FFG
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C13 | C5 | doub | 1.39Å | 1.47Å | Aromatic |
| C13 | C6 | sing | 1.39Å | 1.47Å | Aromatic |
| C13 | C14 | sing | 1.48Å | 1.52Å | Aromatic |
| C18 | C12 | doub | 1.39Å | 1.44Å | Aromatic |
| C18 | C9 | sing | 1.39Å | 1.45Å | Aromatic |
| C18 | N35 | sing | 1.40Å | 1.36Å | Aromatic |
| C17 | C8 | doub | 1.38Å | 1.47Å | Aromatic |
| C17 | C14 | sing | 1.39Å | 1.46Å | Aromatic |
| C17 | C31 | sing | 1.51Å | 1.53Å | |
| C16 | C20 | doub | 1.39Å | 1.39Å | Aromatic |
| C16 | C21 | sing | 1.38Å | 1.41Å | Aromatic |
| C16 | C25 | sing | 1.51Å | 1.51Å | |
| C15 | C22 | sing | 1.48Å | 1.47Å | |
| C15 | C12 | sing | 1.39Å | 1.45Å | Aromatic |
| C15 | C7 | doub | 1.40Å | 1.47Å | Aromatic |
| C19 | C11 | sing | 1.39Å | 1.47Å | Aromatic |
| C19 | C10 | doub | 1.39Å | 1.46Å | Aromatic |
| C19 | N38 | sing | 1.40Å | 1.37Å | |
| C20 | C23 | sing | 1.47Å | 1.40Å | |
| C20 | N35 | sing | 1.35Å | 1.36Å | Aromatic |
| C21 | C32 | sing | 1.51Å | 1.49Å | |
| C21 | N33 | doub | 1.32Å | 1.33Å | Aromatic |
| C22 | N34 | doub | 1.30Å | 1.33Å | |
| C22 | N36 | sing | 1.38Å | 1.36Å | |
| C23 | N38 | sing | 1.35Å | 1.36Å | |
| C23 | O40 | doub | 1.22Å | 1.23Å | |
| C24 | N36 | sing | 1.35Å | 1.32Å | |
| C24 | N37 | sing | 1.35Å | 1.35Å | |
| C24 | O41 | doub | 1.22Å | 1.23Å | |
| C11 | C6 | doub | 1.38Å | 1.45Å | Aromatic |
| C27 | C25 | sing | 1.53Å | 1.53Å | |
| C27 | N38 | sing | 1.46Å | 1.49Å | |
| C1 | C2 | doub | 1.38Å | 1.46Å | Aromatic |
| C1 | C4 | sing | 1.38Å | 1.46Å | Aromatic |
| C2 | C8 | sing | 1.38Å | 1.44Å | Aromatic |
| C3 | C7 | sing | 1.38Å | 1.45Å | Aromatic |
| C3 | C9 | doub | 1.38Å | 1.46Å | Aromatic |
| C4 | C14 | doub | 1.39Å | 1.47Å | Aromatic |
| C5 | C10 | sing | 1.38Å | 1.45Å | Aromatic |
| C26 | C28 | sing | 1.55Å | 1.51Å | |
| C26 | C30 | sing | 1.55Å | 1.52Å | |
| C28 | N39 | sing | 1.48Å | 1.49Å | |
| C29 | C30 | sing | 1.54Å | 1.53Å | |
| C29 | N39 | sing | 1.48Å | 1.49Å | |
| C30 | O42 | sing | 1.43Å | 1.43Å | |
| C31 | N39 | sing | 1.47Å | 1.47Å | |
| C32 | F43 | sing | 1.40Å | 1.31Å | |
| C32 | F44 | sing | 1.40Å | 1.33Å | |
| C32 | F45 | sing | 1.40Å | 1.31Å | |
| N33 | N35 | sing | 1.41Å | 1.36Å | Aromatic |
| N34 | N37 | sing | 1.40Å | 1.25Å | |
