VJX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C19 | C20 | sing | 1.39Å | 1.41Å | Aromatic |
| C19 | C14 | doub | 1.37Å | 1.37Å | Aromatic |
| C20 | C17 | doub | 1.38Å | 1.37Å | Aromatic |
| O05 | C18 | doub | 1.22Å | 1.21Å | |
| C14 | C11 | sing | 1.40Å | 1.41Å | Aromatic |
| C17 | C12 | sing | 1.39Å | 1.41Å | Aromatic |
| O02 | C16 | doub | 1.21Å | 1.22Å | |
| C11 | C12 | doub | 1.41Å | 1.43Å | Aromatic |
| C11 | C10 | sing | 1.46Å | 1.50Å | |
| C12 | N07 | sing | 1.38Å | 1.41Å | |
| C16 | C09 | sing | 1.51Å | 1.62Å | |
| C16 | O04 | sing | 1.34Å | 1.27Å | |
| C18 | N06 | sing | 1.35Å | 1.39Å | |
| C18 | C21 | sing | 1.48Å | 1.57Å | |
| C09 | N06 | sing | 1.46Å | 1.50Å | |
| C09 | C08 | sing | 1.53Å | 1.56Å | |
| C22 | C21 | doub | 1.40Å | 1.40Å | Aromatic |
| C22 | C24 | sing | 1.38Å | 1.41Å | Aromatic |
| C21 | C23 | sing | 1.40Å | 1.42Å | Aromatic |
| C08 | C10 | sing | 1.51Å | 1.55Å | |
| N07 | C15 | sing | 1.34Å | 1.45Å | |
| C10 | C13 | doub | 1.36Å | 1.32Å | |
| C24 | C26 | doub | 1.39Å | 1.40Å | Aromatic |
| C13 | C15 | sing | 1.41Å | 1.50Å | |
| C15 | O03 | doub | 1.22Å | 1.20Å | |
| C23 | C25 | doub | 1.38Å | 1.41Å | Aromatic |
| C26 | C25 | sing | 1.38Å | 1.40Å | Aromatic |
| C26 | CL01 | sing | 1.74Å | 1.81Å | |
| C13 | H1 | sing | 1.08Å | 1.08Å | |
| C17 | H2 | sing | 1.08Å | 1.08Å | |
| C20 | H3 | sing | 1.08Å | 1.08Å | |
| C22 | H4 | sing | 1.08Å | 1.08Å | |
| C24 | H5 | sing | 1.08Å | 1.08Å | |
| O04 | H6 | sing | 0.97Å | 0.95Å | |
| N06 | H7 | sing | 0.97Å | 1.00Å | |
| N07 | H8 | sing | 0.97Å | 1.00Å | |
| C08 | H9 | sing | 1.09Å | 1.10Å | |
| C08 | H10 | sing | 1.09Å | 1.10Å | |
| C09 | H11 | sing | 1.09Å | 1.10Å | |
| C14 | H12 | sing | 1.08Å | 1.08Å | |
| C19 | H13 | sing | 1.08Å | 1.08Å | |
| C23 | H14 | sing | 1.08Å | 1.08Å | |
| C25 | H15 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C20 | C19 | C14 | 119.8° | 120.6° |
| C19 | C20 | C17 | 120.2° | 120.7° |
| C19 | C20 | H3 | 119.9° | 119.7° |
| C20 | C19 | H13 | 120.1° | 119.7° |
| C19 | C14 | C11 | 123.2° | 119.7° |
| C19 | C14 | H12 | 118.4° | 120.1° |
| C14 | C19 | H13 | 120.1° | 119.7° |
| C20 | C17 | C12 | 119.4° | 119.7° |
| C20 | C17 | H2 | 120.3° | 120.1° |
| C17 | C20 | H3 | 119.9° | 119.6° |
| O05 | C18 | N06 | 121.8° | 120.0° |
| O05 | C18 | C21 | 117.1° | 120.0° |
| C14 | C11 | C12 | 115.3° | 119.8° |
| C14 | C11 | C10 | 125.7° | 121.2° |
| C11 | C14 | H12 | 118.4° | 120.1° |
| C17 | C12 | C11 | 122.1° | 119.4° |
| C17 | C12 | N07 | 117.8° | 121.0° |
| C12 | C17 | H2 | 120.3° | 120.1° |
