VL8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C4 | N | sing | 1.46Å | 1.45Å | |
| O | C3 | doub | 1.21Å | 1.23Å | |
| N | C3 | sing | 1.35Å | 1.33Å | |
| C3 | C2 | sing | 1.51Å | 1.52Å | |
| C1 | C2 | sing | 1.53Å | 1.52Å | |
| C1 | C | sing | 1.53Å | 1.50Å | |
| C2 | O1 | sing | 1.43Å | 1.43Å | |
| CL | C9 | sing | 1.74Å | 1.73Å | |
| C10 | C9 | doub | 1.38Å | 1.38Å | Aromatic |
| C10 | C5 | sing | 1.39Å | 1.39Å | Aromatic |
| O1 | C5 | sing | 1.36Å | 1.37Å | |
| C9 | C8 | sing | 1.39Å | 1.39Å | Aromatic |
| C5 | C6 | doub | 1.39Å | 1.38Å | Aromatic |
| C8 | CL1 | sing | 1.74Å | 1.74Å | |
| C8 | C7 | doub | 1.38Å | 1.38Å | Aromatic |
| C6 | C7 | sing | 1.38Å | 1.38Å | Aromatic |
| C7 | H1 | sing | 1.08Å | 1.08Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C6 | H4 | sing | 1.08Å | 1.08Å | |
| C4 | H5 | sing | 1.09Å | 1.10Å | |
| C4 | H6 | sing | 1.09Å | 1.10Å | |
| C4 | H7 | sing | 1.09Å | 1.10Å | |
| C2 | H8 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.08Å | 1.08Å | |
| C | H10 | sing | 1.09Å | 1.10Å | |
| C | H11 | sing | 1.09Å | 1.10Å | |
| C | H12 | sing | 1.09Å | 1.10Å | |
| N | H13 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C4 | N | C3 | 122.1° | 120.0° |
| N | C4 | H5 | 109.5° | 109.5° |
| N | C4 | H6 | 109.5° | 109.5° |
| N | C4 | H7 | 109.5° | 109.5° |
| C4 | N | H13 | 119.0° | 120.0° |
| O | C3 | N | 123.3° | 120.0° |
| O | C3 | C2 | 119.4° | 120.0° |
| N | C3 | C2 | 117.3° | 120.0° |
| C3 | N | H13 | 119.0° | 120.0° |
| C3 | C2 | C1 | 107.8° | 109.5° |
| C3 | C2 | O1 | 112.3° | 109.4° |
| C3 | C2 | H8 | 109.8° | 109.5° |
| C2 | C1 | C | 109.7° | 109.4° |
| C1 | C2 | O1 | 105.8° | 109.4° |
| C2 | C1 | H2 | 109.4° | 109.5° |
| C2 | C1 | H3 | 109.4° | 109.5° |
| C1 | C2 | H8 | 109.9° | 109.5° |
| C | C1 | H2 | 109.4° | 109.5° |
| C | C1 | H3 | 109.4° | 109.5° |
| C1 | C | H10 | 109.5° | 109.4° |
| C1 | C | H11 | 109.4° | 109.5° |
| C1 | C | H12 | 109.4° | 109.5° |
| C2 | O1 | C5 | 116.3° | 116.9° |
| O1 | C2 | H8 | 111.1° | 109.5° |
| CL | C9 | C10 | 118.7° | 120.0° |
| CL | C9 | C8 | 120.9° | 120.0° |
| C9 | C10 | C5 | 119.3° | 119.9° |
| C10 | C9 | C8 | 120.4° | 120.1° |
| C9 | C10 | H9 | 120.3° | 120.0° |
| C10 | C5 | O1 | 123.7° | 120.0° |
| C10 | C5 | C6 | 120.5° | 119.9° |
| C5 | C10 | H9 | 120.4° | 120.1° |
| O1 | C5 | C6 | 115.8° | 120.1° |
| C9 | C8 | CL1 | 121.1° | 120.0° |
| C9 | C8 | C7 | 119.8° | 120.0° |
| C5 | C6 | C7 | 119.7° | 120.0° |
| C5 | C6 | H4 | 120.1° | 120.0° |
| CL1 | C8 | C7 | 119.1° | 120.0° |
| C8 | C7 | C6 | 120.2° | 120.1° |
| C8 | C7 | H1 | 119.9° | 119.9° |
| C6 | C7 | H1 | 119.9° | 120.0° |
| C7 | C6 | H4 | 120.1° | 120.0° |
| H2 | C1 | H3 | 109.4° | 109.4° |
| H5 | C4 | H6 | 109.5° | 109.4° |
| H5 | C4 | H7 | 109.4° | 109.4° |
| H6 | C4 | H7 | 109.5° | 109.5° |
| H10 | C | H11 | 109.5° | 109.5° |
| H10 | C | H12 | 109.5° | 109.5° |
| H11 | C | H12 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C4 | N | C3 | O | 6.7° | 0.0° |
| C4 | N | C3 | H13 | 180.0° | 180.0° |
| C4 | N | C3 | C2 | 173.5° | 180.0° |
| N | C4 | H5 | H6 | 120.0° | 120.0° |
| N | C4 | H5 | H7 | 120.0° | 120.0° |
| N | C4 | H6 | H7 | 120.0° | 120.0° |
