N7U
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O01 | P02 | doub | 1.48Å | 1.51Å | |
| O04 | P02 | sing | 1.61Å | 1.51Å | |
| P02 | O03 | sing | 1.61Å | 1.51Å | |
| P02 | C05 | sing | 1.81Å | 1.85Å | |
| C06 | C05 | doub | 1.38Å | 1.39Å | Aromatic |
| C06 | C07 | sing | 1.38Å | 1.38Å | Aromatic |
| C05 | C26 | sing | 1.38Å | 1.38Å | Aromatic |
| C07 | C08 | doub | 1.39Å | 1.40Å | Aromatic |
| C26 | C25 | doub | 1.38Å | 1.39Å | Aromatic |
| C08 | C25 | sing | 1.39Å | 1.39Å | Aromatic |
| C08 | N09 | sing | 1.40Å | 1.45Å | |
| C21 | C20 | doub | 1.36Å | 1.39Å | Aromatic |
| C21 | C22 | sing | 1.41Å | 1.39Å | Aromatic |
| C20 | C19 | sing | 1.41Å | 1.41Å | Aromatic |
| C22 | C23 | doub | 1.35Å | 1.39Å | Aromatic |
| C17 | C16 | doub | 1.38Å | 1.39Å | Aromatic |
| C17 | C12 | sing | 1.39Å | 1.39Å | Aromatic |
| C16 | C15 | sing | 1.38Å | 1.38Å | Aromatic |
| C19 | N18 | doub | 1.32Å | 1.35Å | Aromatic |
| C19 | N24 | sing | 1.38Å | 1.31Å | Aromatic |
| N18 | C11 | sing | 1.35Å | 1.32Å | Aromatic |
| C23 | N24 | sing | 1.37Å | 1.35Å | Aromatic |
| N24 | C10 | sing | 1.37Å | 1.34Å | Aromatic |
| C11 | C10 | doub | 1.38Å | 1.40Å | Aromatic |
| C11 | C12 | sing | 1.48Å | 1.39Å | |
| C10 | N09 | sing | 1.39Å | 1.45Å | |
| C12 | C13 | doub | 1.40Å | 1.39Å | Aromatic |
| C15 | C14 | doub | 1.38Å | 1.38Å | Aromatic |
| C13 | C14 | sing | 1.38Å | 1.39Å | Aromatic |
| C13 | H1 | sing | 1.08Å | 1.08Å | |
| C15 | H2 | sing | 1.08Å | 1.08Å | |
| C17 | H3 | sing | 1.08Å | 1.08Å | |
| C20 | H4 | sing | 1.08Å | 1.08Å | |
| C21 | H5 | sing | 1.08Å | 1.08Å | |
| C22 | H6 | sing | 1.08Å | 1.08Å | |
| C26 | H7 | sing | 1.08Å | 1.08Å | |
| C06 | H8 | sing | 1.08Å | 1.08Å | |
| C07 | H9 | sing | 1.08Å | 1.08Å | |
| C14 | H10 | sing | 1.08Å | 1.08Å | |
| C16 | H11 | sing | 1.08Å | 1.08Å | |
| C23 | H12 | sing | 1.08Å | 1.08Å | |
| C25 | H13 | sing | 1.08Å | 1.08Å | |
| N09 | H14 | sing | 0.97Å | 1.00Å | |
| O03 | H15 | sing | 0.97Å | 0.95Å | |
| O04 | H16 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O01 | P02 | O04 | 108.4° | 109.5° |
| O01 | P02 | O03 | 110.2° | 109.5° |
| O01 | P02 | C05 | 111.4° | 109.5° |
| O04 | P02 | O03 | 111.6° | 109.5° |
| O04 | P02 | C05 | 105.9° | 109.5° |
| P02 | O04 | H16 | 109.5° | 114.0° |
| O03 | P02 | C05 | 109.3° | 109.4° |
| P02 | O03 | H15 | 109.5° | 114.1° |
| P02 | C05 | C06 | 119.2° | 119.9° |
| P02 | C05 | C26 | 119.2° | 119.9° |
| C05 | C06 | C07 | 119.7° | 120.1° |
| C06 | C05 | C26 | 121.6° | 120.2° |
| C05 | C06 | H8 | 120.2° | 120.0° |
| C06 | C07 | C08 | 118.9° | 119.9° |
| C07 | C06 | H8 | 120.2° | 119.9° |
