V1O
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C4 | O | sing | 1.43Å | 1.44Å | |
| O | C3 | sing | 1.36Å | 1.37Å | |
| BR | C | sing | 1.97Å | 1.95Å | |
| C | C1 | sing | 1.53Å | 1.51Å | |
| C1 | C2 | sing | 1.51Å | 1.52Å | |
| C3 | C2 | doub | 1.39Å | 1.40Å | Aromatic |
| C3 | C5 | sing | 1.38Å | 1.39Å | Aromatic |
| C2 | C15 | sing | 1.39Å | 1.39Å | Aromatic |
| C5 | C6 | doub | 1.40Å | 1.40Å | Aromatic |
| C15 | O3 | sing | 1.36Å | 1.36Å | |
| C15 | C14 | doub | 1.38Å | 1.38Å | Aromatic |
| C6 | C14 | sing | 1.40Å | 1.39Å | Aromatic |
| C6 | N | sing | 1.37Å | 1.46Å | |
| O3 | C16 | sing | 1.43Å | 1.41Å | |
| N | N1 | doub | 1.29Å | 1.26Å | |
| N1 | C7 | sing | 1.37Å | 1.46Å | |
| C13 | C7 | doub | 1.40Å | 1.39Å | Aromatic |
| C13 | C12 | sing | 1.38Å | 1.39Å | Aromatic |
| C7 | C8 | sing | 1.40Å | 1.39Å | Aromatic |
| C12 | C10 | doub | 1.39Å | 1.39Å | Aromatic |
| C8 | C9 | doub | 1.38Å | 1.39Å | Aromatic |
| C10 | C9 | sing | 1.39Å | 1.41Å | Aromatic |
| C10 | O2 | sing | 1.36Å | 1.37Å | |
| C9 | O1 | sing | 1.36Å | 1.36Å | |
| O2 | C11 | sing | 1.43Å | 1.44Å | |
| C8 | H1 | sing | 1.08Å | 1.08Å | |
| C11 | H2 | sing | 1.09Å | 1.10Å | |
| C11 | H3 | sing | 1.09Å | 1.10Å | |
| C11 | H4 | sing | 1.09Å | 1.10Å | |
| C12 | H13 | sing | 1.08Å | 1.08Å | |
| O1 | H5 | sing | 0.97Å | 0.95Å | |
| C1 | H6 | sing | 1.09Å | 1.10Å | |
| C1 | H7 | sing | 1.09Å | 1.10Å | |
| C4 | H8 | sing | 1.09Å | 1.10Å | |
| C4 | H9 | sing | 1.09Å | 1.10Å | |
| C4 | H10 | sing | 1.09Å | 1.10Å | |
| C5 | H11 | sing | 1.08Å | 1.08Å | |
| C | H | sing | 1.09Å | 1.10Å | |
| C | H19 | sing | 1.09Å | 1.10Å | |
| C13 | H14 | sing | 1.08Å | 1.08Å | |
| C14 | H15 | sing | 1.08Å | 1.08Å | |
| C16 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | H17 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C4 | O | C3 | 118.7° | 117.0° |
| O | C4 | H8 | 109.5° | 109.5° |
| O | C4 | H9 | 109.5° | 109.4° |
| O | C4 | H10 | 109.5° | 109.5° |
| O | C3 | C2 | 115.2° | 119.9° |
| O | C3 | C5 | 123.6° | 120.0° |
| BR | C | C1 | 112.8° | 109.4° |
| BR | C | H | 108.7° | 109.5° |
| BR | C | H19 | 108.7° | 109.5° |
| C | C1 | C2 | 112.0° | 109.4° |
| C | C1 | H6 | 108.8° | 109.4° |
| C | C1 | H7 | 108.8° | 109.5° |
| C1 | C | H | 108.6° | 109.4° |
