V6T
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C18 | N16 | sing | 1.47Å | 1.45Å | |
| C17 | N16 | sing | 1.47Å | 1.45Å | |
| N16 | C19 | sing | 1.47Å | 1.45Å | |
| N16 | C15 | sing | 1.40Å | 1.47Å | |
| C14 | C15 | doub | 1.38Å | 1.39Å | Aromatic |
| C14 | C13 | sing | 1.38Å | 1.39Å | Aromatic |
| C15 | C20 | sing | 1.38Å | 1.39Å | Aromatic |
| C13 | C12 | doub | 1.39Å | 1.39Å | Aromatic |
| C20 | C21 | doub | 1.38Å | 1.39Å | Aromatic |
| C12 | C21 | sing | 1.39Å | 1.39Å | Aromatic |
| C12 | N11 | sing | 1.40Å | 1.33Å | |
| O23 | C22 | doub | 1.22Å | 1.19Å | |
| N11 | C22 | sing | 1.35Å | 1.32Å | |
| N11 | C09 | sing | 1.37Å | 1.34Å | |
| C22 | C07 | sing | 1.47Å | 1.38Å | |
| C09 | C10 | sing | 1.51Å | 1.53Å | |
| C09 | N08 | doub | 1.30Å | 1.33Å | |
| C07 | C06 | doub | 1.38Å | 1.32Å | |
| C07 | N08 | sing | 1.37Å | 1.32Å | |
| C06 | C05 | sing | 1.46Å | 1.54Å | |
| C01 | O02 | sing | 1.43Å | 1.40Å | |
| C04 | C05 | doub | 1.40Å | 1.39Å | Aromatic |
| C04 | C03 | sing | 1.38Å | 1.39Å | Aromatic |
| O02 | C03 | sing | 1.36Å | 1.40Å | |
| C05 | C24 | sing | 1.40Å | 1.39Å | Aromatic |
| C03 | C28 | doub | 1.39Å | 1.39Å | Aromatic |
| C24 | C25 | doub | 1.38Å | 1.39Å | Aromatic |
| C28 | C25 | sing | 1.39Å | 1.38Å | Aromatic |
| C28 | O29 | sing | 1.36Å | 1.40Å | |
| C25 | O26 | sing | 1.36Å | 1.40Å | |
| O26 | C27 | sing | 1.43Å | 1.40Å | |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C10 | H3 | sing | 1.09Å | 1.10Å | |
| C01 | H4 | sing | 1.09Å | 1.10Å | |
| C01 | H5 | sing | 1.09Å | 1.10Å | |
| C01 | H6 | sing | 1.09Å | 1.10Å | |
| C04 | H7 | sing | 1.08Å | 1.08Å | |
| C06 | H8 | sing | 1.08Å | 1.08Å | |
| C13 | H11 | sing | 1.08Å | 1.08Å | |
| C14 | H12 | sing | 1.08Å | 1.08Å | |
| C17 | H13 | sing | 1.09Å | 1.10Å | |
| C17 | H14 | sing | 1.09Å | 1.10Å | |
| C17 | H15 | sing | 1.09Å | 1.10Å | |
| C18 | H16 | sing | 1.09Å | 1.10Å | |
| C18 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H20 | sing | 1.09Å | 1.10Å | |
| C19 | H21 | sing | 1.09Å | 1.10Å | |
| C20 | H22 | sing | 1.08Å | 1.08Å | |
| C21 | H23 | sing | 1.08Å | 1.08Å | |
| C24 | H24 | sing | 1.08Å | 1.08Å | |
| C27 | H25 | sing | 1.09Å | 1.10Å | |
| C27 | H26 | sing | 1.09Å | 1.10Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| O29 | H28 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C18 | N16 | C17 | 109.3° | 109.5° |
| C18 | N16 | C19 | 108.1° | 109.5° |
| C18 | N16 | C15 | 110.0° | 109.4° |
| N16 | C18 | H16 | 109.5° | 109.5° |
| N16 | C18 | H17 | 109.5° | 109.5° |
| N16 | C18 | H18 | 109.4° | 109.5° |
| C17 | N16 | C19 | 109.4° | 109.5° |
| C17 | N16 | C15 | 109.8° | 109.5° |
| N16 | C17 | H13 | 109.5° | 109.5° |
