SWP
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C40 | N39 | doub | 1.32Å | 1.35Å | Aromatic |
| C40 | C41 | sing | 1.38Å | 1.38Å | Aromatic |
| F36 | C31 | sing | 1.35Å | 1.35Å | |
| N39 | C6 | sing | 1.32Å | 1.34Å | Aromatic |
| C28 | C27 | sing | 1.52Å | 1.52Å | |
| C28 | N5 | sing | 1.46Å | 1.47Å | |
| C27 | C26 | sing | 1.51Å | 1.49Å | |
| C31 | C32 | doub | 1.38Å | 1.38Å | Aromatic |
| C31 | C30 | sing | 1.40Å | 1.39Å | Aromatic |
| C41 | C7 | doub | 1.40Å | 1.40Å | Aromatic |
| C32 | C33 | sing | 1.38Å | 1.39Å | Aromatic |
| C3 | C4 | sing | 1.53Å | 1.56Å | |
| C3 | C2 | sing | 1.52Å | 1.54Å | |
| C30 | C26 | sing | 1.47Å | 1.49Å | |
| C30 | C35 | doub | 1.40Å | 1.39Å | Aromatic |
| C4 | C23 | sing | 1.53Å | 1.54Å | |
| C6 | C2 | sing | 1.51Å | 1.49Å | |
| C6 | C42 | doub | 1.38Å | 1.39Å | Aromatic |
| C33 | C34 | doub | 1.38Å | 1.38Å | Aromatic |
| C26 | C25 | doub | 1.35Å | 1.34Å | |
| N5 | C2 | sing | 1.46Å | 1.48Å | |
| N5 | C24 | sing | 1.34Å | 1.37Å | |
| O22 | C20 | doub | 1.22Å | 1.23Å | |
| C35 | C34 | sing | 1.38Å | 1.38Å | Aromatic |
| C35 | F37 | sing | 1.35Å | 1.34Å | |
| C7 | C42 | sing | 1.40Å | 1.39Å | Aromatic |
| C7 | C8 | sing | 1.48Å | 1.49Å | |
| C34 | CL1 | sing | 1.74Å | 1.74Å | |
| C25 | C24 | sing | 1.46Å | 1.46Å | |
| C38 | C21 | sing | 1.53Å | 1.53Å | |
| C24 | O29 | doub | 1.22Å | 1.23Å | |
| C23 | C21 | sing | 1.52Å | 1.54Å | |
| C20 | C21 | sing | 1.51Å | 1.52Å | |
| C20 | N19 | sing | 1.36Å | 1.37Å | |
| C8 | C9 | doub | 1.39Å | 1.40Å | Aromatic |
| C8 | C13 | sing | 1.41Å | 1.41Å | Aromatic |
| C9 | C10 | sing | 1.38Å | 1.38Å | Aromatic |
| N19 | C13 | sing | 1.41Å | 1.43Å | |
| C10 | C11 | doub | 1.39Å | 1.39Å | Aromatic |
| C13 | C12 | doub | 1.38Å | 1.40Å | Aromatic |
| C11 | C12 | sing | 1.39Å | 1.39Å | Aromatic |
| C11 | N14 | sing | 1.40Å | 1.43Å | |
| O16 | C15 | doub | 1.22Å | 1.21Å | |
| N14 | C15 | sing | 1.35Å | 1.36Å | |
| C15 | O17 | sing | 1.35Å | 1.34Å | |
| O17 | C18 | sing | 1.45Å | 1.45Å | |
| N14 | H51 | sing | 0.97Å | 1.00Å | |
| C18 | H52 | sing | 1.09Å | 1.10Å | |
| C18 | H53 | sing | 1.09Å | 1.10Å | |
| C18 | H54 | sing | 1.09Å | 1.10Å | |
| C21 | H56 | sing | 1.10Å | 1.10Å | |
| C23 | H58 | sing | 1.10Å | 1.10Å | |
| C23 | H57 | sing | 1.09Å | 1.10Å | |
| C12 | H50 | sing | 1.08Å | 1.08Å | |
| C27 | H60 | sing | 1.09Å | 1.10Å | |
