19B
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O25 | C22 | doub | 1.22Å | 1.23Å | |
| C22 | N24 | sing | 1.35Å | 1.36Å | |
| C22 | C19 | sing | 1.48Å | 1.48Å | |
| N24 | C26 | sing | 1.40Å | 1.40Å | |
| C26 | C27 | doub | 1.39Å | 1.43Å | Aromatic |
| C26 | C28 | sing | 1.39Å | 1.39Å | Aromatic |
| C27 | C29 | sing | 1.39Å | 1.42Å | Aromatic |
| C29 | C32 | doub | 1.39Å | 1.42Å | Aromatic |
| C29 | N31 | sing | 1.40Å | 1.41Å | |
| C32 | C30 | sing | 1.38Å | 1.40Å | Aromatic |
| C30 | C28 | doub | 1.38Å | 1.40Å | Aromatic |
| N31 | C33 | sing | 1.47Å | 1.49Å | |
| N31 | C34 | sing | 1.47Å | 1.50Å | |
| C33 | C35 | sing | 1.53Å | 1.54Å | |
| C35 | O37 | sing | 1.43Å | 1.41Å | |
| O37 | C36 | sing | 1.43Å | 1.42Å | |
| C36 | C34 | sing | 1.53Å | 1.55Å | |
| C19 | C23 | doub | 1.40Å | 1.40Å | Aromatic |
| C19 | C17 | sing | 1.39Å | 1.41Å | Aromatic |
| C23 | C20 | sing | 1.38Å | 1.40Å | Aromatic |
| C20 | C18 | doub | 1.38Å | 1.40Å | Aromatic |
| C18 | C21 | sing | 1.51Å | 1.53Å | |
| C18 | C15 | sing | 1.40Å | 1.40Å | Aromatic |
| C15 | C17 | doub | 1.39Å | 1.38Å | Aromatic |
| C15 | C12 | sing | 1.48Å | 1.47Å | Aromatic |
| C12 | C9 | doub | 1.40Å | 1.39Å | Aromatic |
| C12 | C7 | sing | 1.39Å | 1.39Å | Aromatic |
| C9 | C4 | sing | 1.36Å | 1.40Å | Aromatic |
| C4 | C1 | doub | 1.40Å | 1.41Å | Aromatic |
| C1 | C3 | sing | 1.41Å | 1.37Å | Aromatic |
| C1 | C2 | sing | 1.47Å | 1.40Å | Aromatic |
| C3 | O8 | sing | 1.35Å | 1.36Å | Aromatic |
| C3 | C7 | doub | 1.39Å | 1.37Å | Aromatic |
| O8 | N6 | sing | 1.41Å | 1.33Å | Aromatic |
| C2 | N6 | doub | 1.30Å | 1.37Å | Aromatic |
| C2 | C5 | sing | 1.51Å | 1.51Å | |
| C5 | C10 | sing | 1.53Å | 1.55Å | |
| C5 | C11 | sing | 1.53Å | 1.54Å | |
| C10 | C13 | sing | 1.53Å | 1.53Å | |
| C13 | N16 | sing | 1.47Å | 1.47Å | |
| N16 | C14 | sing | 1.47Å | 1.48Å | |
| C14 | C11 | sing | 1.53Å | 1.55Å | |
| N24 | HN24 | sing | 0.97Å | 1.00Å | |
| C27 | H27 | sing | 1.08Å | 1.08Å | |
| C32 | H32 | sing | 1.08Å | 1.08Å | |
| C30 | H30 | sing | 1.08Å | 1.08Å | |
| C28 | H28 | sing | 1.08Å | 1.08Å | |
| C33 | H33 | sing | 1.09Å | 1.10Å | |
| C33 | H33A | sing | 1.09Å | 1.10Å | |
| C35 | H35 | sing | 1.09Å | 1.10Å | |
| C35 | H35A | sing | 1.09Å | 1.10Å | |
| C36 | H36 | sing | 1.09Å | 1.10Å | |
| C36 | H36A | sing | 1.09Å | 1.10Å | |
| C34 | H34 | sing | 1.09Å | 1.10Å | |
