PQF
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C23 | O36 | sing | 1.43Å | 1.42Å | |
| C23 | C21 | sing | 1.53Å | 1.51Å | |
| O36 | C22 | sing | 1.43Å | 1.42Å | |
| C21 | C24 | sing | 1.53Å | 1.53Å | |
| C22 | C20 | sing | 1.53Å | 1.51Å | |
| C24 | C20 | sing | 1.53Å | 1.53Å | |
| C24 | C29 | sing | 1.53Å | 1.54Å | |
| O37 | C30 | sing | 1.43Å | 1.44Å | |
| C3 | C5 | doub | 1.38Å | 1.39Å | Aromatic |
| C3 | C1 | sing | 1.38Å | 1.37Å | Aromatic |
| C5 | C12 | sing | 1.38Å | 1.39Å | Aromatic |
| C1 | C2 | doub | 1.38Å | 1.38Å | Aromatic |
| C12 | C29 | sing | 1.51Å | 1.52Å | |
| C12 | C4 | doub | 1.38Å | 1.39Å | Aromatic |
| C29 | N34 | sing | 1.46Å | 1.49Å | |
| C2 | C4 | sing | 1.38Å | 1.39Å | Aromatic |
| C26 | C30 | sing | 1.53Å | 1.53Å | |
| C30 | C27 | sing | 1.53Å | 1.52Å | |
| C30 | C13 | sing | 1.51Å | 1.54Å | |
| C8 | C13 | doub | 1.38Å | 1.40Å | Aromatic |
| C8 | C16 | sing | 1.39Å | 1.39Å | Aromatic |
| N34 | C16 | sing | 1.38Å | 1.40Å | Aromatic |
| N34 | C15 | sing | 1.38Å | 1.40Å | Aromatic |
| C13 | C17 | sing | 1.39Å | 1.39Å | Aromatic |
| C16 | C10 | doub | 1.40Å | 1.40Å | Aromatic |
| C15 | C7 | doub | 1.39Å | 1.39Å | Aromatic |
| C15 | C14 | sing | 1.40Å | 1.38Å | Aromatic |
| C7 | C11 | sing | 1.40Å | 1.39Å | Aromatic |
| C17 | F38 | sing | 1.35Å | 1.35Å | |
| C17 | C6 | doub | 1.38Å | 1.37Å | Aromatic |
| C25 | C19 | sing | 1.51Å | 1.49Å | |
| C10 | C14 | sing | 1.47Å | 1.45Å | Aromatic |
| C10 | C6 | sing | 1.39Å | 1.38Å | Aromatic |
| C14 | N31 | doub | 1.33Å | 1.34Å | Aromatic |
| C19 | C18 | doub | 1.37Å | 1.37Å | Aromatic |
| C19 | N32 | sing | 1.34Å | 1.36Å | Aromatic |
| C11 | C18 | sing | 1.48Å | 1.48Å | |
| C11 | C9 | doub | 1.40Å | 1.39Å | Aromatic |
| C18 | N35 | sing | 1.37Å | 1.36Å | Aromatic |
| N32 | N33 | doub | 1.29Å | 1.31Å | Aromatic |
| N31 | C9 | sing | 1.31Å | 1.34Å | Aromatic |
| N35 | N33 | sing | 1.29Å | 1.35Å | Aromatic |
| N35 | C28 | sing | 1.46Å | 1.46Å | |
| C4 | H42 | sing | 1.08Å | 1.08Å | |
| C5 | H43 | sing | 1.08Å | 1.08Å | |
| C6 | H44 | sing | 1.08Å | 1.08Å | |
| C7 | H45 | sing | 1.08Å | 1.08Å | |
| C8 | H46 | sing | 1.08Å | 1.08Å | |
| C20 | H48 | sing | 1.09Å | 1.10Å | |
| C20 | H49 | sing | 1.09Å | 1.10Å | |
| C21 | H50 | sing | 1.09Å | 1.10Å | |
| C21 | H51 | sing | 1.09Å | 1.10Å | |
| C22 | H53 | sing | 1.09Å | 1.10Å | |
| C22 | H52 | sing | 1.09Å | 1.10Å | |
| C24 | H56 | sing | 1.09Å | 1.10Å | |