| C1 | C | H19 | 108.6° | 109.5° |
| C1 | C2 | C3 | 131.0° | 119.9° |
| C1 | C2 | C15 | 111.0° | 119.9° |
| C2 | C1 | H6 | 108.8° | 109.5° |
| C2 | C1 | H7 | 108.8° | 109.5° |
| C2 | C3 | C5 | 121.1° | 120.1° |
| C3 | C2 | C15 | 117.2° | 120.2° |
| C3 | C5 | C6 | 119.6° | 119.9° |
| C3 | C5 | H11 | 120.2° | 120.0° |
| C2 | C15 | O3 | 113.6° | 120.0° |
| C2 | C15 | C14 | 121.4° | 120.1° |
| C5 | C6 | C14 | 119.4° | 119.8° |
| C5 | C6 | N | 122.6° | 120.1° |
| C6 | C5 | H11 | 120.2° | 120.1° |
| O3 | C15 | C14 | 122.3° | 119.9° |
| C15 | O3 | C16 | 118.9° | 117.0° |
| C15 | C14 | C6 | 119.9° | 119.9° |
| C15 | C14 | H15 | 120.0° | 120.1° |
| C14 | C6 | N | 117.9° | 120.1° |
| C6 | C14 | H15 | 120.1° | 120.0° |
| C6 | N | N1 | 116.5° | 120.0° |
| O3 | C16 | H18 | 109.5° | 109.5° |
| O3 | C16 | H17 | 109.5° | 109.4° |
| O3 | C16 | H16 | 109.5° | 109.5° |
| N | N1 | C7 | 118.2° | 120.0° |
| N1 | C7 | C13 | 118.4° | 120.0° |
| N1 | C7 | C8 | 122.0° | 120.1° |
| C7 | C13 | C12 | 120.7° | 119.9° |
| C13 | C7 | C8 | 119.5° | 119.9° |
| C7 | C13 | H14 | 119.7° | 120.0° |
| C13 | C12 | C10 | 119.8° | 120.2° |
| C13 | C12 | H13 | 120.1° | 119.9° |
| C12 | C13 | H14 | 119.7° | 120.0° |
| C7 | C8 | C9 | 120.3° | 119.8° |
| C7 | C8 | H1 | 119.8° | 120.1° |
| C12 | C10 | C9 | 120.1° | 120.2° |
| C12 | C10 | O2 | 125.0° | 119.9° |
| C10 | C12 | H13 | 120.1° | 119.9° |
| C8 | C9 | C10 | 119.5° | 120.0° |
| C8 | C9 | O1 | 117.7° | 120.0° |
| C9 | C8 | H1 | 119.9° | 120.1° |
| C9 | C10 | O2 | 115.0° | 119.9° |
| C10 | C9 | O1 | 122.7° | 120.0° |
| C10 | O2 | C11 | 118.4° | 117.0° |
| C9 | O1 | H5 | 109.5° | 114.0° |
| O2 | C11 | H2 | 109.5° | 109.5° |
| O2 | C11 | H3 | 109.4° | 109.5° |
| O2 | C11 | H4 | 109.5° | 109.5° |
| H2 | C11 | H3 | 109.5° | 109.5° |
| H2 | C11 | H4 | 109.4° | 109.5° |
| H3 | C11 | H4 | 109.5° | 109.4° |
| H6 | C1 | H7 | 109.5° | 109.5° |
| H8 | C4 | H9 | 109.5° | 109.5° |
| H8 | C4 | H10 | 109.4° | 109.5° |
| H9 | C4 | H10 | 109.5° | 109.5° |
| H | C | H19 | 109.5° | 109.5° |
| H18 | C16 | H17 | 109.5° | 109.5° |
| H18 | C16 | H16 | 109.5° | 109.6° |
| H17 | C16 | H16 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C4 | O | C3 | C2 | 69.4° | 174.9° |
| C4 | O | C3 | C5 | 112.6° | 5.1° |
| O | C4 | H8 | H9 | 120.0° | 120.0° |