| C34 | H34A | sing | 1.09Å | 1.10Å | |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H21A | sing | 1.09Å | 1.10Å | |
| C21 | H21B | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.08Å | 1.08Å | |
| C9 | H9 | sing | 1.08Å | 1.08Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H10A | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H13A | sing | 1.09Å | 1.10Å | |
| N16 | HN16 | sing | 1.01Å | 1.00Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H14A | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H11A | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O25 | C22 | N24 | 122.4° | 120.0° |
| O25 | C22 | C19 | 118.2° | 120.0° |
| N24 | C22 | C19 | 119.3° | 120.1° |
| C22 | N24 | C26 | 125.4° | 120.0° |
| C22 | N24 | HN24 | 117.3° | 120.0° |
| C22 | C19 | C23 | 123.9° | 120.0° |
| C22 | C19 | C17 | 116.7° | 120.1° |
| N24 | C26 | C27 | 124.8° | 120.0° |
| N24 | C26 | C28 | 116.7° | 120.0° |
| C26 | N24 | HN24 | 117.3° | 120.0° |
| C27 | C26 | C28 | 118.5° | 120.0° |
| C26 | C27 | C29 | 122.8° | 119.8° |
| C26 | C27 | H27 | 118.6° | 120.1° |
| C26 | C28 | C30 | 120.1° | 120.0° |
| C26 | C28 | H28 | 119.9° | 119.9° |
| C27 | C29 | C32 | 116.1° | 119.9° |
| C27 | C29 | N31 | 122.1° | 120.0° |
| C29 | C27 | H27 | 118.6° | 120.1° |
| C32 | C29 | N31 | 121.7° | 120.1° |
| C29 | C32 | C30 | 121.7° | 120.1° |
| C29 | C32 | H32 | 119.2° | 119.9° |
| C29 | N31 | C33 | 118.6° | 111.0° |
| C29 | N31 | C34 | 122.4° | 111.0° |
| C32 | C30 | C28 | 120.7° | 120.2° |
| C30 | C32 | H32 | 119.1° | 120.0° |
| C32 | C30 | H30 | 119.6° | 119.9° |
| C28 | C30 | H30 | 119.6° | 119.9° |
| C30 | C28 | H28 | 120.0° | 120.0° |
| C33 | N31 | C34 | 118.8° | 110.8° |
| N31 | C33 | C35 | 114.5° | 109.2° |
| N31 | C33 | H33 | 107.9° | 109.5° |
| N31 | C33 | H33A | 106.7° | 109.5° |
| N31 | C34 | C36 | 113.9° | 109.2° |
| N31 | C34 | H34 | 108.0° | 109.5° |
| N31 | C34 | H34A | 107.0° | 109.5° |
| C33 | C35 | O37 | 107.5° | 109.3° |
| C35 | C33 | H33 | 107.8° | 109.5° |
| C35 | C33 | H33A | 106.7° | 109.5° |
| C33 | C35 | H35 | 110.1° | 109.5° |
| C33 | C35 | H35A | 110.5° | 109.6° |
| C35 | O37 | C36 | 112.4° | 113.7° |
| O37 | C35 | H35 | 110.1° | 109.5° |
| O37 | C35 | H35A | 110.5° | 109.5° |
| O37 | C36 | C34 | 110.8° | 109.3° |
| O37 | C36 | H36 | 109.0° | 109.5° |
| O37 | C36 | H36A | 108.7° | 109.5° |
| C34 | C36 | H36 | 109.0° | 109.5° |
