39D
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C19 | C18 | sing | 1.53Å | 1.54Å | |
| C19 | C20 | sing | 1.53Å | 1.53Å | |
| N24 | C23 | sing | 1.47Å | 1.47Å | |
| N10 | C9 | sing | 1.37Å | 1.36Å | Aromatic |
| N10 | C11 | sing | 1.36Å | 1.35Å | Aromatic |
| C6 | C5 | doub | 1.38Å | 1.39Å | Aromatic |
| C6 | C1 | sing | 1.38Å | 1.39Å | Aromatic |
| C18 | C17 | sing | 1.53Å | 1.54Å | |
| C23 | C20 | sing | 1.53Å | 1.53Å | |
| C14 | C1 | sing | 1.51Å | 1.51Å | |
| C14 | C12 | sing | 1.53Å | 1.54Å | |
| C9 | C8 | doub | 1.36Å | 1.37Å | Aromatic |
| C5 | C4 | sing | 1.38Å | 1.38Å | Aromatic |
| N13 | C12 | sing | 1.46Å | 1.45Å | |
| N13 | C15 | sing | 1.35Å | 1.33Å | |
| C20 | C21 | sing | 1.53Å | 1.52Å | |
| C17 | C15 | sing | 1.51Å | 1.52Å | |
| C17 | C22 | sing | 1.53Å | 1.53Å | |
| C1 | C2 | doub | 1.38Å | 1.39Å | Aromatic |
| C12 | C11 | sing | 1.51Å | 1.50Å | |
| C11 | N7 | doub | 1.30Å | 1.32Å | Aromatic |
| C21 | C22 | sing | 1.53Å | 1.53Å | |
| C15 | O16 | doub | 1.21Å | 1.23Å | |
| C8 | N7 | sing | 1.35Å | 1.38Å | Aromatic |
| C8 | C25 | sing | 1.48Å | 1.47Å | |
| C4 | C3 | doub | 1.38Å | 1.38Å | Aromatic |
| C2 | C3 | sing | 1.38Å | 1.39Å | Aromatic |
| C26 | C25 | doub | 1.40Å | 1.39Å | Aromatic |
| C26 | C27 | sing | 1.37Å | 1.39Å | Aromatic |
| C25 | C30 | sing | 1.40Å | 1.39Å | Aromatic |
| C27 | C28 | doub | 1.40Å | 1.39Å | Aromatic |
| C30 | C29 | doub | 1.37Å | 1.39Å | Aromatic |
| C28 | C29 | sing | 1.40Å | 1.40Å | Aromatic |
| C28 | C31 | sing | 1.48Å | 1.52Å | |
| O32 | C31 | doub | 1.22Å | 1.26Å | |
| C31 | N33 | sing | 1.35Å | 1.33Å | |
| C18 | H46 | sing | 1.09Å | 1.10Å | |
| C18 | H47 | sing | 1.09Å | 1.10Å | |
| C17 | H45 | sing | 1.09Å | 1.10Å | |
| C19 | H49 | sing | 1.09Å | 1.10Å | |
| C19 | H48 | sing | 1.09Å | 1.10Å | |
| C20 | H50 | sing | 1.09Å | 1.10Å | |
| C21 | H51 | sing | 1.09Å | 1.10Å | |
| C21 | H52 | sing | 1.09Å | 1.10Å | |
| C22 | H53 | sing | 1.09Å | 1.10Å | |
| C22 | H54 | sing | 1.09Å | 1.10Å | |
| C23 | H55 | sing | 1.09Å | 1.10Å | |
| C23 | H56 | sing | 1.09Å | 1.10Å | |
| C12 | H41 | sing | 1.09Å | 1.10Å | |
| C27 | H60 | sing | 1.08Å | 1.08Å | |
| C2 | H34 | sing | 1.08Å | 1.08Å | |
| C3 | H35 | sing | 1.08Å | 1.08Å | |
| C4 | H36 | sing | 1.08Å | 1.08Å | |
| C5 | H37 | sing | 1.08Å | 1.08Å | |
| C6 | H38 | sing | 1.08Å | 1.08Å | |
| C9 | H39 | sing | 1.08Å | 1.08Å | |
| N10 | H40 | sing | 0.97Å | 1.00Å | |
| N13 | H42 | sing | 0.97Å | 1.00Å | |
| C14 | H43 | sing | 1.09Å | 1.10Å | |