| O02 | C16 | C09 | 116.0° | 120.0° |
| O02 | C16 | O04 | 129.5° | 120.0° |
| C12 | C11 | C10 | 119.0° | 119.0° |
| C11 | C12 | N07 | 120.1° | 119.6° |
| C11 | C10 | C08 | 117.5° | 120.7° |
| C11 | C10 | C13 | 118.3° | 118.5° |
| C12 | N07 | C15 | 122.9° | 121.0° |
| C12 | N07 | H8 | 118.6° | 119.5° |
| C09 | C16 | O04 | 114.5° | 120.0° |
| C16 | C09 | N06 | 111.2° | 109.5° |
| C16 | C09 | C08 | 111.8° | 109.5° |
| C16 | C09 | H11 | 107.3° | 109.4° |
| C16 | O04 | H6 | 109.5° | 117.0° |
| N06 | C18 | C21 | 121.1° | 120.0° |
| C18 | N06 | C09 | 127.1° | 120.0° |
| C18 | N06 | H7 | 116.5° | 120.0° |
| C18 | C21 | C22 | 122.1° | 120.1° |
| C18 | C21 | C23 | 122.0° | 120.1° |
| N06 | C09 | C08 | 109.5° | 109.5° |
| C09 | N06 | H7 | 116.4° | 119.9° |
| N06 | C09 | H11 | 108.8° | 109.5° |
| C09 | C08 | C10 | 110.6° | 109.5° |
| C09 | C08 | H9 | 109.2° | 109.5° |
| C09 | C08 | H10 | 109.2° | 109.4° |
| C08 | C09 | H11 | 108.0° | 109.5° |
| C21 | C22 | C24 | 123.4° | 119.9° |
| C22 | C21 | C23 | 116.0° | 119.8° |
| C21 | C22 | H4 | 118.3° | 120.1° |
| C22 | C24 | C26 | 117.8° | 120.1° |
| C24 | C22 | H4 | 118.3° | 120.1° |
| C22 | C24 | H5 | 121.1° | 119.9° |
| C21 | C23 | C25 | 122.8° | 119.9° |
| C21 | C23 | H14 | 118.6° | 120.1° |
| C08 | C10 | C13 | 124.1° | 120.7° |
| C10 | C08 | H9 | 109.2° | 109.5° |
| C10 | C08 | H10 | 109.2° | 109.5° |
| N07 | C15 | C13 | 113.8° | 121.7° |
| N07 | C15 | O03 | 116.8° | 119.2° |
| C15 | N07 | H8 | 118.6° | 119.5° |
| C10 | C13 | C15 | 125.8° | 120.2° |
| C10 | C13 | H1 | 117.1° | 119.8° |
| C24 | C26 | C25 | 122.0° | 120.3° |
| C24 | C26 | CL01 | 118.9° | 119.8° |
| C26 | C24 | H5 | 121.1° | 120.0° |
| C13 | C15 | O03 | 129.4° | 119.1° |
| C15 | C13 | H1 | 117.1° | 119.9° |
| C23 | C25 | C26 | 118.0° | 120.1° |
| C25 | C23 | H14 | 118.6° | 120.1° |
| C23 | C25 | H15 | 121.0° | 120.0° |
| C25 | C26 | CL01 | 119.1° | 119.9° |
| C26 | C25 | H15 | 121.0° | 119.9° |
| H9 | C08 | H10 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C20 | C19 | C14 | H13 | 180.0° | 179.5° |
| C19 | C20 | C17 | H3 | 180.0° | 178.9° |
| C20 | C19 | C14 | C11 | 0.1° | 0.1° |
| C19 | C20 | C17 | C12 | 0.0° | 1.1° |
| C19 | C20 | C17 | H2 | 179.9° | 180.0° |
| C20 | C19 | C14 | H12 | 179.9° | 180.0° |
| C14 | C19 | C20 | C17 | 0.1° | 0.5° |
| C19 | C14 | C11 | H12 | 180.0° | 179.9° |
| C19 | C14 | C11 | C12 | 0.1° | 0.1° |
| C19 | C14 | C11 | C10 | 179.2° | 179.4° |
| C14 | C19 | C20 | H3 | 179.9° | 179.4° |
| C20 | C17 | C12 | H2 | 180.0° | 178.9° |