| C34 | C36 | H36A | 108.8° | 109.5° |
| C36 | C34 | H34 | 108.0° | 109.5° |
| C36 | C34 | H34A | 107.0° | 109.5° |
| C23 | C19 | C17 | 119.4° | 119.8° |
| C19 | C23 | C20 | 119.8° | 120.1° |
| C19 | C23 | H23 | 120.1° | 120.0° |
| C19 | C17 | C15 | 120.1° | 119.7° |
| C19 | C17 | H17 | 120.0° | 120.1° |
| C23 | C20 | C18 | 120.8° | 120.3° |
| C20 | C23 | H23 | 120.1° | 120.0° |
| C23 | C20 | H20 | 119.6° | 119.8° |
| C20 | C18 | C21 | 119.6° | 119.9° |
| C20 | C18 | C15 | 118.9° | 120.2° |
| C18 | C20 | H20 | 119.6° | 119.8° |
| C21 | C18 | C15 | 121.5° | 119.9° |
| C18 | C21 | H21 | 109.5° | 109.5° |
| C18 | C21 | H21A | 109.4° | 109.4° |
| C18 | C21 | H21B | 109.5° | 109.5° |
| C18 | C15 | C17 | 121.1° | 119.9° |
| C18 | C15 | C12 | 119.3° | 120.1° |
| C17 | C15 | C12 | 119.6° | 120.0° |
| C15 | C17 | H17 | 120.0° | 120.1° |
| C15 | C12 | C9 | 118.9° | 119.9° |
| C15 | C12 | C7 | 120.1° | 119.9° |
| C9 | C12 | C7 | 121.0° | 120.3° |
| C12 | C9 | C4 | 119.4° | 120.4° |
| C12 | C9 | H9 | 120.3° | 119.8° |
| C12 | C7 | C3 | 119.1° | 119.7° |
| C12 | C7 | H7 | 120.5° | 120.1° |
| C9 | C4 | C1 | 118.7° | 120.0° |
| C4 | C9 | H9 | 120.3° | 119.8° |
| C9 | C4 | H4 | 120.7° | 120.0° |
| C4 | C1 | C3 | 120.4° | 120.0° |
| C4 | C1 | C2 | 131.1° | 133.6° |
| C1 | C4 | H4 | 120.7° | 120.1° |
| C3 | C1 | C2 | 108.5° | 106.4° |
| C1 | C3 | O8 | 107.6° | 107.1° |
| C1 | C3 | C7 | 121.5° | 119.6° |
| C1 | C2 | N6 | 104.6° | 107.4° |
| C1 | C2 | C5 | 127.9° | 126.2° |
| O8 | C3 | C7 | 130.9° | 133.3° |
| C3 | O8 | N6 | 108.1° | 109.3° |
| C3 | C7 | H7 | 120.4° | 120.2° |
| O8 | N6 | C2 | 111.1° | 109.8° |
| N6 | C2 | C5 | 127.4° | 126.3° |
| C2 | C5 | C10 | 111.9° | 109.5° |
| C2 | C5 | C11 | 114.7° | 109.5° |
| C2 | C5 | H5 | 102.8° | 109.6° |
| C10 | C5 | C11 | 105.4° | 109.1° |
| C5 | C10 | C13 | 109.6° | 109.3° |
| C10 | C5 | H5 | 112.5° | 109.5° |
| C5 | C10 | H10 | 109.5° | 109.5° |
| C5 | C10 | H10A | 109.4° | 109.5° |
| C5 | C11 | C14 | 110.8° | 109.3° |
| C11 | C5 | H5 | 109.6° | 109.6° |
| C5 | C11 | H11 | 109.0° | 109.5° |
| C5 | C11 | H11A | 108.8° | 109.5° |
| C10 | C13 | N16 | 112.7° | 109.5° |
| C13 | C10 | H10 | 109.4° | 109.5° |
| C13 | C10 | H10A | 109.4° | 109.5° |
| C10 | C13 | H13 | 108.4° | 109.4° |
| C10 | C13 | H13A | 107.7° | 109.4° |
| C13 | N16 | C14 | 116.7° | 111.2° |
| N16 | C13 | H13 | 108.4° | 109.5° |