| O | C3 | N | C2 | 179.8° | 180.0° |
| O | C3 | C2 | C1 | 80.4° | 115.0° |
| O | C3 | C2 | O1 | 163.5° | 5.0° |
| O | C3 | C2 | H8 | 39.3° | 125.0° |
| O | C3 | N | H13 | 173.3° | 180.0° |
| N | C3 | C2 | C1 | 99.4° | 65.0° |
| N | C3 | C2 | O1 | 16.8° | 175.0° |
| C3 | N | C4 | H5 | 180.0° | 180.0° |
| C3 | N | C4 | H6 | 60.0° | 60.0° |
| C3 | N | C4 | H7 | 60.0° | 60.0° |
| N | C3 | C2 | H8 | 140.9° | 55.0° |
| C3 | C2 | C1 | O1 | 120.3° | 119.9° |
| C3 | C2 | C1 | H8 | 119.6° | 120.0° |
| C3 | C2 | C1 | C | 178.9° | 175.0° |
| C3 | C2 | O1 | H8 | 123.4° | 120.0° |
| C3 | C2 | O1 | C5 | 58.8° | 146.1° |
| C3 | C2 | C1 | H2 | 58.9° | 55.0° |
| C3 | C2 | C1 | H3 | 61.0° | 64.9° |
| C2 | C3 | N | H13 | 6.5° | 0.0° |
| C2 | C1 | C | H2 | 120.1° | 120.0° |
| C2 | C1 | C | H3 | 120.1° | 120.0° |
| C1 | C2 | O1 | H8 | 119.2° | 120.1° |
| C1 | C2 | O1 | C5 | 176.1° | 94.0° |
| C2 | C1 | H2 | H3 | 119.9° | 120.0° |
| C2 | C1 | C | H10 | 180.0° | 180.0° |
| C2 | C1 | C | H11 | 60.0° | 60.0° |
| C2 | C1 | C | H12 | 60.0° | 60.0° |
| C | C1 | C2 | O1 | 60.8° | 65.0° |
| C | C1 | H2 | H3 | 119.9° | 120.0° |
| C | C1 | C2 | H8 | 59.3° | 55.0° |
| C1 | C | H10 | H11 | 120.0° | 120.0° |
| C1 | C | H10 | H12 | 120.0° | 120.0° |
| C1 | C | H11 | H12 | 119.9° | 120.0° |
| C2 | O1 | C5 | C10 | 6.1° | 177.2° |
| C2 | O1 | C5 | C6 | 172.8° | 2.6° |
| O1 | C2 | C1 | H2 | 179.2° | 174.9° |
| O1 | C2 | C1 | H3 | 59.3° | 55.0° |
| CL | C9 | C10 | C8 | 178.0° | 180.0° |
| CL | C9 | C10 | C5 | 177.1° | 179.8° |
| CL | C9 | C8 | CL1 | 6.6° | 0.0° |
| CL | C9 | C8 | C7 | 176.3° | 179.9° |
| CL | C9 | C10 | H9 | 2.8° | 0.0° |
| C9 | C10 | C5 | H9 | 180.0° | 179.8° |
| C9 | C10 | C5 | O1 | 178.6° | 179.7° |
| C9 | C10 | C5 | C6 | 0.2° | 0.2° |
| C10 | C9 | C8 | CL1 | 175.5° | 180.0° |
| C10 | C9 | C8 | C7 | 1.7° | 0.0° |
| C10 | C5 | O1 | C6 | 178.9° | 179.9° |
| C5 | C10 | C9 | C8 | 0.9° | 0.2° |
| C10 | C5 | C6 | C7 | 0.5° | 0.1° |
| C10 | C5 | C6 | H4 | 179.6° | 180.0° |
| O1 | C5 | C6 | C7 | 178.5° | 180.0° |
| O1 | C5 | C6 | H4 | 1.5° | 0.1° |
| C5 | O1 | C2 | H8 | 64.6° | 26.1° |
| O1 | C5 | C10 | H9 | 1.4° | 0.1° |
| C9 | C8 | CL1 | C7 | 177.2° | 180.0° |
| C9 | C8 | C7 | C6 | 1.4° | 0.3° |
| C9 | C8 | C7 | H1 | 178.6° | 180.0° |
| C8 | C9 | C10 | H9 | 179.2° | 180.0° |
| C5 | C6 | C7 | C8 | 0.4° | 0.3° |
| C5 | C6 | C7 | H4 | 180.0° | 179.9° |
| C5 | C6 | C7 | H1 | 179.6° | 180.0° |
| C6 | C5 | C10 | H9 | 179.8° | 180.0° |
| CL1 | C8 | C7 | C6 | 175.8° | 179.7° |
| CL1 | C8 | C7 | H1 | 4.2° | 0.1° |
| C8 | C7 | C6 | H1 | 180.0° | 179.6° |
| C8 | C7 | C6 | H4 | 179.6° | 179.8° |
| H1 | C7 | C6 | H4 | 0.4° | 0.1° |
| H2 | C1 | C2 | H8 | 60.8° | 65.0° |
| H2 | C1 | C | H10 | 59.9° | 60.0° |
| H2 | C1 | C | H11 | 179.9° | 180.0° |
| H2 | C1 | C | H12 | 60.1° | 60.0° |
| H3 | C1 | C2 | H8 | 179.3° | 175.1° |
| H3 | C1 | C | H10 | 59.9° | 60.0° |
| H3 | C1 | C | H11 | 60.1° | 60.0° |
| H3 | C1 | C | H12 | 180.0° | 180.0° |
| H5 | C4 | H6 | H7 | 120.0° | 119.9° |
| H5 | C4 | N | H13 | 0.0° | 0.0° |
| H6 | C4 | N | H13 | 120.1° | 120.0° |
| H7 | C4 | N | H13 | 120.0° | 120.0° |
| H10 | C | H11 | H12 | 120.0° | 120.0° |
