J8J
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | doub | 1.41Å | 1.43Å | Aromatic |
| C1 | C4 | sing | 1.38Å | 1.40Å | Aromatic |
| C1 | N23 | sing | 1.39Å | 1.43Å | |
| C2 | C3 | sing | 1.40Å | 1.39Å | Aromatic |
| C2 | C16 | sing | 1.47Å | 1.50Å | |
| C3 | C6 | doub | 1.38Å | 1.38Å | Aromatic |
| C4 | C5 | doub | 1.40Å | 1.40Å | Aromatic |
| C5 | C6 | sing | 1.41Å | 1.40Å | Aromatic |
| C5 | N9 | sing | 1.35Å | 1.39Å | Aromatic |
| C6 | N7 | sing | 1.39Å | 1.38Å | Aromatic |
| N7 | C8 | sing | 1.37Å | 1.36Å | Aromatic |
| C8 | N9 | doub | 1.31Å | 1.33Å | Aromatic |
| C8 | C10 | sing | 1.48Å | 1.47Å | |
| C10 | C11 | doub | 1.40Å | 1.39Å | Aromatic |
| C10 | C15 | sing | 1.40Å | 1.39Å | Aromatic |
| C11 | C14 | sing | 1.38Å | 1.38Å | Aromatic |
| C12 | C13 | sing | 1.38Å | 1.38Å | Aromatic |
| C12 | C14 | doub | 1.38Å | 1.38Å | Aromatic |
| C13 | C15 | doub | 1.38Å | 1.38Å | Aromatic |
| C16 | N17 | sing | 1.35Å | 1.34Å | |
| C16 | O18 | doub | 1.22Å | 1.23Å | |
| N17 | C19 | sing | 1.47Å | 1.46Å | |
| C19 | C20 | sing | 1.53Å | 1.58Å | |
| C19 | C22 | sing | 1.53Å | 1.58Å | |
| C20 | O21 | sing | 1.43Å | 1.45Å | |
| O21 | C22 | sing | 1.43Å | 1.45Å | |
| N23 | C24 | sing | 1.35Å | 1.39Å | |
| C24 | C25 | sing | 1.47Å | 1.51Å | |
| C24 | O26 | doub | 1.22Å | 1.24Å | |
| C25 | C27 | sing | 1.42Å | 1.47Å | |
| C25 | C31 | doub | 1.39Å | 1.37Å | |
| C27 | N28 | sing | 1.35Å | 1.41Å | |
| C27 | O33 | doub | 1.22Å | 1.24Å | |
| N28 | C29 | sing | 1.35Å | 1.36Å | |
| C29 | C30 | doub | 1.36Å | 1.35Å | |
| C30 | C31 | sing | 1.39Å | 1.45Å | |
| C30 | C32 | sing | 1.51Å | 1.48Å | |
| C32 | C35 | sing | 1.53Å | 1.50Å | |
| C32 | C34 | sing | 1.53Å | 1.50Å | |
| C34 | C35 | sing | 1.53Å | 1.48Å | |
| C4 | H37 | sing | 1.08Å | 1.08Å | |
| C13 | H41 | sing | 1.08Å | 1.08Å | |
| C15 | H43 | sing | 1.08Å | 1.08Å | |
| C20 | H46 | sing | 1.09Å | 1.10Å | |
| C20 | H47 | sing | 1.09Å | 1.10Å | |
| C22 | H49 | sing | 1.09Å | 1.10Å | |
| C22 | H48 | sing | 1.09Å | 1.10Å | |
| C11 | H39 | sing | 1.08Å | 1.08Å | |
| C12 | H40 | sing | 1.08Å | 1.08Å | |
| C14 | H42 | sing | 1.08Å | 1.08Å | |
| C19 | H45 | sing | 1.09Å | 1.10Å | |
| C29 | H52 | sing | 1.08Å | 1.08Å | |
| C3 | H36 | sing | 1.08Å | 1.08Å | |
| C31 | H53 | sing | 1.08Å | 1.08Å | |
| C32 | H54 | sing | 1.09Å | 1.10Å | |
| C34 | H56 | sing | 1.09Å | 1.10Å | |
| C34 | H55 | sing | 1.09Å | 1.10Å | |
| C35 | H57 | sing | 1.09Å | 1.10Å | |
| C35 | H58 | sing | 1.09Å | 1.10Å | |
| N17 | H44 | sing | 0.97Å | 1.00Å | |
| N23 | H50 | sing | 0.97Å | 1.00Å | |