| C20 | C17 | C12 | C11 | 0.1° | 1.1° |
| C20 | C17 | C12 | N07 | 179.9° | 179.5° |
| C17 | C20 | C19 | H13 | 179.9° | 180.0° |
| O05 | C18 | N06 | C21 | 178.1° | 180.0° |
| O05 | C18 | N06 | C09 | 1.4° | 0.0° |
| O05 | C18 | C21 | C22 | 29.7° | 179.7° |
| O05 | C18 | C21 | C23 | 151.8° | 0.1° |
| O05 | C18 | N06 | H7 | 178.6° | 180.0° |
| C14 | C11 | C12 | C17 | 0.0° | 0.5° |
| C14 | C11 | C12 | C10 | 179.4° | 179.6° |
| C14 | C11 | C12 | N07 | 180.0° | 180.0° |
| C14 | C11 | C10 | C08 | 1.1° | 0.2° |
| C14 | C11 | C10 | C13 | 179.4° | 179.9° |
| C11 | C14 | C19 | H13 | 179.9° | 179.4° |
| C17 | C12 | C11 | N07 | 180.0° | 179.5° |
| C17 | C12 | C11 | C10 | 179.4° | 180.0° |
| C17 | C12 | N07 | C15 | 179.9° | 179.7° |
| C12 | C17 | C20 | H3 | 180.0° | 180.0° |
| C17 | C12 | N07 | H8 | 0.1° | 0.3° |
| O02 | C16 | C09 | O04 | 179.2° | 180.0° |
| O02 | C16 | C09 | N06 | 169.9° | 0.0° |
| O02 | C16 | C09 | C08 | 47.1° | 120.1° |
| O02 | C16 | O04 | H6 | 0.0° | 0.0° |
| O02 | C16 | C09 | H11 | 71.2° | 120.0° |
| C12 | C11 | C10 | C08 | 179.6° | 179.7° |
| C11 | C12 | N07 | C15 | 0.1° | 0.2° |
| C12 | C11 | C10 | C13 | 1.3° | 0.5° |
| C11 | C12 | C17 | H2 | 179.9° | 179.9° |
| C11 | C12 | N07 | H8 | 180.0° | 179.8° |
| C12 | C11 | C14 | H12 | 179.9° | 180.0° |
| C10 | C11 | C12 | N07 | 0.6° | 0.5° |
| C11 | C10 | C08 | C09 | 93.1° | 84.8° |
| C11 | C10 | C08 | C13 | 178.2° | 179.8° |
| C11 | C10 | C13 | C15 | 1.3° | 0.3° |
| C11 | C10 | C13 | H1 | 178.7° | 179.7° |
| C11 | C10 | C08 | H9 | 146.7° | 35.2° |
| C11 | C10 | C08 | H10 | 27.1° | 155.3° |
| C10 | C11 | C14 | H12 | 0.8° | 0.5° |
| C12 | N07 | C15 | H8 | 180.0° | 180.0° |
| C12 | N07 | C15 | C13 | 0.1° | 0.0° |
| C12 | N07 | C15 | O03 | 179.9° | 180.0° |
| N07 | C12 | C17 | H2 | 0.1° | 0.6° |
| C16 | C09 | N06 | C18 | 95.5° | 85.0° |
| C16 | C09 | N06 | C08 | 124.1° | 120.0° |
| C16 | C09 | N06 | H11 | 118.0° | 120.0° |
| C16 | C09 | C08 | H11 | 117.9° | 119.9° |
| C16 | C09 | C08 | C10 | 179.1° | 175.0° |
| C09 | C16 | O04 | H6 | 179.1° | 180.0° |
| C16 | C09 | N06 | H7 | 84.5° | 95.0° |
| C16 | C09 | C08 | H9 | 60.6° | 55.0° |
| C16 | C09 | C08 | H10 | 59.0° | 65.0° |
| O04 | C16 | C09 | N06 | 10.9° | 180.0° |
| O04 | C16 | C09 | C08 | 133.7° | 60.0° |
| O04 | C16 | C09 | H11 | 108.0° | 60.0° |
| C18 | N06 | C09 | H7 | 180.0° | 180.0° |
| C18 | N06 | C09 | C08 | 140.4° | 155.0° |
| N06 | C18 | C21 | C22 | 148.5° | 0.3° |
| N06 | C18 | C21 | C23 | 30.0° | 180.0° |
| C18 | N06 | C09 | H11 | 22.5° | 35.0° |
| C21 | C18 | N06 | C09 | 179.4° | 180.0° |
