OM8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C11 | C10 | doub | 1.38Å | 1.38Å | Aromatic |
| C11 | C12 | sing | 1.38Å | 1.38Å | Aromatic |
| C10 | C9 | sing | 1.38Å | 1.38Å | Aromatic |
| C12 | C7 | doub | 1.38Å | 1.39Å | Aromatic |
| C9 | CL | sing | 1.74Å | 1.78Å | |
| C9 | C8 | doub | 1.38Å | 1.38Å | Aromatic |
| C7 | C8 | sing | 1.38Å | 1.37Å | Aromatic |
| C7 | C6 | sing | 1.51Å | 1.52Å | |
| C6 | O1 | sing | 1.43Å | 1.39Å | |
| O1 | C5 | sing | 1.36Å | 1.40Å | |
| C4 | C5 | doub | 1.39Å | 1.39Å | Aromatic |
| C4 | C3 | sing | 1.38Å | 1.39Å | Aromatic |
| C5 | C13 | sing | 1.39Å | 1.38Å | Aromatic |
| C3 | C2 | doub | 1.38Å | 1.38Å | Aromatic |
| N | C | sing | 1.35Å | 1.46Å | |
| C13 | F1 | sing | 1.35Å | 1.36Å | |
| C13 | C1 | doub | 1.40Å | 1.38Å | Aromatic |
| C2 | C1 | sing | 1.40Å | 1.38Å | Aromatic |
| C2 | F | sing | 1.35Å | 1.36Å | |
| C1 | C | sing | 1.48Å | 1.52Å | |
| C | O | doub | 1.22Å | 1.19Å | |
| N | HN2 | sing | 0.97Å | 1.00Å | |
| N | HN3 | sing | 0.97Å | 1.00Å | |
| C10 | H101 | sing | 1.08Å | 1.08Å | |
| C11 | H111 | sing | 1.08Å | 1.08Å | |
| C12 | H121 | sing | 1.08Å | 1.08Å | |
| C3 | H31 | sing | 1.08Å | 1.08Å | |
| C4 | H41 | sing | 1.08Å | 1.08Å | |
| C6 | H61 | sing | 1.09Å | 1.10Å | |
| C6 | H62 | sing | 1.09Å | 1.10Å | |
| C8 | H81 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C10 | C11 | C12 | 119.5° | 120.0° |
| C11 | C10 | C9 | 120.6° | 120.0° |
| C11 | C10 | H101 | 119.7° | 120.0° |
| C10 | C11 | H111 | 120.2° | 120.0° |
| C11 | C12 | C7 | 119.5° | 120.1° |
| C12 | C11 | H111 | 120.2° | 120.0° |
| C11 | C12 | H121 | 120.2° | 119.9° |
| C10 | C9 | CL | 120.9° | 120.0° |
| C10 | C9 | C8 | 119.8° | 120.0° |
| C9 | C10 | H101 | 119.7° | 120.0° |
| C12 | C7 | C8 | 120.8° | 120.0° |
| C12 | C7 | C6 | 121.0° | 120.0° |
| C7 | C12 | H121 | 120.2° | 120.0° |
| CL | C9 | C8 | 119.2° | 120.0° |
| C9 | C8 | C7 | 119.7° | 120.0° |
| C9 | C8 | H81 | 120.1° | 120.0° |
| C8 | C7 | C6 | 118.3° | 120.0° |
| C7 | C8 | H81 | 120.1° | 120.0° |
| C7 | C6 | O1 | 107.0° | 109.5° |
| C7 | C6 | H61 | 110.1° | 109.4° |
| C7 | C6 | H62 | 110.1° | 109.5° |
| C6 | O1 | C5 | 116.0° | 117.0° |