| N28 | H51 | sing | 0.97Å | 1.00Å | |
| N7 | H38 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C4 | 119.4° | 120.3° |
| C2 | C1 | N23 | 122.0° | 119.9° |
| C1 | C2 | C3 | 120.0° | 120.0° |
| C1 | C2 | C16 | 122.6° | 120.0° |
| C4 | C1 | N23 | 118.5° | 119.9° |
| C1 | C4 | C5 | 119.7° | 119.9° |
| C1 | C4 | H37 | 120.1° | 120.1° |
| C1 | N23 | C24 | 129.4° | 120.0° |
| C1 | N23 | H50 | 115.3° | 120.0° |
| C3 | C2 | C16 | 117.4° | 119.9° |
| C2 | C3 | C6 | 119.4° | 119.7° |
| C2 | C3 | H36 | 120.3° | 120.1° |
| C2 | C16 | N17 | 117.3° | 120.0° |
| C2 | C16 | O18 | 120.4° | 120.0° |
| C3 | C6 | C5 | 121.5° | 120.3° |
| C3 | C6 | N7 | 132.6° | 133.6° |
| C6 | C3 | H36 | 120.3° | 120.1° |
| C4 | C5 | C6 | 119.9° | 119.7° |
| C4 | C5 | N9 | 130.8° | 133.1° |
| C5 | C4 | H37 | 120.1° | 120.0° |
| C6 | C5 | N9 | 109.3° | 107.2° |
| C5 | C6 | N7 | 105.9° | 106.1° |
| C5 | N9 | C8 | 105.1° | 109.8° |
| C6 | N7 | C8 | 107.1° | 107.0° |
| C6 | N7 | H38 | 126.5° | 126.5° |
| N7 | C8 | N9 | 112.6° | 109.8° |
| N7 | C8 | C10 | 122.9° | 125.1° |
| C8 | N7 | H38 | 126.5° | 126.5° |
| N9 | C8 | C10 | 124.4° | 125.1° |
| C8 | C10 | C11 | 120.1° | 120.1° |
| C8 | C10 | C15 | 120.9° | 120.2° |
| C11 | C10 | C15 | 118.9° | 119.7° |
| C10 | C11 | C14 | 120.3° | 119.9° |
| C10 | C11 | H39 | 119.8° | 120.0° |
| C10 | C15 | C13 | 120.4° | 119.9° |
| C10 | C15 | H43 | 119.8° | 120.1° |
| C11 | C14 | C12 | 120.3° | 120.1° |
| C14 | C11 | H39 | 119.8° | 120.1° |
| C11 | C14 | H42 | 119.9° | 119.9° |
| C13 | C12 | C14 | 119.9° | 120.3° |
| C12 | C13 | C15 | 120.1° | 120.2° |
| C12 | C13 | H41 | 119.9° | 119.9° |
| C13 | C12 | H40 | 120.1° | 119.8° |
| C14 | C12 | H40 | 120.1° | 119.9° |
| C12 | C14 | H42 | 119.9° | 120.0° |
| C15 | C13 | H41 | 119.9° | 119.9° |
| C13 | C15 | H43 | 119.8° | 120.1° |
| N17 | C16 | O18 | 121.8° | 120.0° |
| C16 | N17 | C19 | 121.9° | 120.0° |
| C16 | N17 | H44 | 119.1° | 120.0° |
| N17 | C19 | C20 | 118.8° | 114.5° |
| N17 | C19 | C22 | 119.1° | 114.5° |
| N17 | C19 | H45 | 112.4° | 113.5° |
| C19 | N17 | H44 | 119.0° | 120.0° |
| C20 | C19 | C22 | 81.7° | 81.3° |
| C19 | C20 | O21 | 89.7° | 88.5° |
| C19 | C20 | H46 | 114.2° | 113.3° |
| C19 | C20 | H47 | 114.2° | 113.5° |
| C20 | C19 | H45 | 110.7° | 114.6° |
| C19 | C22 | O21 | 90.0° | 88.4° |
| C19 | C22 | H49 | 114.1° | 113.4° |
| C19 | C22 | H48 | 114.1° | 113.3° |
| C22 | C19 | H45 | 110.8° | 114.6° |
| C20 | O21 | C22 | 90.6° | 88.3° |
| O21 | C20 | H46 | 114.1° | 113.4° |
| O21 | C20 | H47 | 114.2° | 113.4° |
