VU7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C26 | C25 | doub | 1.38Å | 1.38Å | Aromatic |
| C26 | C27 | sing | 1.38Å | 1.38Å | Aromatic |
| C25 | C24 | sing | 1.39Å | 1.40Å | Aromatic |
| C12 | C13 | doub | 1.36Å | 1.36Å | Aromatic |
| C12 | C11 | sing | 1.41Å | 1.42Å | Aromatic |
| C27 | C28 | doub | 1.38Å | 1.38Å | Aromatic |
| C13 | C14 | sing | 1.40Å | 1.40Å | Aromatic |
| C20 | C19 | doub | 1.38Å | 1.38Å | Aromatic |
| C20 | C21 | sing | 1.39Å | 1.41Å | Aromatic |
| C19 | C18 | sing | 1.40Å | 1.42Å | Aromatic |
| C24 | C21 | sing | 1.48Å | 1.47Å | |
| C24 | C29 | doub | 1.40Å | 1.40Å | Aromatic |
| N10 | C11 | sing | 1.33Å | 1.33Å | Aromatic |
| N10 | C9 | doub | 1.32Å | 1.34Å | Aromatic |
| C11 | C17 | doub | 1.42Å | 1.44Å | Aromatic |
| C14 | F15 | sing | 1.35Å | 1.34Å | |
| C14 | C16 | doub | 1.37Å | 1.36Å | Aromatic |
| C21 | C22 | doub | 1.39Å | 1.40Å | Aromatic |
| C28 | C29 | sing | 1.38Å | 1.39Å | Aromatic |
| C29 | F30 | sing | 1.35Å | 1.35Å | |
| C18 | C9 | sing | 1.48Å | 1.47Å | |
| C18 | C23 | doub | 1.40Å | 1.41Å | Aromatic |
| C9 | C7 | sing | 1.40Å | 1.43Å | Aromatic |
| C22 | C23 | sing | 1.38Å | 1.38Å | Aromatic |
| C16 | C17 | sing | 1.40Å | 1.41Å | Aromatic |
| C17 | C6 | sing | 1.46Å | 1.48Å | Aromatic |
| C7 | C6 | doub | 1.39Å | 1.40Å | Aromatic |
| C7 | C8 | sing | 1.51Å | 1.52Å | |
| C6 | C4 | sing | 1.48Å | 1.48Å | |
| C4 | N3 | sing | 1.35Å | 1.35Å | |
| C4 | O5 | doub | 1.22Å | 1.20Å | |
| N3 | O2 | sing | 1.42Å | 1.41Å | |
| C1 | O2 | sing | 1.43Å | 1.43Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C8 | H4 | sing | 1.09Å | 1.10Å | |
| C8 | H5 | sing | 1.09Å | 1.10Å | |
| C8 | H6 | sing | 1.09Å | 1.10Å | |
| C12 | H7 | sing | 1.08Å | 1.08Å | |
| C16 | H8 | sing | 1.08Å | 1.08Å | |
| C19 | H9 | sing | 1.08Å | 1.08Å | |
| C23 | H10 | sing | 1.08Å | 1.08Å | |
| C27 | H11 | sing | 1.08Å | 1.08Å | |
| N3 | H12 | sing | 0.97Å | 1.00Å | |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C20 | H14 | sing | 1.08Å | 1.08Å | |
| C22 | H15 | sing | 1.08Å | 1.08Å | |
| C25 | H16 | sing | 1.08Å | 1.08Å | |
| C26 | H17 | sing | 1.08Å | 1.08Å | |
| C28 | H18 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C25 | C26 | C27 | 120.4° | 120.2° |
| C26 | C25 | C24 | 121.2° | 119.9° |