| C06 | C07 | H9 | 120.6° | 120.0° |
| C05 | C26 | C25 | 119.0° | 120.1° |
| C05 | C26 | H7 | 120.5° | 120.0° |
| C07 | C08 | C25 | 121.0° | 119.9° |
| C07 | C08 | N09 | 120.2° | 120.1° |
| C08 | C07 | H9 | 120.5° | 120.0° |
| C26 | C25 | C08 | 119.8° | 119.9° |
| C25 | C26 | H7 | 120.5° | 119.9° |
| C26 | C25 | H13 | 120.1° | 120.0° |
| C25 | C08 | N09 | 118.8° | 120.1° |
| C08 | C25 | H13 | 120.1° | 120.1° |
| C08 | N09 | C10 | 121.0° | 120.0° |
| C08 | N09 | H14 | 119.5° | 120.0° |
| C20 | C21 | C22 | 118.9° | 119.8° |
| C21 | C20 | C19 | 118.5° | 119.4° |
| C21 | C20 | H4 | 120.8° | 120.3° |
| C20 | C21 | H5 | 120.6° | 120.1° |
| C21 | C22 | C23 | 119.7° | 120.4° |
| C22 | C21 | H5 | 120.5° | 120.1° |
| C21 | C22 | H6 | 120.1° | 119.8° |
| C20 | C19 | N18 | 129.7° | 131.9° |
| C20 | C19 | N24 | 121.1° | 119.5° |
| C19 | C20 | H4 | 120.7° | 120.3° |
| C22 | C23 | N24 | 119.9° | 120.6° |
| C23 | C22 | H6 | 120.2° | 119.8° |
| C22 | C23 | H12 | 120.1° | 119.7° |
| C16 | C17 | C12 | 118.9° | 119.9° |
| C17 | C16 | C15 | 121.4° | 120.1° |
| C16 | C17 | H3 | 120.6° | 120.1° |
| C17 | C16 | H11 | 119.3° | 119.9° |
| C17 | C12 | C11 | 118.3° | 120.2° |
| C17 | C12 | C13 | 119.9° | 119.7° |
| C12 | C17 | H3 | 120.5° | 120.0° |
| C16 | C15 | C14 | 119.3° | 120.3° |
| C16 | C15 | H2 | 120.4° | 119.8° |
| C15 | C16 | H11 | 119.3° | 119.9° |
| N18 | C19 | N24 | 109.2° | 108.6° |
| C19 | N18 | C11 | 108.7° | 109.3° |
| C19 | N24 | C23 | 122.0° | 120.4° |
| C19 | N24 | C10 | 108.6° | 107.3° |
| N18 | C11 | C10 | 106.5° | 108.0° |
| N18 | C11 | C12 | 124.5° | 126.0° |
| C23 | N24 | C10 | 129.4° | 132.3° |
| N24 | C23 | H12 | 120.1° | 119.6° |
| N24 | C10 | C11 | 107.0° | 106.8° |
| N24 | C10 | N09 | 123.3° | 126.6° |
| C10 | C11 | C12 | 128.9° | 126.0° |
| C11 | C10 | N09 | 129.7° | 126.6° |
| C11 | C12 | C13 | 121.7° | 120.1° |
| C10 | N09 | H14 | 119.5° | 120.0° |
| C12 | C13 | C14 | 120.5° | 119.9° |
| C12 | C13 | H1 | 119.8° | 120.1° |
| C15 | C14 | C13 | 120.0° | 120.2° |
| C14 | C15 | H2 | 120.4° | 119.9° |
| C15 | C14 | H10 | 120.0° | 119.9° |
| C14 | C13 | H1 | 119.7° | 120.1° |
| C13 | C14 | H10 | 120.0° | 119.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O01 | P02 | O04 | O03 | 121.6° | 120.0° |
| O01 | P02 | O04 | C05 | 119.6° | 120.0° |
| O01 | P02 | O03 | C05 | 122.7° | 120.0° |
| O01 | P02 | C05 | C06 | 21.0° | 115.0° |
| O01 | P02 | C05 | C26 | 160.2° | 64.9° |
| O01 | P02 | O03 | H15 | 0.0° | 180.0° |
| O01 | P02 | O04 | H16 | 0.0° | 60.0° |
| O04 | P02 | O03 | C05 | 116.8° | 120.0° |
| O04 | P02 | C05 | C06 | 96.7° | 5.0° |
| O04 | P02 | C05 | C26 | 82.2° | 175.0° |
