6HI
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C5 | N3 | sing | 1.34Å | 1.32Å | Aromatic |
| N3 | C2 | doub | 1.32Å | 1.35Å | Aromatic |
| C4 | C6 | sing | 1.53Å | 1.53Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H4A | sing | 1.09Å | 1.10Å | |
| C4 | H4B | sing | 1.09Å | 1.10Å | |
| C12 | C5 | doub | 1.37Å | 1.48Å | Aromatic |
| C27 | C5 | sing | 1.48Å | 1.48Å | Aromatic |
| C6 | N4 | sing | 1.46Å | 1.49Å | |
| C6 | C13 | sing | 1.53Å | 1.53Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C7 | C12 | sing | 1.51Å | 1.52Å | |
| C7 | C8 | sing | 1.53Å | 1.52Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C7 | H7A | sing | 1.09Å | 1.10Å | |
| C9 | C8 | sing | 1.53Å | 1.53Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C8 | H8A | sing | 1.09Å | 1.10Å | |
| C9 | C10 | sing | 1.53Å | 1.53Å | |
| C10 | C11 | sing | 1.53Å | 1.53Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H10A | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H13A | sing | 1.09Å | 1.10Å | |
| C13 | H13B | sing | 1.09Å | 1.10Å | |
| C15 | C18 | doub | 1.38Å | 1.39Å | Aromatic |
| C15 | C30 | sing | 1.39Å | 1.39Å | Aromatic |
| C15 | H15 | sing | 1.08Å | 1.08Å | |
| C20 | C17 | doub | 1.38Å | 1.39Å | Aromatic |
| C17 | C32 | sing | 1.38Å | 1.40Å | Aromatic |
| C17 | H17 | sing | 1.08Å | 1.08Å | |
| C20 | C29 | sing | 1.38Å | 1.39Å | Aromatic |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C27 | C21 | doub | 1.39Å | 1.39Å | Aromatic |
| C24 | C21 | sing | 1.38Å | 1.39Å | Aromatic |
| C21 | H21 | sing | 1.08Å | 1.08Å | |
| C30 | C24 | doub | 1.39Å | 1.39Å | Aromatic |
| C24 | H24 | sing | 1.08Å | 1.08Å | |
| C32 | C26 | doub | 1.38Å | 1.39Å | Aromatic |
| C23 | C26 | sing | 1.38Å | 1.40Å | Aromatic |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| F2 | C29 | sing | 1.35Å | 1.34Å | |
| C29 | C23 | doub | 1.39Å | 1.39Å | Aromatic |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| C32 | C1 | sing | 1.51Å | 1.51Å | |
| N2 | C1 | sing | 1.47Å | 1.46Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H1A | sing | 1.09Å | 1.10Å | |
| N2 | C3 | sing | 1.35Å | 1.33Å | |
| N2 | HN2 | sing | 0.97Å | 1.00Å | |
| C2 | C3 | sing | 1.47Å | 1.49Å | |
| C3 | O2 | doub | 1.22Å | 1.22Å | |
| N4 | C2 | sing | 1.37Å | 1.35Å | Aromatic |
| C12 | N4 | sing | 1.35Å | 1.36Å | Aromatic |
| C18 | C27 | sing | 1.39Å | 1.39Å | Aromatic |