| C11 | H11 | sing | 1.08Å | 1.08Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C27 | H27A | sing | 1.09Å | 1.10Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C9 | H9 | sing | 1.08Å | 1.08Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C25 | H25A | sing | 1.09Å | 1.10Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C26 | H26A | sing | 1.09Å | 1.10Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| C28 | H28A | sing | 1.09Å | 1.10Å | |
| C29 | H29 | sing | 1.09Å | 1.10Å | |
| C29 | H29A | sing | 1.09Å | 1.10Å | |
| C30 | H30 | sing | 1.09Å | 1.10Å | |
| C31 | H31 | sing | 1.09Å | 1.10Å | |
| C31 | H31A | sing | 1.09Å | 1.10Å | |
| N36 | HN36 | sing | 0.97Å | 1.00Å | |
| N37 | HN37 | sing | 0.97Å | 1.00Å | |
| O42 | HO42 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C5 | C13 | C6 | 120.5° | 119.9° |
| C5 | C13 | C14 | 119.4° | 120.0° |
| C13 | C5 | C10 | 119.9° | 120.0° |
| C13 | C5 | H5 | 120.0° | 120.0° |
| C6 | C13 | C14 | 120.2° | 120.1° |
| C13 | C6 | C11 | 119.8° | 120.0° |
| C13 | C6 | H6 | 120.1° | 120.0° |
| C13 | C14 | C17 | 123.9° | 120.1° |
| C13 | C14 | C4 | 119.6° | 120.1° |
| C12 | C18 | C9 | 119.3° | 120.0° |
| C12 | C18 | N35 | 114.6° | 120.1° |
| C18 | C12 | C15 | 120.2° | 119.8° |
| C18 | C12 | H12 | 119.9° | 120.1° |
| C9 | C18 | N35 | 126.1° | 120.0° |
| C18 | C9 | C3 | 121.1° | 120.2° |
| C18 | C9 | H9 | 119.4° | 119.9° |
| C18 | N35 | C20 | 126.9° | 126.3° |
| C18 | N35 | N33 | 122.3° | 126.2° |
| C8 | C17 | C14 | 123.0° | 119.9° |
| C8 | C17 | C31 | 116.1° | 120.1° |
| C17 | C8 | C2 | 119.7° | 120.1° |
| C17 | C8 | H8 | 120.1° | 119.9° |
| C14 | C17 | C31 | 120.9° | 120.0° |
| C17 | C14 | C4 | 116.5° | 119.8° |
| C17 | C31 | N39 | 114.0° | 109.5° |
| C17 | C31 | H31 | 108.0° | 109.5° |
| C17 | C31 | H31A | 107.0° | 109.4° |
| C20 | C16 | C21 | 107.6° | 107.7° |
| C20 | C16 | C25 | 119.3° | 121.4° |
| C16 | C20 | C23 | 125.4° | 120.7° |
| C16 | C20 | N35 | 105.7° | 107.4° |
| C21 | C16 | C25 | 133.1° | 130.9° |
| C16 | C21 | C32 | 127.8° | 125.7° |
| C16 | C21 | N33 | 107.8° | 108.6° |
| C16 | C25 | C27 | 107.2° | 108.8° |
| C16 | C25 | H25 | 110.2° | 109.6° |
| C16 | C25 | H25A | 110.7° | 109.6° |
| C22 | C15 | C12 | 116.1° | 120.1° |
| C22 | C15 | C7 | 122.6° | 120.1° |
| C15 | C22 | N34 | 126.2° | 125.7° |
| C15 | C22 | N36 | 124.6° | 125.7° |
| C12 | C15 | C7 | 121.3° | 119.8° |
| C15 | C12 | H12 | 119.9° | 120.0° |
| C15 | C7 | C3 | 118.3° | 120.0° |
| C15 | C7 | H7 | 120.9° | 120.0° |
| C11 | C19 | C10 | 121.8° | 120.1° |
| C11 | C19 | N38 | 116.7° | 120.0° |
| C19 | C11 | C6 | 119.2° | 120.0° |
| C19 | C11 | H11 | 120.4° | 120.0° |
| C10 | C19 | N38 | 121.5° | 119.9° |