| C27 | H61 | sing | 1.09Å | 1.10Å | |
| C33 | H65 | sing | 1.08Å | 1.08Å | |
| C2 | H43 | sing | 1.10Å | 1.10Å | |
| C3 | H44 | sing | 1.09Å | 1.10Å | |
| C3 | H45 | sing | 1.09Å | 1.10Å | |
| C4 | H47 | sing | 1.08Å | 1.10Å | |
| C4 | H46 | sing | 1.10Å | 1.10Å | |
| C9 | H48 | sing | 1.08Å | 1.08Å | |
| C10 | H49 | sing | 1.08Å | 1.08Å | |
| N19 | H55 | sing | 0.98Å | 1.00Å | |
| C25 | H59 | sing | 1.08Å | 1.08Å | |
| C28 | H63 | sing | 1.09Å | 1.10Å | |
| C28 | H62 | sing | 1.09Å | 1.10Å | |
| C32 | H64 | sing | 1.08Å | 1.08Å | |
| C38 | H68 | sing | 1.09Å | 1.10Å | |
| C38 | H67 | sing | 1.09Å | 1.10Å | |
| C38 | H66 | sing | 1.09Å | 1.10Å | |
| C40 | H69 | sing | 1.08Å | 1.08Å | |
| C41 | H70 | sing | 1.08Å | 1.08Å | |
| C42 | H71 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N39 | C40 | C41 | 123.7° | 121.3° |
| C40 | N39 | C6 | 117.0° | 121.8° |
| N39 | C40 | H69 | 118.1° | 119.4° |
| C40 | C41 | C7 | 119.0° | 118.8° |
| C41 | C40 | H69 | 118.2° | 119.3° |
| C40 | C41 | H70 | 120.5° | 120.6° |
| F36 | C31 | C32 | 118.3° | 120.1° |
| F36 | C31 | C30 | 117.9° | 120.1° |
| N39 | C6 | C2 | 118.1° | 120.2° |
| N39 | C6 | C42 | 122.9° | 120.7° |
| C27 | C28 | N5 | 110.7° | 110.4° |
| C28 | C27 | C26 | 113.4° | 110.2° |
| C28 | C27 | H60 | 108.5° | 109.2° |
| C28 | C27 | H61 | 108.5° | 109.4° |
| C27 | C28 | H63 | 109.1° | 109.3° |
| C27 | C28 | H62 | 109.2° | 109.3° |
| C28 | N5 | C2 | 122.3° | 119.7° |
| C28 | N5 | C24 | 121.5° | 120.5° |
| N5 | C28 | H63 | 109.2° | 109.4° |
| N5 | C28 | H62 | 109.2° | 109.2° |
| C27 | C26 | C30 | 119.5° | 120.0° |
| C27 | C26 | C25 | 117.6° | 119.9° |
| C26 | C27 | H60 | 108.5° | 109.4° |
| C26 | C27 | H61 | 108.5° | 109.4° |
| C32 | C31 | C30 | 123.8° | 119.8° |
| C31 | C32 | C33 | 118.9° | 120.3° |
| C31 | C32 | H64 | 120.5° | 119.8° |
| C31 | C30 | C26 | 122.8° | 120.3° |
| C31 | C30 | C35 | 114.8° | 119.6° |
| C41 | C7 | C42 | 117.5° | 117.8° |
| C41 | C7 | C8 | 122.0° | 121.5° |
| C7 | C41 | H70 | 120.5° | 120.6° |
| C32 | C33 | C34 | 119.7° | 120.4° |
| C32 | C33 | H65 | 120.1° | 119.8° |
| C33 | C32 | H64 | 120.6° | 119.9° |
| C4 | C3 | C2 | 115.9° | 112.0° |
| C3 | C4 | C23 | 118.9° | 109.2° |
| C4 | C3 | H44 | 107.8° | 109.1° |
| C4 | C3 | H45 | 107.8° | 108.9° |
| C3 | C4 | H47 | 107.1° | 111.1° |
| C3 | C4 | H46 | 107.1° | 108.2° |