| N16 | C13 | H13A | 107.6° | 109.5° |
| C13 | N16 | HN16 | 107.2° | 111.1° |
| N16 | C14 | C11 | 117.1° | 109.5° |
| C14 | N16 | HN16 | 107.1° | 111.0° |
| N16 | C14 | H14 | 107.0° | 109.5° |
| N16 | C14 | H14A | 105.2° | 109.4° |
| C11 | C14 | H14 | 107.0° | 109.5° |
| C11 | C14 | H14A | 105.3° | 109.5° |
| C14 | C11 | H11 | 109.1° | 109.5° |
| C14 | C11 | H11A | 108.8° | 109.5° |
| H33 | C33 | H33A | 113.5° | 109.6° |
| H35 | C35 | H35A | 108.0° | 109.5° |
| H36 | C36 | H36A | 110.5° | 109.5° |
| H34 | C34 | H34A | 113.1° | 109.6° |
| H21 | C21 | H21A | 109.5° | 109.4° |
| H21 | C21 | H21B | 109.4° | 109.5° |
| H21A | C21 | H21B | 109.5° | 109.5° |
| H10 | C10 | H10A | 109.5° | 109.5° |
| H13 | C13 | H13A | 112.1° | 109.5° |
| H14 | C14 | H14A | 115.7° | 109.5° |
| H11 | C11 | H11A | 110.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O25 | C22 | N24 | C19 | 175.6° | 179.7° |
| O25 | C22 | N24 | C26 | 2.1° | 4.6° |
| O25 | C22 | C19 | C23 | 147.3° | 179.9° |
| O25 | C22 | C19 | C17 | 30.6° | 0.2° |
| O25 | C22 | N24 | HN24 | 177.9° | 175.4° |
| C22 | N24 | C26 | HN24 | 180.0° | 180.0° |
| C22 | N24 | C26 | C27 | 35.9° | 35.8° |
| C22 | N24 | C26 | C28 | 143.6° | 144.5° |
| N24 | C22 | C19 | C23 | 28.5° | 0.3° |
| N24 | C22 | C19 | C17 | 153.6° | 179.4° |
| C19 | C22 | N24 | C26 | 177.8° | 175.8° |
| C22 | C19 | C23 | C17 | 177.8° | 179.7° |
| C22 | C19 | C23 | C20 | 178.3° | 180.0° |
| C22 | C19 | C17 | C15 | 178.7° | 179.7° |
| C19 | C22 | N24 | HN24 | 2.2° | 4.2° |
| C22 | C19 | C23 | H23 | 1.7° | 0.1° |
| C22 | C19 | C17 | H17 | 1.3° | 0.1° |
| N24 | C26 | C27 | C28 | 179.5° | 179.7° |
| N24 | C26 | C27 | C29 | 179.2° | 180.0° |
| N24 | C26 | C28 | C30 | 179.4° | 179.7° |
| N24 | C26 | C27 | H27 | 0.8° | 0.1° |
| N24 | C26 | C28 | H28 | 0.6° | 0.0° |
| C26 | C27 | C29 | H27 | 180.0° | 179.9° |
| C26 | C27 | C29 | C32 | 0.0° | 0.0° |
| C26 | C27 | C29 | N31 | 176.9° | 180.0° |
| C27 | C26 | C28 | C30 | 0.2° | 0.6° |
| C27 | C26 | N24 | HN24 | 144.1° | 144.2° |
| C27 | C26 | C28 | H28 | 179.9° | 179.7° |
| C28 | C26 | C27 | C29 | 0.3° | 0.3° |
| C26 | C28 | C30 | C32 | 0.3° | 0.6° |
| C26 | C28 | C30 | H28 | 180.0° | 179.7° |
| C28 | C26 | N24 | HN24 | 36.4° | 35.5° |
| C28 | C26 | C27 | H27 | 179.7° | 179.8° |
| C26 | C28 | C30 | H30 | 179.7° | 179.7° |
| C27 | C29 | C32 | N31 | 177.0° | 180.0° |
| C27 | C29 | C32 | C30 | 0.4° | 0.0° |