| C26 | C25 | H16 | 119.4° | 120.0° |
| C25 | C26 | H17 | 119.8° | 119.9° |
| C26 | C27 | C28 | 119.0° | 120.2° |
| C26 | C27 | H11 | 120.5° | 119.9° |
| C27 | C26 | H17 | 119.8° | 119.9° |
| C25 | C24 | C21 | 117.2° | 120.2° |
| C25 | C24 | C29 | 118.0° | 119.7° |
| C24 | C25 | H16 | 119.4° | 120.1° |
| C13 | C12 | C11 | 119.5° | 119.7° |
| C12 | C13 | C14 | 120.6° | 121.0° |
| C13 | C12 | H7 | 120.3° | 120.2° |
| C12 | C13 | H13 | 119.7° | 119.4° |
| C12 | C11 | N10 | 121.1° | 121.0° |
| C12 | C11 | C17 | 120.0° | 119.0° |
| C11 | C12 | H7 | 120.3° | 120.1° |
| C27 | C28 | C29 | 121.2° | 120.1° |
| C28 | C27 | H11 | 120.5° | 119.9° |
| C27 | C28 | H18 | 119.4° | 119.9° |
| C13 | C14 | F15 | 119.6° | 119.6° |
| C13 | C14 | C16 | 121.8° | 120.8° |
| C14 | C13 | H13 | 119.7° | 119.5° |
| C19 | C20 | C21 | 118.9° | 120.0° |
| C20 | C19 | C18 | 120.7° | 120.0° |
| C20 | C19 | H9 | 119.7° | 120.0° |
| C19 | C20 | H14 | 120.5° | 120.0° |
| C20 | C21 | C24 | 122.6° | 120.0° |
| C20 | C21 | C22 | 120.3° | 120.0° |
| C21 | C20 | H14 | 120.5° | 120.0° |
| C19 | C18 | C9 | 117.7° | 120.0° |
| C19 | C18 | C23 | 120.1° | 120.0° |
| C18 | C19 | H9 | 119.6° | 119.9° |
| C21 | C24 | C29 | 124.8° | 120.1° |
| C24 | C21 | C22 | 116.9° | 120.0° |
| C24 | C29 | C28 | 120.2° | 119.8° |
| C24 | C29 | F30 | 120.7° | 120.1° |
| C11 | N10 | C9 | 123.9° | 122.3° |
| N10 | C11 | C17 | 119.0° | 120.0° |
| N10 | C9 | C18 | 112.4° | 118.8° |
| N10 | C9 | C7 | 122.9° | 122.3° |
| C11 | C17 | C16 | 117.9° | 119.9° |
| C11 | C17 | C6 | 118.2° | 118.7° |
| F15 | C14 | C16 | 118.5° | 119.6° |
| C14 | C16 | C17 | 120.2° | 119.6° |
| C14 | C16 | H8 | 119.9° | 120.2° |
| C21 | C22 | C23 | 121.0° | 120.0° |
| C21 | C22 | H15 | 119.5° | 120.0° |
| C28 | C29 | F30 | 119.1° | 120.1° |
| C29 | C28 | H18 | 119.4° | 119.9° |
| C9 | C18 | C23 | 122.2° | 120.0° |
| C18 | C9 | C7 | 124.7° | 118.9° |
| C18 | C23 | C22 | 119.0° | 120.0° |
| C18 | C23 | H10 | 120.5° | 120.0° |
| C9 | C7 | C6 | 116.6° | 119.4° |
| C9 | C7 | C8 | 123.6° | 120.3° |
| C22 | C23 | H10 | 120.5° | 120.0° |
| C23 | C22 | H15 | 119.5° | 120.0° |
| C16 | C17 | C6 | 123.9° | 121.5° |
| C17 | C16 | H8 | 119.9° | 120.2° |
| C17 | C6 | C7 | 119.5° | 117.3° |
| C17 | C6 | C4 | 119.2° | 121.3° |