| C26 | H60 | sing | 1.09Å | 1.10Å | |
| C26 | H61 | sing | 1.09Å | 1.10Å | |
| C26 | H62 | sing | 1.09Å | 1.10Å | |
| C28 | H68 | sing | 1.09Å | 1.10Å | |
| C28 | H66 | sing | 1.09Å | 1.10Å | |
| C28 | H67 | sing | 1.09Å | 1.10Å | |
| C1 | H39 | sing | 1.08Å | 1.08Å | |
| C2 | H40 | sing | 1.08Å | 1.08Å | |
| C3 | H41 | sing | 1.08Å | 1.08Å | |
| C9 | H47 | sing | 1.08Å | 1.08Å | |
| C23 | H55 | sing | 1.09Å | 1.10Å | |
| C23 | H54 | sing | 1.09Å | 1.10Å | |
| C25 | H58 | sing | 1.09Å | 1.10Å | |
| C25 | H57 | sing | 1.09Å | 1.10Å | |
| C25 | H59 | sing | 1.09Å | 1.10Å | |
| C27 | H63 | sing | 1.09Å | 1.10Å | |
| C27 | H64 | sing | 1.09Å | 1.10Å | |
| C27 | H65 | sing | 1.09Å | 1.10Å | |
| C29 | H69 | sing | 1.09Å | 1.10Å | |
| O37 | H70 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O36 | C23 | C21 | 111.5° | 109.4° |
| C23 | O36 | C22 | 110.6° | 114.1° |
| O36 | C23 | H55 | 109.0° | 109.5° |
| O36 | C23 | H54 | 109.0° | 109.5° |
| C23 | C21 | C24 | 110.1° | 109.1° |
| C23 | C21 | H50 | 109.3° | 109.6° |
| C23 | C21 | H51 | 109.3° | 109.5° |
| C21 | C23 | H55 | 109.0° | 109.5° |
| C21 | C23 | H54 | 109.0° | 109.4° |
| O36 | C22 | C20 | 111.4° | 109.4° |
| O36 | C22 | H53 | 109.0° | 109.5° |
| O36 | C22 | H52 | 109.0° | 109.5° |
| C21 | C24 | C20 | 109.3° | 109.0° |
| C21 | C24 | C29 | 112.2° | 109.6° |
| C24 | C21 | H50 | 109.3° | 109.5° |
| C24 | C21 | H51 | 109.3° | 109.5° |
| C21 | C24 | H56 | 108.2° | 109.5° |
| C22 | C20 | C24 | 110.7° | 109.2° |
| C22 | C20 | H48 | 109.2° | 109.6° |
| C22 | C20 | H49 | 109.2° | 109.6° |
| C20 | C22 | H53 | 109.0° | 109.5° |
| C20 | C22 | H52 | 109.0° | 109.5° |
| C20 | C24 | C29 | 110.7° | 109.5° |
| C24 | C20 | H48 | 109.2° | 109.5° |
| C24 | C20 | H49 | 109.2° | 109.5° |
| C20 | C24 | H56 | 108.2° | 109.6° |
| C24 | C29 | C12 | 115.0° | 109.4° |
| C24 | C29 | N34 | 112.2° | 109.5° |
| C29 | C24 | H56 | 108.1° | 109.6° |
| C24 | C29 | H69 | 105.3° | 109.5° |
| O37 | C30 | C26 | 106.9° | 109.5° |
| O37 | C30 | C27 | 105.5° | 109.5° |
| O37 | C30 | C13 | 110.1° | 109.5° |
| C30 | O37 | H70 | 109.5° | 114.1° |
| C5 | C3 | C1 | 120.3° | 120.0° |
| C3 | C5 | C12 | 120.7° | 120.0° |
| C3 | C5 | H43 | 119.6° | 120.0° |
| C5 | C3 | H41 | 119.9° | 120.1° |
| C3 | C1 | C2 | 119.7° | 120.0° |
| C3 | C1 | H39 | 120.2° | 120.0° |
| C1 | C3 | H41 | 119.9° | 119.9° |
| C5 | C12 | C29 | 122.4° | 120.0° |
| C5 | C12 | C4 | 118.3° | 120.0° |
| C12 | C5 | H43 | 119.7° | 120.0° |