| C14 | H44 | sing | 1.09Å | 1.10Å | |
| N24 | H57 | sing | 1.01Å | 1.00Å | |
| N24 | H58 | sing | 1.01Å | 1.00Å | |
| C26 | H59 | sing | 1.08Å | 1.08Å | |
| C29 | H61 | sing | 1.08Å | 1.08Å | |
| C30 | H62 | sing | 1.08Å | 1.08Å | |
| N33 | H64 | sing | 0.97Å | 1.00Å | |
| N33 | H63 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C18 | C19 | C20 | 112.1° | 109.4° |
| C19 | C18 | C17 | 111.5° | 109.5° |
| C19 | C18 | H46 | 109.0° | 109.5° |
| C19 | C18 | H47 | 109.0° | 109.4° |
| C18 | C19 | H49 | 108.8° | 109.5° |
| C18 | C19 | H48 | 108.8° | 109.4° |
| C19 | C20 | C23 | 112.3° | 109.4° |
| C19 | C20 | C21 | 108.8° | 109.5° |
| C20 | C19 | H49 | 108.8° | 109.5° |
| C20 | C19 | H48 | 108.8° | 109.5° |
| C19 | C20 | H50 | 107.9° | 109.5° |
| N24 | C23 | C20 | 113.9° | 109.5° |
| N24 | C23 | H55 | 108.4° | 109.5° |
| N24 | C23 | H56 | 108.4° | 109.4° |
| C23 | N24 | H57 | 109.5° | 111.0° |
| C23 | N24 | H58 | 109.5° | 111.0° |
| C9 | N10 | C11 | 107.2° | 107.4° |
| N10 | C9 | C8 | 106.4° | 106.7° |
| N10 | C9 | H39 | 126.8° | 126.7° |
| C9 | N10 | H40 | 126.4° | 126.2° |
| N10 | C11 | C12 | 122.4° | 125.5° |
| N10 | C11 | N7 | 111.8° | 109.0° |
| C11 | N10 | H40 | 126.4° | 126.4° |
| C5 | C6 | C1 | 120.8° | 120.0° |
| C6 | C5 | C4 | 120.1° | 120.0° |
| C6 | C5 | H37 | 119.9° | 120.0° |
| C5 | C6 | H38 | 119.6° | 120.0° |
| C6 | C1 | C14 | 120.6° | 120.0° |
| C6 | C1 | C2 | 118.5° | 120.0° |
| C1 | C6 | H38 | 119.6° | 120.0° |
| C18 | C17 | C15 | 111.3° | 109.5° |
| C18 | C17 | C22 | 110.1° | 109.4° |
| C17 | C18 | H46 | 109.0° | 109.5° |
| C17 | C18 | H47 | 109.0° | 109.5° |
| C18 | C17 | H45 | 108.0° | 109.4° |
| C23 | C20 | C21 | 111.9° | 109.5° |
| C23 | C20 | H50 | 107.8° | 109.5° |
| C20 | C23 | H55 | 108.4° | 109.5° |
| C20 | C23 | H56 | 108.4° | 109.5° |
| C1 | C14 | C12 | 111.9° | 109.5° |
| C14 | C1 | C2 | 120.7° | 120.0° |
| C1 | C14 | H43 | 108.9° | 109.5° |
| C1 | C14 | H44 | 108.9° | 109.5° |
| C14 | C12 | N13 | 110.5° | 109.5° |
| C14 | C12 | C11 | 110.7° | 109.5° |
| C14 | C12 | H41 | 107.0° | 109.5° |
| C12 | C14 | H43 | 108.9° | 109.5° |
| C12 | C14 | H44 | 108.9° | 109.5° |
| C9 | C8 | N7 | 109.6° | 107.8° |
| C9 | C8 | C25 | 129.5° | 126.1° |
| C8 | C9 | H39 | 126.8° | 126.6° |
| C5 | C4 | C3 | 119.7° | 120.0° |
| C5 | C4 | H36 | 120.2° | 120.0° |
| C4 | C5 | H37 | 120.0° | 120.0° |
| C12 | N13 | C15 | 121.6° | 120.0° |
| N13 | C12 | C11 | 112.7° | 109.5° |
| N13 | C12 | H41 | 108.1° | 109.4° |
