8FO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C7 | C3 | sing | 1.51Å | 1.50Å | |
| C3 | C4 | sing | 1.39Å | 1.38Å | Aromatic |
| C3 | C2 | doub | 1.38Å | 1.39Å | Aromatic |
| F1 | C4 | sing | 1.35Å | 1.36Å | |
| C4 | C5 | doub | 1.38Å | 1.37Å | Aromatic |
| C2 | C1 | sing | 1.38Å | 1.38Å | Aromatic |
| C5 | C6 | sing | 1.39Å | 1.39Å | Aromatic |
| C1 | C6 | doub | 1.39Å | 1.39Å | Aromatic |
| C6 | C8 | sing | 1.48Å | 1.49Å | |
| C9 | C8 | sing | 1.39Å | 1.40Å | Aromatic |
| C9 | C10 | doub | 1.38Å | 1.38Å | Aromatic |
| C8 | C13 | doub | 1.39Å | 1.41Å | Aromatic |
| C10 | C11 | sing | 1.38Å | 1.39Å | Aromatic |
| F2 | C14 | sing | 1.40Å | 1.32Å | |
| F3 | C14 | sing | 1.40Å | 1.33Å | |
| C13 | C14 | sing | 1.51Å | 1.50Å | |
| C13 | C12 | sing | 1.38Å | 1.39Å | Aromatic |
| C14 | F4 | sing | 1.40Å | 1.32Å | |
| C11 | C12 | doub | 1.38Å | 1.39Å | Aromatic |
| C11 | C15 | sing | 1.51Å | 1.52Å | |
| O1 | C16 | doub | 1.21Å | 1.25Å | |
| C16 | O2 | sing | 1.34Å | 1.25Å | |
| C16 | C15 | sing | 1.51Å | 1.53Å | |
| C15 | C17 | sing | 1.53Å | 1.52Å | |
| C17 | C18 | sing | 1.53Å | 1.50Å | |
| C5 | H1 | sing | 1.08Å | 1.08Å | |
| C7 | H2 | sing | 1.09Å | 1.10Å | |
| C7 | H3 | sing | 1.09Å | 1.10Å | |
| C7 | H4 | sing | 1.09Å | 1.10Å | |
| C10 | H5 | sing | 1.08Å | 1.08Å | |
| C15 | H6 | sing | 1.09Å | 1.10Å | |
| C17 | H7 | sing | 1.09Å | 1.10Å | |
| C17 | H8 | sing | 1.09Å | 1.10Å | |
| C1 | H9 | sing | 1.08Å | 1.08Å | |
| C12 | H10 | sing | 1.08Å | 1.08Å | |
| C18 | H11 | sing | 1.09Å | 1.10Å | |
| C18 | H12 | sing | 1.09Å | 1.10Å | |
| C18 | H13 | sing | 1.09Å | 1.10Å | |
| C2 | H14 | sing | 1.08Å | 1.08Å | |
| C9 | H15 | sing | 1.08Å | 1.08Å | |
| O2 | H16 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C7 | C3 | C4 | 121.8° | 119.9° |
| C7 | C3 | C2 | 121.0° | 119.9° |
| C3 | C7 | H2 | 109.5° | 109.5° |
| C3 | C7 | H3 | 109.5° | 109.5° |
| C3 | C7 | H4 | 109.5° | 109.4° |
| C4 | C3 | C2 | 117.2° | 120.2° |
| C3 | C4 | F1 | 118.7° | 119.9° |
| C3 | C4 | C5 | 123.0° | 120.1° |
| C3 | C2 | C1 | 120.7° | 120.2° |
| C3 | C2 | H14 | 119.6° | 119.9° |
| F1 | C4 | C5 | 118.3° | 120.0° |
| C4 | C5 | C6 | 119.9° | 119.9° |
| C4 | C5 | H1 | 120.0° | 120.1° |
| C2 | C1 | C6 | 121.2° | 119.9° |
| C2 | C1 | H9 | 119.4° | 120.1° |
| C1 | C2 | H14 | 119.6° | 119.9° |
| C5 | C6 | C1 | 118.0° | 119.8° |
| C5 | C6 | C8 | 121.2° | 120.1° |
| C6 | C5 | H1 | 120.0° | 120.1° |