| C27 | C29 | N31 | C33 | 10.5° | 180.0° |
| C27 | C29 | N31 | C34 | 175.0° | 56.4° |
| C27 | C29 | C32 | H32 | 179.6° | 180.0° |
| C29 | C32 | C30 | H32 | 180.0° | 180.0° |
| C29 | C32 | C30 | C28 | 0.6° | 0.3° |
| C32 | C29 | N31 | C33 | 166.3° | 0.0° |
| C32 | C29 | N31 | C34 | 8.2° | 123.7° |
| C32 | C29 | C27 | H27 | 180.0° | 179.9° |
| C29 | C32 | C30 | H30 | 179.4° | 180.0° |
| N31 | C29 | C32 | C30 | 177.4° | 179.9° |
| C29 | N31 | C33 | C34 | 174.7° | 123.7° |
| C29 | N31 | C33 | C35 | 159.5° | 177.6° |
| C29 | N31 | C34 | C36 | 164.6° | 177.6° |
| N31 | C29 | C27 | H27 | 3.0° | 0.0° |
| N31 | C29 | C32 | H32 | 2.6° | 0.0° |
| C29 | N31 | C33 | H33 | 80.4° | 62.5° |
| C29 | N31 | C33 | H33A | 41.8° | 57.7° |
| C29 | N31 | C34 | H34 | 44.6° | 57.7° |
| C29 | N31 | C34 | H34A | 77.4° | 62.4° |
| C32 | C30 | C28 | H30 | 180.0° | 179.7° |
| C32 | C30 | C28 | H28 | 179.7° | 179.7° |
| C28 | C30 | C32 | H32 | 179.4° | 179.7° |
| N31 | C33 | C35 | H33 | 120.0° | 119.9° |
| N31 | C33 | C35 | H33A | 117.8° | 119.9° |
| N31 | C33 | C35 | O37 | 47.1° | 56.9° |
| C33 | N31 | C34 | C36 | 20.9° | 58.6° |
| N31 | C33 | H33 | H33A | 118.0° | 120.1° |
| N31 | C33 | C35 | H35 | 167.1° | 176.8° |
| N31 | C33 | C35 | H35A | 73.6° | 63.1° |
| C33 | N31 | C34 | H34 | 140.9° | 178.5° |
| C33 | N31 | C34 | H34A | 97.1° | 61.3° |
| C34 | N31 | C33 | C35 | 25.8° | 58.7° |
| N31 | C34 | C36 | O37 | 38.1° | 56.8° |
| N31 | C34 | C36 | H34 | 120.0° | 119.9° |
| N31 | C34 | C36 | H34A | 118.0° | 119.9° |
| C34 | N31 | C33 | H33 | 94.2° | 61.3° |
| C34 | N31 | C33 | H33A | 143.5° | 178.6° |
| N31 | C34 | C36 | H36 | 158.1° | 176.8° |
| N31 | C34 | C36 | H36A | 81.3° | 63.1° |
| N31 | C34 | H34 | H34A | 118.2° | 120.1° |
| C33 | C35 | O37 | H35 | 120.0° | 119.9° |
| C33 | C35 | O37 | H35A | 120.8° | 120.0° |
| C33 | C35 | O37 | C36 | 69.2° | 58.7° |
| C35 | C33 | H33 | H33A | 117.9° | 120.1° |
| C33 | C35 | H35 | H35A | 120.8° | 120.2° |
| C35 | O37 | C36 | C34 | 65.6° | 58.7° |
| O37 | C35 | C33 | H33 | 72.9° | 63.0° |
| O37 | C35 | C33 | H33A | 164.9° | 176.8° |
| O37 | C35 | H35 | H35A | 120.8° | 120.0° |
| C35 | O37 | C36 | H36 | 174.4° | 178.6° |
| C35 | O37 | C36 | H36A | 53.9° | 61.3° |
| O37 | C36 | C34 | H36 | 120.0° | 120.0° |
| O37 | C36 | C34 | H36A | 119.4° | 119.9° |
| C36 | O37 | C35 | H35 | 170.8° | 178.6° |
