70A
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C45 | C46 | sing | 1.53Å | 1.48Å | |
| C45 | C39 | sing | 1.53Å | 1.52Å | |
| C29 | C30 | doub | 1.38Å | 1.38Å | Aromatic |
| C29 | C28 | sing | 1.38Å | 1.39Å | Aromatic |
| C46 | C39 | sing | 1.53Å | 1.52Å | |
| C39 | C40 | sing | 1.51Å | 1.51Å | |
| C39 | C28 | sing | 1.51Å | 1.54Å | |
| N41 | C40 | sing | 1.35Å | 1.33Å | Aromatic |
| N41 | N42 | sing | 1.29Å | 1.35Å | Aromatic |
| C40 | N44 | doub | 1.31Å | 1.32Å | Aromatic |
| C30 | C31 | sing | 1.39Å | 1.39Å | Aromatic |
| N42 | N43 | doub | 1.29Å | 1.29Å | Aromatic |
| C28 | C27 | doub | 1.38Å | 1.40Å | Aromatic |
| N44 | N43 | sing | 1.29Å | 1.36Å | Aromatic |
| C31 | N33 | sing | 1.41Å | 1.42Å | |
| C31 | C32 | doub | 1.39Å | 1.39Å | Aromatic |
| C27 | C32 | sing | 1.38Å | 1.40Å | Aromatic |
| C27 | C26 | sing | 1.50Å | 1.51Å | |
| N33 | C35 | sing | 1.37Å | 1.35Å | |
| C26 | N25 | sing | 1.48Å | 1.47Å | |
| O24 | C13 | doub | 1.21Å | 1.23Å | |
| C35 | O34 | sing | 1.35Å | 1.35Å | |
| C35 | O36 | doub | 1.21Å | 1.21Å | |
| C9 | C8 | sing | 1.51Å | 1.52Å | |
| O34 | C2 | sing | 1.45Å | 1.45Å | |
| N25 | C13 | sing | 1.36Å | 1.35Å | |
| N25 | C37 | sing | 1.46Å | 1.46Å | |
| C13 | C10 | sing | 1.51Å | 1.52Å | |
| C8 | C7 | doub | 1.38Å | 1.39Å | Aromatic |
| C8 | C3 | sing | 1.38Å | 1.41Å | Aromatic |
| C7 | C6 | sing | 1.38Å | 1.39Å | Aromatic |
| C2 | C1 | sing | 1.51Å | 1.56Å | |
| N12 | C10 | sing | 1.46Å | 1.45Å | |
| N12 | C14 | sing | 1.39Å | 1.39Å | |
| C10 | C6 | sing | 1.51Å | 1.52Å | |
| C6 | C5 | doub | 1.38Å | 1.39Å | Aromatic |
| C1 | C3 | sing | 1.51Å | 1.53Å | |
| C1 | C11 | sing | 1.53Å | 1.54Å | |
| C3 | C4 | doub | 1.38Å | 1.39Å | Aromatic |
| C19 | C14 | doub | 1.40Å | 1.39Å | Aromatic |
| C19 | C18 | sing | 1.36Å | 1.36Å | Aromatic |
| C14 | C15 | sing | 1.38Å | 1.38Å | Aromatic |
| C5 | C4 | sing | 1.38Å | 1.39Å | Aromatic |
| C18 | C17 | doub | 1.40Å | 1.41Å | Aromatic |
| C15 | C16 | doub | 1.40Å | 1.42Å | Aromatic |
| C17 | C16 | sing | 1.42Å | 1.43Å | Aromatic |
| C17 | C23 | sing | 1.41Å | 1.45Å | Aromatic |
| C16 | C20 | sing | 1.41Å | 1.41Å | Aromatic |
| N38 | C23 | sing | 1.38Å | 1.35Å | |
| C23 | N22 | doub | 1.32Å | 1.38Å | Aromatic |
| C20 | C21 | doub | 1.36Å | 1.36Å | Aromatic |
| N22 | C21 | sing | 1.33Å | 1.34Å | Aromatic |
| C18 | H62 | sing | 1.08Å | 1.08Å | |
| C15 | H61 | sing | 1.08Å | 1.08Å | |
| C19 | H63 | sing | 1.08Å | 1.08Å | |
| C20 | H64 | sing | 1.08Å | 1.08Å | |
| C21 | H65 | sing | 1.08Å | 1.08Å | |
| C11 | H59 | sing | 1.09Å | 1.10Å | |
| C11 | H57 | sing | 1.09Å | 1.10Å | |
| C11 | H58 | sing | 1.09Å | 1.10Å | |
| C1 | H47 | sing | 1.09Å | 1.10Å | |