| C1 | C6 | C8 | 120.8° | 120.0° |
| C6 | C1 | H9 | 119.4° | 120.1° |
| C6 | C8 | C9 | 118.1° | 120.1° |
| C6 | C8 | C13 | 123.4° | 120.1° |
| C8 | C9 | C10 | 121.5° | 119.9° |
| C9 | C8 | C13 | 118.4° | 119.8° |
| C8 | C9 | H15 | 119.2° | 120.1° |
| C9 | C10 | C11 | 120.2° | 120.1° |
| C9 | C10 | H5 | 119.9° | 119.9° |
| C10 | C9 | H15 | 119.2° | 120.1° |
| C8 | C13 | C14 | 123.3° | 120.0° |
| C8 | C13 | C12 | 119.1° | 119.9° |
| C10 | C11 | C12 | 118.4° | 120.2° |
| C10 | C11 | C15 | 121.7° | 119.9° |
| C11 | C10 | H5 | 119.9° | 120.0° |
| F2 | C14 | F3 | 106.9° | 109.5° |
| F2 | C14 | C13 | 112.7° | 109.5° |
| F2 | C14 | F4 | 105.5° | 109.4° |
| F3 | C14 | C13 | 113.5° | 109.5° |
| F3 | C14 | F4 | 105.3° | 109.5° |
| C14 | C13 | C12 | 117.6° | 120.0° |
| C13 | C14 | F4 | 112.2° | 109.5° |
| C13 | C12 | C11 | 122.3° | 120.1° |
| C13 | C12 | H10 | 118.9° | 119.9° |
| C12 | C11 | C15 | 119.8° | 119.9° |
| C11 | C12 | H10 | 118.9° | 120.0° |
| C11 | C15 | C16 | 110.4° | 109.4° |
| C11 | C15 | C17 | 113.7° | 109.5° |
| C11 | C15 | H6 | 105.8° | 109.5° |
| O1 | C16 | O2 | 124.4° | 120.0° |
| O1 | C16 | C15 | 117.1° | 120.0° |
| O2 | C16 | C15 | 118.4° | 120.0° |
| C16 | O2 | H16 | 109.5° | 117.0° |
| C16 | C15 | C17 | 114.6° | 109.5° |
| C16 | C15 | H6 | 105.7° | 109.4° |
| C15 | C17 | C18 | 111.2° | 109.5° |
| C17 | C15 | H6 | 105.8° | 109.5° |
| C15 | C17 | H7 | 109.1° | 109.5° |
| C15 | C17 | H8 | 109.0° | 109.5° |
| C18 | C17 | H7 | 109.0° | 109.5° |
| C18 | C17 | H8 | 109.1° | 109.4° |
| C17 | C18 | H11 | 109.5° | 109.5° |
| C17 | C18 | H12 | 109.5° | 109.5° |
| C17 | C18 | H13 | 109.4° | 109.5° |
| H2 | C7 | H3 | 109.4° | 109.5° |
| H2 | C7 | H4 | 109.5° | 109.5° |
| H3 | C7 | H4 | 109.4° | 109.4° |
| H7 | C17 | H8 | 109.5° | 109.5° |
| H11 | C18 | H12 | 109.5° | 109.4° |
| H11 | C18 | H13 | 109.5° | 109.5° |
| H12 | C18 | H13 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C7 | C3 | C4 | C2 | 179.9° | 180.0° |
| C7 | C3 | C4 | F1 | 0.2° | 0.3° |
| C7 | C3 | C4 | C5 | 179.8° | 180.0° |
| C7 | C3 | C2 | C1 | 179.7° | 180.0° |
| C3 | C7 | H2 | H3 | 120.0° | 120.0° |
| C3 | C7 | H2 | H4 | 120.0° | 120.0° |
| C3 | C7 | H3 | H4 | 120.0° | 119.9° |
| C7 | C3 | C2 | H14 | 0.3° | 0.0° |
| C3 | C4 | F1 | C5 | 179.6° | 179.8° |
| C4 | C3 | C2 | C1 | 0.3° | 0.0° |
| C3 | C4 | C5 | C6 | 0.1° | 0.0° |
| C3 | C4 | C5 | H1 | 179.9° | 180.0° |