| C3 | C2 | C6 | 108.0° | 110.3° |
| C3 | C2 | N5 | 113.6° | 110.8° |
| C3 | C2 | H43 | 105.8° | 108.7° |
| C2 | C3 | H44 | 107.8° | 109.3° |
| C2 | C3 | H45 | 107.9° | 109.1° |
| C26 | C30 | C35 | 122.2° | 120.2° |
| C30 | C26 | C25 | 122.2° | 120.1° |
| C30 | C35 | C34 | 123.4° | 119.8° |
| C30 | C35 | F37 | 119.0° | 120.1° |
| C4 | C23 | C21 | 116.0° | 111.6° |
| C4 | C23 | H58 | 107.8° | 108.5° |
| C4 | C23 | H57 | 107.8° | 109.5° |
| C23 | C4 | H47 | 107.1° | 109.9° |
| C23 | C4 | H46 | 107.1° | 109.1° |
| C2 | C6 | C42 | 118.6° | 119.1° |
| C6 | C2 | N5 | 115.9° | 110.2° |
| C6 | C2 | H43 | 106.4° | 108.4° |
| C6 | C42 | C7 | 119.9° | 119.6° |
| C6 | C42 | H71 | 120.1° | 120.4° |
| C33 | C34 | C35 | 119.3° | 120.1° |
| C33 | C34 | CL1 | 120.7° | 120.0° |
| C34 | C33 | H65 | 120.1° | 119.7° |
| C26 | C25 | C24 | 123.0° | 119.5° |
| C26 | C25 | H59 | 118.5° | 120.2° |
| C2 | N5 | C24 | 116.2° | 119.8° |
| N5 | C2 | H43 | 106.5° | 108.4° |
| N5 | C24 | C25 | 117.7° | 119.9° |
| N5 | C24 | O29 | 121.5° | 120.1° |
| O22 | C20 | C21 | 121.4° | 119.7° |
| O22 | C20 | N19 | 123.2° | 120.9° |
| C34 | C35 | F37 | 117.5° | 120.1° |
| C35 | C34 | CL1 | 120.0° | 119.9° |
| C42 | C7 | C8 | 120.5° | 120.7° |
| C7 | C42 | H71 | 120.0° | 120.0° |
| C7 | C8 | C9 | 118.8° | 121.3° |
| C7 | C8 | C13 | 122.8° | 118.9° |
| C25 | C24 | O29 | 120.8° | 120.1° |
| C24 | C25 | H59 | 118.5° | 120.3° |
| C38 | C21 | C23 | 111.0° | 110.4° |
| C38 | C21 | C20 | 109.3° | 109.5° |
| C38 | C21 | H56 | 106.5° | 108.2° |
| C21 | C38 | H68 | 109.5° | 109.5° |
| C21 | C38 | H67 | 109.5° | 109.5° |
| C21 | C38 | H66 | 109.5° | 109.4° |
| C23 | C21 | C20 | 116.6° | 111.6° |
| C23 | C21 | H56 | 106.3° | 108.6° |
| C21 | C23 | H58 | 107.8° | 109.0° |
| C21 | C23 | H57 | 107.8° | 110.2° |
| C21 | C20 | N19 | 115.3° | 119.4° |
| C20 | C21 | H56 | 106.5° | 108.3° |
| C20 | N19 | C13 | 127.4° | 118.4° |
| C20 | N19 | H55 | 116.3° | 121.4° |
| C9 | C8 | C13 | 118.4° | 119.9° |
| C8 | C9 | C10 | 121.4° | 120.0° |
| C8 | C9 | H48 | 119.3° | 120.2° |
| C8 | C13 | N19 | 120.3° | 117.8° |
| C8 | C13 | C12 | 119.8° | 119.6° |
| C9 | C10 | C11 | 120.3° | 120.1° |
| C10 | C9 | H48 | 119.3° | 119.8° |
| C9 | C10 | H49 | 119.8° | 119.9° |
| N19 | C13 | C12 | 119.8° | 122.6° |
| C13 | N19 | H55 | 116.3° | 120.1° |
| C10 | C11 | C12 | 119.2° | 120.1° |