| C2 | H48 | sing | 1.09Å | 1.10Å | |
| C2 | H49 | sing | 1.09Å | 1.10Å | |
| C4 | H50 | sing | 1.08Å | 1.08Å | |
| C5 | H51 | sing | 1.08Å | 1.08Å | |
| C7 | H52 | sing | 1.08Å | 1.08Å | |
| C9 | H55 | sing | 1.09Å | 1.10Å | |
| C9 | H54 | sing | 1.09Å | 1.10Å | |
| C9 | H53 | sing | 1.09Å | 1.10Å | |
| C10 | H56 | sing | 1.09Å | 1.10Å | |
| N12 | H60 | sing | 0.97Å | 1.00Å | |
| C26 | H67 | sing | 1.09Å | 1.10Å | |
| C26 | H66 | sing | 1.09Å | 1.10Å | |
| C29 | H68 | sing | 1.08Å | 1.08Å | |
| C30 | H69 | sing | 1.08Å | 1.08Å | |
| C32 | H70 | sing | 1.08Å | 1.08Å | |
| N33 | H71 | sing | 0.97Å | 1.00Å | |
| C37 | H74 | sing | 1.09Å | 1.10Å | |
| C37 | H72 | sing | 1.09Å | 1.10Å | |
| C37 | H73 | sing | 1.09Å | 1.10Å | |
| N38 | H76 | sing | 0.97Å | 1.00Å | |
| N38 | H75 | sing | 0.97Å | 1.00Å | |
| N41 | H77 | sing | 0.97Å | 1.00Å | |
| C45 | H78 | sing | 1.09Å | 1.10Å | |
| C45 | H79 | sing | 1.09Å | 1.10Å | |
| C46 | H81 | sing | 1.09Å | 1.10Å | |
| C46 | H80 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C46 | C45 | C39 | 60.9° | 60.0° |
| C45 | C46 | C39 | 60.9° | 60.0° |
| C46 | C45 | H78 | 119.9° | 117.5° |
| C46 | C45 | H79 | 119.9° | 117.5° |
| C45 | C46 | H81 | 119.9° | 117.5° |
| C45 | C46 | H80 | 119.8° | 117.5° |
| C45 | C39 | C46 | 58.3° | 60.0° |
| C45 | C39 | C40 | 115.0° | 117.5° |
| C45 | C39 | C28 | 119.7° | 117.5° |
| C39 | C45 | H78 | 119.9° | 117.5° |
| C39 | C45 | H79 | 119.8° | 117.5° |
| C30 | C29 | C28 | 121.5° | 119.9° |
| C29 | C30 | C31 | 120.0° | 119.9° |
| C30 | C29 | H68 | 119.3° | 120.0° |
| C29 | C30 | H69 | 120.0° | 120.1° |
| C29 | C28 | C39 | 119.9° | 119.8° |
| C29 | C28 | C27 | 118.8° | 120.4° |
| C28 | C29 | H68 | 119.2° | 120.0° |
| C46 | C39 | C40 | 117.4° | 117.5° |
| C46 | C39 | C28 | 118.7° | 117.5° |
| C39 | C46 | H81 | 119.9° | 117.5° |
| C39 | C46 | H80 | 119.9° | 117.5° |
| C40 | C39 | C28 | 115.7° | 115.5° |
| C39 | C40 | N41 | 125.8° | 126.7° |
| C39 | C40 | N44 | 126.0° | 126.6° |
| C39 | C28 | C27 | 121.2° | 119.8° |
| C40 | N41 | N42 | 108.9° | 107.2° |
| N41 | C40 | N44 | 108.2° | 106.7° |
| C40 | N41 | H77 | 125.5° | 126.5° |
| N41 | N42 | N43 | 106.0° | 108.8° |
| N42 | N41 | H77 | 125.6° | 126.4° |
| C40 | N44 | N43 | 106.2° | 108.0° |
| C30 | C31 | N33 | 119.8° | 118.8° |
| C30 | C31 | C32 | 119.1° | 120.1° |
| C31 | C30 | H69 | 120.0° | 120.1° |
| N42 | N43 | N44 | 110.7° | 109.4° |
| C28 | C27 | C32 | 119.4° | 119.7° |
| C28 | C27 | C26 | 121.3° | 119.1° |
| N33 | C31 | C32 | 121.1° | 121.0° |
| C31 | N33 | C35 | 126.0° | 117.1° |
| C31 | N33 | H71 | 117.0° | 121.5° |
| C31 | C32 | C27 | 121.2° | 119.9° |
| C31 | C32 | H70 | 119.4° | 120.1° |