| C1 | C2 | C4 | 120.3° | 120.0° |
| C2 | C1 | H39 | 120.2° | 120.0° |
| C1 | C2 | H40 | 119.8° | 120.0° |
| C29 | C12 | C4 | 119.3° | 120.0° |
| C12 | C29 | N34 | 112.3° | 109.5° |
| C12 | C29 | H69 | 105.4° | 109.4° |
| C12 | C4 | C2 | 120.7° | 120.0° |
| C12 | C4 | H42 | 119.6° | 120.0° |
| C29 | N34 | C16 | 125.6° | 125.0° |
| C29 | N34 | C15 | 125.8° | 124.9° |
| N34 | C29 | H69 | 105.8° | 109.5° |
| C2 | C4 | H42 | 119.7° | 120.0° |
| C4 | C2 | H40 | 119.8° | 120.0° |
| C26 | C30 | C27 | 110.6° | 109.4° |
| C26 | C30 | C13 | 112.0° | 109.5° |
| C30 | C26 | H60 | 109.5° | 109.5° |
| C30 | C26 | H61 | 109.5° | 109.4° |
| C30 | C26 | H62 | 109.5° | 109.4° |
| C27 | C30 | C13 | 111.6° | 109.5° |
| C30 | C27 | H63 | 109.5° | 109.5° |
| C30 | C27 | H64 | 109.4° | 109.5° |
| C30 | C27 | H65 | 109.5° | 109.5° |
| C30 | C13 | C8 | 120.0° | 119.7° |
| C30 | C13 | C17 | 122.9° | 119.7° |
| C13 | C8 | C16 | 120.4° | 120.1° |
| C8 | C13 | C17 | 116.8° | 120.5° |
| C13 | C8 | H46 | 119.8° | 120.0° |
| C8 | C16 | N34 | 130.1° | 132.3° |
| C8 | C16 | C10 | 120.9° | 119.3° |
| C16 | C8 | H46 | 119.8° | 119.9° |
| C16 | N34 | C15 | 108.1° | 110.2° |
| N34 | C16 | C10 | 108.9° | 108.4° |
| N34 | C15 | C7 | 128.9° | 132.5° |
| N34 | C15 | C14 | 109.1° | 108.6° |
| C13 | C17 | F38 | 118.9° | 119.8° |
| C13 | C17 | C6 | 123.6° | 120.2° |
| C16 | C10 | C14 | 106.3° | 106.6° |
| C16 | C10 | C6 | 118.9° | 120.1° |
| C7 | C15 | C14 | 122.0° | 118.9° |
| C15 | C7 | C11 | 116.9° | 118.3° |
| C15 | C7 | H45 | 121.6° | 120.8° |
| C15 | C14 | C10 | 107.5° | 106.2° |
| C15 | C14 | N31 | 121.0° | 120.7° |
| C7 | C11 | C18 | 119.9° | 120.4° |
| C7 | C11 | C9 | 118.2° | 119.3° |
| C11 | C7 | H45 | 121.6° | 120.9° |
| F38 | C17 | C6 | 117.3° | 119.9° |
| C17 | C6 | C10 | 119.4° | 119.7° |
| C17 | C6 | H44 | 120.3° | 120.1° |
| C25 | C19 | C18 | 129.2° | 126.8° |
| C25 | C19 | N32 | 121.5° | 126.8° |
| C19 | C25 | H58 | 109.5° | 109.5° |
| C19 | C25 | H57 | 109.5° | 109.5° |
| C19 | C25 | H59 | 109.4° | 109.5° |
| C14 | C10 | C6 | 134.7° | 133.3° |
| C10 | C14 | N31 | 131.5° | 133.0° |
| C10 | C6 | H44 | 120.3° | 120.1° |
| C14 | N31 | C9 | 117.7° | 121.8° |
| C18 | C19 | N32 | 109.2° | 106.4° |
| C19 | C18 | C11 | 131.1° | 127.1° |
| C19 | C18 | N35 | 104.2° | 105.7° |
| C19 | N32 | N33 | 108.3° | 109.3° |
| C18 | C11 | C9 | 121.6° | 120.3° |
| C11 | C18 | N35 | 124.7° | 127.2° |
| C11 | C9 | N31 | 124.2° | 120.9° |