| O04 | P02 | O03 | H15 | 120.6° | 60.0° |
| O03 | P02 | C05 | C06 | 143.0° | 125.1° |
| O03 | P02 | C05 | C26 | 38.2° | 55.0° |
| O03 | P02 | O04 | H16 | 121.6° | 60.0° |
| P02 | C05 | C06 | C26 | 178.8° | 179.9° |
| P02 | C05 | C06 | C07 | 179.4° | 180.0° |
| P02 | C05 | C26 | C25 | 179.3° | 180.0° |
| P02 | C05 | C26 | H7 | 0.7° | 0.4° |
| P02 | C05 | C06 | H8 | 0.6° | 0.1° |
| C05 | P02 | O03 | H15 | 122.7° | 60.0° |
| C05 | P02 | O04 | H16 | 119.6° | 180.0° |
| C05 | C06 | C07 | H8 | 180.0° | 179.9° |
| C05 | C06 | C07 | C08 | 0.3° | 0.0° |
| C06 | C05 | C26 | C25 | 0.5° | 0.1° |
| C06 | C05 | C26 | H7 | 179.5° | 179.7° |
| C05 | C06 | C07 | H9 | 179.6° | 180.0° |
| C07 | C06 | C05 | C26 | 0.6° | 0.1° |
| C06 | C07 | C08 | H9 | 180.0° | 180.0° |
| C06 | C07 | C08 | C25 | 0.0° | 0.1° |
| C06 | C07 | C08 | N09 | 179.6° | 180.0° |
| C05 | C26 | C25 | H7 | 180.0° | 179.7° |
| C05 | C26 | C25 | C08 | 0.2° | 0.0° |
| C26 | C05 | C06 | H8 | 179.4° | 180.0° |
| C05 | C26 | C25 | H13 | 179.8° | 179.7° |
| C07 | C08 | C25 | C26 | 0.0° | 0.0° |
| C07 | C08 | C25 | N09 | 179.6° | 179.9° |
| C07 | C08 | N09 | C10 | 11.6° | 174.2° |
| C08 | C07 | C06 | H8 | 179.7° | 179.9° |
| C07 | C08 | C25 | H13 | 179.9° | 179.8° |
| C07 | C08 | N09 | H14 | 168.5° | 5.8° |
| C26 | C25 | C08 | H13 | 180.0° | 179.7° |
| C26 | C25 | C08 | N09 | 179.6° | 179.9° |
| C25 | C08 | N09 | C10 | 168.1° | 5.7° |
| C08 | C25 | C26 | H7 | 179.8° | 179.7° |
| C25 | C08 | C07 | H9 | 179.9° | 180.0° |
| C25 | C08 | N09 | H14 | 11.9° | 174.3° |
| C08 | N09 | C10 | N24 | 92.2° | 78.2° |
| C08 | N09 | C10 | C11 | 87.9° | 102.1° |
| C08 | N09 | C10 | H14 | 180.0° | 180.0° |
| N09 | C08 | C07 | H9 | 0.5° | 0.0° |
| N09 | C08 | C25 | H13 | 0.3° | 0.3° |
| C20 | C21 | C22 | H5 | 180.0° | 179.9° |
| C21 | C20 | C19 | H4 | 180.0° | 179.9° |
| C20 | C21 | C22 | C23 | 0.1° | 0.1° |
| C21 | C20 | C19 | N18 | 179.9° | 180.0° |
| C21 | C20 | C19 | N24 | 0.1° | 0.2° |
| C20 | C21 | C22 | H6 | 179.8° | 180.0° |
| C22 | C21 | C20 | C19 | 0.0° | 0.1° |
| C21 | C22 | C23 | H6 | 180.0° | 179.9° |
| C21 | C22 | C23 | N24 | 0.3° | 0.2° |
| C22 | C21 | C20 | H4 | 180.0° | 179.9° |
| C21 | C22 | C23 | H12 | 179.7° | 179.8° |
| C20 | C19 | N18 | N24 | 179.9° | 179.8° |
| C20 | C19 | N18 | C11 | 179.3° | 180.0° |
| C20 | C19 | N24 | C23 | 0.1° | 0.2° |
| C20 | C19 | N24 | C10 | 179.7° | 179.8° |
| C19 | C20 | C21 | H5 | 180.0° | 180.0° |
| C22 | C23 | N24 | C19 | 0.2° | 0.0° |
| C22 | C23 | N24 | H12 | 180.0° | 180.0° |
| C22 | C23 | N24 | C10 | 179.5° | 179.6° |
| C23 | C22 | C21 | H5 | 179.9° | 179.8° |