| F1 | C30 | sing | 1.35Å | 1.34Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| O4 | C9 | sing | 1.43Å | 1.42Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| O4 | HO4 | sing | 0.97Å | 0.95Å | |
| O3 | C11 | sing | 1.43Å | 1.42Å | |
| C11 | C35 | sing | 1.53Å | 1.51Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| O3 | HO3 | sing | 0.97Å | 0.95Å | |
| C35 | C36 | sing | 1.51Å | 1.50Å | |
| C35 | H35 | sing | 1.09Å | 1.10Å | |
| C35 | H35A | sing | 1.09Å | 1.10Å | |
| O7 | C36 | doub | 1.21Å | 1.22Å | |
| C36 | O6 | sing | 1.34Å | 1.33Å | |
| O6 | HO6 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C5 | N3 | C2 | 106.8° | 109.0° |
| N3 | C5 | C12 | 109.4° | 108.0° |
| N3 | C5 | C27 | 129.6° | 125.9° |
| N3 | C2 | C3 | 121.9° | 125.7° |
| N3 | C2 | N4 | 111.6° | 108.6° |
| C6 | C4 | H4 | 109.5° | 109.5° |
| C6 | C4 | H4A | 109.5° | 109.5° |
| C6 | C4 | H4B | 109.4° | 109.5° |
| C4 | C6 | N4 | 111.8° | 109.5° |
| C4 | C6 | C13 | 112.9° | 109.4° |
| C4 | C6 | H6 | 105.5° | 109.5° |
| H4 | C4 | H4A | 109.5° | 109.5° |
| H4 | C4 | H4B | 109.5° | 109.4° |
| H4A | C4 | H4B | 109.5° | 109.4° |
| C12 | C5 | C27 | 121.1° | 126.0° |
| C5 | C12 | C7 | 125.9° | 126.4° |
| C5 | C12 | N4 | 103.4° | 107.1° |
| C5 | C27 | C21 | 119.1° | 120.1° |
| C5 | C27 | C18 | 120.3° | 120.0° |
| N4 | C6 | C13 | 109.9° | 109.5° |
| N4 | C6 | H6 | 108.8° | 109.5° |
| C6 | N4 | C2 | 121.5° | 126.3° |
| C6 | N4 | C12 | 129.7° | 126.3° |
| C13 | C6 | H6 | 107.6° | 109.4° |
| C6 | C13 | H13 | 109.5° | 109.5° |
| C6 | C13 | H13A | 109.4° | 109.5° |
| C6 | C13 | H13B | 109.5° | 109.4° |
| C12 | C7 | C8 | 108.2° | 109.5° |
| C12 | C7 | H7 | 109.9° | 109.4° |
| C12 | C7 | H7A | 110.2° | 109.4° |
| C7 | C12 | N4 | 130.7° | 126.5° |
| C8 | C7 | H7 | 109.9° | 109.5° |
| C8 | C7 | H7A | 110.2° | 109.5° |
| C7 | C8 | C9 | 113.3° | 109.4° |
| C7 | C8 | H8 | 108.2° | 109.5° |
| C7 | C8 | H8A | 107.4° | 109.5° |
| H7 | C7 | H7A | 108.5° | 109.5° |
| C9 | C8 | H8 | 108.2° | 109.5° |
| C9 | C8 | H8A | 107.3° | 109.5° |
| C8 | C9 | C10 | 109.8° | 109.4° |
| C8 | C9 | O4 | 110.0° | 109.5° |
| C8 | C9 | H9 | 108.4° | 109.4° |
| H8 | C8 | H8A | 112.5° | 109.5° |
| C9 | C10 | C11 | 112.8° | 109.5° |
| C9 | C10 | H10 | 108.4° | 109.5° |
| C9 | C10 | H10A | 107.6° | 109.5° |
| C10 | C9 | O4 | 107.8° | 109.5° |
| C10 | C9 | H9 | 110.5° | 109.5° |
| C11 | C10 | H10 | 108.4° | 109.5° |