| C19 | C10 | C5 | 118.9° | 120.0° |
| C19 | C10 | H10 | 120.6° | 120.0° |
| C19 | N38 | C23 | 120.0° | 118.7° |
| C19 | N38 | C27 | 119.1° | 118.7° |
| C23 | C20 | N35 | 128.9° | 131.9° |
| C20 | C23 | N38 | 116.4° | 116.7° |
| C20 | C23 | O40 | 121.5° | 121.6° |
| C20 | N35 | N33 | 110.7° | 107.4° |
| C32 | C21 | N33 | 124.3° | 125.7° |
| C21 | C32 | F43 | 108.8° | 109.4° |
| C21 | C32 | F44 | 106.3° | 109.5° |
| C21 | C32 | F45 | 108.2° | 109.5° |
| C21 | N33 | N35 | 108.2° | 108.9° |
| N34 | C22 | N36 | 109.2° | 108.6° |
| C22 | N34 | N37 | 107.1° | 108.0° |
| C22 | N36 | C24 | 105.4° | 108.2° |
| C22 | N36 | HN36 | 127.3° | 125.9° |
| N38 | C23 | O40 | 122.0° | 121.6° |
| C23 | N38 | C27 | 120.9° | 122.5° |
| N36 | C24 | N37 | 107.2° | 107.6° |
| N36 | C24 | O41 | 125.7° | 126.2° |
| C24 | N36 | HN36 | 127.3° | 125.9° |
| N37 | C24 | O41 | 127.1° | 126.2° |
| C24 | N37 | N34 | 111.1° | 107.6° |
| C24 | N37 | HN37 | 124.5° | 126.2° |
| C6 | C11 | H11 | 120.4° | 120.0° |
| C11 | C6 | H6 | 120.1° | 120.0° |
| C25 | C27 | N38 | 116.2° | 112.7° |
| C25 | C27 | H27 | 107.3° | 108.9° |
| C25 | C27 | H27A | 105.8° | 108.8° |
| C27 | C25 | H25 | 110.2° | 109.6° |
| C27 | C25 | H25A | 110.7° | 109.6° |
| N38 | C27 | H27 | 107.3° | 108.9° |
| N38 | C27 | H27A | 105.7° | 108.8° |
| C2 | C1 | C4 | 123.1° | 120.1° |
| C1 | C2 | C8 | 117.7° | 120.2° |
| C2 | C1 | H1 | 118.4° | 119.9° |
| C1 | C2 | H2 | 121.1° | 119.9° |
| C1 | C4 | C14 | 119.9° | 119.9° |
| C4 | C1 | H1 | 118.4° | 120.0° |
| C1 | C4 | H4 | 120.0° | 120.0° |
| C8 | C2 | H2 | 121.2° | 119.9° |
| C2 | C8 | H8 | 120.2° | 119.9° |
| C7 | C3 | C9 | 119.9° | 120.2° |
| C7 | C3 | H3 | 120.1° | 119.9° |
| C3 | C7 | H7 | 120.9° | 120.0° |
| C9 | C3 | H3 | 120.1° | 119.9° |
| C3 | C9 | H9 | 119.4° | 119.9° |
| C14 | C4 | H4 | 120.1° | 120.1° |
| C10 | C5 | H5 | 120.0° | 120.0° |
| C5 | C10 | H10 | 120.6° | 120.0° |
| C28 | C26 | C30 | 111.1° | 101.6° |
| C26 | C28 | N39 | 97.1° | 104.8° |
| C28 | C26 | H26 | 108.9° | 111.0° |
| C28 | C26 | H26A | 108.5° | 111.0° |
| C26 | C28 | H28 | 113.8° | 110.3° |
| C26 | C28 | H28A | 116.3° | 110.4° |
| C26 | C30 | C29 | 94.1° | 103.1° |
| C26 | C30 | O42 | 111.3° | 110.7° |
| C30 | C26 | H26 | 108.9° | 111.0° |
| C30 | C26 | H26A | 108.5° | 110.9° |
| C26 | C30 | H30 | 117.9° | 110.7° |
| C28 | N39 | C29 | 111.7° | 108.5° |
| C28 | N39 | C31 | 115.6° | 111.0° |
| N39 | C28 | H28 | 113.8° | 110.3° |
| N39 | C28 | H28A | 116.3° | 110.4° |