| O21 | C22 | H49 | 114.1° | 113.4° |
| O21 | C22 | H48 | 114.1° | 113.5° |
| N23 | C24 | C25 | 115.1° | 120.0° |
| N23 | C24 | O26 | 124.9° | 120.0° |
| C24 | N23 | H50 | 115.3° | 120.0° |
| C25 | C24 | O26 | 120.1° | 120.0° |
| C24 | C25 | C27 | 122.8° | 120.6° |
| C24 | C25 | C31 | 117.6° | 120.6° |
| C27 | C25 | C31 | 119.5° | 118.8° |
| C25 | C27 | N28 | 114.5° | 119.8° |
| C25 | C27 | O33 | 126.1° | 120.1° |
| C25 | C31 | C30 | 122.3° | 119.0° |
| C25 | C31 | H53 | 118.8° | 120.5° |
| N28 | C27 | O33 | 119.3° | 120.1° |
| C27 | N28 | C29 | 124.6° | 121.0° |
| C27 | N28 | H51 | 117.7° | 119.5° |
| N28 | C29 | C30 | 121.7° | 121.2° |
| N28 | C29 | H52 | 119.2° | 119.4° |
| C29 | N28 | H51 | 117.7° | 119.5° |
| C29 | C30 | C31 | 117.2° | 120.1° |
| C29 | C30 | C32 | 119.3° | 119.9° |
| C30 | C29 | H52 | 119.1° | 119.4° |
| C31 | C30 | C32 | 123.5° | 120.0° |
| C30 | C31 | H53 | 118.8° | 120.5° |
| C30 | C32 | C35 | 118.8° | 117.5° |
| C30 | C32 | C34 | 123.6° | 117.5° |
| C30 | C32 | H54 | 115.0° | 115.6° |
| C35 | C32 | C34 | 58.8° | 60.0° |
| C32 | C35 | C34 | 60.6° | 60.0° |
| C35 | C32 | H54 | 114.5° | 117.4° |
| C32 | C35 | H57 | 119.9° | 117.5° |
| C32 | C35 | H58 | 119.9° | 117.5° |
| C32 | C34 | C35 | 60.6° | 60.0° |
| C34 | C32 | H54 | 114.5° | 117.6° |
| C32 | C34 | H56 | 119.9° | 117.5° |
| C32 | C34 | H55 | 119.9° | 117.6° |
| C35 | C34 | H56 | 119.9° | 117.4° |
| C35 | C34 | H55 | 119.9° | 117.5° |
| C34 | C35 | H57 | 119.9° | 117.5° |
| C34 | C35 | H58 | 119.9° | 117.5° |
| H46 | C20 | H47 | 109.4° | 112.6° |
| H49 | C22 | H48 | 109.5° | 112.7° |
| H56 | C34 | H55 | 109.5° | 115.6° |
| H57 | C35 | H58 | 109.5° | 115.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C4 | N23 | 177.3° | 179.4° |
| C1 | C2 | C3 | C16 | 179.7° | 179.4° |
| C1 | C2 | C3 | C6 | 1.0° | 0.7° |
| C2 | C1 | C4 | C5 | 1.1° | 0.1° |
| C1 | C2 | C16 | N17 | 63.1° | 174.2° |
| C1 | C2 | C16 | O18 | 124.6° | 5.8° |
| C2 | C1 | N23 | C24 | 175.7° | 143.6° |
| C2 | C1 | C4 | H37 | 178.9° | 179.7° |
| C1 | C2 | C3 | H36 | 179.0° | 180.0° |
| C2 | C1 | N23 | H50 | 4.3° | 36.4° |
| C4 | C1 | C2 | C3 | 1.3° | 0.6° |
| C4 | C1 | C2 | C16 | 178.4° | 180.0° |
| C1 | C4 | C5 | H37 | 180.0° | 179.8° |
| C1 | C4 | C5 | C6 | 0.6° | 0.2° |
| C1 | C4 | C5 | N9 | 179.8° | 179.8° |
| C4 | C1 | N23 | C24 | 7.1° | 35.8° |
| C4 | C1 | N23 | H50 | 172.9° | 144.2° |
| N23 | C1 | C2 | C3 | 178.4° | 180.0° |
| N23 | C1 | C2 | C16 | 1.3° | 0.6° |
| N23 | C1 | C4 | C5 | 178.4° | 179.5° |