| C32 | C27 | C26 | 119.3° | 121.2° |
| C27 | C32 | H70 | 119.4° | 120.0° |
| C27 | C26 | N25 | 113.8° | 109.7° |
| C27 | C26 | H67 | 108.4° | 109.4° |
| C27 | C26 | H66 | 108.4° | 109.4° |
| N33 | C35 | O34 | 110.1° | 117.2° |
| N33 | C35 | O36 | 125.3° | 121.4° |
| C35 | N33 | H71 | 117.0° | 121.4° |
| C26 | N25 | C13 | 118.1° | 115.9° |
| C26 | N25 | C37 | 116.9° | 122.1° |
| N25 | C26 | H67 | 108.4° | 109.5° |
| N25 | C26 | H66 | 108.4° | 109.4° |
| O24 | C13 | N25 | 120.7° | 120.8° |
| O24 | C13 | C10 | 118.9° | 120.8° |
| O34 | C35 | O36 | 124.5° | 121.4° |
| C35 | O34 | C2 | 116.6° | 118.9° |
| C9 | C8 | C7 | 118.3° | 120.0° |
| C9 | C8 | C3 | 122.7° | 120.0° |
| C8 | C9 | H55 | 109.5° | 109.5° |
| C8 | C9 | H54 | 109.4° | 109.5° |
| C8 | C9 | H53 | 109.4° | 109.4° |
| O34 | C2 | C1 | 108.6° | 111.2° |
| O34 | C2 | H48 | 109.7° | 109.4° |
| O34 | C2 | H49 | 109.7° | 108.5° |
| C13 | N25 | C37 | 125.0° | 122.0° |
| N25 | C13 | C10 | 120.3° | 118.4° |
| N25 | C37 | H74 | 109.5° | 109.5° |
| N25 | C37 | H72 | 109.5° | 109.4° |
| N25 | C37 | H73 | 109.5° | 109.5° |
| C13 | C10 | N12 | 106.9° | 109.7° |
| C13 | C10 | C6 | 110.6° | 108.5° |
| C13 | C10 | H56 | 108.5° | 109.6° |
| C7 | C8 | C3 | 119.0° | 119.9° |
| C8 | C7 | C6 | 122.0° | 120.1° |
| C8 | C7 | H52 | 119.0° | 120.0° |
| C8 | C3 | C1 | 121.2° | 120.0° |
| C8 | C3 | C4 | 119.0° | 120.0° |
| C7 | C6 | C10 | 120.4° | 119.9° |
| C7 | C6 | C5 | 118.2° | 120.0° |
| C6 | C7 | H52 | 119.0° | 120.0° |
| C2 | C1 | C3 | 111.7° | 109.5° |
| C2 | C1 | C11 | 109.4° | 109.9° |
| C2 | C1 | H47 | 107.2° | 108.8° |
| C1 | C2 | H48 | 109.7° | 109.2° |
| C1 | C2 | H49 | 109.7° | 109.2° |
| C10 | N12 | C14 | 124.1° | 120.0° |
| N12 | C10 | C6 | 112.8° | 109.6° |
| N12 | C10 | H56 | 109.5° | 109.8° |
| C10 | N12 | H60 | 105.7° | 120.0° |
| N12 | C14 | C19 | 117.1° | 119.7° |
| N12 | C14 | C15 | 123.0° | 119.6° |
| C14 | N12 | H60 | 105.7° | 120.0° |
| C10 | C6 | C5 | 121.3° | 120.1° |
| C6 | C10 | H56 | 108.5° | 109.6° |
| C6 | C5 | C4 | 120.8° | 120.0° |
| C6 | C5 | H51 | 119.6° | 120.0° |
| C3 | C1 | C11 | 113.1° | 109.5° |
| C1 | C3 | C4 | 119.7° | 120.0° |
| C3 | C1 | H47 | 107.6° | 109.5° |
| C1 | C11 | H59 | 109.5° | 109.5° |
| C1 | C11 | H57 | 109.5° | 109.5° |
| C1 | C11 | H58 | 109.5° | 109.5° |
| C11 | C1 | H47 | 107.5° | 109.5° |
| C3 | C4 | C5 | 121.0° | 119.9° |
| C3 | C4 | H50 | 119.5° | 120.0° |
| C14 | C19 | C18 | 121.5° | 120.9° |
| C19 | C14 | C15 | 119.8° | 120.7° |
| C14 | C19 | H63 | 119.2° | 119.5° |
| C19 | C18 | C17 | 121.0° | 119.9° |
| C19 | C18 | H62 | 119.5° | 120.1° |
| C18 | C19 | H63 | 119.3° | 119.6° |
| C14 | C15 | C16 | 120.3° | 119.3° |