| C10 | C11 | N14 | 122.5° | 120.0° |
| C11 | C10 | H49 | 119.8° | 119.9° |
| C13 | C12 | C11 | 120.8° | 120.2° |
| C13 | C12 | H50 | 119.6° | 120.3° |
| C12 | C11 | N14 | 118.4° | 120.0° |
| C11 | C12 | H50 | 119.6° | 119.5° |
| C11 | N14 | C15 | 127.3° | 120.0° |
| C11 | N14 | H51 | 116.3° | 119.9° |
| O16 | C15 | N14 | 126.3° | 120.0° |
| O16 | C15 | O17 | 124.0° | 120.0° |
| N14 | C15 | O17 | 109.7° | 120.0° |
| C15 | N14 | H51 | 116.4° | 120.1° |
| C15 | O17 | C18 | 115.7° | 117.0° |
| O17 | C18 | H52 | 109.5° | 109.5° |
| O17 | C18 | H53 | 109.5° | 109.5° |
| O17 | C18 | H54 | 109.5° | 109.4° |
| H52 | C18 | H53 | 109.5° | 109.4° |
| H52 | C18 | H54 | 109.5° | 109.5° |
| H53 | C18 | H54 | 109.5° | 109.4° |
| H58 | C23 | H57 | 109.5° | 107.9° |
| H60 | C27 | H61 | 109.5° | 109.3° |
| H44 | C3 | H45 | 109.5° | 108.3° |
| H47 | C4 | H46 | 109.5° | 109.2° |
| H63 | C28 | H62 | 109.5° | 109.2° |
| H68 | C38 | H67 | 109.4° | 109.5° |
| H68 | C38 | H66 | 109.4° | 109.5° |
| H67 | C38 | H66 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N39 | C40 | C41 | H69 | 180.0° | 180.0° |
| N39 | C40 | C41 | C7 | 0.9° | 0.2° |
| C40 | N39 | C6 | C2 | 169.9° | 179.6° |
| C40 | N39 | C6 | C42 | 2.3° | 0.7° |
| N39 | C40 | C41 | H70 | 179.1° | 179.6° |
| C41 | C40 | N39 | C6 | 0.2° | 0.3° |
| C40 | C41 | C7 | H70 | 180.0° | 179.8° |
| C40 | C41 | C7 | C42 | 0.0° | 0.8° |
| C40 | C41 | C7 | C8 | 177.0° | 178.7° |
| F36 | C31 | C32 | C30 | 179.6° | 179.7° |
| F36 | C31 | C32 | C33 | 179.9° | 180.0° |
| F36 | C31 | C30 | C26 | 5.9° | 0.1° |
| F36 | C31 | C30 | C35 | 178.7° | 180.0° |
| F36 | C31 | C32 | H64 | 0.1° | 0.0° |
| N39 | C6 | C2 | C3 | 62.5° | 119.2° |
| N39 | C6 | C2 | C42 | 172.6° | 179.7° |
| N39 | C6 | C2 | N5 | 66.2° | 118.2° |
| N39 | C6 | C42 | C7 | 3.2° | 1.7° |
| N39 | C6 | C2 | H43 | 175.7° | 0.3° |
| C6 | N39 | C40 | H69 | 179.8° | 179.8° |
| N39 | C6 | C42 | H71 | 176.7° | 176.5° |
| C27 | C28 | N5 | H63 | 120.2° | 120.3° |
| C27 | C28 | N5 | H62 | 120.2° | 120.2° |
| C28 | C27 | C26 | H60 | 120.6° | 120.0° |
| C28 | C27 | C26 | H61 | 120.6° | 120.3° |
| C28 | C27 | C26 | C30 | 156.5° | 146.2° |
| C28 | C27 | C26 | C25 | 32.5° | 33.7° |
| C27 | C28 | N5 | C2 | 151.1° | 141.3° |
| C27 | C28 | N5 | C24 | 31.9° | 38.7° |
| C28 | C27 | H60 | H61 | 118.2° | 119.6° |
| C27 | C28 | H63 | H62 | 119.4° | 119.5° |
