VIX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C10 | O2 | sing | 1.43Å | 1.40Å | |
| C10 | C11 | sing | 1.53Å | 1.54Å | |
| C8 | C9 | sing | 1.53Å | 1.54Å | |
| C8 | N | sing | 1.47Å | 1.51Å | |
| C9 | O2 | sing | 1.43Å | 1.41Å | |
| C4 | C3 | doub | 1.38Å | 1.39Å | Aromatic |
| C4 | C5 | sing | 1.38Å | 1.40Å | Aromatic |
| C11 | N | sing | 1.47Å | 1.52Å | |
| C6 | N | sing | 1.47Å | 1.52Å | |
| C6 | C5 | sing | 1.51Å | 1.50Å | |
| C6 | C7 | sing | 1.51Å | 1.65Å | |
| C3 | C2 | sing | 1.38Å | 1.38Å | Aromatic |
| O | C7 | doub | 1.21Å | 1.23Å | |
| C5 | C | doub | 1.38Å | 1.40Å | Aromatic |
| C7 | O1 | sing | 1.34Å | 1.22Å | |
| C2 | CL | sing | 1.74Å | 1.70Å | |
| C2 | C1 | doub | 1.38Å | 1.39Å | Aromatic |
| C | C1 | sing | 1.38Å | 1.40Å | Aromatic |
| C8 | H1 | sing | 1.09Å | 1.10Å | |
| C8 | H2 | sing | 1.09Å | 1.10Å | |
| C9 | H3 | sing | 1.09Å | 1.10Å | |
| C9 | H4 | sing | 1.09Å | 1.10Å | |
| O1 | H5 | sing | 0.97Å | 0.95Å | |
| C1 | H6 | sing | 1.08Å | 1.08Å | |
| C6 | H7 | sing | 1.09Å | 1.10Å | |
| C4 | H8 | sing | 1.08Å | 1.08Å | |
| C3 | H9 | sing | 1.08Å | 1.08Å | |
| C | H10 | sing | 1.08Å | 1.08Å | |
| C11 | H12 | sing | 1.09Å | 1.10Å | |
| C11 | H13 | sing | 1.09Å | 1.10Å | |
| C10 | H14 | sing | 1.09Å | 1.10Å | |
| C10 | H15 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O2 | C10 | C11 | 109.8° | 109.3° |
| C10 | O2 | C9 | 114.4° | 113.7° |
| O2 | C10 | H14 | 109.4° | 109.5° |
| O2 | C10 | H15 | 109.4° | 109.5° |
| C10 | C11 | N | 111.0° | 109.2° |
| C10 | C11 | H12 | 109.1° | 109.5° |
| C10 | C11 | H13 | 109.1° | 109.5° |
| C11 | C10 | H14 | 109.4° | 109.5° |
| C11 | C10 | H15 | 109.4° | 109.5° |
| C9 | C8 | N | 107.0° | 109.3° |
| C8 | C9 | O2 | 112.5° | 109.3° |
| C9 | C8 | H1 | 110.1° | 109.5° |
| C9 | C8 | H2 | 110.1° | 109.5° |
| C8 | C9 | H3 | 108.7° | 109.5° |
| C8 | C9 | H4 | 108.7° | 109.5° |
| C8 | N | C11 | 108.7° | 110.8° |
| C8 | N | C6 | 109.4° | 111.0° |
| N | C8 | H1 | 110.1° | 109.5° |
| N | C8 | H2 | 110.1° | 109.4° |
| O2 | C9 | H3 | 108.7° | 109.5° |
| O2 | C9 | H4 | 108.7° | 109.5° |
| C3 | C4 | C5 | 121.2° | 120.0° |
| C4 | C3 | C2 | 118.3° | 120.0° |
| C3 | C4 | H8 | 119.4° | 120.0° |
| C4 | C3 | H9 | 120.8° | 120.0° |
| C4 | C5 | C6 | 118.1° | 120.0° |
| C4 | C5 | C | 119.3° | 120.1° |
| C5 | C4 | H8 | 119.4° | 120.0° |
| C11 | N | C6 | 110.4° | 111.0° |
| N | C11 | H12 | 109.1° | 109.5° |
| N | C11 | H13 | 109.1° | 109.5° |
| N | C6 | C5 | 111.9° | 109.4° |
| N | C6 | C7 | 106.4° | 109.5° |
| N | C6 | H7 | 109.4° | 109.4° |