| C12 | N13 | H42 | 119.2° | 120.0° |
| N13 | C15 | C17 | 114.8° | 120.0° |
| N13 | C15 | O16 | 123.0° | 120.0° |
| C15 | N13 | H42 | 119.2° | 120.0° |
| C20 | C21 | C22 | 111.9° | 109.4° |
| C21 | C20 | H50 | 108.0° | 109.5° |
| C20 | C21 | H51 | 108.9° | 109.4° |
| C20 | C21 | H52 | 108.8° | 109.5° |
| C15 | C17 | C22 | 111.0° | 109.5° |
| C17 | C15 | O16 | 122.1° | 120.0° |
| C15 | C17 | H45 | 108.3° | 109.5° |
| C17 | C22 | C21 | 110.7° | 109.5° |
| C22 | C17 | H45 | 108.1° | 109.5° |
| C17 | C22 | H53 | 109.2° | 109.5° |
| C17 | C22 | H54 | 109.1° | 109.4° |
| C1 | C2 | C3 | 120.8° | 120.0° |
| C1 | C2 | H34 | 119.6° | 120.0° |
| C12 | C11 | N7 | 125.6° | 125.5° |
| C11 | C12 | H41 | 107.5° | 109.4° |
| C11 | N7 | C8 | 105.0° | 109.2° |
| C22 | C21 | H51 | 108.9° | 109.5° |
| C22 | C21 | H52 | 108.9° | 109.5° |
| C21 | C22 | H53 | 109.1° | 109.4° |
| C21 | C22 | H54 | 109.1° | 109.5° |
| N7 | C8 | C25 | 120.9° | 126.1° |
| C8 | C25 | C26 | 120.5° | 120.0° |
| C8 | C25 | C30 | 121.0° | 120.0° |
| C4 | C3 | C2 | 120.2° | 120.0° |
| C4 | C3 | H35 | 119.9° | 120.0° |
| C3 | C4 | H36 | 120.2° | 120.0° |
| C3 | C2 | H34 | 119.6° | 120.0° |
| C2 | C3 | H35 | 119.9° | 120.0° |
| C25 | C26 | C27 | 120.8° | 120.0° |
| C26 | C25 | C30 | 118.4° | 120.1° |
| C25 | C26 | H59 | 119.6° | 120.0° |
| C26 | C27 | C28 | 120.9° | 120.0° |
| C26 | C27 | H60 | 119.5° | 120.0° |
| C27 | C26 | H59 | 119.6° | 120.0° |
| C25 | C30 | C29 | 120.9° | 120.0° |
| C25 | C30 | H62 | 119.6° | 119.9° |
| C27 | C28 | C29 | 118.2° | 120.0° |
| C27 | C28 | C31 | 117.9° | 120.0° |
| C28 | C27 | H60 | 119.6° | 120.0° |
| C30 | C29 | C28 | 120.8° | 120.0° |
| C30 | C29 | H61 | 119.6° | 120.1° |
| C29 | C30 | H62 | 119.6° | 120.0° |
| C29 | C28 | C31 | 123.9° | 120.1° |
| C28 | C29 | H61 | 119.6° | 120.0° |
| C28 | C31 | O32 | 119.5° | 120.0° |
| C28 | C31 | N33 | 118.6° | 120.0° |
| O32 | C31 | N33 | 121.9° | 120.0° |
| C31 | N33 | H64 | 120.0° | 120.0° |
| C31 | N33 | H63 | 120.0° | 120.0° |
| H46 | C18 | H47 | 109.5° | 109.4° |
| H49 | C19 | H48 | 109.5° | 109.5° |
| H51 | C21 | H52 | 109.5° | 109.5° |
| H53 | C22 | H54 | 109.5° | 109.5° |
| H55 | C23 | H56 | 109.5° | 109.5° |
| H43 | C14 | H44 | 109.5° | 109.5° |
| H57 | N24 | H58 | 109.4° | 111.0° |
| H64 | N33 | H63 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C18 | C19 | C20 | H49 | 120.4° | 120.0° |
| C18 | C19 | C20 | H48 | 120.4° | 119.9° |
| C19 | C18 | C17 | H46 | 120.3° | 120.0° |
| C19 | C18 | C17 | H47 | 120.3° | 120.0° |