| C30 | C29 | N39 | 105.0° | 107.2° |
| C29 | C30 | O42 | 109.6° | 110.7° |
| C30 | C29 | H29 | 111.0° | 109.9° |
| C30 | C29 | H29A | 111.9° | 109.9° |
| C29 | C30 | H30 | 119.4° | 110.7° |
| C29 | N39 | C31 | 115.7° | 111.0° |
| N39 | C29 | H29 | 111.0° | 109.9° |
| N39 | C29 | H29A | 112.0° | 109.9° |
| O42 | C30 | H30 | 104.5° | 110.7° |
| C30 | O42 | HO42 | 109.5° | 114.0° |
| N39 | C31 | H31 | 108.0° | 109.5° |
| N39 | C31 | H31A | 106.9° | 109.5° |
| F43 | C32 | F44 | 113.1° | 109.5° |
| F43 | C32 | F45 | 112.2° | 109.5° |
| F44 | C32 | F45 | 108.1° | 109.5° |
| N34 | N37 | HN37 | 124.5° | 126.3° |
| H27 | C27 | H27A | 114.9° | 108.7° |
| H25 | C25 | H25A | 107.7° | 109.7° |
| H26 | C26 | H26A | 110.8° | 111.0° |
| H28 | C28 | H28A | 100.4° | 110.4° |
| H29 | C29 | H29A | 106.1° | 110.0° |
| H31 | C31 | H31A | 113.1° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C5 | C13 | C6 | C14 | 179.6° | 179.8° |
| C5 | C13 | C14 | C17 | 60.8° | 123.6° |
| C13 | C5 | C10 | C19 | 0.0° | 0.1° |
| C5 | C13 | C6 | C11 | 0.1° | 0.1° |
| C5 | C13 | C14 | C4 | 119.7° | 56.5° |
| C13 | C5 | C10 | H5 | 180.0° | 179.9° |
| C5 | C13 | C6 | H6 | 179.8° | 180.0° |
| C13 | C5 | C10 | H10 | 179.9° | 179.9° |
| C6 | C13 | C14 | C17 | 119.6° | 56.5° |
| C13 | C6 | C11 | C19 | 0.1° | 0.0° |
| C13 | C6 | C11 | H6 | 180.0° | 179.9° |
| C6 | C13 | C14 | C4 | 59.9° | 123.4° |
| C6 | C13 | C5 | C10 | 0.1° | 0.1° |
| C13 | C6 | C11 | H11 | 179.9° | 180.0° |
| C6 | C13 | C5 | H5 | 179.9° | 180.0° |
| C13 | C14 | C17 | C8 | 179.3° | 180.0° |
| C13 | C14 | C17 | C4 | 179.5° | 179.9° |
| C13 | C14 | C17 | C31 | 1.1° | 0.2° |
| C14 | C13 | C6 | C11 | 179.5° | 179.8° |
| C13 | C14 | C4 | C1 | 179.4° | 180.0° |
| C14 | C13 | C5 | C10 | 179.5° | 179.7° |
| C13 | C14 | C4 | H4 | 0.6° | 0.1° |
| C14 | C13 | C5 | H5 | 0.5° | 0.2° |
| C14 | C13 | C6 | H6 | 0.6° | 0.2° |
| C12 | C18 | C9 | N35 | 179.8° | 179.7° |
| C18 | C12 | C15 | C22 | 179.2° | 179.9° |
| C18 | C12 | C15 | H12 | 180.0° | 180.0° |
| C18 | C12 | C15 | C7 | 0.0° | 0.0° |
| C12 | C18 | N35 | C20 | 102.7° | 137.1° |
| C12 | C18 | C9 | C3 | 0.1° | 0.0° |
| C12 | C18 | N35 | N33 | 72.8° | 42.9° |
| C12 | C18 | C9 | H9 | 179.9° | 180.0° |
| C9 | C18 | C12 | C15 | 0.1° | 0.0° |
| C9 | C18 | N35 | C20 | 77.1° | 42.6° |
| C18 | C9 | C3 | C7 | 0.1° | 0.0° |
| C18 | C9 | C3 | H9 | 180.0° | 180.0° |
| C9 | C18 | N35 | N33 | 107.4° | 137.4° |
| C9 | C18 | C12 | H12 | 180.0° | 180.0° |