| C11 | C10 | H10A | 107.6° | 109.5° |
| C10 | C11 | O3 | 110.6° | 109.5° |
| C10 | C11 | C35 | 108.8° | 109.4° |
| C10 | C11 | H11 | 109.2° | 109.4° |
| H10 | C10 | H10A | 112.1° | 109.5° |
| H13 | C13 | H13A | 109.5° | 109.5° |
| H13 | C13 | H13B | 109.5° | 109.5° |
| H13A | C13 | H13B | 109.5° | 109.4° |
| C18 | C15 | C30 | 119.4° | 120.1° |
| C18 | C15 | H15 | 120.3° | 120.0° |
| C15 | C18 | C27 | 119.7° | 119.9° |
| C15 | C18 | H18 | 120.1° | 120.1° |
| C30 | C15 | H15 | 120.3° | 119.9° |
| C15 | C30 | C24 | 120.7° | 120.2° |
| C15 | C30 | F1 | 120.2° | 119.9° |
| C20 | C17 | C32 | 120.4° | 120.0° |
| C20 | C17 | H17 | 119.8° | 120.0° |
| C17 | C20 | C29 | 119.6° | 120.0° |
| C17 | C20 | H20 | 120.2° | 120.0° |
| C32 | C17 | H17 | 119.8° | 120.0° |
| C17 | C32 | C26 | 119.7° | 120.1° |
| C17 | C32 | C1 | 120.9° | 120.0° |
| C29 | C20 | H20 | 120.2° | 120.0° |
| C20 | C29 | F2 | 119.5° | 120.0° |
| C20 | C29 | C23 | 120.4° | 120.0° |
| C27 | C21 | C24 | 119.9° | 119.9° |
| C27 | C21 | H21 | 120.1° | 120.0° |
| C21 | C27 | C18 | 120.5° | 119.8° |
| C24 | C21 | H21 | 120.1° | 120.1° |
| C21 | C24 | C30 | 119.8° | 120.1° |
| C21 | C24 | H24 | 120.1° | 119.9° |
| C30 | C24 | H24 | 120.1° | 120.0° |
| C24 | C30 | F1 | 119.2° | 119.9° |
| C32 | C26 | C23 | 120.1° | 120.0° |
| C32 | C26 | H26 | 119.9° | 120.0° |
| C26 | C32 | C1 | 119.5° | 119.9° |
| C23 | C26 | H26 | 119.9° | 120.0° |
| C26 | C23 | C29 | 119.8° | 120.0° |
| C26 | C23 | H23 | 120.1° | 120.0° |
| F2 | C29 | C23 | 120.1° | 120.0° |
| C29 | C23 | H23 | 120.1° | 120.1° |
| C32 | C1 | N2 | 109.9° | 109.5° |
| C32 | C1 | H1 | 109.4° | 109.5° |
| C32 | C1 | H1A | 109.2° | 109.4° |
| N2 | C1 | H1 | 109.3° | 109.5° |
| N2 | C1 | H1A | 109.3° | 109.5° |
| C1 | N2 | C3 | 122.6° | 120.0° |
| C1 | N2 | HN2 | 118.7° | 120.0° |
| H1 | C1 | H1A | 109.8° | 109.5° |
| C3 | N2 | HN2 | 118.7° | 120.0° |
| N2 | C3 | C2 | 117.0° | 120.0° |
| N2 | C3 | O2 | 120.5° | 120.0° |
| C2 | C3 | O2 | 116.6° | 120.0° |
| C3 | C2 | N4 | 126.5° | 125.8° |
| C2 | N4 | C12 | 108.8° | 107.4° |
| C27 | C18 | H18 | 120.2° | 120.1° |
| O4 | C9 | H9 | 110.4° | 109.6° |
| C9 | O4 | HO4 | 109.5° | 114.0° |
| O3 | C11 | C35 | 109.4° | 109.5° |
| O3 | C11 | H11 | 108.5° | 109.5° |
| C11 | O3 | HO3 | 109.5° | 114.0° |
| C35 | C11 | H11 | 110.4° | 109.5° |
| C11 | C35 | C36 | 111.2° | 109.4° |
