WOV
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C5 | C4 | sing | 1.51Å | 1.49Å | |
| O2 | C12 | doub | 1.21Å | 1.20Å | |
| C3 | C4 | doub | 1.35Å | 1.37Å | Aromatic |
| C3 | C2 | sing | 1.41Å | 1.41Å | Aromatic |
| C4 | N | sing | 1.37Å | 1.40Å | Aromatic |
| C12 | O1 | sing | 1.35Å | 1.30Å | |
| C12 | C7 | sing | 1.47Å | 1.49Å | |
| C2 | C1 | doub | 1.35Å | 1.37Å | Aromatic |
| N | C6 | sing | 1.40Å | 1.44Å | |
| N | C1 | sing | 1.37Å | 1.40Å | Aromatic |
| C7 | C6 | doub | 1.40Å | 1.41Å | Aromatic |
| C7 | C8 | sing | 1.40Å | 1.39Å | Aromatic |
| C6 | C11 | sing | 1.39Å | 1.39Å | Aromatic |
| C1 | C | sing | 1.51Å | 1.49Å | |
| C8 | C9 | doub | 1.38Å | 1.39Å | Aromatic |
| C11 | C10 | doub | 1.38Å | 1.38Å | Aromatic |
| C9 | C10 | sing | 1.39Å | 1.39Å | Aromatic |
| C9 | O | sing | 1.36Å | 1.36Å | |
| C2 | H1 | sing | 1.08Å | 1.08Å | |
| C3 | H2 | sing | 1.08Å | 1.08Å | |
| C5 | H3 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| O1 | H6 | sing | 0.97Å | 0.95Å | |
| C8 | H7 | sing | 1.08Å | 1.08Å | |
| C10 | H8 | sing | 1.08Å | 1.08Å | |
| C11 | H9 | sing | 1.08Å | 1.08Å | |
| O | H10 | sing | 0.97Å | 0.95Å | |
| C | H11 | sing | 1.09Å | 1.10Å | |
| C | H12 | sing | 1.09Å | 1.10Å | |
| C | H13 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C5 | C4 | C3 | 130.7° | 125.9° |
| C5 | C4 | N | 122.4° | 125.9° |
| C4 | C5 | H3 | 109.5° | 109.4° |
| C4 | C5 | H4 | 109.5° | 109.5° |
| C4 | C5 | H5 | 109.5° | 109.4° |
| O2 | C12 | O1 | 122.0° | 120.0° |
| O2 | C12 | C7 | 121.3° | 120.0° |
| C4 | C3 | C2 | 108.5° | 107.5° |
| C3 | C4 | N | 106.9° | 108.2° |
| C4 | C3 | H2 | 125.7° | 126.2° |
| C3 | C2 | C1 | 108.5° | 107.5° |
| C3 | C2 | H1 | 125.8° | 126.2° |
| C2 | C3 | H2 | 125.8° | 126.3° |
| C4 | N | C6 | 126.2° | 125.7° |
| C4 | N | C1 | 109.3° | 108.6° |
| O1 | C12 | C7 | 116.7° | 120.0° |
| C12 | O1 | H6 | 109.5° | 117.0° |
| C12 | C7 | C6 | 123.1° | 120.2° |
| C12 | C7 | C8 | 117.9° | 120.2° |
| C2 | C1 | N | 106.9° | 108.2° |
| C2 | C1 | C | 130.8° | 125.9° |
| C1 | C2 | H1 | 125.8° | 126.3° |
| C6 | N | C1 | 124.6° | 125.7° |
| N | C6 | C7 | 121.1° | 120.1° |
| N | C6 | C11 | 118.7° | 120.1° |
| N | C1 | C | 122.3° | 125.9° |
| C6 | C7 | C8 | 118.9° | 119.6° |
| C7 | C6 | C11 | 120.2° | 119.8° |
| C7 | C8 | C9 | 120.4° | 119.8° |
| C7 | C8 | H7 | 119.8° | 120.1° |
| C6 | C11 | C10 | 120.1° | 120.1° |
| C6 | C11 | H9 | 120.0° | 119.9° |
| C1 | C | H11 | 109.5° | 109.5° |
| C1 | C | H12 | 109.5° | 109.5° |
| C1 | C | H13 | 109.5° | 109.5° |
| C8 | C9 | C10 | 120.3° | 120.2° |
| C8 | C9 | O | 118.8° | 119.9° |
| C9 | C8 | H7 | 119.8° | 120.1° |
| C11 | C10 | C9 | 120.1° | 120.4° |
| C11 | C10 | H8 | 119.9° | 119.8° |
| C10 | C11 | H9 | 119.9° | 119.9° |
| C10 | C9 | O | 120.9° | 119.9° |
| C9 | C10 | H8 | 120.0° | 119.8° |
| C9 | O | H10 | 109.5° | 114.0° |
| H3 | C5 | H4 | 109.5° | 109.5° |
| H3 | C5 | H5 | 109.5° | 109.5° |
| H4 | C5 | H5 | 109.5° | 109.5° |
| H11 | C | H12 | 109.5° | 109.5° |
| H11 | C | H13 | 109.5° | 109.5° |
| H12 | C | H13 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C5 | C4 | C3 | N | 179.0° | 179.8° |
| C5 | C4 | C3 | C2 | 178.5° | 180.0° |
| C5 | C4 | N | C6 | 2.7° | 0.2° |
| C5 | C4 | N | C1 | 178.7° | 179.9° |