| O1 | C6 | H61 | 110.1° | 109.4° |
| O1 | C6 | H62 | 110.1° | 109.5° |
| O1 | C5 | C4 | 122.3° | 119.9° |
| O1 | C5 | C13 | 117.6° | 120.0° |
| C5 | C4 | C3 | 119.8° | 120.3° |
| C4 | C5 | C13 | 120.1° | 120.1° |
| C5 | C4 | H41 | 120.1° | 119.9° |
| C4 | C3 | C2 | 119.7° | 120.2° |
| C4 | C3 | H31 | 120.2° | 119.9° |
| C3 | C4 | H41 | 120.1° | 119.8° |
| C5 | C13 | F1 | 119.3° | 120.1° |
| C5 | C13 | C1 | 119.9° | 119.8° |
| C3 | C2 | C1 | 120.4° | 119.9° |
| C3 | C2 | F | 120.8° | 120.0° |
| C2 | C3 | H31 | 120.1° | 119.9° |
| N | C | C1 | 118.2° | 120.0° |
| N | C | O | 121.6° | 120.0° |
| C | N | HN2 | 120.0° | 120.0° |
| C | N | HN3 | 120.0° | 120.0° |
| F1 | C13 | C1 | 120.8° | 120.1° |
| C13 | C1 | C2 | 120.1° | 119.7° |
| C13 | C1 | C | 120.5° | 120.2° |
| C1 | C2 | F | 118.8° | 120.1° |
| C2 | C1 | C | 119.4° | 120.1° |
| C1 | C | O | 120.3° | 120.0° |
| HN2 | N | HN3 | 120.1° | 120.0° |
| H61 | C6 | H62 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C10 | C11 | C12 | H111 | 180.0° | 180.0° |
| C11 | C10 | C9 | H101 | 180.0° | 179.7° |
| C10 | C11 | C12 | C7 | 0.2° | 0.0° |
| C11 | C10 | C9 | CL | 179.9° | 179.7° |
| C11 | C10 | C9 | C8 | 0.5° | 0.1° |
| C10 | C11 | C12 | H121 | 179.8° | 180.0° |
| C12 | C11 | C10 | C9 | 0.5° | 0.0° |
| C11 | C12 | C7 | H121 | 180.0° | 180.0° |
| C11 | C12 | C7 | C8 | 0.1° | 0.0° |
| C11 | C12 | C7 | C6 | 179.7° | 180.0° |
| C12 | C11 | C10 | H101 | 179.5° | 179.7° |
| C10 | C9 | CL | C8 | 179.6° | 179.8° |
| C10 | C9 | C8 | C7 | 0.1° | 0.1° |
| C9 | C10 | C11 | H111 | 179.5° | 180.0° |
| C10 | C9 | C8 | H81 | 179.9° | 179.9° |
| C12 | C7 | C8 | C9 | 0.2° | 0.0° |
| C12 | C7 | C8 | C6 | 179.9° | 180.0° |
| C12 | C7 | C6 | O1 | 11.6° | 90.0° |
| C7 | C12 | C11 | H111 | 179.8° | 180.0° |
| C12 | C7 | C6 | H61 | 131.2° | 150.0° |
| C12 | C7 | C6 | H62 | 108.0° | 30.1° |
| C12 | C7 | C8 | H81 | 179.8° | 179.9° |
| CL | C9 | C8 | C7 | 179.8° | 179.7° |
| CL | C9 | C10 | H101 | 0.1° | 0.0° |
| CL | C9 | C8 | H81 | 0.2° | 0.2° |
| C9 | C8 | C7 | H81 | 180.0° | 179.9° |
| C9 | C8 | C7 | C6 | 179.7° | 179.9° |
| C8 | C9 | C10 | H101 | 179.5° | 179.7° |
| C8 | C7 | C6 | O1 | 168.5° | 90.0° |