| C1 | N23 | C24 | H50 | 180.0° | 180.0° |
| C1 | N23 | C24 | C25 | 160.3° | 174.8° |
| C1 | N23 | C24 | O26 | 20.4° | 5.2° |
| N23 | C1 | C4 | H37 | 1.6° | 0.3° |
| C2 | C3 | C6 | H36 | 180.0° | 179.3° |
| C2 | C3 | C6 | C5 | 0.5° | 0.4° |
| C2 | C3 | C6 | N7 | 179.3° | 179.5° |
| C3 | C2 | C16 | N17 | 116.6° | 5.2° |
| C3 | C2 | C16 | O18 | 55.6° | 174.8° |
| C16 | C2 | C3 | C6 | 178.8° | 179.8° |
| C2 | C16 | N17 | O18 | 172.2° | 180.0° |
| C2 | C16 | N17 | C19 | 175.4° | 180.0° |
| C16 | C2 | C3 | H36 | 1.3° | 0.5° |
| C2 | C16 | N17 | H44 | 4.7° | 0.0° |
| C3 | C6 | C5 | C4 | 0.3° | 0.0° |
| C3 | C6 | C5 | N7 | 179.9° | 180.0° |
| C3 | C6 | C5 | N9 | 180.0° | 180.0° |
| C3 | C6 | N7 | C8 | 179.3° | 180.0° |
| C3 | C6 | N7 | H38 | 0.7° | 0.0° |
| C4 | C5 | C6 | N9 | 179.6° | 180.0° |
| C4 | C5 | C6 | N7 | 179.5° | 180.0° |
| C4 | C5 | N9 | C8 | 179.7° | 180.0° |
| C5 | C6 | N7 | C8 | 0.9° | 0.0° |
| C6 | C5 | N9 | C8 | 0.7° | 0.0° |
| C6 | C5 | C4 | H37 | 179.3° | 180.0° |
| C5 | C6 | C3 | H36 | 179.4° | 179.7° |
| C5 | C6 | N7 | H38 | 179.1° | 180.0° |
| N9 | C5 | C6 | N7 | 0.1° | 0.0° |
| C5 | N9 | C8 | N7 | 1.3° | 0.0° |
| C5 | N9 | C8 | C10 | 177.8° | 180.0° |
| N9 | C5 | C4 | H37 | 0.2° | 0.0° |
| C6 | N7 | C8 | H38 | 180.0° | 180.0° |
| C6 | N7 | C8 | N9 | 1.4° | 0.0° |
| C6 | N7 | C8 | C10 | 177.9° | 180.0° |
| N7 | C6 | C3 | H36 | 0.7° | 0.2° |
| N7 | C8 | N9 | C10 | 176.5° | 180.0° |
| N7 | C8 | C10 | C11 | 158.4° | 180.0° |
| N7 | C8 | C10 | C15 | 17.3° | 0.2° |
| N9 | C8 | C10 | C11 | 17.7° | 0.0° |
| N9 | C8 | C10 | C15 | 166.6° | 179.8° |
| N9 | C8 | N7 | H38 | 178.6° | 180.0° |
| C8 | C10 | C11 | C15 | 175.8° | 179.8° |
| C8 | C10 | C11 | C14 | 177.9° | 180.0° |
| C8 | C10 | C15 | C13 | 178.1° | 180.0° |
| C8 | C10 | C15 | H43 | 1.9° | 0.0° |
| C8 | C10 | C11 | H39 | 2.1° | 0.1° |
| C10 | C8 | N7 | H38 | 2.1° | 0.0° |
| C10 | C11 | C14 | H39 | 180.0° | 179.9° |
| C10 | C11 | C14 | C12 | 1.2° | 0.0° |
| C11 | C10 | C15 | C13 | 2.4° | 0.2° |
| C11 | C10 | C15 | H43 | 177.6° | 179.8° |
| C10 | C11 | C14 | H42 | 178.7° | 180.0° |
| C15 | C10 | C11 | C14 | 2.1° | 0.2° |
| C10 | C15 | C13 | C12 | 1.8° | 0.0° |
| C10 | C15 | C13 | H43 | 180.0° | 180.0° |
| C10 | C15 | C13 | H41 | 178.2° | 180.0° |
| C15 | C10 | C11 | H39 | 177.9° | 179.7° |
| C11 | C14 | C12 | C13 | 0.6° | 0.3° |
| C11 | C14 | C12 | H42 | 180.0° | 180.0° |
| C11 | C14 | C12 | H40 | 179.4° | 180.0° |
| C13 | C12 | C14 | H40 | 180.0° | 179.7° |
| C12 | C13 | C15 | H41 | 180.0° | 179.9° |
| C12 | C13 | C15 | H43 | 178.2° | 180.0° |