| C5 | C6 | C7 | 111.5° | 109.5° |
| C6 | C5 | C | 122.6° | 120.0° |
| C5 | C6 | H7 | 109.6° | 109.5° |
| C6 | C7 | O | 113.0° | 120.1° |
| C6 | C7 | O1 | 114.1° | 120.0° |
| C7 | C6 | H7 | 107.8° | 109.5° |
| C3 | C2 | CL | 118.0° | 120.0° |
| C3 | C2 | C1 | 122.3° | 120.0° |
| C2 | C3 | H9 | 120.8° | 120.0° |
| O | C7 | O1 | 132.9° | 120.0° |
| C5 | C | C1 | 119.9° | 120.0° |
| C5 | C | H10 | 120.1° | 120.0° |
| C7 | O1 | H5 | 109.5° | 117.0° |
| CL | C2 | C1 | 119.3° | 120.0° |
| C2 | C1 | C | 118.8° | 119.9° |
| C2 | C1 | H6 | 120.6° | 120.0° |
| C | C1 | H6 | 120.6° | 120.0° |
| C1 | C | H10 | 120.0° | 120.0° |
| H1 | C8 | H2 | 109.5° | 109.6° |
| H3 | C9 | H4 | 109.5° | 109.6° |
| H12 | C11 | H13 | 109.4° | 109.6° |
| H14 | C10 | H15 | 109.5° | 109.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O2 | C10 | C11 | H14 | 120.1° | 119.9° |
| O2 | C10 | C11 | H15 | 120.0° | 119.9° |
| C10 | O2 | C9 | C8 | 22.7° | 58.7° |
| O2 | C10 | C11 | N | 38.1° | 56.9° |
| C10 | O2 | C9 | H3 | 97.8° | 178.6° |
| C10 | O2 | C9 | H4 | 143.1° | 61.3° |
| O2 | C10 | C11 | H12 | 158.3° | 176.8° |
| O2 | C10 | C11 | H13 | 82.1° | 63.1° |
| O2 | C10 | H14 | H15 | 119.8° | 120.1° |
| C10 | C11 | N | C8 | 24.8° | 58.6° |
| C11 | C10 | O2 | C9 | 65.4° | 58.7° |
| C10 | C11 | N | H12 | 120.2° | 119.9° |
| C10 | C11 | N | H13 | 120.3° | 119.9° |
| C10 | C11 | N | C6 | 144.9° | 177.6° |
| C10 | C11 | H12 | H13 | 119.3° | 120.1° |
| C11 | C10 | H14 | H15 | 119.8° | 120.1° |
| C9 | C8 | N | H1 | 119.6° | 120.0° |
| C9 | C8 | N | H2 | 119.6° | 119.9° |
| C8 | C9 | O2 | H3 | 120.5° | 119.9° |
| C8 | C9 | O2 | H4 | 120.4° | 120.0° |
| C9 | C8 | N | C11 | 64.8° | 58.6° |
| C9 | C8 | N | C6 | 174.5° | 177.6° |
| C9 | C8 | H1 | H2 | 121.1° | 120.2° |
| C8 | C9 | H3 | H4 | 118.6° | 120.2° |
| N | C8 | C9 | O2 | 42.3° | 56.9° |
| C8 | N | C11 | C6 | 120.1° | 123.8° |
| C8 | N | C6 | C5 | 67.0° | 55.9° |
| C8 | N | C6 | C7 | 171.0° | 175.9° |
| N | C8 | H1 | H2 | 121.1° | 120.0° |
| N | C8 | C9 | H3 | 162.8° | 176.8° |
| N | C8 | C9 | H4 | 78.2° | 63.1° |
| C8 | N | C6 | H7 | 54.7° | 64.1° |
| C8 | N | C11 | H12 | 95.5° | 178.5° |
| C8 | N | C11 | H13 | 145.1° | 61.3° |
| O2 | C9 | C8 | H1 | 161.9° | 176.8° |
| O2 | C9 | C8 | H2 | 77.3° | 63.0° |
| O2 | C9 | H3 | H4 | 118.6° | 120.1° |
| C9 | O2 | C10 | H14 | 54.7° | 61.2° |
| C9 | O2 | C10 | H15 | 174.6° | 178.6° |
| C3 | C4 | C5 | H8 | 180.0° | 179.8° |
| C3 | C4 | C5 | C6 | 178.0° | 179.7° |
| C4 | C3 | C2 | H9 | 180.0° | 179.7° |
| C3 | C4 | C5 | C | 1.0° | 0.3° |