| C36 | O37 | C35 | H35A | 51.5° | 61.4° |
| O37 | C36 | H36 | H36A | 119.4° | 120.1° |
| O37 | C36 | C34 | H34 | 158.1° | 176.8° |
| O37 | C36 | C34 | H34A | 79.9° | 63.0° |
| C34 | C36 | H36 | H36A | 119.5° | 120.1° |
| C36 | C34 | H34 | H34A | 118.2° | 120.2° |
| C19 | C23 | C20 | H23 | 180.0° | 179.9° |
| C19 | C23 | C20 | C18 | 0.1° | 0.0° |
| C23 | C19 | C17 | C15 | 0.7° | 0.6° |
| C19 | C23 | C20 | H20 | 179.9° | 179.9° |
| C23 | C19 | C17 | H17 | 179.3° | 179.7° |
| C17 | C19 | C23 | C20 | 0.5° | 0.3° |
| C19 | C17 | C15 | C18 | 0.4° | 0.5° |
| C19 | C17 | C15 | H17 | 180.0° | 179.7° |
| C19 | C17 | C15 | C12 | 179.2° | 179.7° |
| C17 | C19 | C23 | H23 | 179.5° | 179.7° |
| C23 | C20 | C18 | H20 | 180.0° | 179.9° |
| C23 | C20 | C18 | C21 | 179.7° | 180.0° |
| C23 | C20 | C18 | C15 | 0.4° | 0.1° |
| C20 | C18 | C21 | C15 | 179.8° | 179.9° |
| C20 | C18 | C15 | C17 | 0.2° | 0.2° |
| C20 | C18 | C15 | C12 | 179.7° | 180.0° |
| C18 | C20 | C23 | H23 | 179.9° | 179.9° |
| C20 | C18 | C21 | H21 | 101.4° | 95.1° |
| C20 | C18 | C21 | H21A | 138.6° | 145.0° |
| C20 | C18 | C21 | H21B | 18.6° | 25.0° |
| C21 | C18 | C15 | C17 | 180.0° | 179.7° |
| C21 | C18 | C15 | C12 | 0.4° | 0.1° |
| C21 | C18 | C20 | H20 | 0.3° | 0.1° |
| C18 | C21 | H21 | H21A | 120.0° | 119.9° |
| C18 | C21 | H21 | H21B | 120.0° | 120.1° |
| C18 | C21 | H21A | H21B | 120.0° | 120.0° |
| C18 | C15 | C17 | C12 | 179.6° | 179.8° |
| C18 | C15 | C12 | C9 | 95.0° | 124.1° |
| C18 | C15 | C12 | C7 | 83.5° | 55.6° |
| C15 | C18 | C20 | H20 | 179.6° | 180.0° |
| C15 | C18 | C21 | H21 | 78.4° | 84.8° |
| C15 | C18 | C21 | H21A | 41.6° | 35.1° |
| C15 | C18 | C21 | H21B | 161.6° | 155.1° |
| C18 | C15 | C17 | H17 | 179.6° | 179.8° |
| C17 | C15 | C12 | C9 | 84.5° | 56.1° |
| C17 | C15 | C12 | C7 | 97.0° | 124.3° |
| C15 | C12 | C9 | C7 | 178.5° | 179.7° |
| C15 | C12 | C9 | C4 | 178.8° | 180.0° |
| C15 | C12 | C7 | C3 | 179.1° | 179.7° |
| C12 | C15 | C17 | H17 | 0.8° | 0.0° |
| C15 | C12 | C9 | H9 | 1.1° | 0.0° |
| C15 | C12 | C7 | H7 | 0.9° | 0.0° |
| C12 | C9 | C4 | H9 | 180.0° | 179.9° |
| C12 | C9 | C4 | C1 | 0.0° | 0.0° |
| C9 | C12 | C7 | C3 | 0.7° | 0.6° |
| C12 | C9 | C4 | H4 | 180.0° | 180.0° |
| C9 | C12 | C7 | H7 | 179.3° | 179.7° |
| C7 | C12 | C9 | C4 | 0.3° | 0.3° |
| C12 | C7 | C3 | C1 | 0.6° | 0.5° |
| C12 | C7 | C3 | O8 | 179.7° | 179.8° |