| C18 | C21 | C22 | C23 | 178.6° | 179.7° |
| C18 | C21 | C22 | C24 | 179.3° | 179.8° |
| C18 | C21 | C23 | C25 | 179.2° | 179.8° |
| C18 | C21 | C22 | H4 | 0.7° | 0.3° |
| C21 | C18 | N06 | H7 | 0.6° | 0.0° |
| C18 | C21 | C23 | H14 | 0.8° | 0.2° |
| N06 | C09 | C08 | H11 | 118.4° | 120.0° |
| N06 | C09 | C08 | C10 | 57.1° | 65.0° |
| N06 | C09 | C08 | H9 | 63.1° | 175.0° |
| N06 | C09 | C08 | H10 | 177.3° | 55.0° |
| C09 | C08 | C10 | H9 | 120.2° | 120.0° |
| C09 | C08 | C10 | H10 | 120.2° | 120.0° |
| C09 | C08 | C10 | C13 | 85.1° | 95.0° |
| C08 | C09 | N06 | H7 | 39.6° | 25.1° |
| C09 | C08 | H9 | H10 | 119.5° | 119.9° |
| C21 | C22 | C24 | H4 | 180.0° | 180.0° |
| C21 | C22 | C24 | C26 | 0.4° | 0.0° |
| C22 | C21 | C23 | C25 | 0.6° | 0.0° |
| C21 | C22 | C24 | H5 | 179.6° | 180.0° |
| C22 | C21 | C23 | H14 | 179.4° | 180.0° |
| C24 | C22 | C21 | C23 | 0.7° | 0.0° |
| C22 | C24 | C26 | H5 | 180.0° | 179.9° |
| C22 | C24 | C26 | C25 | 0.0° | 0.1° |
| C22 | C24 | C26 | CL01 | 179.7° | 180.0° |
| C21 | C23 | C25 | H14 | 180.0° | 180.0° |
| C21 | C23 | C25 | C26 | 0.3° | 0.0° |
| C23 | C21 | C22 | H4 | 179.3° | 180.0° |
| C21 | C23 | C25 | H15 | 179.7° | 180.0° |
| C08 | C10 | C13 | C15 | 179.5° | 180.0° |
| C08 | C10 | C13 | H1 | 0.5° | 0.0° |
| C10 | C08 | H9 | H10 | 119.5° | 120.0° |
| C10 | C08 | C09 | H11 | 61.3° | 55.1° |
| N07 | C15 | C13 | C10 | 0.6° | 0.0° |
| N07 | C15 | C13 | O03 | 179.8° | 180.0° |
| N07 | C15 | C13 | H1 | 179.4° | 180.0° |
| C10 | C13 | C15 | H1 | 180.0° | 180.0° |
| C10 | C13 | C15 | O03 | 179.1° | 180.0° |
| C13 | C10 | C08 | H9 | 35.1° | 145.0° |
| C13 | C10 | C08 | H10 | 154.7° | 25.0° |
| C24 | C26 | C25 | C23 | 0.0° | 0.1° |
| C24 | C26 | C25 | CL01 | 179.8° | 179.9° |
| C26 | C24 | C22 | H4 | 179.6° | 180.0° |
| C24 | C26 | C25 | H15 | 180.0° | 180.0° |
| C13 | C15 | N07 | H8 | 179.9° | 180.0° |
| O03 | C15 | C13 | H1 | 0.8° | 0.0° |
| O03 | C15 | N07 | H8 | 0.1° | 0.0° |
| C23 | C25 | C26 | H15 | 180.0° | 179.9° |
| C23 | C25 | C26 | CL01 | 179.8° | 180.0° |
| C25 | C26 | C24 | H5 | 179.9° | 180.0° |
| C26 | C25 | C23 | H14 | 179.7° | 179.9° |
| CL01 | C26 | C24 | H5 | 0.3° | 0.1° |
| CL01 | C26 | C25 | H15 | 0.2° | 0.1° |
| H2 | C17 | C20 | H3 | 0.0° | 1.1° |
| H3 | C20 | C19 | H13 | 0.1° | 1.0° |
| H4 | C22 | C24 | H5 | 0.5° | 0.1° |
| H7 | N06 | C09 | H11 | 157.5° | 145.1° |
| H9 | C08 | C09 | H11 | 178.5° | 65.0° |
| H10 | C08 | C09 | H11 | 58.9° | 175.1° |
| H12 | C14 | C19 | H13 | 0.1° | 0.5° |
| H14 | C23 | C25 | H15 | 0.3° | 0.0° |