| N16 | C17 | H14 | 109.5° | 109.5° |
| N16 | C17 | H15 | 109.5° | 109.5° |
| C19 | N16 | C15 | 110.3° | 109.4° |
| N16 | C19 | H19 | 109.5° | 109.4° |
| N16 | C19 | H20 | 109.5° | 109.5° |
| N16 | C19 | H21 | 109.5° | 109.5° |
| N16 | C15 | C14 | 120.2° | 119.9° |
| N16 | C15 | C20 | 120.7° | 119.9° |
| C15 | C14 | C13 | 120.0° | 120.1° |
| C14 | C15 | C20 | 119.1° | 120.2° |
| C15 | C14 | H12 | 120.0° | 119.9° |
| C14 | C13 | C12 | 121.0° | 119.9° |
| C14 | C13 | H11 | 119.5° | 120.1° |
| C13 | C14 | H12 | 120.0° | 120.0° |
| C15 | C20 | C21 | 120.8° | 120.0° |
| C15 | C20 | H22 | 119.6° | 120.0° |
| C13 | C12 | C21 | 119.1° | 119.9° |
| C13 | C12 | N11 | 119.2° | 120.1° |
| C12 | C13 | H11 | 119.5° | 120.0° |
| C20 | C21 | C12 | 120.0° | 119.9° |
| C21 | C20 | H22 | 119.6° | 120.0° |
| C20 | C21 | H23 | 120.0° | 120.0° |
| C21 | C12 | N11 | 121.8° | 120.1° |
| C12 | C21 | H23 | 120.0° | 120.0° |
| C12 | N11 | C22 | 125.3° | 125.8° |
| C12 | N11 | C09 | 127.3° | 125.9° |
| O23 | C22 | N11 | 126.2° | 127.4° |
| O23 | C22 | C07 | 125.8° | 127.4° |
| C22 | N11 | C09 | 107.3° | 108.3° |
| N11 | C22 | C07 | 108.0° | 105.3° |
| N11 | C09 | C10 | 127.0° | 124.3° |
| N11 | C09 | N08 | 109.2° | 111.3° |
| C22 | C07 | C06 | 125.6° | 127.1° |
| C22 | C07 | N08 | 107.2° | 105.8° |
| C10 | C09 | N08 | 123.8° | 124.3° |
| C09 | C10 | H1 | 109.5° | 109.5° |
| C09 | C10 | H2 | 109.5° | 109.5° |
| C09 | C10 | H3 | 109.5° | 109.5° |
| C09 | N08 | C07 | 108.3° | 109.3° |
| C06 | C07 | N08 | 127.2° | 127.1° |
| C07 | C06 | C05 | 124.4° | 120.0° |
| C07 | C06 | H8 | 117.8° | 120.0° |
| C06 | C05 | C04 | 118.5° | 120.1° |
| C06 | C05 | C24 | 121.8° | 120.2° |
| C05 | C06 | H8 | 117.8° | 120.0° |
| C01 | O02 | C03 | 114.6° | 116.9° |
| O02 | C01 | H4 | 109.5° | 109.5° |
| O02 | C01 | H5 | 109.4° | 109.4° |
| O02 | C01 | H6 | 109.5° | 109.5° |
| C05 | C04 | C03 | 120.2° | 119.9° |
| C04 | C05 | C24 | 119.6° | 119.8° |
| C05 | C04 | H7 | 119.9° | 120.0° |
| C04 | C03 | O02 | 120.0° | 120.0° |
| C04 | C03 | C28 | 119.9° | 120.1° |
| C03 | C04 | H7 | 119.9° | 120.1° |
| O02 | C03 | C28 | 120.1° | 119.9° |
| C05 | C24 | C25 | 120.1° | 119.9° |
| C05 | C24 | H24 | 120.0° | 120.0° |
| C03 | C28 | C25 | 120.2° | 120.2° |
| C03 | C28 | O29 | 120.8° | 119.9° |
| C24 | C25 | C28 | 119.9° | 120.1° |
| C24 | C25 | O26 | 121.4° | 119.9° |
| C25 | C24 | H24 | 119.9° | 120.0° |
| C25 | C28 | O29 | 119.0° | 119.9° |
| C28 | C25 | O26 | 118.6° | 120.0° |
| C28 | O29 | H28 | 109.5° | 114.0° |
| C25 | O26 | C27 | 115.1° | 117.0° |
| O26 | C27 | H25 | 109.5° | 109.5° |
| O26 | C27 | H26 | 109.5° | 109.4° |
| O26 | C27 | H27 | 109.4° | 109.5° |
| H1 | C10 | H2 | 109.5° | 109.5° |