| C11 | C35 | H35 | 108.9° | 109.5° |
| C11 | C35 | H35A | 108.5° | 109.5° |
| C36 | C35 | H35 | 108.9° | 109.5° |
| C36 | C35 | H35A | 108.5° | 109.5° |
| C35 | C36 | O7 | 120.0° | 120.1° |
| C35 | C36 | O6 | 119.4° | 120.0° |
| H35 | C35 | H35A | 110.9° | 109.5° |
| O7 | C36 | O6 | 120.7° | 120.0° |
| C36 | O6 | HO6 | 109.5° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N3 | C5 | C12 | C27 | 179.3° | 180.0° |
| N3 | C5 | C12 | C7 | 179.5° | 180.0° |
| N3 | C5 | C27 | C21 | 78.8° | 41.2° |
| C5 | N3 | C2 | C3 | 178.9° | 180.0° |
| C5 | N3 | C2 | N4 | 0.2° | 0.0° |
| N3 | C5 | C12 | N4 | 0.3° | 0.1° |
| N3 | C5 | C27 | C18 | 98.8° | 138.9° |
| C2 | N3 | C5 | C12 | 0.3° | 0.1° |
| C2 | N3 | C5 | C27 | 179.5° | 180.0° |
| N3 | C2 | N4 | C6 | 179.6° | 180.0° |
| N3 | C2 | C3 | N2 | 38.0° | 5.5° |
| N3 | C2 | C3 | N4 | 178.9° | 180.0° |
| N3 | C2 | C3 | O2 | 115.1° | 174.5° |
| N3 | C2 | N4 | C12 | 0.0° | 0.0° |
| C6 | C4 | H4 | H4A | 120.0° | 120.0° |
| C6 | C4 | H4 | H4B | 120.0° | 120.0° |
| C6 | C4 | H4A | H4B | 120.0° | 120.0° |
| C4 | C6 | N4 | C13 | 126.2° | 120.0° |
| C4 | C6 | N4 | H6 | 116.1° | 120.1° |
| C4 | C6 | C13 | H6 | 116.0° | 120.0° |
| C4 | C6 | C13 | H13 | 6.7° | 53.6° |
| C4 | C6 | C13 | H13A | 113.3° | 173.7° |
| C4 | C6 | C13 | H13B | 126.7° | 66.4° |
| C4 | C6 | N4 | C2 | 133.7° | 126.8° |
| C4 | C6 | N4 | C12 | 46.8° | 53.2° |
| H4 | C4 | H4A | H4B | 120.0° | 120.0° |
| H4 | C4 | C6 | N4 | 56.1° | 67.9° |
| H4 | C4 | C6 | C13 | 179.3° | 52.1° |
| H4 | C4 | C6 | H6 | 62.0° | 172.0° |
| H4A | C4 | C6 | N4 | 176.1° | 172.0° |
| H4A | C4 | C6 | C13 | 59.3° | 68.0° |
| H4A | C4 | C6 | H6 | 58.0° | 52.0° |
| H4B | C4 | C6 | N4 | 63.9° | 52.0° |
| H4B | C4 | C6 | C13 | 60.7° | 172.0° |
| H4B | C4 | C6 | H6 | 178.0° | 68.0° |
| C5 | C12 | N4 | C6 | 179.3° | 180.0° |
| C5 | C12 | C7 | N4 | 179.0° | 179.9° |
| C5 | C12 | C7 | C8 | 94.2° | 84.3° |
| C5 | C12 | C7 | H7 | 25.8° | 155.7° |
| C5 | C12 | C7 | H7A | 145.3° | 35.7° |
| C12 | C5 | C27 | C21 | 102.1° | 138.9° |
| C5 | C12 | N4 | C2 | 0.2° | 0.1° |
| C12 | C5 | C27 | C18 | 80.3° | 41.1° |
| C27 | C5 | C12 | C7 | 1.2° | 0.1° |
| C5 | C27 | C18 | C15 | 178.7° | 180.0° |
| C5 | C27 | C21 | C18 | 177.6° | 179.9° |
| C5 | C27 | C21 | C24 | 178.9° | 180.0° |
| C5 | C27 | C21 | H21 | 1.1° | 0.1° |
| C27 | C5 | C12 | N4 | 179.6° | 180.0° |
| C5 | C27 | C18 | H18 | 1.4° | 0.0° |
