SV5
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | C1 | doub | 1.38Å | 1.38Å | Aromatic |
| C | C5 | sing | 1.38Å | 1.38Å | Aromatic |
| C1 | C2 | sing | 1.38Å | 1.39Å | Aromatic |
| C5 | C4 | doub | 1.38Å | 1.39Å | Aromatic |
| C2 | C3 | doub | 1.38Å | 1.39Å | Aromatic |
| C4 | C3 | sing | 1.38Å | 1.39Å | Aromatic |
| C3 | C6 | sing | 1.51Å | 1.51Å | |
| C6 | N | sing | 1.47Å | 1.47Å | |
| C7 | N | sing | 1.37Å | 1.38Å | Aromatic |
| C7 | C8 | doub | 1.34Å | 1.37Å | Aromatic |
| N | C10 | sing | 1.36Å | 1.38Å | Aromatic |
| C8 | C9 | sing | 1.46Å | 1.44Å | Aromatic |
| C10 | C9 | doub | 1.40Å | 1.41Å | Aromatic |
| C10 | C11 | sing | 1.41Å | 1.42Å | |
| C9 | C13 | sing | 1.41Å | 1.45Å | |
| C11 | C12 | doub | 1.35Å | 1.35Å | |
| C13 | O | doub | 1.22Å | 1.23Å | |
| C13 | N1 | sing | 1.35Å | 1.40Å | |
| C12 | N1 | sing | 1.36Å | 1.36Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C7 | H3 | sing | 1.08Å | 1.08Å | |
| C8 | H4 | sing | 1.08Å | 1.08Å | |
| C11 | H5 | sing | 1.08Å | 1.08Å | |
| C12 | H7 | sing | 1.08Å | 1.08Å | |
| C6 | H8 | sing | 1.09Å | 1.10Å | |
| C6 | H9 | sing | 1.09Å | 1.10Å | |
| C4 | H10 | sing | 1.08Å | 1.08Å | |
| C5 | H11 | sing | 1.08Å | 1.08Å | |
| C | H12 | sing | 1.08Å | 1.08Å | |
| N1 | H6 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | C | C5 | 119.7° | 120.0° |
| C | C1 | C2 | 120.2° | 120.0° |
| C | C1 | H1 | 119.9° | 120.0° |
| C1 | C | H12 | 120.1° | 120.0° |
| C | C5 | C4 | 120.2° | 120.0° |
| C | C5 | H11 | 119.9° | 120.0° |
| C5 | C | H12 | 120.1° | 119.9° |
| C1 | C2 | C3 | 120.7° | 120.0° |
| C2 | C1 | H1 | 119.9° | 120.0° |
| C1 | C2 | H2 | 119.7° | 120.0° |
| C5 | C4 | C3 | 120.7° | 120.0° |
| C5 | C4 | H10 | 119.6° | 120.0° |
| C4 | C5 | H11 | 119.9° | 120.0° |
| C2 | C3 | C4 | 118.5° | 120.0° |
| C2 | C3 | C6 | 121.4° | 120.0° |
| C3 | C2 | H2 | 119.6° | 120.0° |
| C4 | C3 | C6 | 120.1° | 120.0° |
| C3 | C4 | H10 | 119.6° | 120.0° |
| C3 | C6 | N | 113.9° | 109.5° |
| C3 | C6 | H8 | 108.4° | 109.4° |
| C3 | C6 | H9 | 108.3° | 109.5° |
| C6 | N | C7 | 124.6° | 125.0° |
| C6 | N | C10 | 126.2° | 125.0° |
| N | C6 | H8 | 108.4° | 109.5° |
| N | C6 | H9 | 108.3° | 109.5° |
| N | C7 | C8 | 109.1° | 109.6° |
| C7 | N | C10 | 109.2° | 110.1° |
| N | C7 | H3 | 125.5° | 125.2° |