| C14 | C15 | H61 | 119.9° | 120.3° |
| C5 | C4 | H50 | 119.5° | 120.1° |
| C4 | C5 | H51 | 119.6° | 120.0° |
| C18 | C17 | C16 | 118.1° | 119.6° |
| C18 | C17 | C23 | 124.4° | 121.9° |
| C17 | C18 | H62 | 119.5° | 120.1° |
| C15 | C16 | C17 | 119.3° | 119.7° |
| C15 | C16 | C20 | 121.9° | 122.1° |
| C16 | C15 | H61 | 119.9° | 120.4° |
| C16 | C17 | C23 | 117.4° | 118.5° |
| C17 | C16 | C20 | 118.7° | 118.2° |
| C17 | C23 | N38 | 121.4° | 120.1° |
| C17 | C23 | N22 | 121.3° | 119.8° |
| C16 | C20 | C21 | 119.6° | 118.9° |
| C16 | C20 | H64 | 120.2° | 120.5° |
| N38 | C23 | N22 | 117.2° | 120.1° |
| C23 | N38 | H76 | 109.5° | 120.0° |
| C23 | N38 | H75 | 109.5° | 120.0° |
| C23 | N22 | C21 | 118.5° | 122.6° |
| C20 | C21 | N22 | 124.3° | 122.0° |
| C21 | C20 | H64 | 120.2° | 120.6° |
| C20 | C21 | H65 | 117.8° | 119.0° |
| N22 | C21 | H65 | 117.9° | 119.0° |
| H59 | C11 | H57 | 109.5° | 109.5° |
| H59 | C11 | H58 | 109.4° | 109.4° |
| H57 | C11 | H58 | 109.5° | 109.5° |
| H48 | C2 | H49 | 109.5° | 109.2° |
| H55 | C9 | H54 | 109.4° | 109.5° |
| H55 | C9 | H53 | 109.5° | 109.5° |
| H54 | C9 | H53 | 109.5° | 109.4° |
| H67 | C26 | H66 | 109.5° | 109.4° |
| H74 | C37 | H72 | 109.5° | 109.4° |
| H74 | C37 | H73 | 109.5° | 109.5° |
| H72 | C37 | H73 | 109.5° | 109.5° |
| H76 | N38 | H75 | 109.4° | 120.0° |
| H78 | C45 | H79 | 109.5° | 115.5° |
| H81 | C46 | H80 | 109.5° | 115.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C46 | C45 | C39 | H78 | 109.7° | 107.5° |
| C46 | C45 | C39 | H79 | 109.7° | 107.5° |
| C45 | C46 | C39 | H81 | 109.7° | 107.5° |
| C45 | C46 | C39 | H80 | 109.7° | 107.5° |
| C46 | C45 | C39 | C40 | 108.0° | 107.5° |
| C46 | C45 | C39 | C28 | 107.3° | 107.5° |
| C46 | C45 | H78 | H79 | 144.3° | 145.7° |
| C45 | C46 | H81 | H80 | 144.2° | 145.7° |
| C45 | C39 | C28 | C29 | 32.6° | 98.9° |
| C45 | C39 | C40 | C28 | 146.1° | 145.7° |
| C45 | C39 | C40 | N41 | 50.7° | 152.7° |
| C45 | C39 | C40 | N44 | 126.9° | 27.6° |
| C45 | C39 | C28 | C27 | 143.5° | 81.0° |
| C39 | C45 | H78 | H79 | 144.3° | 145.7° |
| C30 | C29 | C28 | H68 | 180.0° | 180.0° |
| C30 | C29 | C28 | C39 | 173.0° | 179.7° |
| C29 | C30 | C31 | H69 | 180.0° | 180.0° |
| C30 | C29 | C28 | C27 | 3.3° | 0.2° |
| C29 | C30 | C31 | N33 | 179.1° | 179.9° |
| C29 | C30 | C31 | C32 | 3.7° | 1.9° |
| C29 | C28 | C39 | C46 | 100.4° | 30.3° |
| C29 | C28 | C39 | C40 | 111.8° | 115.4° |
| C29 | C28 | C39 | C27 | 176.2° | 179.9° |
| C28 | C29 | C30 | C31 | 4.3° | 1.6° |
| C29 | C28 | C27 | C32 | 1.7° | 1.7° |
| C29 | C28 | C27 | C26 | 176.0° | 177.7° |
| C28 | C29 | C30 | H69 | 175.6° | 178.4° |
| C46 | C39 | C40 | C28 | 148.2° | 145.6° |
