C2 | C3 | C8 | 179.4° | 179.8° |
| C2 | C7 | C6 | C5 | 0.0° | 0.5° |
| C2 | C7 | C6 | H7 | 180.0° | 179.7° |
| C2 | C7 | C6 | H6 | 179.9° | 179.7° |
| C3 | C4 | C5 | H4 | 180.0° | 179.9° |
| C3 | C4 | C5 | C6 | 0.1° | 0.1° |
| C3 | C4 | C5 | H5 | 179.9° | 180.0° |
| C8 | C3 | C4 | C5 | 179.3° | 180.0° |
| C3 | C8 | N | HN | 34.9° | 5.5° |
| C8 | C3 | C4 | H4 | 0.7° | 0.1° |
| C4 | C5 | C6 | H5 | 180.0° | 179.9° |
| C4 | C5 | C6 | C7 | 0.3° | 0.3° |
| C4 | C5 | C6 | H6 | 179.7° | 179.9° |
| C5 | C6 | C7 | H6 | 180.0° | 179.8° |
| C6 | C5 | C4 | H4 | 179.9° | 180.0° |
| C5 | C6 | C7 | H7 | 180.0° | 179.7° |
| C7 | C6 | C5 | H5 | 179.8° | 179.8° |
| C9 | C10 | C11 | H10 | 180.0° | 180.0° |
| C9 | C10 | C11 | C12 | 0.8° | 0.0° |
| C9 | C10 | C11 | C15 | 179.5° | 180.0° |
| C10 | C9 | C14 | C13 | 0.2° | 0.5° |
| C10 | C9 | N | HN | 10.3° | 33.1° |
| C10 | C9 | C14 | H14 | 179.8° | 179.8° |
| C14 | C9 | C10 | C11 | 0.6° | 0.2° |
| C9 | C14 | C13 | C12 | 0.1° | 0.5° |
| C9 | C14 | C13 | H14 | 180.0° | 179.8° |
| C14 | C9 | N | HN | 169.3° | 146.7° |
| C14 | C9 | C10 | H10 | 179.4° | 179.8° |
| C9 | C14 | C13 | H13 | 180.0° | 179.7° |
| C10 | C11 | C12 | C15 | 178.6° | 180.0° |
| C10 | C11 | C12 | C13 | 0.7° | 0.0° |
| C10 | C11 | C15 | C16 | 136.7° | 180.0° |
| C10 | C11 | C15 | C20 | 42.1° | 0.3° |
| C10 | C11 | C12 | H12 | 179.3° | 180.0° |
| C11 | C12 | C13 | H12 | 180.0° | 180.0° |
| C11 | C12 | C13 | C14 | 0.3° | 0.3° |
| C12 | C11 | C15 | C16 | 41.9° | 0.0° |
| C12 | C11 | C15 | C20 | 139.3° | 179.7° |
| C12 | C11 | C10 | H10 | 179.2° | 180.0° |
| C11 | C12 | C13 | H13 | 179.7° | 180.0° |
| C15 | C11 | C12 | C13 | 179.3° | 180.0° |
| C11 | C15 | C16 | C20 | 178.8° | 179.7° |
| C11 | C15 | C16 | C17 | 179.2° | 179.9° |
| C11 | C15 | C20 | C19 | 179.1° | 179.8° |
| C15 | C11 | C10 | H10 | 0.5° | 0.0° |
| C15 | C11 | C12 | H12 | 0.7° | 0.0° |
| C11 | C15 | C16 | H16 | 0.8° | 0.1° |
| C11 | C15 | C20 | H20 | 0.9° | 0.0° |
| C12 | C13 | C14 | H13 | 180.0° | 179.7° |
| C12 | C13 | C14 | H14 | 180.0° | 179.7° |
| C14 | C13 | C12 | H12 | 179.7° | 179.7° |
| C15 | C16 | C17 | H16 | 180.0° | 180.0° |
| C15 | C16 | C17 | C18 | 0.3° | 0.0° |
| C16 | C15 | C20 | C19 | 0.3° | 0.5° |
| C15 | C16 | C17 | H17 | 179.7° | 180.0° |
| C16 | C15 | C20 | H20 | 179.7° | 179.7° |
| C20 | C15 | C16 | C17 | 0.4° | 0.2° |
| C15 | C20 | C19 | C18 | 0.1° | 0.5° |
| C15 | C20 | C19 | H20 | 180.0° | 179.8° |
| C20 | C15 | C16 | H16 | 179.6° | 179.7° |
| C15 | C20 | C19 | H19 | 179.9° | 179.7° |
| C16 | C17 | C18 | H17 | 180.0° | 180.0° |
| C16 | C17 | C18 | C19 | 0.1° | 0.0° |
| C16 | C17 | C18 | H18 | 179.9° | 179.9° |
| C17 | C18 | C19 | H18 | 180.0° | 179.9° |
| C17 | C18 | C19 | C20 | 0.0° | 0.3° |
| C18 | C17 | C16 | H16 | 179.7° | 180.0° |
| C17 | C18 | C19 | H19 | 180.0° | 179.9° |
| C18 | C19 | C20 | H19 | 180.0° | 179.8° |
| C19 | C18 | C17 | H17 | 179.9° | 180.0° |
| C18 | C19 | C20 | H20 | 179.9° | 179.7° |
| C20 | C19 | C18 | H18 | 180.0° | 179.8° |
| H4 | C4 | C5 | H5 | 0.2° | 0.1° |
| H5 | C5 | C6 | H6 | 0.3° | 0.0° |
| H6 | C6 | C7 | H7 | 0.1° | 0.0° |
| H12 | C12 | C13 | H13 | 0.3° | 0.0° |
| H13 | C13 | C14 | H14 | 0.0° | 0.0° |
| H16 | C16 | C17 | H17 | 0.3° | 0.0° |
| H17 | C17 | C18 | H18 | 0.0° | 0.0° |
| H18 | C18 | C19 | H19 | 0.0° | 0.0° |
| H19 | C19 | C20 | H20 | 0.1° | 0.1° |