| C18 | C19 | C20 | C23 | 179.0° | 180.0° |
| C18 | C19 | C20 | C21 | 56.6° | 60.0° |
| C19 | C18 | C17 | C15 | 177.4° | 180.0° |
| C19 | C18 | C17 | C22 | 53.9° | 60.0° |
| C19 | C18 | H46 | H47 | 119.1° | 119.9° |
| C19 | C18 | C17 | H45 | 63.9° | 60.0° |
| C18 | C19 | H49 | H48 | 118.8° | 120.0° |
| C18 | C19 | C20 | H50 | 60.4° | 60.0° |
| C19 | C20 | C23 | N24 | 62.9° | 175.0° |
| C20 | C19 | C18 | C17 | 55.6° | 60.0° |
| C19 | C20 | C23 | C21 | 122.7° | 120.0° |
| C19 | C20 | C23 | H50 | 118.7° | 120.0° |
| C19 | C20 | C21 | H50 | 116.9° | 120.0° |
| C19 | C20 | C21 | C22 | 58.3° | 60.0° |
| C20 | C19 | C18 | H46 | 175.9° | 60.0° |
| C20 | C19 | C18 | H47 | 64.7° | 180.0° |
| C20 | C19 | H49 | H48 | 118.8° | 120.0° |
| C19 | C20 | C21 | H51 | 178.6° | 180.0° |
| C19 | C20 | C21 | H52 | 62.1° | 60.0° |
| C19 | C20 | C23 | H55 | 176.4° | 55.0° |
| C19 | C20 | C23 | H56 | 57.7° | 65.0° |
| N24 | C23 | C20 | H55 | 120.7° | 120.0° |
| N24 | C23 | C20 | H56 | 120.6° | 120.0° |
| N24 | C23 | C20 | C21 | 174.4° | 65.0° |
| N24 | C23 | C20 | H50 | 55.8° | 55.0° |
| N24 | C23 | H55 | H56 | 118.0° | 120.0° |
| C23 | N24 | H57 | H58 | 120.0° | 123.9° |
| C9 | N10 | C11 | H40 | 180.0° | 179.5° |
| N10 | C9 | C8 | H39 | 180.0° | 179.8° |
| C9 | N10 | C11 | C12 | 174.6° | 179.9° |
| C9 | N10 | C11 | N7 | 1.2° | 0.5° |
| N10 | C9 | C8 | N7 | 0.7° | 0.2° |
| N10 | C9 | C8 | C25 | 179.5° | 179.8° |
| N10 | C11 | C12 | C14 | 69.9° | 124.6° |
| C11 | N10 | C9 | C8 | 1.1° | 0.4° |
| N10 | C11 | C12 | N13 | 54.4° | 4.6° |
| N10 | C11 | C12 | N7 | 175.2° | 179.5° |
| N10 | C11 | N7 | C8 | 0.7° | 0.4° |
| N10 | C11 | C12 | H41 | 173.5° | 115.3° |
| C11 | N10 | C9 | H39 | 178.9° | 179.8° |
| C5 | C6 | C1 | H38 | 180.0° | 180.0° |
| C5 | C6 | C1 | C14 | 174.6° | 179.7° |
| C6 | C5 | C4 | H37 | 180.0° | 180.0° |
| C5 | C6 | C1 | C2 | 0.6° | 0.0° |
| C6 | C5 | C4 | C3 | 0.8° | 0.0° |
| C6 | C5 | C4 | H36 | 179.2° | 180.0° |
| C6 | C1 | C14 | C2 | 173.9° | 179.7° |
| C6 | C1 | C14 | C12 | 108.3° | 90.3° |
| C1 | C6 | C5 | C4 | 0.2° | 0.0° |
| C6 | C1 | C2 | C3 | 0.7° | 0.0° |
| C6 | C1 | C2 | H34 | 179.3° | 180.0° |
| C1 | C6 | C5 | H37 | 179.8° | 180.0° |
| C6 | C1 | C14 | H43 | 12.0° | 149.7° |
| C6 | C1 | C14 | H44 | 131.3° | 29.7° |
| C18 | C17 | C15 | N13 | 101.8° | 180.0° |
| C18 | C17 | C15 | C22 | 123.0° | 120.0° |
| C18 | C17 | C15 | H45 | 118.5° | 120.0° |
| C18 | C17 | C22 | H45 | 117.8° | 119.9° |
| C18 | C17 | C22 | C21 | 55.3° | 60.0° |
