5ON
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O03 | C02 | doub | 1.22Å | 1.26Å | |
| C02 | O01 | sing | 1.35Å | 1.26Å | |
| C02 | C04 | sing | 1.46Å | 1.51Å | |
| C04 | C05 | doub | 1.35Å | 1.34Å | |
| C05 | C06 | sing | 1.47Å | 1.51Å | |
| C06 | C07 | doub | 1.40Å | 1.38Å | Aromatic |
| C06 | C23 | sing | 1.40Å | 1.38Å | Aromatic |
| C07 | C08 | sing | 1.38Å | 1.39Å | Aromatic |
| C10 | C11 | sing | 1.51Å | 1.51Å | |
| C10 | O09 | sing | 1.43Å | 1.43Å | |
| C23 | C22 | doub | 1.38Å | 1.39Å | Aromatic |
| C12 | C11 | doub | 1.38Å | 1.39Å | Aromatic |
| C12 | C13 | sing | 1.38Å | 1.37Å | Aromatic |
| C11 | C20 | sing | 1.38Å | 1.39Å | Aromatic |
| C08 | O09 | sing | 1.36Å | 1.38Å | |
| C08 | C21 | doub | 1.39Å | 1.39Å | Aromatic |
| O19 | C17 | doub | 1.21Å | 1.28Å | |
| C13 | C14 | doub | 1.38Å | 1.38Å | Aromatic |
| C20 | C15 | doub | 1.38Å | 1.39Å | Aromatic |
| C22 | C21 | sing | 1.38Å | 1.38Å | Aromatic |
| C14 | C15 | sing | 1.38Å | 1.38Å | Aromatic |
| C15 | C16 | sing | 1.51Å | 1.53Å | |
| C17 | C16 | sing | 1.51Å | 1.53Å | |
| C17 | O18 | sing | 1.34Å | 1.28Å | |
| O01 | H1 | sing | 0.97Å | 0.95Å | |
| C04 | H2 | sing | 1.08Å | 1.08Å | |
| C05 | H3 | sing | 1.08Å | 1.08Å | |
| C07 | H4 | sing | 1.08Å | 1.08Å | |
| C10 | H5 | sing | 1.09Å | 1.10Å | |
| C10 | H6 | sing | 1.09Å | 1.10Å | |
| C12 | H7 | sing | 1.08Å | 1.08Å | |
| C13 | H8 | sing | 1.08Å | 1.08Å | |
| C14 | H9 | sing | 1.08Å | 1.08Å | |
| C16 | H10 | sing | 1.09Å | 1.10Å | |
| C16 | H11 | sing | 1.09Å | 1.10Å | |
| O18 | H12 | sing | 0.97Å | 0.95Å | |
| C20 | H13 | sing | 1.08Å | 1.08Å | |
| C21 | H14 | sing | 1.08Å | 1.08Å | |
| C22 | H15 | sing | 1.08Å | 1.08Å | |
| C23 | H16 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O03 | C02 | O01 | 120.3° | 120.0° |
| O03 | C02 | C04 | 119.8° | 120.1° |
| O01 | C02 | C04 | 119.9° | 120.0° |
| C02 | O01 | H1 | 109.5° | 114.0° |
| C02 | C04 | C05 | 119.3° | 120.0° |
| C02 | C04 | H2 | 120.4° | 120.0° |
| C04 | C05 | C06 | 118.8° | 120.0° |
| C05 | C04 | H2 | 120.3° | 120.0° |
| C04 | C05 | H3 | 120.6° | 120.0° |
| C05 | C06 | C07 | 119.7° | 120.1° |
| C05 | C06 | C23 | 120.0° | 120.1° |
| C06 | C05 | H3 | 120.6° | 120.0° |
| C07 | C06 | C23 | 120.3° | 119.7° |
| C06 | C07 | C08 | 118.9° | 119.8° |
| C06 | C07 | H4 | 120.6° | 120.1° |
| C06 | C23 | C22 | 120.3° | 119.9° |
| C06 | C23 | H16 | 119.8° | 120.1° |
| C07 | C08 | O09 | 119.9° | 119.9° |
| C07 | C08 | C21 | 121.4° | 120.0° |
| C08 | C07 | H4 | 120.6° | 120.1° |
| C11 | C10 | O09 | 105.9° | 109.5° |
| C10 | C11 | C12 | 120.4° | 120.0° |
| C10 | C11 | C20 | 120.2° | 120.0° |
| C11 | C10 | H5 | 110.4° | 109.4° |
| C11 | C10 | H6 | 110.4° | 109.5° |
| C10 | O09 | C08 | 117.9° | 117.0° |
| O09 | C10 | H5 | 110.4° | 109.5° |
| O09 | C10 | H6 | 110.4° | 109.5° |
| C23 | C22 | C21 | 120.0° | 120.2° |
| C23 | C22 | H15 | 120.0° | 119.8° |
| C22 | C23 | H16 | 119.9° | 120.1° |
| C11 | C12 | C13 | 119.9° | 120.0° |