| N4 | C6 | C13 | H6 | 118.4° | 120.0° |
| C6 | N4 | C12 | C7 | 0.2° | 0.1° |
| N4 | C6 | C13 | H13 | 118.9° | 66.4° |
| N4 | C6 | C13 | H13A | 121.1° | 53.6° |
| N4 | C6 | C13 | H13B | 1.1° | 173.6° |
| C6 | N4 | C2 | C3 | 0.5° | 0.1° |
| C6 | N4 | C2 | C12 | 179.6° | 179.9° |
| C6 | C13 | H13 | H13A | 120.0° | 120.0° |
| C6 | C13 | H13 | H13B | 120.0° | 120.0° |
| C6 | C13 | H13A | H13B | 120.0° | 119.9° |
| C13 | C6 | N4 | C2 | 100.0° | 113.2° |
| C13 | C6 | N4 | C12 | 79.5° | 66.7° |
| H6 | C6 | C13 | H13 | 122.7° | 173.6° |
| H6 | C6 | C13 | H13A | 2.8° | 66.3° |
| H6 | C6 | C13 | H13B | 117.2° | 53.6° |
| H6 | C6 | N4 | C2 | 17.6° | 6.8° |
| H6 | C6 | N4 | C12 | 162.9° | 173.3° |
| C12 | C7 | C8 | H7 | 120.0° | 120.0° |
| C12 | C7 | C8 | H7A | 120.5° | 120.0° |
| C12 | C7 | H7 | H7A | 120.5° | 119.9° |
| C12 | C7 | C8 | C9 | 177.7° | 174.9° |
| C12 | C7 | C8 | H8 | 62.3° | 55.0° |
| C12 | C7 | C8 | H8A | 59.4° | 65.0° |
| C7 | C12 | N4 | C2 | 179.4° | 180.0° |
| C8 | C7 | H7 | H7A | 120.5° | 120.1° |
| C7 | C8 | C9 | H8 | 120.0° | 120.0° |
| C7 | C8 | C9 | H8A | 118.4° | 120.0° |
| C7 | C8 | H8 | H8A | 118.4° | 120.0° |
| C7 | C8 | C9 | C10 | 169.9° | 175.0° |
| C8 | C7 | C12 | N4 | 84.8° | 95.5° |
| C7 | C8 | C9 | O4 | 71.7° | 65.0° |
| C7 | C8 | C9 | H9 | 49.0° | 55.1° |
| H7 | C7 | C8 | C9 | 57.7° | 55.0° |
| H7 | C7 | C8 | H8 | 177.7° | 65.0° |
| H7 | C7 | C8 | H8A | 60.6° | 175.0° |
| H7 | C7 | C12 | N4 | 155.2° | 24.5° |
| H7A | C7 | C8 | C9 | 61.8° | 65.1° |
| H7A | C7 | C8 | H8 | 58.2° | 175.0° |
| H7A | C7 | C8 | H8A | 179.9° | 55.0° |
| H7A | C7 | C12 | N4 | 35.7° | 144.4° |
| C9 | C8 | H8 | H8A | 118.4° | 120.1° |
| C8 | C9 | C10 | O4 | 119.8° | 120.0° |
| C8 | C9 | C10 | H9 | 119.5° | 119.9° |
| C8 | C9 | C10 | C11 | 74.0° | 175.0° |
| C8 | C9 | C10 | H10 | 166.0° | 65.0° |
| C8 | C9 | C10 | H10A | 44.6° | 54.9° |
| C8 | C9 | O4 | H9 | 119.5° | 120.0° |
| C8 | C9 | O4 | HO4 | 53.1° | 60.0° |
| H8 | C8 | C9 | C10 | 70.1° | 65.1° |
| H8 | C8 | C9 | O4 | 48.3° | 54.9° |
| H8 | C8 | C9 | H9 | 169.1° | 175.0° |
| H8A | C8 | C9 | C10 | 51.5° | 55.0° |
| H8A | C8 | C9 | O4 | 170.0° | 175.0° |
| H8A | C8 | C9 | H9 | 69.3° | 64.9° |
| C9 | C10 | C11 | H10 | 120.0° | 120.0° |
| C9 | C10 | C11 | H10A | 118.6° | 120.1° |
| C9 | C10 | H10 | H10A | 118.7° | 120.0° |
| C10 | C9 | O4 | H9 | 120.8° | 120.0° |