| C18 | C17 | C15 | O16 | 81.0° | 0.0° |
| C17 | C18 | H46 | H47 | 119.1° | 120.0° |
| C17 | C18 | C19 | H49 | 176.0° | 180.0° |
| C17 | C18 | C19 | H48 | 64.8° | 60.0° |
| C18 | C17 | C22 | H53 | 175.5° | 180.0° |
| C18 | C17 | C22 | H54 | 64.9° | 60.0° |
| C23 | C20 | C21 | H50 | 118.5° | 120.0° |
| C23 | C20 | C21 | C22 | 177.1° | 180.0° |
| C23 | C20 | C19 | H49 | 58.6° | 60.0° |
| C23 | C20 | C19 | H48 | 60.5° | 60.1° |
| C23 | C20 | C21 | H51 | 56.8° | 60.0° |
| C23 | C20 | C21 | H52 | 62.5° | 60.0° |
| C20 | C23 | H55 | H56 | 118.0° | 120.0° |
| C20 | C23 | N24 | H57 | 180.0° | 180.0° |
| C20 | C23 | N24 | H58 | 60.0° | 56.1° |
| C1 | C14 | C12 | H43 | 120.3° | 120.0° |
| C1 | C14 | C12 | H44 | 120.4° | 120.0° |
| C1 | C14 | C12 | N13 | 178.6° | 65.0° |
| C1 | C14 | C12 | C11 | 53.0° | 175.0° |
| C14 | C1 | C2 | C3 | 174.7° | 179.7° |
| C1 | C14 | C12 | H41 | 63.9° | 55.0° |
| C14 | C1 | C2 | H34 | 5.2° | 0.3° |
| C14 | C1 | C6 | H38 | 5.4° | 0.3° |
| C1 | C14 | H43 | H44 | 118.9° | 120.0° |
| C14 | C12 | N13 | C11 | 124.5° | 120.1° |
| C14 | C12 | N13 | H41 | 116.8° | 120.0° |
| C14 | C12 | N13 | C15 | 162.0° | 84.9° |
| C12 | C14 | C1 | C2 | 65.6° | 90.0° |
| C14 | C12 | C11 | H41 | 116.6° | 120.0° |
| C14 | C12 | C11 | N7 | 105.2° | 54.9° |
| C14 | C12 | N13 | H42 | 18.0° | 95.0° |
| C12 | C14 | H43 | H44 | 118.9° | 120.0° |
| C9 | C8 | N7 | C11 | 0.0° | 0.1° |
| C9 | C8 | N7 | C25 | 179.8° | 180.0° |
| C9 | C8 | C25 | C26 | 18.6° | 0.8° |
| C9 | C8 | C25 | C30 | 157.2° | 180.0° |
| C8 | C9 | N10 | H40 | 178.9° | 179.9° |
| C5 | C4 | C3 | H36 | 180.0° | 180.0° |
| C5 | C4 | C3 | C2 | 0.6° | 0.0° |
| C5 | C4 | C3 | H35 | 179.4° | 179.9° |
| C4 | C5 | C6 | H38 | 179.8° | 179.9° |
| C12 | N13 | C15 | H42 | 180.0° | 179.9° |
| C12 | N13 | C15 | C17 | 170.5° | 180.0° |
| N13 | C12 | C11 | H41 | 119.0° | 119.9° |
| N13 | C12 | C11 | N7 | 130.4° | 175.0° |
| C12 | N13 | C15 | O16 | 6.6° | 0.1° |
| N13 | C12 | C14 | H43 | 58.3° | 55.0° |
| N13 | C12 | C14 | H44 | 61.0° | 175.0° |
| N13 | C15 | C17 | O16 | 177.1° | 179.9° |
| N13 | C15 | C17 | C22 | 135.2° | 60.1° |
| C15 | N13 | C12 | C11 | 73.5° | 155.0° |
| N13 | C15 | C17 | H45 | 16.7° | 60.0° |
| C15 | N13 | C12 | H41 | 45.2° | 35.1° |
| C20 | C21 | C22 | C17 | 58.9° | 60.0° |
| C20 | C21 | C22 | H51 | 120.4° | 120.0° |
| C20 | C21 | C22 | H52 | 120.3° | 120.0° |
| C21 | C20 | C19 | H49 | 177.0° | 180.0° |
| C21 | C20 | C19 | H48 | 63.9° | 59.9° |