| C12 | C11 | C20 | 119.4° | 120.0° |
| C11 | C12 | H7 | 120.0° | 120.0° |
| C12 | C13 | C14 | 120.4° | 120.0° |
| C13 | C12 | H7 | 120.0° | 120.0° |
| C12 | C13 | H8 | 119.8° | 120.0° |
| C11 | C20 | C15 | 120.6° | 120.0° |
| C11 | C20 | H13 | 119.7° | 120.0° |
| O09 | C08 | C21 | 118.8° | 120.0° |
| C08 | C21 | C22 | 119.2° | 120.4° |
| C08 | C21 | H14 | 120.4° | 119.8° |
| O19 | C17 | C16 | 120.6° | 120.0° |
| O19 | C17 | O18 | 120.0° | 120.0° |
| C13 | C14 | C15 | 121.0° | 120.0° |
| C14 | C13 | H8 | 119.8° | 120.0° |
| C13 | C14 | H9 | 119.5° | 120.0° |
| C20 | C15 | C14 | 118.6° | 120.0° |
| C20 | C15 | C16 | 119.9° | 120.0° |
| C15 | C20 | H13 | 119.7° | 120.0° |
| C22 | C21 | H14 | 120.4° | 119.8° |
| C21 | C22 | H15 | 120.0° | 119.9° |
| C14 | C15 | C16 | 121.5° | 120.0° |
| C15 | C14 | H9 | 119.5° | 120.0° |
| C15 | C16 | C17 | 111.7° | 109.5° |
| C15 | C16 | H10 | 108.9° | 109.5° |
| C15 | C16 | H11 | 108.9° | 109.5° |
| C16 | C17 | O18 | 119.4° | 120.0° |
| C17 | C16 | H10 | 108.9° | 109.5° |
| C17 | C16 | H11 | 108.9° | 109.5° |
| C17 | O18 | H12 | 109.5° | 117.0° |
| H5 | C10 | H6 | 109.4° | 109.5° |
| H10 | C16 | H11 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O03 | C02 | O01 | C04 | 179.0° | 179.9° |
| O03 | C02 | C04 | C05 | 16.4° | 0.1° |
| O03 | C02 | O01 | H1 | 0.0° | 0.0° |
| O03 | C02 | C04 | H2 | 163.6° | 179.9° |
| O01 | C02 | C04 | C05 | 164.6° | 180.0° |
| O01 | C02 | C04 | H2 | 15.3° | 0.1° |
| C02 | C04 | C05 | H2 | 180.0° | 179.9° |
| C02 | C04 | C05 | C06 | 179.5° | 180.0° |
| C04 | C02 | O01 | H1 | 179.0° | 180.0° |
| C02 | C04 | C05 | H3 | 0.4° | 0.0° |
| C04 | C05 | C06 | H3 | 180.0° | 180.0° |
| C04 | C05 | C06 | C07 | 168.6° | 180.0° |
| C04 | C05 | C06 | C23 | 12.0° | 0.2° |
| C05 | C06 | C07 | C23 | 179.4° | 179.8° |
| C05 | C06 | C07 | C08 | 179.7° | 180.0° |
| C05 | C06 | C23 | C22 | 179.6° | 179.8° |
| C06 | C05 | C04 | H2 | 0.5° | 0.1° |
| C05 | C06 | C07 | H4 | 0.3° | 0.0° |
| C05 | C06 | C23 | H16 | 0.5° | 0.1° |
| C06 | C07 | C08 | H4 | 180.0° | 179.9° |
| C07 | C06 | C23 | C22 | 0.2° | 0.4° |
| C06 | C07 | C08 | O09 | 179.9° | 180.0° |
| C06 | C07 | C08 | C21 | 0.9° | 0.1° |
| C07 | C06 | C05 | H3 | 11.4° | 0.0° |
| C07 | C06 | C23 | H16 | 179.9° | 179.7° |
| C23 | C06 | C07 | C08 | 0.9° | 0.2° |
| C06 | C23 | C22 | H16 | 180.0° | 179.8° |
| C06 | C23 | C22 | C21 | 0.5° | 0.5° |
| C23 | C06 | C05 | H3 | 168.0° | 179.7° |
| C23 | C06 | C07 | H4 | 179.1° | 179.8° |
| C06 | C23 | C22 | H15 | 179.5° | 179.7° |
| C07 | C08 | O09 | C10 | 5.3° | 180.0° |
| C07 | C08 | O09 | C21 | 179.2° | 179.9° |
| C07 | C08 | C21 | C22 | 0.3° | 0.1° |
| C07 | C08 | C21 | H14 | 179.7° | 179.9° |
| C11 | C10 | O09 | H5 | 119.4° | 120.0° |
| C11 | C10 | O09 | H6 | 119.4° | 120.0° |
| C10 | C11 | C12 | C20 | 179.6° | 179.7° |
| C10 | C11 | C12 | C13 | 178.2° | 180.0° |
| C11 | C10 | O09 | C08 | 174.7° | 180.0° |
| C10 | C11 | C20 | C15 | 178.5° | 179.8° |