| C12 | C7 | C3 | H7 | 180.0° | 179.7° |
| C7 | C12 | C9 | H9 | 179.6° | 179.7° |
| C9 | C4 | C1 | H4 | 180.0° | 180.0° |
| C9 | C4 | C1 | C3 | 0.1° | 0.0° |
| C9 | C4 | C1 | C2 | 179.8° | 180.0° |
| C4 | C1 | C3 | C2 | 180.0° | 180.0° |
| C4 | C1 | C3 | O8 | 180.0° | 180.0° |
| C4 | C1 | C3 | C7 | 0.2° | 0.3° |
| C4 | C1 | C2 | N6 | 179.9° | 180.0° |
| C4 | C1 | C2 | C5 | 0.9° | 0.0° |
| C1 | C4 | C9 | H9 | 180.0° | 180.0° |
| C1 | C3 | O8 | C7 | 179.7° | 179.7° |
| C1 | C3 | O8 | N6 | 0.1° | 0.0° |
| C3 | C1 | C2 | N6 | 0.2° | 0.0° |
| C3 | C1 | C2 | C5 | 179.0° | 180.0° |
| C3 | C1 | C4 | H4 | 179.9° | 180.0° |
| C1 | C3 | C7 | H7 | 179.4° | 179.8° |
| C2 | C1 | C3 | O8 | 0.1° | 0.0° |
| C2 | C1 | C3 | C7 | 179.8° | 179.7° |
| C1 | C2 | N6 | O8 | 0.2° | 0.0° |
| C1 | C2 | N6 | C5 | 179.2° | 180.0° |
| C1 | C2 | C5 | C10 | 71.6° | 120.0° |
| C1 | C2 | C5 | C11 | 168.3° | 120.3° |
| C2 | C1 | C4 | H4 | 0.2° | 0.0° |
| C1 | C2 | C5 | H5 | 49.4° | 0.1° |
| C3 | O8 | N6 | C2 | 0.2° | 0.0° |
| O8 | C3 | C7 | H7 | 0.3° | 0.1° |
| C7 | C3 | O8 | N6 | 179.7° | 179.7° |
| O8 | N6 | C2 | C5 | 179.0° | 180.0° |
| N6 | C2 | C5 | C10 | 107.5° | 60.0° |
| N6 | C2 | C5 | C11 | 12.6° | 59.7° |
| N6 | C2 | C5 | H5 | 131.5° | 179.9° |
| C2 | C5 | C10 | C11 | 125.4° | 119.9° |
| C2 | C5 | C10 | H5 | 115.2° | 120.2° |
| C2 | C5 | C11 | H5 | 115.0° | 120.2° |
| C2 | C5 | C10 | C13 | 167.3° | 177.5° |
| C2 | C5 | C11 | C14 | 177.9° | 177.5° |
| C2 | C5 | C10 | H10 | 72.7° | 57.6° |
| C2 | C5 | C10 | H10A | 47.3° | 62.5° |
| C2 | C5 | C11 | H11 | 57.9° | 62.5° |
| C2 | C5 | C11 | H11A | 62.6° | 57.6° |
| C10 | C5 | C11 | H5 | 121.4° | 119.9° |
| C5 | C10 | C13 | H10 | 120.0° | 119.9° |
| C5 | C10 | C13 | H10A | 120.0° | 119.9° |
| C5 | C10 | C13 | N16 | 58.6° | 59.2° |
| C10 | C5 | C11 | C14 | 58.4° | 57.6° |
| C5 | C10 | H10 | H10A | 120.0° | 120.1° |
| C5 | C10 | C13 | H13 | 178.6° | 179.2° |
| C5 | C10 | C13 | H13A | 60.0° | 60.9° |
| C10 | C5 | C11 | H11 | 178.5° | 177.6° |
| C10 | C5 | C11 | H11A | 61.0° | 62.3° |
| C11 | C5 | C10 | C13 | 67.3° | 57.6° |
| C5 | C11 | C14 | N16 | 43.1° | 59.2° |
| C5 | C11 | C14 | H11 | 120.0° | 119.9° |
| C5 | C11 | C14 | H11A | 119.5° | 120.0° |
| C11 | C5 | C10 | H10 | 52.7° | 62.3° |
| C11 | C5 | C10 | H10A | 172.7° | 177.6° |
| C5 | C11 | C14 | H14 | 163.1° | 179.2° |
| C5 | C11 | C14 | H14A | 73.3° | 60.8° |