| O | C4 | H8 | H10 | 120.0° | 120.0° |
| O | C4 | H9 | H10 | 120.0° | 120.0° |
| O | C3 | C2 | C1 | 16.4° | 0.0° |
| O | C3 | C2 | C5 | 178.1° | 180.0° |
| O | C3 | C2 | C15 | 174.4° | 179.8° |
| O | C3 | C5 | C6 | 176.1° | 180.0° |
| C3 | O | C4 | H8 | 180.0° | 175.2° |
| C3 | O | C4 | H9 | 60.0° | 55.2° |
| C3 | O | C4 | H10 | 60.0° | 64.8° |
| O | C3 | C5 | H11 | 4.0° | 0.1° |
| BR | C | C1 | H | 120.5° | 119.9° |
| BR | C | C1 | H19 | 120.5° | 120.0° |
| BR | C | C1 | C2 | 151.2° | 180.0° |
| BR | C | C1 | H6 | 88.5° | 60.1° |
| BR | C | C1 | H7 | 30.8° | 60.0° |
| BR | C | H | H19 | 118.5° | 120.1° |
| C | C1 | C2 | H6 | 120.4° | 119.9° |
| C | C1 | C2 | H7 | 120.4° | 120.0° |
| C | C1 | C2 | C3 | 103.9° | 89.7° |
| C | C1 | C2 | C15 | 86.4° | 90.0° |
| C | C1 | H6 | H7 | 118.9° | 120.0° |
| C1 | C | H | H19 | 118.5° | 120.0° |
| C1 | C2 | C3 | C15 | 169.2° | 179.7° |
| C1 | C2 | C3 | C5 | 161.7° | 180.0° |
| C1 | C2 | C15 | O3 | 40.3° | 0.0° |
| C1 | C2 | C15 | C14 | 158.1° | 179.7° |
| C2 | C1 | H6 | H7 | 118.8° | 120.1° |
| C2 | C1 | C | H | 30.7° | 60.1° |
| C2 | C1 | C | H19 | 88.3° | 60.0° |
| C2 | C3 | C5 | C6 | 1.9° | 0.0° |
| C3 | C2 | C15 | O3 | 148.5° | 179.8° |
| C3 | C2 | C15 | C14 | 13.2° | 0.5° |
| C3 | C2 | C1 | H6 | 16.5° | 30.2° |
| C3 | C2 | C1 | H7 | 135.7° | 150.3° |
| C2 | C3 | C5 | H11 | 178.1° | 179.9° |
| C5 | C3 | C2 | C15 | 7.5° | 0.2° |
| C3 | C5 | C6 | H11 | 180.0° | 179.9° |
| C3 | C5 | C6 | C14 | 5.9° | 0.0° |
| C3 | C5 | C6 | N | 173.8° | 180.0° |
| C2 | C15 | O3 | C14 | 161.4° | 179.7° |
| C2 | C15 | C14 | C6 | 9.4° | 0.5° |
| C2 | C15 | O3 | C16 | 132.3° | 175.1° |
| C15 | C2 | C1 | H6 | 153.3° | 150.0° |
| C15 | C2 | C1 | H7 | 34.0° | 30.0° |
| C2 | C15 | C14 | H15 | 170.6° | 179.8° |
| C5 | C6 | C14 | C15 | 0.4° | 0.3° |
| C5 | C6 | C14 | N | 179.8° | 180.0° |
| C5 | C6 | N | N1 | 92.1° | 17.0° |
| C5 | C6 | C14 | H15 | 179.6° | 179.9° |
| O3 | C15 | C14 | C6 | 150.6° | 179.8° |
| O3 | C15 | C14 | H15 | 29.4° | 0.1° |
| C15 | O3 | C16 | H18 | 180.0° | 55.2° |
| C15 | O3 | C16 | H17 | 60.0° | 64.8° |
| C15 | O3 | C16 | H16 | 60.0° | 175.2° |
| C15 | C14 | C6 | H15 | 180.0° | 179.7° |
| C15 | C14 | C6 | N | 179.3° | 179.7° |
| C14 | C15 | O3 | C16 | 66.2° | 5.2° |
| C14 | C6 | N | N1 | 88.2° | 163.0° |