| C6 | C7 | C8 | 119.8° | 120.3° |
| C7 | C6 | C4 | 121.2° | 121.3° |
| C7 | C8 | H4 | 109.5° | 109.5° |
| C7 | C8 | H5 | 109.5° | 109.4° |
| C7 | C8 | H6 | 109.5° | 109.5° |
| C6 | C4 | N3 | 116.6° | 120.0° |
| C6 | C4 | O5 | 122.3° | 120.0° |
| N3 | C4 | O5 | 121.0° | 120.0° |
| C4 | N3 | O2 | 122.4° | 120.0° |
| C4 | N3 | H12 | 118.8° | 120.0° |
| N3 | O2 | C1 | 112.0° | 114.0° |
| O2 | N3 | H12 | 118.8° | 120.0° |
| O2 | C1 | H1 | 109.5° | 109.5° |
| O2 | C1 | H2 | 109.4° | 109.4° |
| O2 | C1 | H3 | 109.5° | 109.5° |
| H1 | C1 | H2 | 109.4° | 109.5° |
| H1 | C1 | H3 | 109.5° | 109.5° |
| H2 | C1 | H3 | 109.5° | 109.5° |
| H4 | C8 | H5 | 109.5° | 109.5° |
| H4 | C8 | H6 | 109.5° | 109.5° |
| H5 | C8 | H6 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C25 | C26 | C27 | H17 | 180.0° | 180.0° |
| C26 | C25 | C24 | H16 | 180.0° | 180.0° |
| C25 | C26 | C27 | C28 | 0.0° | 0.2° |
| C26 | C25 | C24 | C21 | 179.5° | 180.0° |
| C26 | C25 | C24 | C29 | 0.2° | 0.2° |
| C25 | C26 | C27 | H11 | 179.9° | 180.0° |
| C27 | C26 | C25 | C24 | 0.1° | 0.0° |
| C26 | C27 | C28 | H11 | 180.0° | 179.7° |
| C26 | C27 | C28 | C29 | 0.0° | 0.2° |
| C27 | C26 | C25 | H16 | 179.9° | 180.0° |
| C26 | C27 | C28 | H18 | 180.0° | 179.8° |
| C25 | C24 | C21 | C20 | 59.5° | 129.9° |
| C25 | C24 | C21 | C29 | 179.2° | 179.8° |
| C25 | C24 | C21 | C22 | 115.5° | 49.8° |
| C25 | C24 | C29 | C28 | 0.2° | 0.2° |
| C25 | C24 | C29 | F30 | 179.7° | 179.8° |
| C24 | C25 | C26 | H17 | 179.9° | 180.0° |
| C13 | C12 | C11 | H7 | 180.0° | 180.0° |
| C12 | C13 | C14 | H13 | 180.0° | 180.0° |
| C13 | C12 | C11 | N10 | 178.8° | 180.0° |
| C13 | C12 | C11 | C17 | 1.2° | 0.3° |
| C12 | C13 | C14 | F15 | 179.5° | 180.0° |
| C12 | C13 | C14 | C16 | 0.3° | 0.2° |
| C11 | C12 | C13 | C14 | 1.2° | 0.0° |
| C12 | C11 | N10 | C17 | 180.0° | 179.7° |
| C12 | C11 | N10 | C9 | 178.4° | 180.0° |
| C12 | C11 | C17 | C16 | 0.4° | 0.3° |
| C12 | C11 | C17 | C6 | 179.8° | 179.8° |
| C11 | C12 | C13 | H13 | 178.8° | 180.0° |
| C27 | C28 | C29 | C24 | 0.1° | 0.0° |
| C27 | C28 | C29 | H18 | 180.0° | 180.0° |
| C27 | C28 | C29 | F30 | 179.8° | 180.0° |
| C28 | C27 | C26 | H17 | 180.0° | 179.7° |
| C13 | C14 | F15 | C16 | 179.2° | 179.8° |
| C13 | C14 | C16 | C17 | 0.5° | 0.2° |