| C8 | C7 | C12 | H121 | 179.8° | 180.0° |
| C8 | C7 | C6 | H61 | 48.9° | 30.0° |
| C8 | C7 | C6 | H62 | 71.9° | 150.0° |
| C7 | C6 | O1 | H61 | 119.6° | 120.0° |
| C7 | C6 | O1 | H62 | 119.6° | 120.0° |
| C7 | C6 | O1 | C5 | 175.8° | 180.0° |
| C6 | C7 | C12 | H121 | 0.3° | 0.1° |
| C7 | C6 | H61 | H62 | 121.1° | 120.0° |
| C6 | C7 | C8 | H81 | 0.3° | 0.1° |
| C6 | O1 | C5 | C4 | 11.6° | 0.1° |
| C6 | O1 | C5 | C13 | 169.3° | 179.7° |
| O1 | C6 | H61 | H62 | 121.1° | 120.0° |
| O1 | C5 | C4 | C13 | 179.1° | 179.6° |
| O1 | C5 | C4 | C3 | 179.5° | 179.9° |
| O1 | C5 | C13 | F1 | 0.9° | 0.3° |
| O1 | C5 | C13 | C1 | 180.0° | 179.7° |
| O1 | C5 | C4 | H41 | 0.5° | 0.3° |
| C5 | O1 | C6 | H61 | 56.2° | 60.1° |
| C5 | O1 | C6 | H62 | 64.6° | 59.9° |
| C5 | C4 | C3 | H41 | 180.0° | 179.7° |
| C5 | C4 | C3 | C2 | 0.4° | 0.2° |
| C4 | C5 | C13 | F1 | 180.0° | 180.0° |
| C4 | C5 | C13 | C1 | 0.9° | 0.0° |
| C5 | C4 | C3 | H31 | 179.6° | 179.7° |
| C3 | C4 | C5 | C13 | 0.5° | 0.3° |
| C4 | C3 | C2 | H31 | 180.0° | 179.9° |
| C4 | C3 | C2 | C1 | 0.9° | 0.1° |
| C4 | C3 | C2 | F | 179.9° | 180.0° |
| C5 | C13 | F1 | C1 | 179.1° | 180.0° |
| C5 | C13 | C1 | C2 | 0.4° | 0.3° |
| C5 | C13 | C1 | C | 179.8° | 180.0° |
| C13 | C5 | C4 | H41 | 179.6° | 180.0° |
| C3 | C2 | C1 | C13 | 0.5° | 0.4° |
| C3 | C2 | C1 | F | 179.2° | 179.9° |
| C3 | C2 | C1 | C | 178.9° | 180.0° |
| C2 | C3 | C4 | H41 | 179.6° | 180.0° |
| N | C | C1 | C13 | 58.1° | 89.9° |
| N | C | C1 | C2 | 121.3° | 89.7° |
| N | C | C1 | O | 179.1° | 179.9° |
| C | N | HN2 | HN3 | 180.0° | 179.7° |
| F1 | C13 | C1 | C2 | 179.5° | 179.7° |
| F1 | C13 | C1 | C | 1.1° | 0.0° |
| C13 | C1 | C2 | C | 179.4° | 179.7° |
| C13 | C1 | C2 | F | 179.7° | 179.7° |
| C13 | C1 | C | O | 122.8° | 90.0° |
| C2 | C1 | C | O | 57.8° | 90.4° |
| C1 | C2 | C3 | H31 | 179.2° | 180.0° |
| F | C2 | C1 | C | 0.3° | 0.0° |
| F | C2 | C3 | H31 | 0.1° | 0.0° |
| C1 | C | N | HN2 | 179.1° | 180.0° |
| C1 | C | N | HN3 | 0.9° | 0.3° |
| O | C | N | HN2 | 0.0° | 0.1° |
| O | C | N | HN3 | 180.0° | 179.8° |
| H101 | C10 | C11 | H111 | 0.5° | 0.3° |
| H111 | C11 | C12 | H121 | 0.2° | 0.0° |
| H31 | C3 | C4 | H41 | 0.4° | 0.1° |