| C14 | C6 | C5 | H11 | 174.1° | 179.9° |
| C6 | N | N1 | C7 | 74.8° | 31.8° |
| N | C6 | C5 | H11 | 6.2° | 0.1° |
| N | C6 | C14 | H15 | 0.6° | 0.0° |
| O3 | C16 | H18 | H17 | 120.0° | 119.9° |
| O3 | C16 | H18 | H16 | 120.0° | 120.0° |
| O3 | C16 | H17 | H16 | 120.0° | 120.0° |
| N | N1 | C7 | C13 | 89.9° | 163.7° |
| N | N1 | C7 | C8 | 92.8° | 16.6° |
| N1 | C7 | C13 | C8 | 177.4° | 179.7° |
| N1 | C7 | C13 | C12 | 175.7° | 179.7° |
| N1 | C7 | C8 | C9 | 176.6° | 179.7° |
| N1 | C7 | C8 | H1 | 3.5° | 0.3° |
| N1 | C7 | C13 | H14 | 4.3° | 0.2° |
| C7 | C13 | C12 | H14 | 180.0° | 179.9° |
| C7 | C13 | C12 | C10 | 0.6° | 0.0° |
| C13 | C7 | C8 | C9 | 0.8° | 0.0° |
| C13 | C7 | C8 | H1 | 179.2° | 180.0° |
| C7 | C13 | C12 | H13 | 179.4° | 180.0° |
| C12 | C13 | C7 | C8 | 1.7° | 0.0° |
| C13 | C12 | C10 | H13 | 180.0° | 180.0° |
| C13 | C12 | C10 | C9 | 1.4° | 0.0° |
| C13 | C12 | C10 | O2 | 177.6° | 180.0° |
| C7 | C8 | C9 | H1 | 180.0° | 180.0° |
| C7 | C8 | C9 | C10 | 1.3° | 0.0° |
| C7 | C8 | C9 | O1 | 176.5° | 180.0° |
| C8 | C7 | C13 | H14 | 178.3° | 179.9° |
| C12 | C10 | C9 | C8 | 2.3° | 0.0° |
| C12 | C10 | C9 | O2 | 179.1° | 180.0° |
| C12 | C10 | C9 | O1 | 175.3° | 180.0° |
| C12 | C10 | O2 | C11 | 109.1° | 5.2° |
| C10 | C12 | C13 | H14 | 179.4° | 179.9° |
| C8 | C9 | C10 | O1 | 177.6° | 180.0° |
| C8 | C9 | C10 | O2 | 176.7° | 180.0° |
| C8 | C9 | O1 | H5 | 180.0° | 95.0° |
| C9 | C10 | O2 | C11 | 69.9° | 174.9° |
| C10 | C9 | C8 | H1 | 178.8° | 180.0° |
| C9 | C10 | C12 | H13 | 178.6° | 180.0° |
| C10 | C9 | O1 | H5 | 2.3° | 85.1° |
| O2 | C10 | C9 | O1 | 5.6° | 0.0° |
| C10 | O2 | C11 | H2 | 180.0° | 65.0° |
| C10 | O2 | C11 | H3 | 60.0° | 55.0° |
| C10 | O2 | C11 | H4 | 60.0° | 175.0° |
| O2 | C10 | C12 | H13 | 2.5° | 0.1° |
| O1 | C9 | C8 | H1 | 3.5° | 0.0° |
| O2 | C11 | H2 | H3 | 120.0° | 120.1° |
| O2 | C11 | H2 | H4 | 120.0° | 120.0° |
| O2 | C11 | H3 | H4 | 120.0° | 120.0° |
| H2 | C11 | H3 | H4 | 120.0° | 120.0° |
| H13 | C12 | C13 | H14 | 0.6° | 0.1° |
| H6 | C1 | C | H | 151.0° | 180.0° |
| H6 | C1 | C | H19 | 32.0° | 60.0° |
| H7 | C1 | C | H | 89.7° | 60.0° |
| H7 | C1 | C | H19 | 151.3° | 180.0° |
| H8 | C4 | H9 | H10 | 119.9° | 120.0° |
| H18 | C16 | H17 | H16 | 120.0° | 120.1° |