| C10 | C9 | O4 | HO4 | 66.6° | 60.0° |
| C9 | C10 | C11 | O3 | 68.5° | 65.0° |
| C9 | C10 | C11 | C35 | 171.3° | 175.0° |
| C9 | C10 | C11 | H11 | 50.9° | 55.0° |
| C11 | C10 | H10 | H10A | 118.6° | 120.0° |
| C11 | C10 | C9 | O4 | 166.2° | 65.0° |
| C11 | C10 | C9 | H9 | 45.5° | 55.1° |
| C10 | C11 | O3 | C35 | 119.8° | 120.0° |
| C10 | C11 | O3 | H11 | 119.7° | 120.0° |
| C10 | C11 | C35 | H11 | 119.7° | 119.9° |
| C10 | C11 | O3 | HO3 | 26.4° | 60.0° |
| C10 | C11 | C35 | C36 | 173.0° | 175.0° |
| C10 | C11 | C35 | H35 | 67.0° | 65.1° |
| C10 | C11 | C35 | H35A | 53.8° | 55.0° |
| H10 | C10 | C9 | O4 | 46.2° | 54.9° |
| H10 | C10 | C9 | H9 | 74.5° | 175.1° |
| H10 | C10 | C11 | O3 | 51.5° | 55.0° |
| H10 | C10 | C11 | C35 | 68.7° | 65.0° |
| H10 | C10 | C11 | H11 | 170.9° | 175.0° |
| H10A | C10 | C9 | O4 | 75.2° | 174.9° |
| H10A | C10 | C9 | H9 | 164.1° | 65.0° |
| H10A | C10 | C11 | O3 | 173.0° | 175.0° |
| H10A | C10 | C11 | C35 | 52.8° | 55.0° |
| H10A | C10 | C11 | H11 | 67.7° | 65.0° |
| H13 | C13 | H13A | H13B | 120.0° | 120.1° |
| C18 | C15 | C30 | H15 | 180.0° | 179.7° |
| C15 | C18 | C27 | C21 | 1.1° | 0.0° |
| C18 | C15 | C30 | C24 | 0.4° | 0.0° |
| C15 | C18 | C27 | H18 | 180.0° | 180.0° |
| C18 | C15 | C30 | F1 | 179.3° | 180.0° |
| C15 | C30 | C24 | C21 | 0.6° | 0.0° |
| C15 | C30 | C24 | F1 | 178.9° | 180.0° |
| C15 | C30 | C24 | H24 | 179.3° | 179.9° |
| C30 | C15 | C18 | C27 | 0.6° | 0.0° |
| C30 | C15 | C18 | H18 | 179.4° | 180.0° |
| H15 | C15 | C30 | C24 | 179.6° | 179.7° |
| H15 | C15 | C18 | C27 | 179.4° | 179.7° |
| H15 | C15 | C30 | F1 | 0.7° | 0.3° |
| H15 | C15 | C18 | H18 | 0.6° | 0.3° |
| C20 | C17 | C32 | H17 | 180.0° | 179.8° |
| C17 | C20 | C29 | H20 | 180.0° | 180.0° |
| C20 | C17 | C32 | C26 | 0.2° | 0.0° |
| C17 | C20 | C29 | F2 | 179.7° | 179.9° |
| C17 | C20 | C29 | C23 | 0.3° | 0.0° |
| C20 | C17 | C32 | C1 | 179.6° | 179.7° |
| C32 | C17 | C20 | C29 | 0.1° | 0.0° |
| C32 | C17 | C20 | H20 | 179.8° | 180.0° |
| C17 | C32 | C26 | C1 | 179.8° | 179.7° |
| C17 | C32 | C26 | C23 | 0.3° | 0.0° |
| C17 | C32 | C26 | H26 | 179.7° | 180.0° |
| C17 | C32 | C1 | N2 | 22.8° | 90.0° |
| C17 | C32 | C1 | H1 | 142.8° | 150.0° |
| C17 | C32 | C1 | H1A | 97.0° | 30.0° |
| H17 | C17 | C20 | C29 | 179.9° | 179.8° |
| H17 | C17 | C20 | H20 | 0.2° | 0.3° |
| H17 | C17 | C32 | C26 | 179.8° | 179.8° |