| C7 | C8 | C9 | 107.6° | 106.8° |
| C8 | C7 | H3 | 125.5° | 125.2° |
| C7 | C8 | H4 | 126.2° | 126.6° |
| N | C10 | C9 | 107.5° | 107.4° |
| N | C10 | C11 | 132.6° | 134.0° |
| C8 | C9 | C10 | 106.6° | 106.1° |
| C8 | C9 | C13 | 132.6° | 134.6° |
| C9 | C8 | H4 | 126.2° | 126.6° |
| C9 | C10 | C11 | 119.9° | 118.6° |
| C10 | C9 | C13 | 120.8° | 119.3° |
| C10 | C11 | C12 | 119.0° | 119.8° |
| C10 | C11 | H5 | 120.5° | 120.1° |
| C9 | C13 | O | 126.2° | 120.2° |
| C9 | C13 | N1 | 114.3° | 119.5° |
| C11 | C12 | N1 | 121.3° | 121.6° |
| C12 | C11 | H5 | 120.5° | 120.2° |
| C11 | C12 | H7 | 119.4° | 119.2° |
| O | C13 | N1 | 119.5° | 120.2° |
| C13 | N1 | C12 | 124.7° | 121.2° |
| C13 | N1 | H6 | 117.7° | 119.3° |
| N1 | C12 | H7 | 119.3° | 119.2° |
| C12 | N1 | H6 | 117.7° | 119.4° |
| H8 | C6 | H9 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | C | C5 | H12 | 180.0° | 179.5° |
| C | C1 | C2 | H1 | 180.0° | 179.7° |
| C1 | C | C5 | C4 | 0.3° | 0.5° |
| C | C1 | C2 | C3 | 0.0° | 0.3° |
| C | C1 | C2 | H2 | 179.9° | 179.8° |
| C1 | C | C5 | H11 | 179.7° | 179.7° |
| C5 | C | C1 | C2 | 0.3° | 0.5° |
| C | C5 | C4 | H11 | 180.0° | 179.8° |
| C | C5 | C4 | C3 | 0.1° | 0.3° |
| C5 | C | C1 | H1 | 179.8° | 179.8° |
| C | C5 | C4 | H10 | 179.9° | 179.7° |
| C1 | C2 | C3 | H2 | 180.0° | 179.9° |
| C1 | C2 | C3 | C4 | 0.3° | 0.1° |
| C1 | C2 | C3 | C6 | 180.0° | 180.0° |
| C2 | C1 | C | H12 | 179.7° | 180.0° |
| C5 | C4 | C3 | C2 | 0.2° | 0.1° |
| C5 | C4 | C3 | H10 | 180.0° | 180.0° |
| C5 | C4 | C3 | C6 | 180.0° | 180.0° |
| C4 | C5 | C | H12 | 179.7° | 180.0° |
| C2 | C3 | C4 | C6 | 179.8° | 179.9° |
| C2 | C3 | C6 | N | 7.3° | 89.9° |
| C3 | C2 | C1 | H1 | 179.9° | 180.0° |
| C2 | C3 | C6 | H8 | 128.0° | 150.0° |
| C2 | C3 | C6 | H9 | 113.3° | 30.1° |
| C2 | C3 | C4 | H10 | 179.8° | 179.9° |
| C4 | C3 | C6 | N | 172.9° | 89.9° |
| C4 | C3 | C2 | H2 | 179.7° | 180.0° |
| C4 | C3 | C6 | H8 | 52.3° | 30.1° |
| C4 | C3 | C6 | H9 | 66.5° | 150.0° |
| C3 | C4 | C5 | H11 | 179.9° | 179.9° |
| C3 | C6 | N | H8 | 120.7° | 120.0° |
| C3 | C6 | N | H9 | 120.6° | 120.0° |
| C3 | C6 | N | C7 | 112.7° | 95.0° |
| C3 | C6 | N | C10 | 68.0° | 85.0° |
| C6 | C3 | C2 | H2 | 0.1° | 0.1° |
| C3 | C6 | H8 | H9 | 118.0° | 119.9° |
| C6 | C3 | C4 | H10 | 0.0° | 0.0° |