| C11 | C9 | H47 | 117.9° | 119.5° |
| C18 | N35 | N33 | 110.7° | 108.0° |
| C18 | N35 | C28 | 128.5° | 126.0° |
| N32 | N33 | N35 | 107.6° | 110.6° |
| N31 | C9 | H47 | 117.9° | 119.5° |
| N33 | N35 | C28 | 120.7° | 126.0° |
| N35 | C28 | H68 | 109.5° | 109.5° |
| N35 | C28 | H66 | 109.5° | 109.4° |
| N35 | C28 | H67 | 109.5° | 109.5° |
| H48 | C20 | H49 | 109.5° | 109.5° |
| H50 | C21 | H51 | 109.5° | 109.5° |
| H53 | C22 | H52 | 109.5° | 109.4° |
| H60 | C26 | H61 | 109.5° | 109.5° |
| H60 | C26 | H62 | 109.5° | 109.5° |
| H61 | C26 | H62 | 109.4° | 109.5° |
| H68 | C28 | H66 | 109.5° | 109.5° |
| H68 | C28 | H67 | 109.5° | 109.5° |
| H66 | C28 | H67 | 109.5° | 109.5° |
| H55 | C23 | H54 | 109.4° | 109.5° |
| H58 | C25 | H57 | 109.5° | 109.4° |
| H58 | C25 | H59 | 109.4° | 109.5° |
| H57 | C25 | H59 | 109.5° | 109.5° |
| H63 | C27 | H64 | 109.5° | 109.5° |
| H63 | C27 | H65 | 109.5° | 109.5° |
| H64 | C27 | H65 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O36 | C23 | C21 | H55 | 120.3° | 120.0° |
| O36 | C23 | C21 | H54 | 120.3° | 120.0° |
| O36 | C23 | C21 | C24 | 57.6° | 57.6° |
| C23 | O36 | C22 | C20 | 61.7° | 61.2° |
| O36 | C23 | C21 | H50 | 62.5° | 177.6° |
| O36 | C23 | C21 | H51 | 177.7° | 62.3° |
| C23 | O36 | C22 | H53 | 58.6° | 178.8° |
| C23 | O36 | C22 | H52 | 178.0° | 58.9° |
| O36 | C23 | H55 | H54 | 119.1° | 120.1° |
| C21 | C23 | O36 | C22 | 62.2° | 61.2° |
| C23 | C21 | C24 | H50 | 120.1° | 119.9° |
| C23 | C21 | C24 | H51 | 120.1° | 119.9° |
| C23 | C21 | C24 | C20 | 51.8° | 56.9° |
| C23 | C21 | C24 | C29 | 175.0° | 176.8° |
| C23 | C21 | H50 | H51 | 119.7° | 120.2° |
| C23 | C21 | C24 | H56 | 65.9° | 62.9° |
| C21 | C23 | H55 | H54 | 119.1° | 120.0° |
| O36 | C22 | C20 | H53 | 120.3° | 120.0° |
| O36 | C22 | C20 | H52 | 120.3° | 120.0° |
| O36 | C22 | C20 | C24 | 56.9° | 57.6° |
| O36 | C22 | C20 | H48 | 177.1° | 177.5° |
| O36 | C22 | C20 | H49 | 63.2° | 62.3° |
| O36 | C22 | H53 | H52 | 119.1° | 120.0° |
| C22 | O36 | C23 | H55 | 177.4° | 58.8° |
| C22 | O36 | C23 | H54 | 58.1° | 178.9° |
| C21 | C24 | C20 | C22 | 51.6° | 56.9° |
| C21 | C24 | C20 | C29 | 124.0° | 119.9° |
| C21 | C24 | C20 | H56 | 117.6° | 119.8° |
| C21 | C24 | C29 | H56 | 119.2° | 120.2° |
| C21 | C24 | C29 | C12 | 63.2° | 68.4° |
| C21 | C24 | C29 | N34 | 166.9° | 171.6° |
| C21 | C24 | C20 | H48 | 171.8° | 176.9° |
| C21 | C24 | C20 | H49 | 68.6° | 63.0° |