| C13 | C12 | C14 | H42 | 179.4° | 179.7° |
| C14 | C12 | C13 | C15 | 0.9° | 0.3° |
| C14 | C12 | C13 | H41 | 179.1° | 179.8° |
| C12 | C14 | C11 | H39 | 178.8° | 179.9° |
| C15 | C13 | C12 | H40 | 179.2° | 180.0° |
| C16 | N17 | C19 | H44 | 180.0° | 180.0° |
| C16 | N17 | C19 | C20 | 57.6° | 155.1° |
| C16 | N17 | C19 | C22 | 154.3° | 113.5° |
| C16 | N17 | C19 | H45 | 73.8° | 20.8° |
| O18 | C16 | N17 | C19 | 3.2° | 0.0° |
| O18 | C16 | N17 | H44 | 176.8° | 180.0° |
| N17 | C19 | C20 | C22 | 118.7° | 113.0° |
| N17 | C19 | C20 | H45 | 132.2° | 133.8° |
| N17 | C19 | C22 | H45 | 132.6° | 133.8° |
| N17 | C19 | C20 | O21 | 139.2° | 86.6° |
| N17 | C19 | C22 | O21 | 138.8° | 86.6° |
| N17 | C19 | C20 | H46 | 104.3° | 158.5° |
| N17 | C19 | C20 | H47 | 22.6° | 28.4° |
| N17 | C19 | C22 | H49 | 22.3° | 28.3° |
| N17 | C19 | C22 | H48 | 104.6° | 158.5° |
| C20 | C19 | C22 | H45 | 109.0° | 113.2° |
| C19 | C20 | O21 | H46 | 116.5° | 114.9° |
| C19 | C20 | O21 | H47 | 116.5° | 115.0° |
| C20 | C19 | C22 | O21 | 20.5° | 26.4° |
| C19 | C20 | H46 | H47 | 129.3° | 130.5° |
| C20 | C19 | C22 | H49 | 96.0° | 141.4° |
| C20 | C19 | C22 | H48 | 137.1° | 88.5° |
| C20 | C19 | N17 | H44 | 122.4° | 25.0° |
| C19 | C22 | O21 | H49 | 116.5° | 114.9° |
| C19 | C22 | O21 | H48 | 116.6° | 114.8° |
| C22 | C19 | C20 | H46 | 137.0° | 88.5° |
| C22 | C19 | C20 | H47 | 96.0° | 141.4° |
| C19 | C22 | H49 | H48 | 129.3° | 130.5° |
| C22 | C19 | N17 | H44 | 25.7° | 66.4° |
| O21 | C20 | H46 | H47 | 129.4° | 130.5° |
| C20 | O21 | C22 | H49 | 94.4° | 143.0° |
| C20 | O21 | C22 | H48 | 138.7° | 86.7° |
| O21 | C20 | C19 | H45 | 88.7° | 139.6° |
| C22 | O21 | C20 | H46 | 138.6° | 86.7° |
| C22 | O21 | C20 | H47 | 94.5° | 143.1° |
| O21 | C22 | H49 | H48 | 129.3° | 130.6° |
| O21 | C22 | C19 | H45 | 88.5° | 139.6° |
| N23 | C24 | C25 | O26 | 179.4° | 180.0° |
| N23 | C24 | C25 | C27 | 24.6° | 5.3° |
| N23 | C24 | C25 | C31 | 158.1° | 174.3° |
| C24 | C25 | C27 | C31 | 177.2° | 179.7° |
| C24 | C25 | C27 | N28 | 179.0° | 180.0° |
| C24 | C25 | C27 | O33 | 2.3° | 0.1° |
| C24 | C25 | C31 | C30 | 179.5° | 180.0° |
| C24 | C25 | C31 | H53 | 0.4° | 0.0° |
| C25 | C24 | N23 | H50 | 19.7° | 5.1° |
| O26 | C24 | C25 | C27 | 156.1° | 174.7° |
| O26 | C24 | C25 | C31 | 21.2° | 5.7° |
| O26 | C24 | N23 | H50 | 159.6° | 174.8° |
| C25 | C27 | N28 | O33 | 178.8° | 179.9° |
| C25 | C27 | N28 | C29 | 1.0° | 0.0° |
| C27 | C25 | C31 | C30 | 2.2° | 0.4° |
| C27 | C25 | C31 | H53 | 177.8° | 179.7° |
| C25 | C27 | N28 | H51 | 179.0° | 179.9° |