| C46 | C39 | C40 | N41 | 15.0° | 138.7° |
| C46 | C39 | C40 | N44 | 167.4° | 41.1° |
| C46 | C39 | C28 | C27 | 75.7° | 149.6° |
| C39 | C46 | H81 | H80 | 144.3° | 145.7° |
| C39 | C40 | N41 | N44 | 178.0° | 179.8° |
| C39 | C40 | N41 | N42 | 177.1° | 180.0° |
| C40 | C39 | C28 | C27 | 72.0° | 64.7° |
| C39 | C40 | N44 | N43 | 176.7° | 179.9° |
| C39 | C40 | N41 | H77 | 2.9° | 0.1° |
| C40 | C39 | C45 | H78 | 1.7° | 145.0° |
| C40 | C39 | C45 | H79 | 142.3° | 0.0° |
| C40 | C39 | C46 | H81 | 146.5° | 0.0° |
| C40 | C39 | C46 | H80 | 5.9° | 145.0° |
| C28 | C39 | C40 | N41 | 163.2° | 7.0° |
| C28 | C39 | C40 | N44 | 19.2° | 173.3° |
| C39 | C28 | C27 | C32 | 174.5° | 178.2° |
| C39 | C28 | C27 | C26 | 7.8° | 2.4° |
| C39 | C28 | C29 | H68 | 7.0° | 0.3° |
| C28 | C39 | C45 | H78 | 143.0° | 0.0° |
| C28 | C39 | C45 | H79 | 2.4° | 145.0° |
| C28 | C39 | C46 | H81 | 0.7° | 145.0° |
| C28 | C39 | C46 | H80 | 141.3° | 0.0° |
| C40 | N41 | N42 | H77 | 180.0° | 180.0° |
| C40 | N41 | N42 | N43 | 0.0° | 0.0° |
| N41 | C40 | N44 | N43 | 1.2° | 0.3° |
| N42 | N41 | C40 | N44 | 0.8° | 0.2° |
| N41 | N42 | N43 | N44 | 0.7° | 0.2° |
| C40 | N44 | N43 | N42 | 1.2° | 0.4° |
| N44 | C40 | N41 | H77 | 179.2° | 179.8° |
| C30 | C31 | N33 | C32 | 177.2° | 178.2° |
| C30 | C31 | C32 | C27 | 2.2° | 0.3° |
| C30 | C31 | N33 | C35 | 165.1° | 160.2° |
| C31 | C30 | C29 | H68 | 175.7° | 178.4° |
| C30 | C31 | C32 | H70 | 177.8° | 179.7° |
| C30 | C31 | N33 | H71 | 15.0° | 19.8° |
| N43 | N42 | N41 | H77 | 180.0° | 180.0° |
| C28 | C27 | C32 | C31 | 1.2° | 1.4° |
| C28 | C27 | C32 | C26 | 177.7° | 179.4° |
| C28 | C27 | C26 | N25 | 158.4° | 150.9° |
| C28 | C27 | C26 | H67 | 37.8° | 89.0° |
| C28 | C27 | C26 | H66 | 80.9° | 30.8° |
| C27 | C28 | C29 | H68 | 176.7° | 179.8° |
| C28 | C27 | C32 | H70 | 178.8° | 178.5° |
| N33 | C31 | C32 | C27 | 179.4° | 178.5° |
| C31 | N33 | C35 | H71 | 180.0° | 179.9° |
| C31 | N33 | C35 | O34 | 163.2° | 178.6° |
| C31 | N33 | C35 | O36 | 20.3° | 1.5° |
| N33 | C31 | C30 | H69 | 0.9° | 0.1° |
| N33 | C31 | C32 | H70 | 0.6° | 1.5° |
| C31 | C32 | C27 | H70 | 180.0° | 180.0° |
| C31 | C32 | C27 | C26 | 176.6° | 178.0° |
| C32 | C31 | N33 | C35 | 17.8° | 21.7° |
| C32 | C31 | C30 | H69 | 176.3° | 178.1° |
| C32 | C31 | N33 | H71 | 162.2° | 158.4° |
| C32 | C27 | C26 | N25 | 23.9° | 29.7° |
| C32 | C27 | C26 | H67 | 144.5° | 90.4° |
| C32 | C27 | C26 | H66 | 96.8° | 149.8° |
| C27 | C26 | N25 | H67 | 120.6° | 120.1° |
| C27 | C26 | N25 | H66 | 120.7° | 120.0° |
| C27 | C26 | N25 | C13 | 73.8° | 133.0° |
| C27 | C26 | N25 | C37 | 104.7° | 47.0° |
| C27 | C26 | H67 | H66 | 118.1° | 119.9° |