| C24 | C21 | H50 | H51 | 119.7° | 120.1° |
| C24 | C21 | C23 | H55 | 177.9° | 62.4° |
| C24 | C21 | C23 | H54 | 62.7° | 177.6° |
| C21 | C24 | C29 | H69 | 52.4° | 51.6° |
| C22 | C20 | C24 | H48 | 120.2° | 120.0° |
| C22 | C20 | C24 | H49 | 120.2° | 120.0° |
| C22 | C20 | C24 | C29 | 175.7° | 176.8° |
| C22 | C20 | H48 | H49 | 119.4° | 120.2° |
| C20 | C22 | H53 | H52 | 119.1° | 120.0° |
| C22 | C20 | C24 | H56 | 66.0° | 62.9° |
| C20 | C24 | C29 | H56 | 118.4° | 120.2° |
| C20 | C24 | C29 | C12 | 174.4° | 172.1° |
| C20 | C24 | C29 | N34 | 44.5° | 52.1° |
| C24 | C20 | H48 | H49 | 119.4° | 120.1° |
| C20 | C24 | C21 | H50 | 68.3° | 176.9° |
| C20 | C24 | C21 | H51 | 171.9° | 63.0° |
| C24 | C20 | C22 | H53 | 63.4° | 177.6° |
| C24 | C20 | C22 | H52 | 177.2° | 62.4° |
| C20 | C24 | C29 | H69 | 70.0° | 68.0° |
| C24 | C29 | C12 | C5 | 16.6° | 116.5° |
| C24 | C29 | C12 | N34 | 129.8° | 120.1° |
| C24 | C29 | C12 | H69 | 115.5° | 119.9° |
| C24 | C29 | C12 | C4 | 161.0° | 63.6° |
| C24 | C29 | N34 | H69 | 114.2° | 120.0° |
| C24 | C29 | N34 | C16 | 101.5° | 159.5° |
| C24 | C29 | N34 | C15 | 69.1° | 20.5° |
| C29 | C24 | C20 | H48 | 64.1° | 63.2° |
| C29 | C24 | C20 | H49 | 55.5° | 56.9° |
| C29 | C24 | C21 | H50 | 54.9° | 63.3° |
| C29 | C24 | C21 | H51 | 64.9° | 56.9° |
| O37 | C30 | C26 | C27 | 114.3° | 120.0° |
| O37 | C30 | C26 | C13 | 120.6° | 120.0° |
| O37 | C30 | C27 | C13 | 119.5° | 120.0° |
| O37 | C30 | C13 | C8 | 5.1° | 0.1° |
| O37 | C30 | C13 | C17 | 178.5° | 179.7° |
| O37 | C30 | C26 | H60 | 180.0° | 60.0° |
| O37 | C30 | C26 | H61 | 60.0° | 60.0° |
| O37 | C30 | C26 | H62 | 60.0° | 180.0° |
| O37 | C30 | C27 | H63 | 180.0° | 180.0° |
| O37 | C30 | C27 | H64 | 60.0° | 60.0° |
| O37 | C30 | C27 | H65 | 60.0° | 60.0° |
| C5 | C3 | C1 | H41 | 180.0° | 179.7° |
| C3 | C5 | C12 | H43 | 180.0° | 180.0° |
| C5 | C3 | C1 | C2 | 0.1° | 0.3° |
| C3 | C5 | C12 | C29 | 177.5° | 180.0° |
| C3 | C5 | C12 | C4 | 0.1° | 0.1° |
| C5 | C3 | C1 | H39 | 179.9° | 179.7° |
| C1 | C3 | C5 | C12 | 0.0° | 0.4° |
| C3 | C1 | C2 | H39 | 180.0° | 180.0° |
| C3 | C1 | C2 | C4 | 0.0° | 0.0° |
| C1 | C3 | C5 | H43 | 180.0° | 179.7° |
| C3 | C1 | C2 | H40 | 180.0° | 179.9° |
| C5 | C12 | C29 | C4 | 177.6° | 179.9° |
| C5 | C12 | C29 | N34 | 113.2° | 123.4° |
| C5 | C12 | C4 | C2 | 0.2° | 0.2° |
| C5 | C12 | C4 | H42 | 179.8° | 179.9° |
| C12 | C5 | C3 | H41 | 180.0° | 179.9° |
| C5 | C12 | C29 | H69 | 132.1° | 3.4° |