| C18 | C9 | C3 | H3 | 179.9° | 180.0° |
| C18 | N35 | C20 | C16 | 175.8° | 179.6° |
| N35 | C18 | C12 | C15 | 179.8° | 179.7° |
| C18 | N35 | C20 | C23 | 2.5° | 0.6° |
| C18 | N35 | C20 | N33 | 175.9° | 180.0° |
| C18 | N35 | N33 | C21 | 175.6° | 179.7° |
| N35 | C18 | C9 | C3 | 179.7° | 179.7° |
| N35 | C18 | C12 | H12 | 0.2° | 0.3° |
| N35 | C18 | C9 | H9 | 0.3° | 0.3° |
| C8 | C17 | C14 | C31 | 179.6° | 179.7° |
| C17 | C8 | C2 | C1 | 0.1° | 0.0° |
| C17 | C8 | C2 | H8 | 180.0° | 179.9° |
| C8 | C17 | C14 | C4 | 0.2° | 0.0° |
| C8 | C17 | C31 | N39 | 65.5° | 105.8° |
| C17 | C8 | C2 | H2 | 179.9° | 180.0° |
| C8 | C17 | C31 | H31 | 174.5° | 134.1° |
| C8 | C17 | C31 | H31A | 52.5° | 14.2° |
| C17 | C14 | C4 | C1 | 0.2° | 0.1° |
| C14 | C17 | C8 | C2 | 0.1° | 0.0° |
| C14 | C17 | C31 | N39 | 114.9° | 74.5° |
| C17 | C14 | C4 | H4 | 179.8° | 180.0° |
| C14 | C17 | C8 | H8 | 179.9° | 179.9° |
| C14 | C17 | C31 | H31 | 5.1° | 45.6° |
| C14 | C17 | C31 | H31A | 127.1° | 165.5° |
| C31 | C17 | C8 | C2 | 179.5° | 179.7° |
| C31 | C17 | C14 | C4 | 179.4° | 179.7° |
| C17 | C31 | N39 | C28 | 179.3° | 66.2° |
| C17 | C31 | N39 | C29 | 45.9° | 173.0° |
| C17 | C31 | N39 | H31 | 120.0° | 120.1° |
| C17 | C31 | N39 | H31A | 118.0° | 120.0° |
| C31 | C17 | C8 | H8 | 0.5° | 0.2° |
| C17 | C31 | H31 | H31A | 118.2° | 120.0° |
| C20 | C16 | C21 | C25 | 179.5° | 179.4° |
| C16 | C20 | C23 | N35 | 178.0° | 179.8° |
| C20 | C16 | C21 | C32 | 175.6° | 179.7° |
| C20 | C16 | C21 | N33 | 0.7° | 0.2° |
| C16 | C20 | C23 | N38 | 14.7° | 9.1° |
| C16 | C20 | C23 | O40 | 166.3° | 170.8° |
| C20 | C16 | C25 | C27 | 30.1° | 28.5° |
| C16 | C20 | N35 | N33 | 0.1° | 0.4° |
| C20 | C16 | C25 | H25 | 150.1° | 91.3° |
| C20 | C16 | C25 | H25A | 90.7° | 148.3° |
| C21 | C16 | C20 | C23 | 178.0° | 179.4° |
| C21 | C16 | C20 | N35 | 0.4° | 0.4° |
| C16 | C21 | C32 | N33 | 175.7° | 179.9° |
| C21 | C16 | C25 | C27 | 150.4° | 152.2° |
| C16 | C21 | C32 | F43 | 37.6° | 90.1° |
| C16 | C21 | C32 | F44 | 84.4° | 150.0° |
| C16 | C21 | C32 | F45 | 159.7° | 29.9° |
| C16 | C21 | N33 | N35 | 0.7° | 0.1° |
| C21 | C16 | C25 | H25 | 30.4° | 88.0° |
| C21 | C16 | C25 | H25A | 88.7° | 32.4° |
| C25 | C16 | C20 | C23 | 2.4° | 1.2° |
| C25 | C16 | C20 | N35 | 179.2° | 179.0° |
| C25 | C16 | C21 | C32 | 5.0° | 0.9° |
| C25 | C16 | C21 | N33 | 178.8° | 179.1° |
| C16 | C25 | C27 | H25 | 120.0° | 119.8° |
| C16 | C25 | C27 | H25A | 120.9° | 119.8° |