| C6 | N | C7 | C10 | 179.4° | 180.0° |
| C6 | N | C7 | C8 | 179.9° | 180.0° |
| C6 | N | C10 | C9 | 179.9° | 180.0° |
| C6 | N | C10 | C11 | 0.4° | 0.0° |
| C6 | N | C7 | H3 | 0.1° | 0.3° |
| N | C6 | H8 | H9 | 118.0° | 120.0° |
| N | C7 | C8 | H3 | 180.0° | 179.7° |
| N | C7 | C8 | C9 | 0.3° | 0.0° |
| C7 | N | C10 | C9 | 0.5° | 0.0° |
| C7 | N | C10 | C11 | 179.8° | 180.0° |
| N | C7 | C8 | H4 | 179.7° | 180.0° |
| C7 | N | C6 | H8 | 126.6° | 145.0° |
| C7 | N | C6 | H9 | 7.9° | 25.0° |
| C8 | C7 | N | C10 | 0.5° | 0.0° |
| C7 | C8 | C9 | H4 | 180.0° | 179.9° |
| C7 | C8 | C9 | C10 | 0.0° | 0.0° |
| C7 | C8 | C9 | C13 | 179.7° | 179.9° |
| N | C10 | C9 | C8 | 0.3° | 0.0° |
| N | C10 | C9 | C11 | 179.7° | 180.0° |
| N | C10 | C9 | C13 | 180.0° | 179.9° |
| N | C10 | C11 | C12 | 179.6° | 180.0° |
| C10 | N | C7 | H3 | 179.5° | 179.7° |
| N | C10 | C11 | H5 | 0.4° | 0.0° |
| C10 | N | C6 | H8 | 52.7° | 35.0° |
| C10 | N | C6 | H9 | 171.4° | 155.0° |
| C8 | C9 | C10 | C13 | 179.7° | 179.9° |
| C8 | C9 | C10 | C11 | 180.0° | 180.0° |
| C8 | C9 | C13 | O | 0.5° | 0.1° |
| C8 | C9 | C13 | N1 | 179.9° | 180.0° |
| C9 | C8 | C7 | H3 | 179.7° | 179.7° |
| C9 | C10 | C11 | C12 | 0.0° | 0.1° |
| C10 | C9 | C13 | O | 179.9° | 180.0° |
| C10 | C9 | C13 | N1 | 0.2° | 0.1° |
| C10 | C9 | C8 | H4 | 180.0° | 179.9° |
| C9 | C10 | C11 | H5 | 180.0° | 180.0° |
| C11 | C10 | C9 | C13 | 0.2° | 0.1° |
| C10 | C11 | C12 | H5 | 180.0° | 179.9° |
| C10 | C11 | C12 | N1 | 0.4° | 0.1° |
| C10 | C11 | C12 | H7 | 179.6° | 180.0° |
| C9 | C13 | O | N1 | 179.7° | 179.9° |
| C9 | C13 | N1 | C12 | 0.1° | 0.0° |
| C13 | C9 | C8 | H4 | 0.3° | 0.0° |
| C9 | C13 | N1 | H6 | 179.9° | 179.9° |
| C11 | C12 | N1 | C13 | 0.4° | 0.0° |
| C11 | C12 | N1 | H7 | 180.0° | 180.0° |
| C11 | C12 | N1 | H6 | 179.6° | 179.9° |
| O | C13 | N1 | C12 | 179.6° | 180.0° |
| O | C13 | N1 | H6 | 0.4° | 0.0° |
| C13 | N1 | C12 | H6 | 180.0° | 180.0° |
| C13 | N1 | C12 | H7 | 179.6° | 180.0° |
| N1 | C12 | C11 | H5 | 179.7° | 180.0° |
| H1 | C1 | C2 | H2 | 0.1° | 0.1° |
| H1 | C1 | C | H12 | 0.2° | 0.3° |
| H3 | C7 | C8 | H4 | 0.3° | 0.4° |
| H5 | C11 | C12 | H7 | 0.3° | 0.0° |
| H7 | C12 | N1 | H6 | 0.4° | 0.0° |
| H10 | C4 | C5 | H11 | 0.1° | 0.0° |
| H11 | C5 | C | H12 | 0.3° | 0.2° |