| C1 | C2 | C4 | C12 | 0.1° | 0.3° |
| C1 | C2 | C4 | H40 | 180.0° | 179.9° |
| C1 | C2 | C4 | H42 | 179.9° | 180.0° |
| C2 | C1 | C3 | H41 | 179.9° | 179.9° |
| C12 | C29 | N34 | H69 | 114.5° | 120.0° |
| C29 | C12 | C4 | C2 | 177.5° | 179.7° |
| C12 | C29 | N34 | C16 | 127.2° | 80.5° |
| C12 | C29 | N34 | C15 | 62.2° | 99.5° |
| C29 | C12 | C4 | H42 | 2.5° | 0.0° |
| C29 | C12 | C5 | H43 | 2.5° | 0.1° |
| C12 | C29 | C24 | H56 | 56.0° | 51.9° |
| C4 | C12 | C29 | N34 | 69.2° | 56.5° |
| C12 | C4 | C2 | H42 | 180.0° | 179.7° |
| C4 | C12 | C5 | H43 | 179.9° | 180.0° |
| C12 | C4 | C2 | H40 | 179.9° | 179.8° |
| C4 | C12 | C29 | H69 | 45.5° | 176.5° |
| C29 | N34 | C16 | C8 | 11.7° | 0.1° |
| C29 | N34 | C16 | C15 | 172.0° | 179.9° |
| C29 | N34 | C16 | C10 | 171.6° | 179.7° |
| C29 | N34 | C15 | C7 | 8.7° | 0.1° |
| C29 | N34 | C15 | C14 | 171.8° | 179.7° |
| N34 | C29 | C24 | H56 | 73.9° | 68.2° |
| C4 | C2 | C1 | H39 | 180.0° | 180.0° |
| C26 | C30 | C27 | C13 | 125.3° | 120.0° |
| C26 | C30 | C13 | C8 | 123.8° | 120.0° |
| C26 | C30 | C13 | C17 | 62.8° | 60.2° |
| C30 | C26 | H60 | H61 | 120.0° | 119.9° |
| C30 | C26 | H60 | H62 | 120.0° | 120.0° |
| C30 | C26 | H61 | H62 | 120.0° | 119.9° |
| C26 | C30 | C27 | H63 | 64.9° | 60.0° |
| C26 | C30 | C27 | H64 | 55.2° | 180.0° |
| C26 | C30 | C27 | H65 | 175.1° | 60.0° |
| C26 | C30 | O37 | H70 | 180.0° | 60.0° |
| C27 | C30 | C13 | C8 | 111.6° | 120.0° |
| C27 | C30 | C13 | C17 | 61.7° | 59.7° |
| C27 | C30 | C26 | H60 | 65.7° | 60.0° |
| C27 | C30 | C26 | H61 | 174.3° | 180.0° |
| C27 | C30 | C26 | H62 | 54.3° | 60.0° |
| C30 | C27 | H63 | H64 | 120.0° | 120.0° |
| C30 | C27 | H63 | H65 | 120.0° | 120.0° |
| C30 | C27 | H64 | H65 | 120.0° | 120.0° |
| C27 | C30 | O37 | H70 | 62.3° | 59.9° |
| C30 | C13 | C8 | C17 | 173.8° | 179.8° |
| C30 | C13 | C8 | C16 | 172.7° | 180.0° |
| C30 | C13 | C17 | F38 | 1.4° | 0.3° |
| C30 | C13 | C17 | C6 | 173.4° | 179.7° |
| C30 | C13 | C8 | H46 | 7.3° | 0.2° |
| C13 | C30 | C26 | H60 | 59.4° | 180.0° |
| C13 | C30 | C26 | H61 | 60.6° | 60.0° |
| C13 | C30 | C26 | H62 | 179.4° | 60.0° |
| C13 | C30 | C27 | H63 | 60.5° | 60.0° |
| C13 | C30 | C27 | H64 | 179.5° | 60.0° |
| C13 | C30 | C27 | H65 | 59.5° | 180.0° |
| C13 | C30 | O37 | H70 | 58.2° | 179.9° |
| C13 | C8 | C16 | H46 | 180.0° | 179.8° |
| C13 | C8 | C16 | N34 | 175.4° | 180.0° |
| C13 | C8 | C16 | C10 | 1.0° | 0.2° |