| C26 | C27 | C32 | H70 | 3.5° | 2.1° |
| N33 | C35 | O34 | O36 | 176.5° | 179.9° |
| N33 | C35 | O34 | C2 | 175.0° | 165.2° |
| C26 | N25 | C13 | O24 | 5.9° | 9.8° |
| C26 | N25 | C13 | C37 | 178.4° | 180.0° |
| C26 | N25 | C13 | C10 | 170.7° | 169.9° |
| N25 | C26 | H67 | H66 | 118.0° | 119.9° |
| C26 | N25 | C37 | H74 | 180.0° | 154.3° |
| C26 | N25 | C37 | H72 | 60.0° | 34.3° |
| C26 | N25 | C37 | H73 | 60.0° | 85.7° |
| O24 | C13 | N25 | C10 | 176.6° | 179.7° |
| O24 | C13 | N25 | C37 | 175.7° | 170.2° |
| O24 | C13 | C10 | N12 | 23.8° | 0.9° |
| O24 | C13 | C10 | C6 | 99.3° | 120.6° |
| O24 | C13 | C10 | H56 | 141.7° | 119.7° |
| C35 | O34 | C2 | C1 | 97.3° | 79.0° |
| C35 | O34 | C2 | H48 | 22.6° | 160.2° |
| C35 | O34 | C2 | H49 | 142.9° | 41.1° |
| O34 | C35 | N33 | H71 | 16.8° | 1.3° |
| O36 | C35 | O34 | C2 | 8.4° | 14.9° |
| O36 | C35 | N33 | H71 | 159.7° | 178.6° |
| C9 | C8 | C7 | C3 | 179.0° | 180.0° |
| C9 | C8 | C7 | C6 | 179.3° | 180.0° |
| C9 | C8 | C3 | C1 | 7.4° | 1.6° |
| C9 | C8 | C3 | C4 | 177.4° | 178.3° |
| C9 | C8 | C7 | H52 | 0.7° | 0.0° |
| C8 | C9 | H55 | H54 | 120.0° | 120.0° |
| C8 | C9 | H55 | H53 | 120.0° | 120.0° |
| C8 | C9 | H54 | H53 | 120.0° | 119.9° |
| O34 | C2 | C1 | H48 | 119.9° | 120.8° |
| O34 | C2 | C1 | H49 | 119.9° | 119.7° |
| O34 | C2 | C1 | C3 | 60.7° | 73.8° |
| O34 | C2 | C1 | C11 | 173.3° | 165.8° |
| O34 | C2 | C1 | H47 | 56.9° | 45.9° |
| O34 | C2 | H48 | H49 | 120.4° | 118.7° |
| N25 | C13 | C10 | N12 | 159.6° | 178.8° |
| N25 | C13 | C10 | C6 | 77.3° | 59.1° |
| N25 | C13 | C10 | H56 | 41.6° | 60.6° |
| C13 | N25 | C26 | H67 | 46.8° | 12.9° |
| C13 | N25 | C26 | H66 | 165.5° | 107.0° |
| C13 | N25 | C37 | H74 | 1.6° | 25.7° |
| C13 | N25 | C37 | H72 | 121.6° | 145.7° |
| C13 | N25 | C37 | H73 | 118.4° | 94.3° |
| C37 | N25 | C13 | C10 | 7.7° | 10.1° |
| C37 | N25 | C26 | H67 | 134.7° | 167.1° |
| C37 | N25 | C26 | H66 | 16.0° | 73.0° |
| N25 | C37 | H74 | H72 | 120.0° | 119.9° |
| N25 | C37 | H74 | H73 | 120.0° | 120.0° |
| N25 | C37 | H72 | H73 | 120.0° | 120.0° |
| C13 | C10 | C6 | C7 | 62.4° | 79.9° |
| C13 | C10 | N12 | C6 | 121.7° | 119.1° |
| C13 | C10 | N12 | H56 | 117.4° | 120.5° |
| C13 | C10 | N12 | C14 | 159.1° | 84.9° |
| C13 | C10 | C6 | H56 | 119.0° | 119.7° |
| C13 | C10 | C6 | C5 | 114.7° | 98.7° |
| C13 | C10 | N12 | H60 | 78.8° | 94.9° |
| C8 | C7 | C6 | H52 | 180.0° | 179.9° |
| C8 | C7 | C6 | C10 | 175.4° | 176.9° |
| C8 | C7 | C6 | C5 | 1.8° | 1.7° |
| C7 | C8 | C3 | C1 | 173.6° | 178.4° |
| C7 | C8 | C3 | C4 | 1.5° | 1.7° |
| C7 | C8 | C9 | H55 | 89.5° | 96.1° |
| C7 | C8 | C9 | H54 | 150.5° | 143.9° |
| C7 | C8 | C9 | H53 | 30.5° | 23.9° |