| N5 | C28 | C27 | C26 | 45.9° | 49.9° |
| C28 | N5 | C2 | C3 | 42.3° | 122.5° |
| C28 | N5 | C2 | C6 | 83.6° | 0.2° |
| C28 | N5 | C2 | C24 | 177.2° | 180.0° |
| C28 | N5 | C24 | C25 | 2.5° | 6.7° |
| C28 | N5 | C24 | O29 | 176.8° | 173.6° |
| N5 | C28 | C27 | H60 | 166.5° | 70.3° |
| N5 | C28 | C27 | H61 | 74.7° | 170.1° |
| C28 | N5 | C2 | H43 | 158.3° | 118.3° |
| N5 | C28 | H63 | H62 | 119.5° | 119.5° |
| C27 | C26 | C30 | C31 | 94.2° | 90.0° |
| C27 | C26 | C30 | C25 | 170.6° | 179.8° |
| C27 | C26 | C30 | C35 | 90.6° | 90.0° |
| C27 | C26 | C25 | C24 | 1.7° | 1.9° |
| C26 | C27 | H60 | H61 | 118.2° | 119.8° |
| C27 | C26 | C25 | H59 | 178.3° | 178.0° |
| C26 | C27 | C28 | H63 | 166.1° | 170.3° |
| C26 | C27 | C28 | H62 | 74.3° | 70.3° |
| C31 | C32 | C33 | H64 | 180.0° | 180.0° |
| C32 | C31 | C30 | C26 | 173.7° | 179.7° |
| C32 | C31 | C30 | C35 | 1.8° | 0.3° |
| C31 | C32 | C33 | C34 | 0.3° | 0.1° |
| C31 | C32 | C33 | H65 | 179.7° | 180.0° |
| C30 | C31 | C32 | C33 | 0.5° | 0.3° |
| C31 | C30 | C26 | C35 | 175.1° | 180.0° |
| C31 | C30 | C26 | C25 | 95.2° | 90.1° |
| C31 | C30 | C35 | C34 | 2.2° | 0.0° |
| C31 | C30 | C35 | F37 | 175.7° | 180.0° |
| C30 | C31 | C32 | H64 | 179.5° | 179.7° |
| C41 | C7 | C42 | C6 | 2.0° | 1.7° |
| C41 | C7 | C42 | C8 | 177.1° | 179.5° |
| C41 | C7 | C8 | C9 | 48.2° | 28.3° |
| C41 | C7 | C8 | C13 | 134.4° | 149.9° |
| C7 | C41 | C40 | H69 | 179.1° | 179.8° |
| C41 | C7 | C42 | H71 | 178.0° | 176.5° |
| C32 | C33 | C34 | H65 | 180.0° | 180.0° |
| C32 | C33 | C34 | C35 | 0.1° | 0.2° |
| C32 | C33 | C34 | CL1 | 179.5° | 180.0° |
| C4 | C3 | C2 | H44 | 120.9° | 121.1° |
| C4 | C3 | C2 | H45 | 120.9° | 120.6° |
| C3 | C4 | C23 | H47 | 121.3° | 122.2° |
| C3 | C4 | C23 | H46 | 121.4° | 118.1° |
| C4 | C3 | C2 | C6 | 56.7° | 84.5° |
| C4 | C3 | C2 | N5 | 173.3° | 37.8° |
| C3 | C4 | C23 | C21 | 149.2° | 161.7° |
| C3 | C4 | C23 | H58 | 28.3° | 78.2° |
| C3 | C4 | C23 | H57 | 89.8° | 39.4° |
| C4 | C3 | C2 | H43 | 56.9° | 156.8° |
| C4 | C3 | H44 | H45 | 117.1° | 118.4° |
| C3 | C4 | H47 | H46 | 115.8° | 119.4° |
| C2 | C3 | C4 | C23 | 55.1° | 136.9° |
| C3 | C2 | C6 | N5 | 128.7° | 122.6° |
| C3 | C2 | C6 | H43 | 113.2° | 118.9° |
| C3 | C2 | C6 | C42 | 110.1° | 61.1° |
| C3 | C2 | N5 | H43 | 116.0° | 119.2° |
| C3 | C2 | N5 | C24 | 140.5° | 57.5° |