| C8 | C13 | C17 | F38 | 175.0° | 179.9° |
| C8 | C13 | C17 | C6 | 0.2° | 0.1° |
| C8 | C16 | N34 | C10 | 176.8° | 179.8° |
| C8 | C16 | N34 | C15 | 176.3° | 179.8° |
| C16 | C8 | C13 | C17 | 1.1° | 0.2° |
| C8 | C16 | C10 | C14 | 176.7° | 179.9° |
| C8 | C16 | C10 | C6 | 0.1° | 0.0° |
| C16 | N34 | C15 | C7 | 179.4° | 179.8° |
| C16 | N34 | C15 | C14 | 0.2° | 0.3° |
| N34 | C16 | C10 | C14 | 0.5° | 0.2° |
| N34 | C16 | C10 | C6 | 177.0° | 179.8° |
| N34 | C16 | C8 | H46 | 4.6° | 0.2° |
| C16 | N34 | C29 | H69 | 12.7° | 39.5° |
| C15 | N34 | C16 | C10 | 0.4° | 0.4° |
| N34 | C15 | C7 | C14 | 179.5° | 179.8° |
| N34 | C15 | C7 | C11 | 177.3° | 179.8° |
| N34 | C15 | C14 | C10 | 0.1° | 0.2° |
| N34 | C15 | C14 | N31 | 178.1° | 179.8° |
| N34 | C15 | C7 | H45 | 2.7° | 0.2° |
| C15 | N34 | C29 | H69 | 176.7° | 140.6° |
| C13 | C17 | F38 | C6 | 175.1° | 180.0° |
| C13 | C17 | C6 | C10 | 0.7° | 0.3° |
| C13 | C17 | C6 | H44 | 179.3° | 180.0° |
| C17 | C13 | C8 | H46 | 178.9° | 180.0° |
| C16 | C10 | C14 | C15 | 0.3° | 0.0° |
| C16 | C10 | C6 | C17 | 0.8° | 0.3° |
| C16 | C10 | C14 | C6 | 175.8° | 179.9° |
| C16 | C10 | C14 | N31 | 177.6° | 180.0° |
| C16 | C10 | C6 | H44 | 179.2° | 180.0° |
| C10 | C16 | C8 | H46 | 179.0° | 180.0° |
| C15 | C7 | C11 | H45 | 180.0° | 179.9° |
| C7 | C15 | C14 | C10 | 179.7° | 180.0° |
| C7 | C15 | C14 | N31 | 1.5° | 0.1° |
| C15 | C7 | C11 | C18 | 172.2° | 180.0° |
| C15 | C7 | C11 | C9 | 2.0° | 0.0° |
| C14 | C15 | C7 | C11 | 2.2° | 0.1° |
| C15 | C14 | C10 | N31 | 178.0° | 179.9° |
| C15 | C14 | C10 | C6 | 176.1° | 180.0° |
| C15 | C14 | N31 | C9 | 0.5° | 0.0° |
| C14 | C15 | C7 | H45 | 177.8° | 180.0° |
| C7 | C11 | C18 | C19 | 38.4° | 54.1° |
| C7 | C11 | C18 | C9 | 174.0° | 180.0° |
| C7 | C11 | C18 | N35 | 138.8° | 125.5° |
| C7 | C11 | C9 | N31 | 1.3° | 0.1° |
| C7 | C11 | C9 | H47 | 178.7° | 180.0° |
| F38 | C17 | C6 | C10 | 174.1° | 179.7° |
| F38 | C17 | C6 | H44 | 5.9° | 0.0° |
| C17 | C6 | C10 | C14 | 174.6° | 179.6° |
| C17 | C6 | C10 | H44 | 180.0° | 179.7° |
| C25 | C19 | C18 | N32 | 179.9° | 180.0° |
| C25 | C19 | C18 | C11 | 2.2° | 0.0° |
| C25 | C19 | C18 | N35 | 179.9° | 179.7° |
| C25 | C19 | N32 | N33 | 179.8° | 180.0° |
| C19 | C25 | H58 | H57 | 120.0° | 119.9° |
| C19 | C25 | H58 | H59 | 120.0° | 120.0° |
| C19 | C25 | H57 | H59 | 120.0° | 120.0° |
| C10 | C14 | N31 | C9 | 178.3° | 180.0° |
| C14 | C10 | C6 | H44 | 5.4° | 0.1° |