| C31 | C25 | C27 | N28 | 1.8° | 0.3° |
| C31 | C25 | C27 | O33 | 179.5° | 179.7° |
| C25 | C31 | C30 | C29 | 1.5° | 0.1° |
| C25 | C31 | C30 | H53 | 180.0° | 180.0° |
| C25 | C31 | C30 | C32 | 179.4° | 180.0° |
| C27 | N28 | C29 | H51 | 180.0° | 179.9° |
| C27 | N28 | C29 | C30 | 0.4° | 0.3° |
| C27 | N28 | C29 | H52 | 179.6° | 179.9° |
| O33 | C27 | N28 | C29 | 179.8° | 180.0° |
| O33 | C27 | N28 | H51 | 0.2° | 0.0° |
| N28 | C29 | C30 | H52 | 180.0° | 179.8° |
| N28 | C29 | C30 | C31 | 0.6° | 0.2° |
| N28 | C29 | C30 | C32 | 179.7° | 179.7° |
| C29 | C30 | C31 | C32 | 179.1° | 179.9° |
| C29 | C30 | C32 | C35 | 104.3° | 120.0° |
| C29 | C30 | C32 | C34 | 174.2° | 171.3° |
| C29 | C30 | C31 | H53 | 178.5° | 179.9° |
| C29 | C30 | C32 | H54 | 36.7° | 25.6° |
| C30 | C29 | N28 | H51 | 179.6° | 179.8° |
| C31 | C30 | C32 | C35 | 76.7° | 60.0° |
| C31 | C30 | C32 | C34 | 6.8° | 8.6° |
| C31 | C30 | C29 | H52 | 179.4° | 180.0° |
| C31 | C30 | C32 | H54 | 142.3° | 154.4° |
| C30 | C32 | C35 | C34 | 113.9° | 107.5° |
| C30 | C32 | C35 | H54 | 141.2° | 144.9° |
| C30 | C32 | C34 | H54 | 149.2° | 145.1° |
| C32 | C30 | C29 | H52 | 0.3° | 0.1° |
| C32 | C30 | C31 | H53 | 0.6° | 0.0° |
| C30 | C32 | C34 | H56 | 144.5° | 145.1° |
| C30 | C32 | C34 | H55 | 3.7° | 0.0° |
| C30 | C32 | C35 | H57 | 4.3° | 0.1° |
| C30 | C32 | C35 | H58 | 136.4° | 145.0° |
| C35 | C32 | C34 | H54 | 104.9° | 107.4° |
| C32 | C35 | C34 | H57 | 109.6° | 107.5° |
| C32 | C35 | C34 | H58 | 109.6° | 107.5° |
| C35 | C32 | C34 | H56 | 109.6° | 107.4° |
| C35 | C32 | C34 | H55 | 109.6° | 107.5° |
| C32 | C35 | H57 | H58 | 144.4° | 145.7° |
| C32 | C34 | H56 | H55 | 144.4° | 145.8° |
| C35 | C34 | H56 | H55 | 144.4° | 145.7° |
| C34 | C35 | H57 | H58 | 144.4° | 145.7° |
| H41 | C13 | C15 | H43 | 1.8° | 0.0° |
| H41 | C13 | C12 | H40 | 0.9° | 0.1° |
| H46 | C20 | C19 | H45 | 27.9° | 24.7° |
| H47 | C20 | C19 | H45 | 154.8° | 105.4° |
| H49 | C22 | C19 | H45 | 154.9° | 105.5° |
| H48 | C22 | C19 | H45 | 28.0° | 24.6° |
| H39 | C11 | C14 | H42 | 1.2° | 0.0° |
| H40 | C12 | C14 | H42 | 0.6° | 0.0° |
| H45 | C19 | N17 | H44 | 106.2° | 159.3° |
| H52 | C29 | N28 | H51 | 0.4° | 0.0° |
| H54 | C32 | C34 | H56 | 4.7° | 0.0° |
| H54 | C32 | C34 | H55 | 145.5° | 145.1° |
| H54 | C32 | C35 | H57 | 145.5° | 145.0° |
| H54 | C32 | C35 | H58 | 4.8° | 0.1° |
| H56 | C34 | C35 | H57 | 140.7° | 145.0° |
| H56 | C34 | C35 | H58 | 0.0° | 0.0° |
| H55 | C34 | C35 | H57 | 0.0° | 0.1° |
| H55 | C34 | C35 | H58 | 140.7° | 145.0° |