| C2 | C3 | H44 | H45 | 117.1° | 118.8° |
| C2 | C3 | C4 | H47 | 176.5° | 15.5° |
| C2 | C3 | C4 | H46 | 66.2° | 104.4° |
| C26 | C30 | C35 | C34 | 173.3° | 179.9° |
| C26 | C30 | C35 | F37 | 8.8° | 0.0° |
| C30 | C26 | C25 | C24 | 172.4° | 177.9° |
| C30 | C26 | C27 | H60 | 36.0° | 93.8° |
| C30 | C26 | C27 | H61 | 82.9° | 25.9° |
| C30 | C26 | C25 | H59 | 7.6° | 2.1° |
| C30 | C35 | C34 | C33 | 1.5° | 0.3° |
| C35 | C30 | C26 | C25 | 79.9° | 89.8° |
| C30 | C35 | C34 | F37 | 177.9° | 180.0° |
| C30 | C35 | C34 | CL1 | 178.1° | 180.0° |
| C4 | C23 | C21 | C38 | 63.5° | 49.1° |
| C4 | C23 | C21 | H58 | 120.9° | 119.8° |
| C4 | C23 | C21 | H57 | 121.0° | 121.9° |
| C4 | C23 | C21 | C20 | 62.6° | 73.0° |
| C4 | C23 | C21 | H56 | 178.9° | 167.6° |
| C4 | C23 | H58 | H57 | 117.0° | 118.6° |
| C23 | C4 | C3 | H44 | 176.0° | 15.8° |
| C23 | C4 | C3 | H45 | 65.8° | 102.3° |
| C23 | C4 | H47 | H46 | 115.7° | 119.6° |
| C6 | C2 | N5 | H43 | 118.0° | 118.5° |
| C6 | C2 | N5 | C24 | 93.6° | 179.8° |
| C2 | C6 | C42 | C7 | 169.0° | 178.6° |
| C6 | C2 | C3 | H44 | 64.3° | 36.6° |
| C6 | C2 | C3 | H45 | 177.6° | 154.9° |
| C2 | C6 | C42 | H71 | 11.1° | 3.3° |
| C42 | C6 | C2 | N5 | 121.2° | 61.5° |
| C6 | C42 | C7 | H71 | 180.0° | 178.1° |
| C6 | C42 | C7 | C8 | 175.1° | 177.8° |
| C42 | C6 | C2 | H43 | 3.1° | 180.0° |
| C33 | C34 | C35 | CL1 | 179.6° | 179.7° |
| C33 | C34 | C35 | F37 | 176.4° | 179.7° |
| C34 | C33 | C32 | H64 | 179.7° | 180.0° |
| C26 | C25 | C24 | N5 | 14.7° | 13.6° |
| C26 | C25 | C24 | H59 | 180.0° | 179.9° |
| C26 | C25 | C24 | O29 | 166.0° | 166.1° |
| C25 | C26 | C27 | H60 | 153.1° | 86.3° |
| C25 | C26 | C27 | H61 | 88.1° | 153.9° |
| C2 | N5 | C24 | C25 | 179.7° | 173.3° |
| C2 | N5 | C24 | O29 | 0.4° | 6.4° |
| N5 | C2 | C3 | H44 | 65.8° | 158.9° |
| N5 | C2 | C3 | H45 | 52.4° | 82.8° |
| C2 | N5 | C28 | H63 | 30.9° | 20.9° |
| C2 | N5 | C28 | H62 | 88.7° | 98.6° |
| N5 | C24 | C25 | O29 | 179.3° | 179.7° |
| C24 | N5 | C2 | H43 | 24.5° | 61.7° |
| N5 | C24 | C25 | H59 | 165.3° | 166.5° |
| C24 | N5 | C28 | H63 | 152.0° | 159.0° |
| C24 | N5 | C28 | H62 | 88.3° | 81.5° |
| O22 | C20 | C21 | C38 | 33.9° | 33.4° |
| O22 | C20 | C21 | C23 | 93.0° | 156.0° |
| O22 | C20 | C21 | N19 | 177.2° | 179.4° |
| O22 | C20 | N19 | C13 | 0.8° | 8.3° |
| O22 | C20 | C21 | H56 | 148.6° | 84.4° |