| C3 | C8 | C7 | C6 | 0.3° | 0.0° |
| C8 | C3 | C1 | C2 | 95.3° | 134.8° |
| C8 | C3 | C1 | C4 | 175.1° | 179.9° |
| C8 | C3 | C1 | C11 | 140.8° | 104.6° |
| C8 | C3 | C4 | C5 | 1.8° | 1.6° |
| C8 | C3 | C1 | H47 | 22.2° | 15.5° |
| C8 | C3 | C4 | H50 | 178.1° | 178.3° |
| C3 | C8 | C7 | H52 | 179.7° | 180.0° |
| C3 | C8 | C9 | H55 | 89.4° | 83.8° |
| C3 | C8 | C9 | H54 | 30.6° | 36.1° |
| C3 | C8 | C9 | H53 | 150.6° | 156.1° |
| C7 | C6 | C10 | N12 | 57.2° | 39.9° |
| C7 | C6 | C10 | C5 | 177.1° | 178.5° |
| C7 | C6 | C5 | C4 | 1.5° | 1.7° |
| C7 | C6 | C5 | H51 | 178.4° | 178.3° |
| C7 | C6 | C10 | H56 | 178.6° | 160.5° |
| C2 | C1 | C3 | C11 | 123.9° | 120.6° |
| C2 | C1 | C3 | H47 | 117.4° | 119.3° |
| C2 | C1 | C11 | H47 | 116.1° | 119.5° |
| C2 | C1 | C3 | C4 | 79.9° | 45.3° |
| C2 | C1 | C11 | H59 | 180.0° | 60.4° |
| C2 | C1 | C11 | H57 | 60.0° | 59.6° |
| C2 | C1 | C11 | H58 | 60.0° | 179.6° |
| C1 | C2 | H48 | H49 | 120.4° | 119.4° |
| C10 | N12 | C14 | H60 | 122.0° | 179.9° |
| N12 | C10 | C6 | H56 | 121.4° | 120.5° |
| N12 | C10 | C6 | C5 | 125.7° | 141.5° |
| C10 | N12 | C14 | C19 | 167.4° | 0.1° |
| C10 | N12 | C14 | C15 | 13.4° | 179.6° |
| C14 | N12 | C10 | C6 | 79.1° | 156.0° |
| N12 | C14 | C19 | C15 | 179.3° | 179.5° |
| N12 | C14 | C19 | C18 | 179.7° | 180.0° |
| N12 | C14 | C15 | C16 | 178.5° | 179.7° |
| N12 | C14 | C15 | H61 | 1.5° | 0.3° |
| N12 | C14 | C19 | H63 | 0.3° | 0.5° |
| C14 | N12 | C10 | H56 | 41.8° | 35.5° |
| C10 | C6 | C5 | C4 | 175.7° | 176.8° |
| C10 | C6 | C5 | H51 | 4.4° | 3.1° |
| C10 | C6 | C7 | H52 | 4.6° | 3.2° |
| C6 | C10 | N12 | H60 | 42.9° | 24.1° |
| C6 | C5 | C4 | C3 | 0.3° | 0.1° |
| C6 | C5 | C4 | H51 | 180.0° | 180.0° |
| C6 | C5 | C4 | H50 | 179.7° | 180.0° |
| C5 | C6 | C7 | H52 | 178.2° | 178.3° |
| C5 | C6 | C10 | H56 | 4.3° | 21.0° |
| C3 | C1 | C11 | H47 | 118.7° | 120.2° |
| C1 | C3 | C4 | C5 | 173.4° | 178.5° |
| C3 | C1 | C11 | H59 | 54.8° | 60.0° |
| C3 | C1 | C11 | H57 | 65.2° | 180.0° |
| C3 | C1 | C11 | H58 | 174.8° | 60.0° |
| C3 | C1 | C2 | H48 | 59.2° | 165.3° |
| C3 | C1 | C2 | H49 | 179.4° | 45.9° |
| C1 | C3 | C4 | H50 | 6.6° | 1.6° |
| C11 | C1 | C3 | C4 | 44.1° | 75.3° |
| C1 | C11 | H59 | H57 | 120.0° | 120.0° |
| C1 | C11 | H59 | H58 | 120.0° | 120.0° |
| C1 | C11 | H57 | H58 | 120.0° | 120.0° |
| C11 | C1 | C2 | H48 | 66.8° | 45.0° |
| C11 | C1 | C2 | H49 | 53.4° | 74.5° |
| C3 | C4 | C5 | H50 | 180.0° | 180.0° |
| C4 | C3 | C1 | H47 | 162.7° | 164.6° |
| C3 | C4 | C5 | H51 | 179.7° | 180.0° |
| C14 | C19 | C18 | H63 | 180.0° | 179.5° |
| C14 | C19 | C18 | C17 | 1.7° | 0.5° |
| C19 | C14 | C15 | C16 | 0.7° | 0.2° |
