U7C
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C11 | C12 | doub | 1.39Å | 1.39Å | Aromatic |
| C11 | C14 | sing | 1.38Å | 1.39Å | Aromatic |
| C12 | C13 | sing | 1.38Å | 1.39Å | Aromatic |
| C14 | C9 | doub | 1.39Å | 1.40Å | Aromatic |
| C13 | C10 | doub | 1.39Å | 1.40Å | Aromatic |
| O2 | N3 | sing | 1.21Å | 1.32Å | Aromatic |
| O2 | C1 | sing | 1.35Å | 1.31Å | Aromatic |
| C9 | C10 | sing | 1.41Å | 1.38Å | Aromatic |
| C9 | C8 | sing | 1.47Å | 1.41Å | Aromatic |
| C10 | N6 | sing | 1.38Å | 1.34Å | Aromatic |
| N3 | C4 | doub | 1.31Å | 1.33Å | Aromatic |
| C8 | C1 | sing | 1.48Å | 1.52Å | |
| C8 | C7 | doub | 1.36Å | 1.39Å | Aromatic |
| N6 | C7 | sing | 1.36Å | 1.32Å | Aromatic |
| C1 | C5 | doub | 1.37Å | 1.40Å | Aromatic |
| O17 | C15 | doub | 1.21Å | 1.26Å | |
| C4 | C5 | sing | 1.42Å | 1.44Å | Aromatic |
| C4 | C15 | sing | 1.48Å | 1.52Å | |
| C15 | O16 | sing | 1.35Å | 1.26Å | |
| C5 | H1 | sing | 1.08Å | 1.08Å | |
| C7 | H2 | sing | 1.08Å | 1.08Å | |
| C11 | H3 | sing | 1.08Å | 1.08Å | |
| C12 | H4 | sing | 1.08Å | 1.08Å | |
| C13 | H5 | sing | 1.08Å | 1.08Å | |
| C14 | H6 | sing | 1.08Å | 1.08Å | |
| N6 | H7 | sing | 0.97Å | 1.00Å | |
| O16 | H8 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C12 | C11 | C14 | 120.0° | 120.3° |
| C11 | C12 | C13 | 120.2° | 120.7° |
| C12 | C11 | H3 | 120.0° | 119.9° |
| C11 | C12 | H4 | 119.9° | 119.7° |
| C11 | C14 | C9 | 119.8° | 119.6° |
| C14 | C11 | H3 | 120.0° | 119.8° |
| C11 | C14 | H6 | 120.1° | 120.2° |
| C12 | C13 | C10 | 119.8° | 120.0° |
| C13 | C12 | H4 | 119.9° | 119.7° |
| C12 | C13 | H5 | 120.1° | 120.1° |
| C14 | C9 | C10 | 120.3° | 120.1° |
| C14 | C9 | C8 | 133.9° | 133.9° |
| C9 | C14 | H6 | 120.1° | 120.1° |
| C13 | C10 | C9 | 119.9° | 119.3° |
| C13 | C10 | N6 | 130.9° | 133.2° |
| C10 | C13 | H5 | 120.1° | 120.0° |
| N3 | O2 | C1 | 110.5° | 111.7° |
| O2 | N3 | C4 | 109.8° | 111.8° |
| O2 | C1 | C8 | 125.2° | 126.8° |
| O2 | C1 | C5 | 109.1° | 106.3° |
| C10 | C9 | C8 | 105.9° | 106.0° |
| C9 | C10 | N6 | 109.2° | 107.4° |
| C9 | C8 | C1 | 126.4° | 126.7° |
| C9 | C8 | C7 | 106.4° | 106.6° |
| C10 | N6 | C7 | 109.6° | 110.3° |
| C10 | N6 | H7 | 125.2° | 124.9° |
| N3 | C4 | C5 | 107.3° | 106.3° |
| N3 | C4 | C15 | 126.9° | 126.9° |
| C1 | C8 | C7 | 127.2° | 126.7° |
| C8 | C1 | C5 | 125.7° | 126.8° |
| C8 | C7 | N6 | 109.0° | 109.7° |
| C8 | C7 | H2 | 125.5° | 125.1° |
| N6 | C7 | H2 | 125.5° | 125.2° |
| C7 | N6 | H7 | 125.2° | 124.8° |
| C1 | C5 | C4 | 103.2° | 103.8° |
| C1 | C5 | H1 | 128.4° | 128.1° |
| O17 | C15 | C4 | 118.6° | 120.0° |
| O17 | C15 | O16 | 120.9° | 120.0° |
| C5 | C4 | C15 | 125.8° | 126.8° |
| C4 | C5 | H1 | 128.4° | 128.1° |
| C4 | C15 | O16 | 120.5° | 120.0° |
| C15 | O16 | H8 | 109.5° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C12 | C11 | C14 | H3 | 180.0° | 179.2° |
| C11 | C12 | C13 | H4 | 180.0° | 179.2° |
| C12 | C11 | C14 | C9 | 0.0° | 0.5° |