| C16 | C25 | C27 | N38 | 43.0° | 46.0° |
| C16 | C25 | C27 | H27 | 77.0° | 166.9° |
| C16 | C25 | C27 | H27A | 160.0° | 74.8° |
| C16 | C25 | H25 | H25A | 120.9° | 120.3° |
| C22 | C15 | C12 | C7 | 179.3° | 179.9° |
| C15 | C22 | N34 | N36 | 179.4° | 179.7° |
| C15 | C22 | N36 | C24 | 177.0° | 179.9° |
| C22 | C15 | C7 | C3 | 179.2° | 180.0° |
| C15 | C22 | N34 | N37 | 178.3° | 179.9° |
| C22 | C15 | C12 | H12 | 0.8° | 0.0° |
| C22 | C15 | C7 | H7 | 0.9° | 0.1° |
| C15 | C22 | N36 | HN36 | 3.0° | 0.0° |
| C12 | C15 | C22 | N34 | 178.3° | 0.1° |
| C12 | C15 | C22 | N36 | 1.1° | 179.7° |
| C12 | C15 | C7 | C3 | 0.1° | 0.0° |
| C12 | C15 | C7 | H7 | 179.9° | 180.0° |
| C7 | C15 | C22 | N34 | 1.0° | 180.0° |
| C7 | C15 | C22 | N36 | 179.7° | 0.3° |
| C15 | C7 | C3 | H7 | 180.0° | 180.0° |
| C15 | C7 | C3 | C9 | 0.0° | 0.0° |
| C7 | C15 | C12 | H12 | 179.9° | 180.0° |
| C15 | C7 | C3 | H3 | 180.0° | 180.0° |
| C11 | C19 | C10 | N38 | 179.4° | 180.0° |
| C11 | C19 | N38 | C23 | 122.1° | 122.7° |
| C19 | C11 | C6 | H11 | 180.0° | 180.0° |
| C11 | C19 | N38 | C27 | 56.5° | 57.3° |
| C11 | C19 | C10 | C5 | 0.1° | 0.0° |
| C19 | C11 | C6 | H6 | 179.9° | 179.9° |
| C11 | C19 | C10 | H10 | 179.9° | 180.0° |
| C10 | C19 | N38 | C23 | 57.4° | 57.4° |
| C10 | C19 | C11 | C6 | 0.0° | 0.0° |
| C10 | C19 | N38 | C27 | 124.0° | 122.7° |
| C19 | C10 | C5 | H10 | 180.0° | 180.0° |
| C10 | C19 | C11 | H11 | 180.0° | 180.0° |
| C19 | C10 | C5 | H5 | 180.0° | 180.0° |
| C19 | N38 | C23 | C20 | 179.0° | 167.9° |
| C19 | N38 | C23 | C27 | 178.6° | 179.9° |
| C19 | N38 | C23 | O40 | 0.0° | 12.1° |
| N38 | C19 | C11 | C6 | 179.4° | 180.0° |
| C19 | N38 | C27 | C25 | 150.5° | 138.8° |
| N38 | C19 | C10 | C5 | 179.3° | 180.0° |
| N38 | C19 | C11 | H11 | 0.6° | 0.0° |
| C19 | N38 | C27 | H27 | 89.5° | 17.9° |
| C19 | N38 | C27 | H27A | 33.5° | 100.4° |
| N38 | C19 | C10 | H10 | 0.7° | 0.1° |
| C20 | C23 | N38 | O40 | 179.0° | 180.0° |
| C20 | C23 | N38 | C27 | 0.4° | 12.1° |
| C23 | C20 | N35 | N33 | 178.4° | 179.4° |
| C20 | N35 | N33 | C21 | 0.5° | 0.3° |
| N35 | C20 | C23 | N38 | 163.3° | 170.6° |
| N35 | C20 | C23 | O40 | 15.7° | 9.4° |
| C21 | C32 | F43 | F44 | 117.8° | 120.0° |
| C21 | C32 | F43 | F45 | 119.6° | 120.0° |
| C21 | C32 | F44 | F45 | 115.9° | 120.0° |
| C32 | C21 | N33 | N35 | 175.7° | 180.0° |
| N33 | C21 | C32 | F43 | 146.7° | 90.0° |
| N33 | C21 | C32 | F44 | 91.2° | 30.0° |
| N33 | C21 | C32 | F45 | 24.6° | 150.0° |
| N34 | C22 | N36 | C24 | 2.5° | 0.2° |