| C14 | C19 | C18 | H62 | 178.3° | 179.8° |
| C19 | C14 | C15 | H61 | 179.3° | 179.8° |
| C19 | C14 | N12 | H60 | 45.4° | 180.0° |
| C18 | C19 | C14 | C15 | 0.4° | 0.5° |
| C19 | C18 | C17 | H62 | 180.0° | 179.7° |
| C19 | C18 | C17 | C16 | 1.6° | 0.3° |
| C19 | C18 | C17 | C23 | 175.0° | 179.7° |
| C14 | C15 | C16 | H61 | 180.0° | 180.0° |
| C14 | C15 | C16 | C17 | 0.7° | 0.0° |
| C14 | C15 | C16 | C20 | 177.8° | 180.0° |
| C15 | C14 | C19 | H63 | 179.6° | 180.0° |
| C15 | C14 | N12 | H60 | 135.4° | 0.6° |
| C18 | C17 | C16 | C15 | 0.4° | 0.0° |
| C18 | C17 | C16 | C23 | 176.9° | 179.9° |
| C18 | C17 | C16 | C20 | 179.0° | 180.0° |
| C18 | C17 | C23 | N38 | 8.5° | 0.0° |
| C18 | C17 | C23 | N22 | 174.4° | 180.0° |
| C17 | C18 | C19 | H63 | 178.4° | 180.0° |
| C15 | C16 | C17 | C20 | 178.5° | 180.0° |
| C15 | C16 | C17 | C23 | 176.4° | 180.0° |
| C15 | C16 | C20 | C21 | 174.2° | 180.0° |
| C15 | C16 | C20 | H64 | 5.8° | 0.0° |
| C16 | C17 | C23 | N38 | 174.8° | 180.0° |
| C16 | C17 | C23 | N22 | 2.2° | 0.0° |
| C17 | C16 | C20 | C21 | 4.3° | 0.0° |
| C16 | C17 | C18 | H62 | 178.4° | 180.0° |
| C17 | C16 | C15 | H61 | 179.3° | 180.0° |
| C17 | C16 | C20 | H64 | 175.7° | 179.9° |
| C23 | C17 | C16 | C20 | 2.1° | 0.0° |
| C17 | C23 | N38 | N22 | 177.1° | 180.0° |
| C17 | C23 | N22 | C21 | 4.3° | 0.0° |
| C23 | C17 | C18 | H62 | 5.0° | 0.0° |
| C17 | C23 | N38 | H76 | 177.1° | 0.0° |
| C17 | C23 | N38 | H75 | 57.1° | 180.0° |
| C16 | C20 | C21 | H64 | 180.0° | 180.0° |
| C16 | C20 | C21 | N22 | 2.3° | 0.0° |
| C20 | C16 | C15 | H61 | 2.2° | 0.0° |
| C16 | C20 | C21 | H65 | 177.7° | 180.0° |
| N38 | C23 | N22 | C21 | 172.8° | 180.0° |
| C23 | N38 | H76 | H75 | 120.0° | 180.0° |
| C23 | N22 | C21 | C20 | 2.1° | 0.0° |
| C23 | N22 | C21 | H65 | 177.9° | 179.9° |
| N22 | C23 | N38 | H76 | 0.0° | 180.0° |
| N22 | C23 | N38 | H75 | 120.0° | 0.0° |
| C20 | C21 | N22 | H65 | 180.0° | 180.0° |
| N22 | C21 | C20 | H64 | 177.7° | 180.0° |
| H62 | C18 | C19 | H63 | 1.7° | 0.3° |
| H64 | C20 | C21 | H65 | 2.3° | 0.0° |
| H59 | C11 | H57 | H58 | 120.0° | 120.0° |
| H59 | C11 | C1 | H47 | 63.8° | 179.8° |
| H57 | C11 | C1 | H47 | 176.1° | 59.8° |
| H58 | C11 | C1 | H47 | 56.1° | 60.2° |
| H47 | C1 | C2 | H48 | 176.8° | 74.9° |
| H47 | C1 | C2 | H49 | 62.9° | 165.6° |
| H50 | C4 | C5 | H51 | 0.3° | 0.0° |
| H55 | C9 | H54 | H53 | 120.0° | 120.1° |
| H56 | C10 | N12 | H60 | 163.8° | 144.6° |
| H68 | C29 | C30 | H69 | 4.4° | 1.6° |
| H74 | C37 | H72 | H73 | 120.0° | 120.0° |
| H78 | C45 | C46 | H81 | 140.6° | 145.0° |
| H78 | C45 | C46 | H80 | 0.0° | 0.1° |
| H79 | C45 | C46 | H81 | 0.0° | 0.0° |
| H79 | C45 | C46 | H80 | 140.6° | 145.0° |