| C20 | C21 | H51 | H52 | 118.9° | 120.0° |
| C20 | C21 | C22 | H53 | 179.0° | 180.0° |
| C20 | C21 | C22 | H54 | 61.3° | 60.0° |
| C21 | C20 | C23 | H55 | 53.8° | 175.0° |
| C21 | C20 | C23 | H56 | 64.9° | 54.9° |
| C15 | C17 | C22 | H45 | 118.6° | 120.0° |
| C15 | C17 | C22 | C21 | 179.0° | 180.0° |
| C15 | C17 | C18 | H46 | 62.3° | 60.0° |
| C15 | C17 | C18 | H47 | 57.1° | 60.0° |
| C15 | C17 | C22 | H53 | 60.9° | 60.0° |
| C15 | C17 | C22 | H54 | 58.8° | 60.0° |
| C17 | C15 | N13 | H42 | 9.5° | 0.1° |
| C17 | C22 | C21 | H53 | 120.2° | 120.0° |
| C17 | C22 | C21 | H54 | 120.2° | 120.0° |
| C22 | C17 | C15 | O16 | 41.9° | 120.0° |
| C22 | C17 | C18 | H46 | 174.2° | 60.1° |
| C22 | C17 | C18 | H47 | 66.4° | 180.0° |
| C17 | C22 | C21 | H51 | 179.2° | 180.0° |
| C17 | C22 | C21 | H52 | 61.5° | 59.9° |
| C17 | C22 | H53 | H54 | 119.4° | 120.0° |
| C1 | C2 | C3 | C4 | 0.1° | 0.0° |
| C1 | C2 | C3 | H34 | 180.0° | 180.0° |
| C1 | C2 | C3 | H35 | 179.9° | 179.9° |
| C2 | C1 | C6 | H38 | 179.5° | 179.9° |
| C2 | C1 | C14 | H43 | 174.1° | 30.0° |
| C2 | C1 | C14 | H44 | 54.8° | 150.0° |
| C12 | C11 | N7 | C8 | 174.9° | 180.0° |
| C12 | C11 | N10 | H40 | 5.4° | 0.4° |
| C11 | C12 | N13 | H42 | 106.5° | 25.1° |
| C11 | C12 | C14 | H43 | 67.3° | 65.0° |
| C11 | C12 | C14 | H44 | 173.4° | 55.0° |
| C11 | N7 | C8 | C25 | 179.8° | 179.9° |
| N7 | C11 | C12 | H41 | 11.4° | 65.1° |
| N7 | C11 | N10 | H40 | 178.8° | 180.0° |
| C21 | C22 | C17 | H45 | 62.4° | 59.9° |
| C22 | C21 | C20 | H50 | 58.6° | 60.0° |
| C22 | C21 | H51 | H52 | 118.9° | 120.1° |
| C21 | C22 | H53 | H54 | 119.4° | 120.0° |
| O16 | C15 | C17 | H45 | 160.4° | 120.0° |
| O16 | C15 | N13 | H42 | 173.4° | 180.0° |
| N7 | C8 | C25 | C26 | 161.7° | 179.2° |
| N7 | C8 | C25 | C30 | 22.5° | 0.0° |
| N7 | C8 | C9 | H39 | 179.3° | 180.0° |
| C8 | C25 | C26 | C30 | 176.0° | 179.2° |
| C8 | C25 | C26 | C27 | 173.5° | 179.8° |
| C8 | C25 | C30 | C29 | 175.2° | 180.0° |
| C25 | C8 | C9 | H39 | 0.5° | 0.0° |
| C8 | C25 | C26 | H59 | 6.5° | 0.2° |
| C8 | C25 | C30 | H62 | 4.8° | 0.8° |
| C4 | C3 | C2 | H35 | 180.0° | 179.9° |
| C4 | C3 | C2 | H34 | 179.9° | 180.0° |
| C3 | C4 | C5 | H37 | 179.2° | 180.0° |
| C2 | C3 | C4 | H36 | 179.3° | 180.0° |
| C25 | C26 | C27 | H59 | 180.0° | 180.0° |
| C25 | C26 | C27 | C28 | 2.3° | 0.1° |
| C26 | C25 | C30 | C29 | 0.7° | 0.7° |
| C25 | C26 | C27 | H60 | 177.7° | 179.8° |
| C26 | C25 | C30 | H62 | 179.3° | 180.0° |
| C27 | C26 | C25 | C30 | 2.4° | 0.5° |