| C22 | N34 | N37 | C24 | 0.6° | 0.1° |
| N34 | C22 | N36 | HN36 | 177.5° | 179.7° |
| C22 | N34 | N37 | HN37 | 179.4° | 179.9° |
| C22 | N36 | C24 | HN36 | 180.0° | 179.9° |
| C22 | N36 | C24 | N37 | 2.8° | 0.1° |
| C22 | N36 | C24 | O41 | 176.9° | 180.0° |
| N36 | C22 | N34 | N37 | 1.2° | 0.2° |
| C23 | N38 | C27 | C25 | 30.9° | 41.3° |
| C23 | N38 | C27 | H27 | 89.1° | 162.2° |
| C23 | N38 | C27 | H27A | 147.9° | 79.5° |
| O40 | C23 | N38 | C27 | 178.5° | 167.9° |
| N36 | C24 | N37 | O41 | 179.7° | 179.9° |
| N36 | C24 | N37 | N34 | 2.2° | 0.0° |
| N36 | C24 | N37 | HN37 | 177.8° | 180.0° |
| C24 | N37 | N34 | HN37 | 180.0° | 180.0° |
| N37 | C24 | N36 | HN36 | 177.2° | 179.8° |
| O41 | C24 | N37 | N34 | 177.5° | 179.9° |
| O41 | C24 | N36 | HN36 | 3.1° | 0.1° |
| O41 | C24 | N37 | HN37 | 2.6° | 0.1° |
| C25 | C27 | N38 | H27 | 120.0° | 120.9° |
| C25 | C27 | N38 | H27A | 117.0° | 120.8° |
| C25 | C27 | H27 | H27A | 117.3° | 118.4° |
| C27 | C25 | H25 | H25A | 120.9° | 120.3° |
| N38 | C27 | H27 | H27A | 117.2° | 118.4° |
| N38 | C27 | C25 | H25 | 163.0° | 73.8° |
| N38 | C27 | C25 | H25A | 77.9° | 165.8° |
| C2 | C1 | C4 | H1 | 180.0° | 180.0° |
| C1 | C2 | C8 | H2 | 180.0° | 180.0° |
| C2 | C1 | C4 | C14 | 0.0° | 0.1° |
| C2 | C1 | C4 | H4 | 180.0° | 180.0° |
| C1 | C2 | C8 | H8 | 179.9° | 180.0° |
| C4 | C1 | C2 | C8 | 0.1° | 0.0° |
| C1 | C4 | C14 | H4 | 180.0° | 179.9° |
| C4 | C1 | C2 | H2 | 179.9° | 180.0° |
| C8 | C2 | C1 | H1 | 179.9° | 180.0° |
| C7 | C3 | C9 | H3 | 180.0° | 179.9° |
| C7 | C3 | C9 | H9 | 179.9° | 180.0° |
| C9 | C3 | C7 | H7 | 180.0° | 180.0° |
| C14 | C4 | C1 | H1 | 180.0° | 179.9° |
| C28 | C26 | C30 | H26 | 120.0° | 118.1° |
| C28 | C26 | C30 | H26A | 119.3° | 118.0° |
| C26 | C28 | N39 | H28 | 120.0° | 118.8° |
| C26 | C28 | N39 | H28A | 124.0° | 118.9° |
| C28 | C26 | C30 | C29 | 46.3° | 35.7° |
| C26 | C28 | N39 | C29 | 5.7° | 24.1° |
| C28 | C26 | C30 | O42 | 159.2° | 154.1° |
| C26 | C28 | N39 | C31 | 140.8° | 146.4° |
| C28 | C26 | H26 | H26A | 119.3° | 123.9° |
| C26 | C28 | H28 | H28A | 125.0° | 122.3° |
| C28 | C26 | C30 | H30 | 80.2° | 82.8° |
| C30 | C26 | C28 | N39 | 33.7° | 37.1° |
| C26 | C30 | C29 | O42 | 114.3° | 118.4° |
| C26 | C30 | C29 | H30 | 125.3° | 118.4° |
| C26 | C30 | C29 | N39 | 38.5° | 22.3° |
| C26 | C30 | O42 | H30 | 128.2° | 123.2° |
| C30 | C26 | H26 | H26A | 119.3° | 123.9° |
| C30 | C26 | C28 | H28 | 153.6° | 155.9° |