| C4 | C3 | C2 | CL | 170.2° | 180.0° |
| C4 | C3 | C2 | C1 | 2.0° | 0.0° |
| C4 | C5 | C6 | N | 107.4° | 43.1° |
| C4 | C5 | C6 | C | 178.9° | 180.0° |
| C4 | C5 | C6 | C7 | 133.6° | 76.9° |
| C5 | C4 | C3 | C2 | 0.6° | 0.2° |
| C4 | C5 | C | C1 | 1.3° | 0.1° |
| C4 | C5 | C6 | H7 | 14.2° | 163.1° |
| C5 | C4 | C3 | H9 | 179.4° | 180.0° |
| C4 | C5 | C | H10 | 178.7° | 180.0° |
| C11 | N | C6 | C5 | 173.4° | 179.5° |
| C11 | N | C6 | C7 | 51.4° | 60.4° |
| C11 | N | C8 | H1 | 175.6° | 178.6° |
| C11 | N | C8 | H2 | 54.8° | 61.3° |
| C11 | N | C6 | H7 | 64.9° | 59.6° |
| N | C11 | H12 | H13 | 119.3° | 120.1° |
| N | C11 | C10 | H14 | 82.0° | 63.1° |
| N | C11 | C10 | H15 | 158.2° | 176.8° |
| N | C6 | C5 | C7 | 119.0° | 120.0° |
| N | C6 | C5 | H7 | 121.6° | 119.9° |
| N | C6 | C7 | H7 | 117.3° | 120.0° |
| N | C6 | C7 | O | 156.4° | 28.0° |
| N | C6 | C5 | C | 73.7° | 136.9° |
| N | C6 | C7 | O1 | 22.9° | 152.3° |
| C6 | N | C8 | H1 | 54.9° | 57.6° |
| C6 | N | C8 | H2 | 65.8° | 62.5° |
| C6 | N | C11 | H12 | 24.6° | 57.7° |
| C6 | N | C11 | H13 | 94.9° | 62.5° |
| C5 | C6 | C7 | H7 | 120.4° | 120.0° |
| C5 | C6 | C7 | O | 81.4° | 92.0° |
| C5 | C6 | C7 | O1 | 99.3° | 87.7° |
| C6 | C5 | C | C1 | 177.6° | 179.9° |
| C6 | C5 | C4 | H8 | 2.0° | 0.0° |
| C6 | C5 | C | H10 | 2.3° | 0.0° |
| C6 | C7 | O | O1 | 179.1° | 179.7° |
| C7 | C6 | C5 | C | 45.4° | 103.1° |
| C6 | C7 | O1 | H5 | 179.1° | 180.0° |
| C3 | C2 | CL | C1 | 172.4° | 180.0° |
| C3 | C2 | C1 | C | 1.7° | 0.1° |
| C3 | C2 | C1 | H6 | 178.3° | 180.0° |
| C2 | C3 | C4 | H8 | 179.3° | 180.0° |
| O | C7 | O1 | H5 | 0.0° | 0.3° |
| O | C7 | C6 | H7 | 39.0° | 148.0° |
| C5 | C | C1 | C2 | 0.0° | 0.1° |
| C5 | C | C1 | H10 | 180.0° | 179.9° |
| C5 | C | C1 | H6 | 180.0° | 180.0° |
| C | C5 | C6 | H7 | 164.7° | 17.0° |
| C | C5 | C4 | H8 | 179.1° | 180.0° |
| O1 | C7 | C6 | H7 | 140.2° | 32.3° |
| CL | C2 | C1 | C | 170.4° | 179.8° |
| CL | C2 | C1 | H6 | 9.6° | 0.0° |
| CL | C2 | C3 | H9 | 9.8° | 0.3° |
| C2 | C1 | C | H6 | 180.0° | 179.9° |
| C1 | C2 | C3 | H9 | 178.0° | 179.8° |
| C2 | C1 | C | H10 | 180.0° | 179.8° |
| H1 | C8 | C9 | H3 | 77.6° | 63.3° |
| H1 | C8 | C9 | H4 | 41.5° | 56.8° |
| H2 | C8 | C9 | H3 | 43.2° | 56.9° |
| H2 | C8 | C9 | H4 | 162.2° | 177.0° |
| H6 | C1 | C | H10 | 0.0° | 0.1° |
| H8 | C4 | C3 | H9 | 0.6° | 0.3° |
| H12 | C11 | C10 | H14 | 38.3° | 56.8° |
| H12 | C11 | C10 | H15 | 81.6° | 63.3° |
| H13 | C11 | C10 | H14 | 157.8° | 177.0° |
| H13 | C11 | C10 | H15 | 37.9° | 56.8° |