| H1 | C10 | H3 | 109.5° | 109.4° |
| H2 | C10 | H3 | 109.4° | 109.5° |
| H4 | C01 | H5 | 109.5° | 109.4° |
| H4 | C01 | H6 | 109.5° | 109.5° |
| H5 | C01 | H6 | 109.5° | 109.5° |
| H13 | C17 | H14 | 109.4° | 109.5° |
| H13 | C17 | H15 | 109.5° | 109.4° |
| H14 | C17 | H15 | 109.5° | 109.5° |
| H16 | C18 | H17 | 109.4° | 109.5° |
| H16 | C18 | H18 | 109.4° | 109.4° |
| H17 | C18 | H18 | 109.5° | 109.4° |
| H19 | C19 | H20 | 109.4° | 109.4° |
| H19 | C19 | H21 | 109.5° | 109.5° |
| H20 | C19 | H21 | 109.5° | 109.5° |
| H25 | C27 | H26 | 109.4° | 109.4° |
| H25 | C27 | H27 | 109.5° | 109.5° |
| H26 | C27 | H27 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C18 | N16 | C17 | C19 | 118.2° | 120.1° |
| C18 | N16 | C17 | C15 | 120.7° | 120.0° |
| C18 | N16 | C19 | C15 | 120.2° | 119.9° |
| C18 | N16 | C15 | C14 | 32.3° | 180.0° |
| C18 | N16 | C15 | C20 | 147.9° | 0.0° |
| C18 | N16 | C17 | H13 | 180.0° | 60.0° |
| C18 | N16 | C17 | H14 | 60.0° | 180.0° |
| C18 | N16 | C17 | H15 | 60.0° | 59.9° |
| N16 | C18 | H16 | H17 | 120.0° | 120.1° |
| N16 | C18 | H16 | H18 | 120.0° | 120.0° |
| N16 | C18 | H17 | H18 | 120.0° | 120.0° |
| C18 | N16 | C19 | H19 | 180.0° | 60.0° |
| C18 | N16 | C19 | H20 | 60.0° | 59.9° |
| C18 | N16 | C19 | H21 | 60.0° | 180.0° |
| C17 | N16 | C19 | C15 | 120.8° | 120.0° |
| C17 | N16 | C15 | C14 | 87.9° | 60.0° |
| C17 | N16 | C15 | C20 | 91.9° | 120.0° |
| N16 | C17 | H13 | H14 | 120.0° | 120.1° |
| N16 | C17 | H13 | H15 | 120.0° | 120.0° |
| N16 | C17 | H14 | H15 | 120.0° | 120.1° |
| C17 | N16 | C18 | H16 | 180.0° | 59.9° |
| C17 | N16 | C18 | H17 | 60.0° | 180.0° |
| C17 | N16 | C18 | H18 | 60.0° | 60.0° |
| C17 | N16 | C19 | H19 | 61.1° | 60.1° |
| C17 | N16 | C19 | H20 | 58.9° | 180.0° |
| C17 | N16 | C19 | H21 | 178.9° | 59.9° |
| C19 | N16 | C15 | C14 | 151.5° | 60.0° |
| C19 | N16 | C15 | C20 | 28.7° | 120.0° |
| C19 | N16 | C17 | H13 | 61.8° | 60.1° |
| C19 | N16 | C17 | H14 | 178.2° | 60.0° |
| C19 | N16 | C17 | H15 | 58.2° | 180.0° |
| C19 | N16 | C18 | H16 | 61.0° | 180.0° |
| C19 | N16 | C18 | H17 | 59.0° | 59.9° |
| C19 | N16 | C18 | H18 | 179.0° | 60.1° |
| N16 | C19 | H19 | H20 | 120.0° | 119.9° |
| N16 | C19 | H19 | H21 | 120.0° | 120.0° |
| N16 | C19 | H20 | H21 | 120.0° | 120.0° |
| N16 | C15 | C14 | C20 | 179.8° | 180.0° |
| N16 | C15 | C14 | C13 | 179.9° | 180.0° |
| N16 | C15 | C20 | C21 | 179.8° | 179.9° |
| N16 | C15 | C14 | H12 | 0.1° | 0.0° |
| C15 | N16 | C17 | H13 | 59.3° | 180.0° |
| C15 | N16 | C17 | H14 | 60.6° | 60.0° |
| C15 | N16 | C17 | H15 | 179.4° | 60.0° |
| C15 | N16 | C18 | H16 | 59.4° | 60.1° |
| C15 | N16 | C18 | H17 | 179.4° | 60.0° |