| C11 | C12 | C13 | C10 | 0.2° | 0.5° |
| C11 | C12 | C13 | H5 | 179.8° | 179.6° |
| C12 | C11 | C14 | H6 | 180.0° | 180.0° |
| C14 | C11 | C12 | C13 | 0.1° | 0.8° |
| C11 | C14 | C9 | H6 | 180.0° | 179.5° |
| C11 | C14 | C9 | C10 | 0.1° | 0.0° |
| C11 | C14 | C9 | C8 | 179.7° | 179.6° |
| C14 | C11 | C12 | H4 | 179.9° | 180.0° |
| C12 | C13 | C10 | H5 | 180.0° | 179.9° |
| C12 | C13 | C10 | C9 | 0.3° | 0.0° |
| C12 | C13 | C10 | N6 | 179.8° | 179.7° |
| C13 | C12 | C11 | H3 | 179.9° | 180.0° |
| C14 | C9 | C10 | C13 | 0.2° | 0.2° |
| C14 | C9 | C10 | C8 | 179.9° | 179.7° |
| C14 | C9 | C10 | N6 | 179.9° | 180.0° |
| C14 | C9 | C8 | C1 | 0.9° | 0.3° |
| C14 | C9 | C8 | C7 | 179.8° | 179.7° |
| C9 | C14 | C11 | H3 | 180.0° | 179.8° |
| C13 | C10 | C9 | N6 | 179.9° | 179.8° |
| C13 | C10 | C9 | C8 | 179.7° | 179.9° |
| C13 | C10 | N6 | C7 | 179.9° | 179.8° |
| C10 | C13 | C12 | H4 | 179.8° | 179.7° |
| C13 | C10 | N6 | H7 | 0.1° | 0.2° |
| N3 | O2 | C1 | C8 | 179.5° | 179.8° |
| N3 | O2 | C1 | C5 | 0.2° | 0.0° |
| O2 | N3 | C4 | C5 | 0.1° | 0.5° |
| O2 | N3 | C4 | C15 | 179.8° | 180.0° |
| O2 | C1 | C8 | C9 | 5.9° | 49.7° |
| C1 | O2 | N3 | C4 | 0.1° | 0.3° |
| O2 | C1 | C8 | C5 | 179.1° | 179.7° |
| O2 | C1 | C8 | C7 | 172.8° | 130.3° |
| O2 | C1 | C5 | C4 | 0.3° | 0.3° |
| O2 | C1 | C5 | H1 | 179.8° | 179.8° |
| C10 | C9 | C8 | C1 | 179.3° | 180.0° |
| C10 | C9 | C8 | C7 | 0.4° | 0.0° |
| C9 | C10 | N6 | C7 | 0.1° | 0.4° |
| C9 | C10 | C13 | H5 | 179.7° | 180.0° |
| C10 | C9 | C14 | H6 | 179.9° | 179.5° |
| C9 | C10 | N6 | H7 | 179.9° | 180.0° |
| C8 | C9 | C10 | N6 | 0.3° | 0.2° |
| C9 | C8 | C1 | C7 | 178.7° | 180.0° |
| C9 | C8 | C7 | N6 | 0.3° | 0.3° |
| C9 | C8 | C1 | C5 | 175.0° | 130.0° |
| C9 | C8 | C7 | H2 | 179.7° | 179.9° |
| C8 | C9 | C14 | H6 | 0.3° | 0.2° |
| C10 | N6 | C7 | C8 | 0.2° | 0.4° |
| C10 | N6 | C7 | H7 | 180.0° | 179.6° |
| C10 | N6 | C7 | H2 | 179.8° | 179.9° |
| N6 | C10 | C13 | H5 | 0.2° | 0.2° |
| N3 | C4 | C5 | C1 | 0.2° | 0.5° |
| N3 | C4 | C15 | O17 | 151.6° | 179.5° |
| N3 | C4 | C5 | C15 | 179.7° | 179.5° |
| N3 | C4 | C15 | O16 | 28.0° | 0.5° |
| N3 | C4 | C5 | H1 | 179.8° | 179.6° |
| C1 | C8 | C7 | N6 | 179.3° | 179.7° |
| C8 | C1 | C5 | C4 | 179.5° | 180.0° |
| C8 | C1 | C5 | H1 | 0.5° | 0.0° |
| C1 | C8 | C7 | H2 | 0.8° | 0.1° |
| C8 | C7 | N6 | H2 | 180.0° | 179.7° |
| C7 | C8 | C1 | C5 | 6.3° | 50.0° |
| C8 | C7 | N6 | H7 | 179.8° | 180.0° |
| C1 | C5 | C4 | H1 | 180.0° | 179.9° |
| C1 | C5 | C4 | C15 | 179.9° | 180.0° |
| O17 | C15 | C4 | C5 | 28.0° | 0.0° |
| O17 | C15 | C4 | O16 | 179.6° | 180.0° |
| O17 | C15 | O16 | H8 | 0.0° | 0.1° |
| C5 | C4 | C15 | O16 | 152.4° | 179.9° |
| C15 | C4 | C5 | H1 | 0.1° | 0.1° |
| C4 | C15 | O16 | H8 | 179.6° | 180.0° |
| H2 | C7 | N6 | H7 | 0.1° | 0.3° |
| H3 | C11 | C12 | H4 | 0.1° | 0.8° |
| H3 | C11 | C14 | H6 | 0.0° | 0.8° |
| H4 | C12 | C13 | H5 | 0.2° | 0.3° |