| O22 | C20 | N19 | H55 | 179.2° | 173.6° |
| C35 | C34 | C33 | H65 | 179.9° | 179.7° |
| F37 | C35 | C34 | CL1 | 4.0° | 0.0° |
| C42 | C7 | C8 | C9 | 134.9° | 152.3° |
| C42 | C7 | C8 | C13 | 42.5° | 29.6° |
| C42 | C7 | C41 | H70 | 180.0° | 179.4° |
| C7 | C8 | C9 | C13 | 177.5° | 178.1° |
| C7 | C8 | C9 | C10 | 178.2° | 178.3° |
| C7 | C8 | C13 | N19 | 6.4° | 3.3° |
| C7 | C8 | C13 | C12 | 175.8° | 177.5° |
| C7 | C8 | C9 | H48 | 1.8° | 1.6° |
| C8 | C7 | C41 | H70 | 3.0° | 1.1° |
| C8 | C7 | C42 | H71 | 4.9° | 4.0° |
| CL1 | C34 | C33 | H65 | 0.5° | 0.0° |
| C38 | C21 | C23 | C20 | 126.1° | 122.1° |
| C38 | C21 | C23 | H56 | 115.3° | 118.5° |
| C38 | C21 | C20 | H56 | 114.7° | 117.8° |
| C38 | C21 | C20 | N19 | 148.9° | 146.0° |
| C38 | C21 | C23 | H58 | 175.6° | 70.8° |
| C38 | C21 | C23 | H57 | 57.4° | 171.0° |
| C21 | C38 | H68 | H67 | 120.0° | 120.0° |
| C21 | C38 | H68 | H66 | 120.0° | 120.0° |
| C21 | C38 | H67 | H66 | 120.0° | 119.9° |
| O29 | C24 | C25 | H59 | 14.0° | 13.8° |
| C23 | C21 | C20 | H56 | 118.4° | 119.5° |
| C23 | C21 | C20 | N19 | 84.2° | 23.4° |
| C21 | C23 | H58 | H57 | 117.0° | 119.7° |
| C21 | C23 | C4 | H47 | 89.4° | 39.5° |
| C21 | C23 | C4 | H46 | 27.9° | 80.2° |
| C23 | C21 | C38 | H68 | 180.0° | 176.7° |
| C23 | C21 | C38 | H67 | 60.0° | 56.7° |
| C23 | C21 | C38 | H66 | 60.0° | 63.3° |
| C21 | C20 | N19 | C13 | 176.3° | 172.3° |
| C20 | C21 | C23 | H58 | 58.4° | 167.1° |
| C20 | C21 | C23 | H57 | 176.5° | 48.9° |
| C21 | C20 | N19 | H55 | 3.7° | 5.8° |
| C20 | C21 | C38 | H68 | 50.0° | 60.0° |
| C20 | C21 | C38 | H67 | 169.9° | 180.0° |
| C20 | C21 | C38 | H66 | 70.1° | 60.0° |
| C20 | N19 | C13 | C8 | 56.7° | 146.5° |
| C20 | N19 | C13 | H55 | 180.0° | 178.1° |
| C20 | N19 | C13 | C12 | 121.1° | 34.3° |
| N19 | C20 | C21 | H56 | 34.2° | 96.1° |
| C8 | C9 | C10 | H48 | 180.0° | 179.9° |
| C9 | C8 | C13 | N19 | 176.2° | 174.9° |
| C8 | C9 | C10 | C11 | 2.0° | 0.7° |
| C9 | C8 | C13 | C12 | 1.6° | 4.3° |
| C8 | C9 | C10 | H49 | 178.0° | 179.2° |
| C13 | C8 | C9 | C10 | 0.7° | 3.6° |
| C8 | C13 | N19 | C12 | 177.8° | 179.2° |
| C8 | C13 | C12 | C11 | 2.6° | 2.3° |
| C8 | C13 | C12 | H50 | 177.4° | 178.4° |
| C13 | C8 | C9 | H48 | 179.3° | 176.5° |
| C8 | C13 | N19 | H55 | 123.3° | 35.4° |
| C9 | C10 | C11 | H49 | 180.0° | 179.9° |
| C9 | C10 | C11 | C12 | 1.0° | 1.3° |