| C14 | C13 | C12 | H7 | 178.8° | 180.0° |
| C13 | C14 | C16 | H8 | 179.5° | 179.7° |
| C19 | C20 | C21 | H14 | 180.0° | 180.0° |
| C20 | C19 | C18 | H9 | 180.0° | 179.9° |
| C19 | C20 | C21 | C24 | 175.9° | 180.0° |
| C19 | C20 | C21 | C22 | 1.0° | 0.3° |
| C20 | C19 | C18 | C9 | 179.1° | 180.0° |
| C20 | C19 | C18 | C23 | 1.3° | 0.2° |
| C21 | C20 | C19 | C18 | 0.5° | 0.0° |
| C20 | C21 | C24 | C22 | 175.1° | 179.7° |
| C20 | C21 | C24 | C29 | 121.3° | 50.2° |
| C20 | C21 | C22 | C23 | 1.6° | 0.3° |
| C21 | C20 | C19 | H9 | 179.5° | 179.9° |
| C20 | C21 | C22 | H15 | 178.4° | 180.0° |
| C19 | C18 | C9 | N10 | 55.8° | 135.9° |
| C19 | C18 | C9 | C23 | 177.8° | 179.8° |
| C19 | C18 | C9 | C7 | 123.5° | 44.4° |
| C19 | C18 | C23 | C22 | 0.7° | 0.2° |
| C19 | C18 | C23 | H10 | 179.3° | 179.7° |
| C18 | C19 | C20 | H14 | 179.5° | 180.0° |
| C21 | C24 | C29 | C28 | 179.4° | 180.0° |
| C21 | C24 | C29 | F30 | 0.5° | 0.1° |
| C24 | C21 | C22 | C23 | 176.8° | 180.0° |
| C24 | C21 | C20 | H14 | 4.1° | 0.0° |
| C24 | C21 | C22 | H15 | 3.2° | 0.3° |
| C21 | C24 | C25 | H16 | 0.5° | 0.1° |
| C29 | C24 | C21 | C22 | 63.7° | 130.1° |
| C24 | C29 | C28 | F30 | 179.9° | 180.0° |
| C29 | C24 | C25 | H16 | 179.8° | 179.7° |
| C24 | C29 | C28 | H18 | 179.9° | 180.0° |
| C11 | N10 | C9 | C18 | 178.1° | 180.0° |
| C11 | N10 | C9 | C7 | 1.3° | 0.4° |
| N10 | C11 | C17 | C16 | 179.6° | 180.0° |
| N10 | C11 | C17 | C6 | 0.2° | 0.1° |
| N10 | C11 | C12 | H7 | 1.2° | 0.0° |
| C9 | N10 | C11 | C17 | 1.6° | 0.3° |
| N10 | C9 | C18 | C7 | 179.3° | 179.7° |
| N10 | C9 | C18 | C23 | 122.0° | 43.8° |
| N10 | C9 | C7 | C6 | 0.5° | 0.1° |
| N10 | C9 | C7 | C8 | 178.6° | 180.0° |
| C11 | C17 | C16 | C14 | 0.4° | 0.1° |
| C11 | C17 | C16 | C6 | 179.3° | 179.9° |
| C11 | C17 | C6 | C7 | 1.4° | 0.2° |
| C11 | C17 | C6 | C4 | 177.6° | 180.0° |
| C17 | C11 | C12 | H7 | 178.8° | 179.7° |
| C11 | C17 | C16 | H8 | 179.6° | 180.0° |
| F15 | C14 | C16 | C17 | 178.7° | 180.0° |
| F15 | C14 | C16 | H8 | 1.3° | 0.1° |
| F15 | C14 | C13 | H13 | 0.5° | 0.0° |
| C14 | C16 | C17 | H8 | 180.0° | 179.9° |
| C14 | C16 | C17 | C6 | 178.9° | 180.0° |
| C16 | C14 | C13 | H13 | 179.7° | 179.8° |
| C21 | C22 | C23 | C18 | 0.7° | 0.1° |
| C21 | C22 | C23 | H15 | 180.0° | 179.7° |