| C11 | C10 | H5 | H6 | 121.6° | 120.0° |
| C10 | C11 | C12 | H7 | 1.8° | 0.1° |
| C10 | C11 | C20 | H13 | 1.5° | 0.0° |
| O09 | C10 | C11 | C12 | 73.8° | 89.7° |
| O09 | C10 | C11 | C20 | 106.6° | 90.0° |
| C10 | O09 | C08 | C21 | 175.5° | 0.0° |
| O09 | C10 | H5 | H6 | 121.7° | 120.0° |
| C23 | C22 | C21 | C08 | 0.4° | 0.3° |
| C23 | C22 | C21 | H15 | 180.0° | 179.8° |
| C23 | C22 | C21 | H14 | 179.6° | 179.7° |
| C11 | C12 | C13 | H7 | 180.0° | 179.9° |
| C11 | C12 | C13 | C14 | 1.8° | 0.1° |
| C12 | C11 | C20 | C15 | 1.9° | 0.5° |
| C12 | C11 | C10 | H5 | 166.8° | 150.3° |
| C12 | C11 | C10 | H6 | 45.7° | 30.3° |
| C11 | C12 | C13 | H8 | 178.2° | 180.0° |
| C12 | C11 | C20 | H13 | 178.1° | 179.7° |
| C13 | C12 | C11 | C20 | 2.2° | 0.4° |
| C12 | C13 | C14 | H8 | 180.0° | 179.9° |
| C12 | C13 | C14 | C15 | 1.0° | 0.0° |
| C12 | C13 | C14 | H9 | 179.0° | 180.0° |
| C11 | C20 | C15 | H13 | 180.0° | 179.8° |
| C11 | C20 | C15 | C14 | 1.1° | 0.5° |
| C11 | C20 | C15 | C16 | 179.5° | 179.7° |
| C20 | C11 | C10 | H5 | 12.8° | 30.0° |
| C20 | C11 | C10 | H6 | 133.9° | 150.0° |
| C20 | C11 | C12 | H7 | 177.8° | 179.8° |
| O09 | C08 | C21 | C22 | 179.4° | 180.0° |
| O09 | C08 | C07 | H4 | 0.1° | 0.1° |
| C08 | O09 | C10 | H5 | 55.2° | 60.0° |
| C08 | O09 | C10 | H6 | 65.9° | 60.0° |
| O09 | C08 | C21 | H14 | 0.6° | 0.0° |
| C08 | C21 | C22 | H14 | 180.0° | 180.0° |
| C21 | C08 | C07 | H4 | 179.1° | 180.0° |
| C08 | C21 | C22 | H15 | 179.6° | 179.9° |
| O19 | C17 | C16 | C15 | 89.0° | 0.0° |
| O19 | C17 | C16 | O18 | 177.0° | 180.0° |
| O19 | C17 | C16 | H10 | 31.3° | 120.0° |
| O19 | C17 | C16 | H11 | 150.6° | 120.0° |
| O19 | C17 | O18 | H12 | 0.0° | 0.0° |
| C13 | C14 | C15 | C20 | 0.7° | 0.2° |
| C13 | C14 | C15 | H9 | 180.0° | 180.0° |
| C13 | C14 | C15 | C16 | 179.9° | 180.0° |
| C14 | C13 | C12 | H7 | 178.2° | 180.0° |
| C20 | C15 | C14 | C16 | 179.4° | 179.8° |
| C20 | C15 | C16 | C17 | 129.5° | 89.8° |
| C20 | C15 | C14 | H9 | 179.3° | 179.8° |
| C20 | C15 | C16 | H10 | 9.2° | 30.2° |
| C20 | C15 | C16 | H11 | 110.1° | 150.2° |
| C21 | C22 | C23 | H16 | 179.5° | 179.7° |
| C14 | C15 | C16 | C17 | 49.9° | 90.0° |
| C15 | C14 | C13 | H8 | 179.0° | 179.9° |
| C14 | C15 | C16 | H10 | 170.2° | 150.0° |
| C14 | C15 | C16 | H11 | 70.4° | 30.0° |
| C14 | C15 | C20 | H13 | 178.9° | 179.8° |
| C15 | C16 | C17 | H10 | 120.3° | 120.0° |
| C15 | C16 | C17 | H11 | 120.3° | 120.0° |
| C15 | C16 | C17 | O18 | 93.9° | 180.0° |
| C16 | C15 | C14 | H9 | 0.1° | 0.0° |
| C15 | C16 | H10 | H11 | 119.0° | 120.0° |
| C16 | C15 | C20 | H13 | 0.5° | 0.0° |
| C17 | C16 | H10 | H11 | 119.0° | 120.0° |
| C16 | C17 | O18 | H12 | 177.1° | 180.0° |
| O18 | C17 | C16 | H10 | 145.7° | 60.0° |
| O18 | C17 | C16 | H11 | 26.4° | 60.0° |
| H2 | C04 | C05 | H3 | 179.5° | 179.9° |
| H7 | C12 | C13 | H8 | 1.8° | 0.1° |
| H8 | C13 | C14 | H9 | 1.0° | 0.1° |
| H14 | C21 | C22 | H15 | 0.4° | 0.0° |
| H15 | C22 | C23 | H16 | 0.5° | 0.1° |