| C4 | C3 | C7 | H2 | 90.1° | 90.0° |
| C4 | C3 | C7 | H3 | 150.0° | 150.0° |
| C4 | C3 | C7 | H4 | 30.0° | 30.0° |
| C4 | C3 | C2 | H14 | 179.7° | 180.0° |
| C2 | C3 | C4 | F1 | 179.7° | 179.7° |
| C2 | C3 | C4 | C5 | 0.1° | 0.0° |
| C3 | C2 | C1 | H14 | 180.0° | 180.0° |
| C3 | C2 | C1 | C6 | 0.2° | 0.0° |
| C2 | C3 | C7 | H2 | 90.0° | 90.0° |
| C2 | C3 | C7 | H3 | 30.0° | 30.0° |
| C2 | C3 | C7 | H4 | 149.9° | 150.0° |
| C3 | C2 | C1 | H9 | 179.8° | 180.0° |
| F1 | C4 | C5 | C6 | 179.5° | 179.7° |
| F1 | C4 | C5 | H1 | 0.5° | 0.3° |
| C4 | C5 | C6 | H1 | 180.0° | 180.0° |
| C4 | C5 | C6 | C1 | 0.2° | 0.0° |
| C4 | C5 | C6 | C8 | 179.9° | 180.0° |
| C2 | C1 | C6 | C5 | 0.1° | 0.0° |
| C2 | C1 | C6 | H9 | 180.0° | 180.0° |
| C2 | C1 | C6 | C8 | 180.0° | 180.0° |
| C5 | C6 | C1 | C8 | 179.9° | 180.0° |
| C5 | C6 | C8 | C9 | 122.9° | 121.7° |
| C5 | C6 | C8 | C13 | 59.9° | 58.5° |
| C5 | C6 | C1 | H9 | 179.9° | 180.0° |
| C1 | C6 | C8 | C9 | 57.0° | 58.3° |
| C1 | C6 | C8 | C13 | 120.2° | 121.5° |
| C1 | C6 | C5 | H1 | 179.8° | 180.0° |
| C6 | C1 | C2 | H14 | 179.8° | 180.0° |
| C6 | C8 | C9 | C13 | 177.3° | 179.8° |
| C6 | C8 | C9 | C10 | 178.9° | 180.0° |
| C6 | C8 | C13 | C14 | 1.6° | 0.0° |
| C6 | C8 | C13 | C12 | 178.9° | 180.0° |
| C8 | C6 | C5 | H1 | 0.1° | 0.0° |
| C8 | C6 | C1 | H9 | 0.0° | 0.1° |
| C6 | C8 | C9 | H15 | 1.1° | 0.1° |
| C8 | C9 | C10 | H15 | 180.0° | 180.0° |
| C8 | C9 | C10 | C11 | 0.3° | 0.1° |
| C9 | C8 | C13 | C14 | 178.8° | 179.8° |
| C9 | C8 | C13 | C12 | 1.7° | 0.2° |
| C8 | C9 | C10 | H5 | 179.7° | 179.7° |
| C10 | C9 | C8 | C13 | 1.6° | 0.2° |
| C9 | C10 | C11 | H5 | 180.0° | 179.7° |
| C9 | C10 | C11 | C12 | 0.9° | 0.3° |
| C9 | C10 | C11 | C15 | 180.0° | 179.7° |
| C8 | C13 | C14 | F2 | 79.5° | 66.7° |
| C8 | C13 | C14 | F3 | 42.2° | 53.4° |
| C8 | C13 | C14 | C12 | 179.5° | 180.0° |
| C8 | C13 | C14 | F4 | 161.5° | 173.3° |
| C8 | C13 | C12 | C11 | 0.6° | 0.0° |
| C8 | C13 | C12 | H10 | 179.4° | 179.9° |
| C13 | C8 | C9 | H15 | 178.4° | 179.7° |
| C10 | C11 | C12 | C13 | 0.7° | 0.3° |
| C10 | C11 | C12 | C15 | 179.2° | 180.0° |
| C10 | C11 | C15 | C16 | 86.2° | 60.1° |
| C10 | C11 | C15 | C17 | 44.2° | 60.0° |
| C10 | C11 | C15 | H6 | 159.9° | 180.0° |
| C10 | C11 | C12 | H10 | 179.3° | 179.7° |
| C11 | C10 | C9 | H15 | 179.7° | 180.0° |
| F2 | C14 | F3 | C13 | 124.9° | 120.1° |
| F2 | C14 | F3 | F4 | 111.9° | 120.0° |