| C15 | N16 | C18 | H18 | 60.5° | 180.0° |
| C15 | N16 | C19 | H19 | 59.8° | 180.0° |
| C15 | N16 | C19 | H20 | 179.7° | 60.0° |
| C15 | N16 | C19 | H21 | 60.3° | 60.1° |
| N16 | C15 | C20 | H22 | 0.2° | 0.0° |
| C15 | C14 | C13 | H12 | 180.0° | 180.0° |
| C15 | C14 | C13 | C12 | 0.1° | 0.0° |
| C14 | C15 | C20 | C21 | 0.0° | 0.0° |
| C15 | C14 | C13 | H11 | 179.9° | 180.0° |
| C14 | C15 | C20 | H22 | 180.0° | 180.0° |
| C13 | C14 | C15 | C20 | 0.1° | 0.0° |
| C14 | C13 | C12 | H11 | 180.0° | 180.0° |
| C14 | C13 | C12 | C21 | 0.4° | 0.0° |
| C14 | C13 | C12 | N11 | 179.9° | 179.8° |
| C15 | C20 | C21 | H22 | 180.0° | 180.0° |
| C15 | C20 | C21 | C12 | 0.3° | 0.0° |
| C20 | C15 | C14 | H12 | 179.9° | 180.0° |
| C15 | C20 | C21 | H23 | 179.7° | 179.7° |
| C13 | C12 | C21 | C20 | 0.5° | 0.0° |
| C13 | C12 | C21 | N11 | 179.7° | 179.8° |
| C13 | C12 | N11 | C22 | 64.6° | 122.7° |
| C13 | C12 | N11 | C09 | 114.0° | 57.5° |
| C12 | C13 | C14 | H12 | 179.9° | 180.0° |
| C13 | C12 | C21 | H23 | 179.5° | 179.7° |
| C20 | C21 | C12 | H23 | 180.0° | 179.7° |
| C20 | C21 | C12 | N11 | 179.8° | 179.8° |
| C21 | C12 | N11 | C22 | 115.0° | 57.1° |
| C21 | C12 | N11 | C09 | 66.3° | 122.7° |
| C21 | C12 | C13 | H11 | 179.6° | 179.9° |
| C12 | C21 | C20 | H22 | 179.6° | 180.0° |
| C12 | N11 | C22 | O23 | 1.0° | 0.0° |
| C12 | N11 | C22 | C09 | 178.9° | 179.9° |
| C12 | N11 | C22 | C07 | 179.2° | 180.0° |
| C12 | N11 | C09 | C10 | 0.9° | 0.0° |
| C12 | N11 | C09 | N08 | 179.2° | 179.9° |
| N11 | C12 | C13 | H11 | 0.1° | 0.3° |
| N11 | C12 | C21 | H23 | 0.2° | 0.1° |
| O23 | C22 | N11 | C07 | 179.8° | 179.9° |
| O23 | C22 | N11 | C09 | 179.8° | 179.9° |
| O23 | C22 | C07 | C06 | 0.4° | 0.1° |
| O23 | C22 | C07 | N08 | 180.0° | 179.8° |
| C22 | N11 | C09 | C10 | 179.7° | 179.8° |
| C22 | N11 | C09 | N08 | 0.4° | 0.0° |
| N11 | C22 | C07 | C06 | 179.4° | 180.0° |
| N11 | C22 | C07 | N08 | 0.2° | 0.2° |
| C09 | N11 | C22 | C07 | 0.3° | 0.2° |
| N11 | C09 | C10 | N08 | 179.8° | 179.8° |
| N11 | C09 | N08 | C07 | 0.3° | 0.1° |
| N11 | C09 | C10 | H1 | 179.8° | 174.7° |
| N11 | C09 | C10 | H2 | 59.8° | 65.3° |
| N11 | C09 | C10 | H3 | 60.1° | 54.7° |
| C22 | C07 | N08 | C09 | 0.1° | 0.2° |
| C22 | C07 | C06 | N08 | 179.5° | 179.7° |
| C22 | C07 | C06 | C05 | 162.1° | 172.7° |
| C22 | C07 | C06 | H8 | 17.9° | 7.3° |
| C10 | C09 | N08 | C07 | 179.8° | 180.0° |
| C09 | C10 | H1 | H2 | 120.0° | 120.0° |
| C09 | C10 | H1 | H3 | 120.0° | 120.0° |
| C09 | C10 | H2 | H3 | 120.0° | 120.0° |
| C09 | N08 | C07 | C06 | 179.6° | 180.0° |
| N08 | C09 | C10 | H1 | 0.0° | 5.1° |
| N08 | C09 | C10 | H2 | 120.0° | 114.9° |
| N08 | C09 | C10 | H3 | 120.0° | 125.1° |