| C21 | C22 | C23 | H10 | 179.2° | 180.0° |
| C22 | C21 | C20 | H14 | 179.0° | 179.7° |
| C29 | C28 | C27 | H11 | 180.0° | 180.0° |
| F30 | C29 | C28 | H18 | 0.3° | 0.1° |
| C9 | C18 | C23 | C22 | 178.4° | 180.0° |
| C18 | C9 | C7 | C6 | 179.7° | 179.7° |
| C18 | C9 | C7 | C8 | 2.2° | 0.3° |
| C9 | C18 | C19 | H9 | 0.8° | 0.1° |
| C9 | C18 | C23 | H10 | 1.6° | 0.1° |
| C23 | C18 | C9 | C7 | 58.7° | 135.9° |
| C18 | C23 | C22 | H10 | 180.0° | 179.9° |
| C23 | C18 | C19 | H9 | 178.7° | 179.8° |
| C18 | C23 | C22 | H15 | 179.2° | 179.8° |
| C9 | C7 | C6 | C17 | 1.7° | 0.2° |
| C9 | C7 | C6 | C8 | 178.2° | 179.9° |
| C9 | C7 | C6 | C4 | 177.8° | 180.0° |
| C9 | C7 | C8 | H4 | 89.0° | 93.9° |
| C9 | C7 | C8 | H5 | 151.0° | 26.1° |
| C9 | C7 | C8 | H6 | 31.1° | 146.0° |
| C16 | C17 | C6 | C7 | 177.9° | 179.7° |
| C16 | C17 | C6 | C4 | 1.8° | 0.1° |
| C17 | C6 | C7 | C4 | 176.0° | 179.8° |
| C17 | C6 | C7 | C8 | 179.9° | 179.7° |
| C17 | C6 | C4 | N3 | 102.6° | 89.7° |
| C17 | C6 | C4 | O5 | 74.7° | 90.3° |
| C6 | C17 | C16 | H8 | 1.1° | 0.1° |
| C7 | C6 | C4 | N3 | 73.4° | 90.0° |
| C7 | C6 | C4 | O5 | 109.3° | 90.0° |
| C6 | C7 | C8 | H4 | 89.1° | 86.0° |
| C6 | C7 | C8 | H5 | 30.9° | 154.0° |
| C6 | C7 | C8 | H6 | 150.9° | 34.0° |
| C8 | C7 | C6 | C4 | 4.1° | 0.0° |
| C7 | C8 | H4 | H5 | 120.0° | 120.0° |
| C7 | C8 | H4 | H6 | 120.0° | 120.0° |
| C7 | C8 | H5 | H6 | 120.0° | 120.0° |
| C6 | C4 | N3 | O5 | 177.3° | 180.0° |
| C6 | C4 | N3 | O2 | 177.8° | 180.0° |
| C6 | C4 | N3 | H12 | 2.2° | 0.0° |
| C4 | N3 | O2 | H12 | 180.0° | 180.0° |
| C4 | N3 | O2 | C1 | 133.4° | 180.0° |
| O5 | C4 | N3 | O2 | 0.5° | 0.0° |
| O5 | C4 | N3 | H12 | 179.5° | 180.0° |
| N3 | O2 | C1 | H1 | 180.0° | 180.0° |
| N3 | O2 | C1 | H2 | 60.0° | 60.0° |
| N3 | O2 | C1 | H3 | 60.0° | 59.9° |
| O2 | C1 | H1 | H2 | 120.0° | 119.9° |
| O2 | C1 | H1 | H3 | 120.1° | 120.0° |
| O2 | C1 | H2 | H3 | 120.0° | 119.9° |
| C1 | O2 | N3 | H12 | 46.5° | 0.0° |
| H1 | C1 | H2 | H3 | 120.0° | 120.1° |
| H4 | C8 | H5 | H6 | 120.0° | 120.0° |
| H7 | C12 | C13 | H13 | 1.2° | 0.0° |
| H9 | C19 | C20 | H14 | 0.5° | 0.1° |
| H10 | C23 | C22 | H15 | 0.8° | 0.3° |
| H11 | C27 | C26 | H17 | 0.1° | 0.0° |
| H11 | C27 | C28 | H18 | 0.1° | 0.1° |
| H16 | C25 | C26 | H17 | 0.1° | 0.0° |