| C26 | C27 | C28 | H60 | 180.0° | 179.8° |
| C26 | C27 | C28 | C29 | 0.5° | 0.2° |
| C26 | C27 | C28 | C31 | 178.1° | 179.8° |
| C25 | C30 | C29 | H62 | 180.0° | 179.3° |
| C25 | C30 | C29 | C28 | 1.1° | 0.5° |
| C30 | C25 | C26 | H59 | 177.6° | 179.5° |
| C25 | C30 | C29 | H61 | 178.9° | 179.5° |
| C27 | C28 | C29 | C30 | 1.2° | 0.0° |
| C27 | C28 | C29 | C31 | 177.5° | 180.0° |
| C27 | C28 | C31 | O32 | 3.4° | 0.0° |
| C27 | C28 | C31 | N33 | 177.1° | 180.0° |
| C28 | C27 | C26 | H59 | 177.7° | 180.0° |
| C27 | C28 | C29 | H61 | 178.8° | 180.0° |
| C30 | C29 | C28 | H61 | 180.0° | 179.9° |
| C30 | C29 | C28 | C31 | 176.3° | 180.0° |
| C29 | C28 | C31 | O32 | 174.1° | 180.0° |
| C29 | C28 | C31 | N33 | 5.4° | 0.0° |
| C29 | C28 | C27 | H60 | 179.6° | 180.0° |
| C28 | C29 | C30 | H62 | 178.9° | 179.7° |
| C28 | C31 | O32 | N33 | 179.4° | 180.0° |
| C31 | C28 | C27 | H60 | 1.9° | 0.1° |
| C31 | C28 | C29 | H61 | 3.7° | 0.0° |
| C28 | C31 | N33 | H64 | 179.4° | 0.0° |
| C28 | C31 | N33 | H63 | 0.6° | 180.0° |
| O32 | C31 | N33 | H64 | 0.0° | 180.0° |
| O32 | C31 | N33 | H63 | 180.0° | 0.0° |
| C31 | N33 | H64 | H63 | 180.0° | 179.9° |
| H46 | C18 | C17 | H45 | 56.4° | 180.0° |
| H46 | C18 | C19 | H49 | 63.7° | 60.0° |
| H46 | C18 | C19 | H48 | 55.5° | 180.0° |
| H47 | C18 | C17 | H45 | 175.8° | 60.0° |
| H47 | C18 | C19 | H49 | 55.7° | 60.0° |
| H47 | C18 | C19 | H48 | 174.9° | 60.1° |
| H45 | C17 | C22 | H53 | 57.7° | 60.0° |
| H45 | C17 | C22 | H54 | 177.4° | 180.0° |
| H49 | C19 | C20 | H50 | 60.0° | 60.0° |
| H48 | C19 | C20 | H50 | 179.2° | 180.0° |
| H50 | C20 | C21 | H51 | 61.7° | 60.0° |
| H50 | C20 | C21 | H52 | 178.9° | 180.0° |
| H50 | C20 | C23 | H55 | 64.8° | 65.0° |
| H50 | C20 | C23 | H56 | 176.5° | 175.0° |
| H51 | C21 | C22 | H53 | 60.6° | 60.0° |
| H51 | C21 | C22 | H54 | 59.0° | 60.0° |
| H52 | C21 | C22 | H53 | 58.7° | 60.0° |
| H52 | C21 | C22 | H54 | 178.3° | 180.0° |
| H55 | C23 | N24 | H57 | 59.3° | 60.0° |
| H55 | C23 | N24 | H58 | 60.7° | 176.1° |
| H56 | C23 | N24 | H57 | 59.4° | 60.0° |
| H56 | C23 | N24 | H58 | 179.3° | 63.9° |
| H41 | C12 | N13 | H42 | 134.8° | 145.0° |
| H41 | C12 | C14 | H43 | 175.8° | 175.0° |
| H41 | C12 | C14 | H44 | 56.5° | 65.0° |
| H60 | C27 | C26 | H59 | 2.3° | 0.2° |
| H34 | C2 | C3 | H35 | 0.2° | 0.1° |
| H35 | C3 | C4 | H36 | 0.6° | 0.0° |
| H36 | C4 | C5 | H37 | 0.8° | 0.0° |
| H37 | C5 | C6 | H38 | 0.2° | 0.0° |
| H39 | C9 | N10 | H40 | 1.2° | 0.3° |
| H61 | C29 | C30 | H62 | 1.1° | 0.2° |