| C07 | C06 | C05 | H8 | 180.0° | 180.0° |
| C07 | C06 | C05 | C04 | 139.0° | 6.5° |
| C07 | C06 | C05 | C24 | 41.6° | 173.6° |
| N08 | C07 | C06 | C05 | 18.4° | 7.0° |
| N08 | C07 | C06 | H8 | 161.6° | 173.1° |
| C06 | C05 | C04 | C24 | 179.5° | 180.0° |
| C06 | C05 | C04 | C03 | 179.4° | 180.0° |
| C06 | C05 | C24 | C25 | 179.6° | 180.0° |
| C06 | C05 | C04 | H7 | 0.6° | 0.0° |
| C06 | C05 | C24 | H24 | 0.4° | 0.0° |
| C01 | O02 | C03 | C04 | 30.0° | 0.3° |
| C01 | O02 | C03 | C28 | 150.6° | 180.0° |
| O02 | C01 | H4 | H5 | 120.0° | 119.9° |
| O02 | C01 | H4 | H6 | 120.0° | 120.1° |
| O02 | C01 | H5 | H6 | 120.0° | 120.0° |
| C05 | C04 | C03 | H7 | 180.0° | 179.9° |
| C05 | C04 | C03 | O02 | 179.8° | 179.7° |
| C05 | C04 | C03 | C28 | 0.4° | 0.1° |
| C04 | C05 | C24 | C25 | 0.2° | 0.0° |
| C04 | C05 | C06 | H8 | 41.0° | 173.5° |
| C04 | C05 | C24 | H24 | 179.8° | 180.0° |
| C04 | C03 | O02 | C28 | 179.4° | 179.7° |
| C03 | C04 | C05 | C24 | 0.1° | 0.1° |
| C04 | C03 | C28 | C25 | 0.5° | 0.0° |
| C04 | C03 | C28 | O29 | 179.9° | 180.0° |
| O02 | C03 | C28 | C25 | 179.9° | 179.7° |
| O02 | C03 | C28 | O29 | 0.5° | 0.2° |
| C03 | O02 | C01 | H4 | 180.0° | 60.1° |
| C03 | O02 | C01 | H5 | 60.0° | 180.0° |
| C03 | O02 | C01 | H6 | 60.0° | 60.0° |
| O02 | C03 | C04 | H7 | 0.2° | 0.3° |
| C05 | C24 | C25 | H24 | 180.0° | 180.0° |
| C05 | C24 | C25 | C28 | 0.1° | 0.0° |
| C05 | C24 | C25 | O26 | 179.9° | 180.0° |
| C24 | C05 | C04 | H7 | 179.9° | 180.0° |
| C24 | C05 | C06 | H8 | 138.5° | 6.4° |
| C03 | C28 | C25 | C24 | 0.2° | 0.0° |
| C03 | C28 | C25 | O29 | 179.7° | 179.9° |
| C03 | C28 | C25 | O26 | 179.8° | 180.0° |
| C28 | C03 | C04 | H7 | 179.6° | 180.0° |
| C03 | C28 | O29 | H28 | 180.0° | 90.1° |
| C24 | C25 | C28 | O26 | 179.9° | 179.9° |
| C24 | C25 | C28 | O29 | 179.9° | 179.9° |
| C24 | C25 | O26 | C27 | 3.0° | 0.0° |
| C28 | C25 | O26 | C27 | 176.9° | 179.9° |
| C28 | C25 | C24 | H24 | 179.9° | 180.0° |
| C25 | C28 | O29 | H28 | 0.3° | 90.0° |
| O29 | C28 | C25 | O26 | 0.2° | 0.0° |
| O26 | C25 | C24 | H24 | 0.2° | 0.0° |
| C25 | O26 | C27 | H25 | 180.0° | 180.0° |
| C25 | O26 | C27 | H26 | 60.0° | 60.0° |
| C25 | O26 | C27 | H27 | 60.0° | 60.0° |
| O26 | C27 | H25 | H26 | 120.0° | 119.9° |
| O26 | C27 | H25 | H27 | 120.0° | 120.1° |
| O26 | C27 | H26 | H27 | 120.0° | 120.0° |
| H1 | C10 | H2 | H3 | 120.0° | 120.0° |
| H4 | C01 | H5 | H6 | 120.0° | 120.1° |
| H11 | C13 | C14 | H12 | 0.1° | 0.0° |
| H13 | C17 | H14 | H15 | 120.0° | 119.9° |
| H16 | C18 | H17 | H18 | 120.0° | 119.9° |
| H19 | C19 | H20 | H21 | 120.0° | 120.0° |
| H22 | C20 | C21 | H23 | 0.3° | 0.3° |
| H25 | C27 | H26 | H27 | 120.0° | 120.0° |