| C16 | C17 | C12 | H3 | 180.0° | 179.2° |
| C17 | C16 | C15 | H11 | 180.0° | 179.2° |
| C16 | C17 | C12 | C11 | 178.8° | 179.5° |
| C16 | C17 | C12 | C13 | 1.4° | 0.5° |
| C17 | C16 | C15 | C14 | 0.7° | 0.6° |
| C17 | C16 | C15 | H2 | 179.3° | 179.4° |
| C12 | C17 | C16 | C15 | 1.2° | 0.8° |
| C17 | C12 | C11 | N18 | 8.0° | 34.9° |
| C17 | C12 | C11 | C10 | 168.4° | 145.0° |
| C17 | C12 | C11 | C13 | 177.4° | 180.0° |
| C17 | C12 | C13 | C14 | 1.1° | 0.0° |
| C17 | C12 | C13 | H1 | 178.9° | 179.8° |
| C12 | C17 | C16 | H11 | 178.8° | 180.0° |
| C16 | C15 | C14 | H2 | 180.0° | 180.0° |
| C16 | C15 | C14 | C13 | 0.3° | 0.0° |
| C15 | C16 | C17 | H3 | 178.8° | 180.0° |
| C16 | C15 | C14 | H10 | 179.7° | 180.0° |
| N18 | C19 | N24 | C23 | 180.0° | 180.0° |
| N18 | C19 | N24 | C10 | 0.3° | 0.3° |
| C19 | N18 | C11 | C10 | 0.7° | 0.0° |
| C19 | N18 | C11 | C12 | 177.8° | 180.0° |
| N18 | C19 | C20 | H4 | 0.1° | 0.0° |
| N24 | C19 | N18 | C11 | 0.6° | 0.2° |
| C19 | N24 | C23 | C10 | 179.7° | 179.6° |
| C19 | N24 | C10 | C11 | 0.2° | 0.4° |
| C19 | N24 | C10 | N09 | 180.0° | 179.9° |
| N24 | C19 | C20 | H4 | 179.9° | 179.7° |
| C19 | N24 | C23 | H12 | 179.8° | 180.0° |
| N18 | C11 | C10 | N24 | 0.6° | 0.3° |
| N18 | C11 | C10 | C12 | 176.9° | 179.9° |
| N18 | C11 | C10 | N09 | 179.6° | 180.0° |
| N18 | C11 | C12 | C13 | 174.7° | 145.1° |
| C23 | N24 | C10 | C11 | 179.6° | 180.0° |
| C23 | N24 | C10 | N09 | 0.3° | 0.3° |
| N24 | C23 | C22 | H6 | 179.7° | 179.9° |
| N24 | C10 | C11 | N09 | 179.9° | 179.8° |
| N24 | C10 | C11 | C12 | 177.5° | 179.8° |
| C10 | N24 | C23 | H12 | 0.5° | 0.5° |
| N24 | C10 | N09 | H14 | 87.8° | 101.8° |
| C10 | C11 | C12 | C13 | 8.9° | 35.0° |
| C11 | C10 | N09 | H14 | 92.1° | 77.9° |
| C12 | C11 | C10 | N09 | 2.7° | 0.1° |
| C11 | C12 | C13 | C14 | 178.4° | 180.0° |
| C11 | C12 | C13 | H1 | 1.6° | 0.2° |
| C11 | C12 | C17 | H3 | 1.2° | 0.3° |
| C12 | C13 | C14 | C15 | 0.6° | 0.2° |
| C12 | C13 | C14 | H1 | 180.0° | 179.8° |
| C13 | C12 | C17 | H3 | 178.6° | 179.7° |
| C12 | C13 | C14 | H10 | 179.4° | 179.7° |
| C15 | C14 | C13 | H10 | 180.0° | 179.9° |
| C15 | C14 | C13 | H1 | 179.4° | 180.0° |
| C14 | C15 | C16 | H11 | 179.3° | 179.7° |
| C13 | C14 | C15 | H2 | 179.6° | 179.9° |
| H1 | C13 | C14 | H10 | 0.6° | 0.1° |
| H2 | C15 | C14 | H10 | 0.4° | 0.0° |
| H2 | C15 | C16 | H11 | 0.7° | 0.2° |
| H3 | C17 | C16 | H11 | 1.2° | 0.9° |
| H4 | C20 | C21 | H5 | 0.0° | 0.1° |
| H5 | C21 | C22 | H6 | 0.2° | 0.1° |
| H6 | C22 | C23 | H12 | 0.3° | 0.1° |
| H7 | C26 | C25 | H13 | 0.2° | 0.1° |
| H8 | C06 | C07 | H9 | 0.4° | 0.1° |