| F2 | C14 | C13 | F4 | 119.0° | 120.0° |
| F2 | C14 | C13 | C12 | 100.0° | 113.3° |
| F3 | C14 | C13 | F4 | 119.3° | 120.0° |
| F3 | C14 | C13 | C12 | 138.3° | 126.7° |
| C14 | C13 | C12 | C11 | 179.8° | 180.0° |
| C14 | C13 | C12 | H10 | 0.1° | 0.1° |
| C12 | C13 | C14 | F4 | 19.0° | 6.7° |
| C13 | C12 | C11 | H10 | 180.0° | 180.0° |
| C13 | C12 | C11 | C15 | 179.9° | 179.7° |
| C12 | C11 | C15 | C16 | 94.6° | 120.0° |
| C12 | C11 | C15 | C17 | 134.9° | 120.0° |
| C12 | C11 | C10 | H5 | 179.1° | 180.0° |
| C12 | C11 | C15 | H6 | 19.2° | 0.0° |
| C11 | C15 | C16 | O1 | 54.9° | 120.1° |
| C11 | C15 | C16 | O2 | 126.4° | 60.0° |
| C11 | C15 | C16 | C17 | 129.9° | 120.0° |
| C11 | C15 | C16 | H6 | 113.9° | 119.9° |
| C11 | C15 | C17 | H6 | 115.7° | 120.0° |
| C11 | C15 | C17 | C18 | 71.4° | 175.0° |
| C15 | C11 | C10 | H5 | 0.0° | 0.0° |
| C11 | C15 | C17 | H7 | 48.9° | 55.0° |
| C11 | C15 | C17 | H8 | 168.4° | 65.0° |
| C15 | C11 | C12 | H10 | 0.1° | 0.3° |
| O1 | C16 | O2 | C15 | 178.6° | 179.9° |
| O1 | C16 | C15 | C17 | 175.1° | 0.0° |
| O1 | C16 | C15 | H6 | 59.0° | 120.0° |
| O1 | C16 | O2 | H16 | 0.0° | 0.0° |
| O2 | C16 | C15 | C17 | 3.6° | 180.0° |
| O2 | C16 | C15 | H6 | 119.7° | 59.9° |
| C16 | C15 | C17 | H6 | 116.0° | 120.0° |
| C16 | C15 | C17 | C18 | 160.3° | 65.0° |
| C16 | C15 | C17 | H7 | 79.4° | 175.0° |
| C16 | C15 | C17 | H8 | 40.1° | 55.0° |
| C15 | C16 | O2 | H16 | 178.6° | 180.0° |
| C15 | C17 | C18 | H7 | 120.3° | 120.0° |
| C15 | C17 | C18 | H8 | 120.2° | 120.0° |
| C15 | C17 | H7 | H8 | 119.2° | 120.0° |
| C15 | C17 | C18 | H11 | 180.0° | 180.0° |
| C15 | C17 | C18 | H12 | 60.0° | 60.0° |
| C15 | C17 | C18 | H13 | 60.0° | 60.0° |
| C18 | C17 | C15 | H6 | 44.3° | 55.0° |
| C18 | C17 | H7 | H8 | 119.2° | 120.0° |
| C17 | C18 | H11 | H12 | 120.0° | 120.0° |
| C17 | C18 | H11 | H13 | 120.0° | 120.0° |
| C17 | C18 | H12 | H13 | 120.0° | 120.0° |
| H2 | C7 | H3 | H4 | 120.0° | 120.1° |
| H5 | C10 | C9 | H15 | 0.3° | 0.3° |
| H6 | C15 | C17 | H7 | 164.5° | 65.0° |
| H6 | C15 | C17 | H8 | 76.0° | 175.0° |
| H7 | C17 | C18 | H11 | 59.7° | 60.0° |
| H7 | C17 | C18 | H12 | 179.7° | 180.0° |
| H7 | C17 | C18 | H13 | 60.3° | 60.0° |
| H8 | C17 | C18 | H11 | 59.8° | 60.0° |
| H8 | C17 | C18 | H12 | 60.2° | 60.0° |
| H8 | C17 | C18 | H13 | 179.8° | 180.0° |
| H9 | C1 | C2 | H14 | 0.2° | 0.0° |
| H11 | C18 | H12 | H13 | 120.0° | 119.9° |