| C5 | C11 | H11 | H11A | 119.5° | 120.1° |
| C10 | C13 | N16 | H13 | 120.0° | 120.0° |
| C10 | C13 | N16 | H13A | 118.6° | 120.0° |
| C10 | C13 | N16 | C14 | 40.3° | 61.8° |
| C13 | C10 | C5 | H5 | 52.1° | 62.3° |
| C13 | C10 | H10 | H10A | 119.9° | 120.1° |
| C10 | C13 | H13 | H13A | 118.7° | 119.9° |
| C10 | C13 | N16 | HN16 | 79.7° | 62.4° |
| C13 | N16 | C14 | HN16 | 120.0° | 124.2° |
| C13 | N16 | C14 | C11 | 33.2° | 61.8° |
| N16 | C13 | C10 | H10 | 61.4° | 60.7° |
| N16 | C13 | C10 | H10A | 178.5° | 179.1° |
| N16 | C13 | H13 | H13A | 118.6° | 120.1° |
| C13 | N16 | C14 | H14 | 153.2° | 178.2° |
| C13 | N16 | C14 | H14A | 83.3° | 58.2° |
| N16 | C14 | C11 | H14 | 120.0° | 120.0° |
| N16 | C14 | C11 | H14A | 116.4° | 120.0° |
| C14 | N16 | C13 | H13 | 160.3° | 178.3° |
| C14 | N16 | C13 | H13A | 78.3° | 58.2° |
| N16 | C14 | H14 | H14A | 116.8° | 119.9° |
| N16 | C14 | C11 | H11 | 163.1° | 179.1° |
| N16 | C14 | C11 | H11A | 76.4° | 60.8° |
| C14 | C11 | C5 | H5 | 62.9° | 62.2° |
| C11 | C14 | N16 | HN16 | 86.9° | 62.4° |
| C11 | C14 | H14 | H14A | 116.9° | 120.0° |
| C14 | C11 | H11 | H11A | 119.5° | 120.1° |
| H32 | C32 | C30 | H30 | 0.6° | 0.0° |
| H30 | C30 | C28 | H28 | 0.3° | 0.0° |
| H33 | C33 | C35 | H35 | 47.1° | 56.9° |
| H33 | C33 | C35 | H35A | 166.4° | 177.0° |
| H33A | C33 | C35 | H35 | 75.1° | 63.3° |
| H33A | C33 | C35 | H35A | 44.2° | 56.8° |
| H36 | C36 | C34 | H34 | 81.9° | 63.3° |
| H36 | C36 | C34 | H34A | 40.1° | 56.9° |
| H36A | C36 | C34 | H34 | 38.7° | 56.8° |
| H36A | C36 | C34 | H34A | 160.7° | 177.0° |
| H23 | C23 | C20 | H20 | 0.1° | 0.0° |
| H21 | C21 | H21A | H21B | 120.0° | 120.0° |
| H9 | C9 | C4 | H4 | 0.0° | 0.0° |
| H5 | C5 | C10 | H10 | 172.1° | 177.7° |
| H5 | C5 | C10 | H10A | 67.9° | 57.6° |
| H5 | C5 | C11 | H11 | 57.1° | 57.7° |
| H5 | C5 | C11 | H11A | 177.6° | 177.8° |
| H10 | C10 | C13 | H13 | 58.6° | 59.3° |
| H10 | C10 | C13 | H13A | 180.0° | 179.2° |
| H10A | C10 | C13 | H13 | 61.5° | 60.9° |
| H10A | C10 | C13 | H13A | 60.0° | 59.1° |
| H13 | C13 | N16 | HN16 | 40.3° | 57.6° |
| H13A | C13 | N16 | HN16 | 161.7° | 177.6° |
| HN16 | N16 | C14 | H14 | 33.2° | 57.6° |
| HN16 | N16 | C14 | H14A | 156.7° | 177.6° |
| H14 | C14 | C11 | H11 | 76.9° | 60.9° |
| H14 | C14 | C11 | H11A | 43.6° | 59.2° |
| H14A | C14 | C11 | H11 | 46.7° | 59.1° |
| H14A | C14 | C11 | H11A | 167.2° | 179.3° |