| C30 | C26 | C28 | H28A | 90.4° | 81.8° |
| C26 | C30 | C29 | H29 | 158.5° | 141.7° |
| C26 | C30 | C29 | H29A | 83.2° | 97.1° |
| C26 | C30 | O42 | HO42 | 39.7° | 61.4° |
| C28 | N39 | C29 | C30 | 22.6° | 1.0° |
| C28 | N39 | C29 | C31 | 135.0° | 122.2° |
| N39 | C28 | C26 | H26 | 153.7° | 155.2° |
| N39 | C28 | C26 | H26A | 85.6° | 80.9° |
| N39 | C28 | H28 | H28A | 125.0° | 122.3° |
| C28 | N39 | C29 | H29 | 142.6° | 118.3° |
| C28 | N39 | C29 | H29A | 99.1° | 120.5° |
| C28 | N39 | C31 | H31 | 59.2° | 173.7° |
| C28 | N39 | C31 | H31A | 62.8° | 53.8° |
| C30 | C29 | N39 | H29 | 120.0° | 119.4° |
| C30 | C29 | N39 | H29A | 121.7° | 119.4° |
| C29 | C30 | O42 | H30 | 129.0° | 123.2° |
| C30 | C29 | N39 | C31 | 112.5° | 123.2° |
| C29 | C30 | C26 | H26 | 166.3° | 153.8° |
| C29 | C30 | C26 | H26A | 73.0° | 82.3° |
| C30 | C29 | H29 | H29A | 121.8° | 121.1° |
| C29 | C30 | O42 | HO42 | 63.1° | 175.0° |
| N39 | C29 | C30 | O42 | 152.9° | 140.7° |
| C29 | N39 | C28 | H28 | 125.7° | 142.9° |
| C29 | N39 | C28 | H28A | 118.4° | 94.8° |
| N39 | C29 | H29 | H29A | 121.9° | 121.1° |
| N39 | C29 | C30 | H30 | 86.8° | 96.1° |
| C29 | N39 | C31 | H31 | 74.1° | 52.9° |
| C29 | N39 | C31 | H31A | 163.9° | 67.0° |
| O42 | C30 | C26 | H26 | 80.8° | 87.8° |
| O42 | C30 | C26 | H26A | 39.9° | 36.1° |
| O42 | C30 | C29 | H29 | 87.1° | 99.9° |
| O42 | C30 | C29 | H29A | 31.1° | 21.3° |
| C31 | N39 | C28 | H28 | 99.2° | 94.8° |
| C31 | N39 | C28 | H28A | 16.8° | 27.4° |
| C31 | N39 | C29 | H29 | 7.5° | 3.9° |
| C31 | N39 | C29 | H29A | 125.9° | 117.3° |
| N39 | C31 | H31 | H31A | 118.1° | 120.0° |
| F43 | C32 | F44 | F45 | 124.8° | 120.1° |
| H11 | C11 | C6 | H6 | 0.1° | 0.0° |
| H27 | C27 | C25 | H25 | 43.0° | 47.1° |
| H27 | C27 | C25 | H25A | 162.1° | 73.3° |
| H27A | C27 | C25 | H25 | 80.0° | 165.4° |
| H27A | C27 | C25 | H25A | 39.1° | 45.0° |
| H1 | C1 | C2 | H2 | 0.1° | 0.0° |
| H1 | C1 | C4 | H4 | 0.0° | 0.0° |
| H2 | C2 | C8 | H8 | 0.1° | 0.1° |
| H3 | C3 | C7 | H7 | 0.0° | 0.0° |
| H3 | C3 | C9 | H9 | 0.1° | 0.1° |
| H5 | C5 | C10 | H10 | 0.1° | 0.0° |
| H26 | C26 | C28 | H28 | 86.3° | 86.0° |
| H26 | C26 | C28 | H28A | 29.6° | 36.3° |
| H26 | C26 | C30 | H30 | 39.8° | 35.3° |
| H26A | C26 | C28 | H28 | 34.4° | 37.9° |
| H26A | C26 | C28 | H28A | 150.3° | 160.2° |
| H26A | C26 | C30 | H30 | 160.5° | 159.2° |
| H29 | C29 | C30 | H30 | 33.2° | 23.3° |
| H29A | C29 | C30 | H30 | 151.5° | 144.5° |
| H30 | C30 | O42 | HO42 | 167.9° | 61.8° |