| C9 | C10 | C11 | N14 | 179.9° | 178.8° |
| N19 | C13 | C12 | C11 | 175.2° | 176.9° |
| N19 | C13 | C12 | H50 | 4.8° | 2.4° |
| C10 | C11 | C12 | C13 | 1.3° | 0.5° |
| C10 | C11 | C12 | N14 | 179.2° | 179.8° |
| C10 | C11 | N14 | C15 | 6.6° | 33.2° |
| C10 | C11 | N14 | H51 | 173.4° | 147.0° |
| C10 | C11 | C12 | H50 | 178.7° | 178.8° |
| C11 | C10 | C9 | H48 | 178.0° | 179.4° |
| C13 | C12 | C11 | H50 | 180.0° | 179.3° |
| C13 | C12 | C11 | N14 | 177.9° | 179.6° |
| C12 | C13 | N19 | H55 | 58.9° | 143.8° |
| C12 | C11 | N14 | C15 | 172.6° | 146.9° |
| C12 | C11 | N14 | H51 | 7.4° | 32.8° |
| C12 | C11 | C10 | H49 | 179.0° | 178.8° |
| C11 | N14 | C15 | O16 | 3.9° | 4.7° |
| C11 | N14 | C15 | H51 | 180.0° | 179.7° |
| C11 | N14 | C15 | O17 | 176.4° | 175.3° |
| N14 | C11 | C12 | H50 | 2.1° | 1.1° |
| N14 | C11 | C10 | H49 | 0.1° | 1.1° |
| O16 | C15 | N14 | O17 | 179.7° | 179.9° |
| O16 | C15 | O17 | C18 | 9.9° | 0.1° |
| O16 | C15 | N14 | H51 | 176.1° | 175.1° |
| N14 | C15 | O17 | C18 | 170.3° | 180.0° |
| O17 | C15 | N14 | H51 | 3.6° | 5.0° |
| C15 | O17 | C18 | H52 | 180.0° | 60.0° |
| C15 | O17 | C18 | H53 | 60.0° | 60.0° |
| C15 | O17 | C18 | H54 | 60.0° | 180.0° |
| O17 | C18 | H52 | H53 | 120.0° | 120.0° |
| O17 | C18 | H52 | H54 | 120.0° | 120.0° |
| O17 | C18 | H53 | H54 | 120.0° | 120.0° |
| H52 | C18 | H53 | H54 | 120.0° | 120.0° |
| H56 | C21 | C23 | H58 | 60.2° | 47.8° |
| H56 | C21 | C23 | H57 | 57.9° | 70.5° |
| H56 | C21 | C38 | H68 | 64.8° | 57.9° |
| H56 | C21 | C38 | H67 | 55.2° | 62.1° |
| H56 | C21 | C38 | H66 | 175.2° | 178.0° |
| H58 | C23 | C4 | H47 | 149.6° | 159.6° |
| H58 | C23 | C4 | H46 | 93.1° | 39.9° |
| H57 | C23 | C4 | H47 | 31.5° | 82.8° |
| H57 | C23 | C4 | H46 | 148.8° | 157.5° |
| H60 | C27 | C28 | H63 | 73.3° | 50.1° |
| H60 | C27 | C28 | H62 | 46.3° | 169.6° |
| H61 | C27 | C28 | H63 | 45.5° | 69.4° |
| H61 | C27 | C28 | H62 | 165.1° | 50.0° |
| H65 | C33 | C32 | H64 | 0.3° | 0.0° |
| H43 | C2 | C3 | H44 | 177.8° | 82.1° |
| H43 | C2 | C3 | H45 | 64.0° | 36.2° |
| H44 | C3 | C4 | H47 | 62.6° | 105.7° |
| H44 | C3 | C4 | H46 | 54.7° | 134.4° |
| H45 | C3 | C4 | H47 | 55.5° | 136.3° |
| H45 | C3 | C4 | H46 | 172.8° | 16.3° |
| H48 | C9 | C10 | H49 | 2.0° | 0.8° |
| H68 | C38 | H67 | H66 | 119.9° | 120.0° |
| H69 | C40 | C41 | H70 | 0.9° | 0.3° |