| C6 | C10 | C14 | N31 | 1.8° | 0.1° |
| C14 | N31 | C9 | C11 | 0.5° | 0.0° |
| C14 | N31 | C9 | H47 | 179.5° | 180.0° |
| C19 | C18 | C11 | N35 | 177.3° | 179.7° |
| C19 | C18 | C11 | C9 | 135.6° | 125.9° |
| C18 | C19 | N32 | N33 | 0.0° | 0.0° |
| C19 | C18 | N35 | N33 | 0.1° | 0.5° |
| C19 | C18 | N35 | C28 | 177.6° | 179.7° |
| C18 | C19 | C25 | H58 | 179.8° | 90.0° |
| C18 | C19 | C25 | H57 | 60.1° | 150.0° |
| C18 | C19 | C25 | H59 | 59.9° | 30.0° |
| N32 | C19 | C18 | C11 | 177.6° | 180.0° |
| N32 | C19 | C18 | N35 | 0.1° | 0.3° |
| C19 | N32 | N33 | N35 | 0.1° | 0.3° |
| N32 | C19 | C25 | H58 | 0.0° | 89.9° |
| N32 | C19 | C25 | H57 | 120.0° | 30.0° |
| N32 | C19 | C25 | H59 | 120.0° | 150.0° |
| C18 | C11 | C9 | N31 | 172.9° | 180.0° |
| C11 | C18 | N35 | N33 | 177.7° | 179.8° |
| C11 | C18 | N35 | C28 | 4.5° | 0.0° |
| C18 | C11 | C7 | H45 | 7.8° | 0.0° |
| C18 | C11 | C9 | H47 | 7.1° | 0.1° |
| C9 | C11 | C18 | N35 | 47.1° | 54.4° |
| C11 | C9 | N31 | H47 | 180.0° | 179.9° |
| C9 | C11 | C7 | H45 | 178.0° | 179.9° |
| C18 | N35 | N33 | N32 | 0.2° | 0.5° |
| C18 | N35 | N33 | C28 | 178.0° | 179.8° |
| C18 | N35 | C28 | H68 | 177.5° | 90.0° |
| C18 | N35 | C28 | H66 | 62.5° | 150.0° |
| C18 | N35 | C28 | H67 | 57.5° | 30.0° |
| N32 | N33 | N35 | C28 | 177.8° | 179.7° |
| N33 | N35 | C28 | H68 | 0.0° | 89.8° |
| N33 | N35 | C28 | H66 | 120.0° | 30.2° |
| N33 | N35 | C28 | H67 | 120.0° | 150.2° |
| N35 | C28 | H68 | H66 | 120.0° | 120.0° |
| N35 | C28 | H68 | H67 | 120.0° | 120.0° |
| N35 | C28 | H66 | H67 | 120.0° | 120.0° |
| H42 | C4 | C2 | H40 | 0.1° | 0.1° |
| H43 | C5 | C3 | H41 | 0.0° | 0.1° |
| H48 | C20 | C22 | H53 | 56.8° | 62.5° |
| H48 | C20 | C22 | H52 | 62.6° | 57.5° |
| H48 | C20 | C24 | H56 | 54.2° | 57.1° |
| H49 | C20 | C22 | H53 | 176.5° | 57.6° |
| H49 | C20 | C22 | H52 | 57.1° | 177.6° |
| H49 | C20 | C24 | H56 | 173.8° | 177.1° |
| H50 | C21 | C24 | H56 | 174.1° | 57.0° |
| H50 | C21 | C23 | H55 | 57.8° | 57.5° |
| H50 | C21 | C23 | H54 | 177.2° | 62.5° |
| H51 | C21 | C24 | H56 | 54.2° | 177.2° |
| H51 | C21 | C23 | H55 | 62.0° | 177.7° |
| H51 | C21 | C23 | H54 | 57.4° | 57.7° |
| H56 | C24 | C29 | H69 | 171.6° | 171.8° |
| H60 | C26 | H61 | H62 | 120.0° | 120.1° |
| H68 | C28 | H66 | H67 | 120.0° | 120.0° |
| H39 | C1 | C2 | H40 | 0.0° | 0.0° |
| H39 | C1 | C3 | H41 | 0.1° | 0.0° |
| H58 | C25 | H57 | H59 | 120.0° | 120.0° |
| H63 | C27 | H64 | H65 | 120.0° | 120.0° |