| C5 | C4 | C3 | H2 | 1.5° | 0.2° |
| C4 | C5 | H3 | H4 | 120.0° | 120.0° |
| C4 | C5 | H3 | H5 | 120.0° | 119.9° |
| C4 | C5 | H4 | H5 | 120.0° | 120.0° |
| O2 | C12 | O1 | C7 | 177.2° | 180.0° |
| O2 | C12 | C7 | C6 | 32.3° | 0.0° |
| O2 | C12 | C7 | C8 | 149.2° | 179.9° |
| O2 | C12 | O1 | H6 | 0.0° | 0.1° |
| C4 | C3 | C2 | H2 | 180.0° | 179.8° |
| C4 | C3 | C2 | C1 | 0.5° | 0.0° |
| C3 | C4 | N | C6 | 178.2° | 180.0° |
| C3 | C4 | N | C1 | 0.4° | 0.3° |
| C4 | C3 | C2 | H1 | 179.5° | 180.0° |
| C3 | C4 | C5 | H3 | 90.6° | 90.0° |
| C3 | C4 | C5 | H4 | 149.4° | 150.0° |
| C3 | C4 | C5 | H5 | 29.4° | 30.0° |
| C2 | C3 | C4 | N | 0.5° | 0.2° |
| C3 | C2 | C1 | H1 | 180.0° | 180.0° |
| C3 | C2 | C1 | N | 0.2° | 0.2° |
| C3 | C2 | C1 | C | 179.7° | 180.0° |
| C4 | N | C1 | C2 | 0.1° | 0.4° |
| C4 | N | C6 | C1 | 178.4° | 179.6° |
| C4 | N | C6 | C7 | 91.8° | 89.8° |
| C4 | N | C6 | C11 | 90.1° | 90.0° |
| C4 | N | C1 | C | 179.9° | 179.9° |
| N | C4 | C3 | H2 | 179.5° | 180.0° |
| N | C4 | C5 | H3 | 90.5° | 89.8° |
| N | C4 | C5 | H4 | 29.5° | 30.3° |
| N | C4 | C5 | H5 | 149.5° | 150.2° |
| O1 | C12 | C7 | C6 | 145.0° | 180.0° |
| O1 | C12 | C7 | C8 | 33.6° | 0.0° |
| C12 | C7 | C6 | N | 0.5° | 0.3° |
| C12 | C7 | C6 | C8 | 178.5° | 179.9° |
| C12 | C7 | C6 | C11 | 178.5° | 180.0° |
| C12 | C7 | C8 | C9 | 177.6° | 180.0° |
| C7 | C12 | O1 | H6 | 177.3° | 180.0° |
| C12 | C7 | C8 | H7 | 2.5° | 0.1° |
| C2 | C1 | N | C6 | 178.5° | 179.9° |
| C2 | C1 | N | C | 179.9° | 179.7° |
| C1 | C2 | C3 | H2 | 179.5° | 179.8° |
| C2 | C1 | C | H11 | 90.1° | 90.1° |
| C2 | C1 | C | H12 | 150.0° | 150.0° |
| C2 | C1 | C | H13 | 30.0° | 30.0° |
| N | C6 | C7 | C11 | 178.0° | 179.7° |
| N | C6 | C7 | C8 | 178.1° | 179.8° |
| C6 | N | C1 | C | 1.4° | 0.2° |
| N | C6 | C11 | C10 | 177.3° | 179.8° |
| N | C6 | C11 | H9 | 2.7° | 0.3° |
| C1 | N | C6 | C7 | 86.6° | 89.9° |
| C1 | N | C6 | C11 | 91.5° | 90.4° |
| N | C1 | C2 | H1 | 179.8° | 179.8° |
| N | C1 | C | H11 | 90.0° | 90.3° |
| N | C1 | C | H12 | 30.0° | 29.7° |
| N | C1 | C | H13 | 149.9° | 149.7° |
| C6 | C7 | C8 | C9 | 1.0° | 0.0° |
| C7 | C6 | C11 | C10 | 0.8° | 0.0° |
| C6 | C7 | C8 | H7 | 178.9° | 180.0° |
| C7 | C6 | C11 | H9 | 179.2° | 180.0° |
| C8 | C7 | C6 | C11 | 0.0° | 0.0° |
| C7 | C8 | C9 | H7 | 180.0° | 180.0° |
| C7 | C8 | C9 | C10 | 1.2° | 0.0° |
| C7 | C8 | C9 | O | 178.1° | 180.0° |
| C6 | C11 | C10 | H9 | 180.0° | 180.0° |
| C6 | C11 | C10 | C9 | 0.6° | 0.1° |
| C6 | C11 | C10 | H8 | 179.4° | 179.9° |
| C | C1 | C2 | H1 | 0.3° | 0.1° |
| C1 | C | H11 | H12 | 120.0° | 120.0° |
| C1 | C | H11 | H13 | 120.0° | 120.0° |
| C1 | C | H12 | H13 | 120.0° | 120.0° |
| C8 | C9 | C10 | C11 | 0.4° | 0.1° |
| C8 | C9 | C10 | O | 179.3° | 180.0° |
| C8 | C9 | C10 | H8 | 179.6° | 179.9° |
| C8 | C9 | O | H10 | 180.0° | 90.0° |
| C11 | C10 | C9 | H8 | 180.0° | 180.0° |
| C11 | C10 | C9 | O | 178.9° | 180.0° |
| C10 | C9 | C8 | H7 | 178.8° | 180.0° |
| C9 | C10 | C11 | H9 | 179.4° | 180.0° |
| C10 | C9 | O | H10 | 0.7° | 90.0° |
| O | C9 | C8 | H7 | 1.9° | 0.0° |
| O | C9 | C10 | H8 | 1.1° | 0.1° |
| H1 | C2 | C3 | H2 | 0.5° | 0.2° |
| H3 | C5 | H4 | H5 | 120.0° | 120.0° |
| H8 | C10 | C11 | H9 | 0.6° | 0.0° |
| H11 | C | H12 | H13 | 120.0° | 120.0° |