| H17 | C17 | C32 | C1 | 0.4° | 0.0° |
| C20 | C29 | C23 | C26 | 0.2° | 0.0° |
| C20 | C29 | F2 | C23 | 179.4° | 180.0° |
| C20 | C29 | C23 | H23 | 179.8° | 179.9° |
| H20 | C20 | C29 | F2 | 0.3° | 0.1° |
| H20 | C20 | C29 | C23 | 179.6° | 180.0° |
| C27 | C21 | C24 | H21 | 180.0° | 179.9° |
| C27 | C21 | C24 | C30 | 1.0° | 0.0° |
| C27 | C21 | C24 | H24 | 178.9° | 180.0° |
| C21 | C27 | C18 | H18 | 179.0° | 180.0° |
| C21 | C24 | C30 | H24 | 180.0° | 179.9° |
| C24 | C21 | C27 | C18 | 1.3° | 0.1° |
| C21 | C24 | C30 | F1 | 179.5° | 180.0° |
| H21 | C21 | C24 | C30 | 178.9° | 180.0° |
| H21 | C21 | C24 | H24 | 1.1° | 0.1° |
| H21 | C21 | C27 | C18 | 178.7° | 180.0° |
| H24 | C24 | C30 | F1 | 0.4° | 0.0° |
| C32 | C26 | C23 | H26 | 180.0° | 179.9° |
| C32 | C26 | C23 | C29 | 0.1° | 0.0° |
| C32 | C26 | C23 | H23 | 179.9° | 179.9° |
| C26 | C32 | C1 | N2 | 157.4° | 90.2° |
| C26 | C32 | C1 | H1 | 37.4° | 29.8° |
| C26 | C32 | C1 | H1A | 82.8° | 149.8° |
| C26 | C23 | C29 | F2 | 179.6° | 180.0° |
| C26 | C23 | C29 | H23 | 180.0° | 179.9° |
| C23 | C26 | C32 | C1 | 179.5° | 179.7° |
| H26 | C26 | C23 | C29 | 179.9° | 180.0° |
| H26 | C26 | C23 | H23 | 0.1° | 0.0° |
| H26 | C26 | C32 | C1 | 0.5° | 0.2° |
| F2 | C29 | C23 | H23 | 0.4° | 0.0° |
| C32 | C1 | N2 | H1 | 120.0° | 120.0° |
| C32 | C1 | N2 | H1A | 119.8° | 120.0° |
| C32 | C1 | H1 | H1A | 119.8° | 120.0° |
| C32 | C1 | N2 | C3 | 92.2° | 180.0° |
| C32 | C1 | N2 | HN2 | 87.8° | 0.0° |
| N2 | C1 | H1 | H1A | 119.8° | 120.0° |
| C1 | N2 | C3 | HN2 | 180.0° | 180.0° |
| C1 | N2 | C3 | C2 | 152.5° | 180.0° |
| C1 | N2 | C3 | O2 | 0.4° | 0.0° |
| H1 | C1 | N2 | C3 | 27.8° | 60.0° |
| H1 | C1 | N2 | HN2 | 152.2° | 120.0° |
| H1A | C1 | N2 | C3 | 148.0° | 60.0° |
| H1A | C1 | N2 | HN2 | 32.0° | 119.9° |
| N2 | C3 | C2 | O2 | 153.1° | 180.0° |
| N2 | C3 | C2 | N4 | 143.0° | 174.5° |
| HN2 | N2 | C3 | C2 | 27.5° | 0.0° |
| HN2 | N2 | C3 | O2 | 179.6° | 180.0° |
| C3 | C2 | N4 | C12 | 179.1° | 180.0° |
| O2 | C3 | C2 | N4 | 63.8° | 5.5° |
| H9 | C9 | O4 | HO4 | 172.6° | 180.0° |
| O3 | C11 | C35 | H11 | 119.3° | 120.1° |
| O3 | C11 | C35 | C36 | 66.0° | 65.0° |
| O3 | C11 | C35 | H35 | 54.0° | 54.9° |
| O3 | C11 | C35 | H35A | 174.7° | 175.0° |
| C35 | C11 | O3 | HO3 | 146.2° | 60.0° |
| C11 | C35 | C36 | H35 | 120.0° | 120.0° |
| C11 | C35 | C36 | H35A | 119.2° | 120.0° |
| C11 | C35 | H35 | H35A | 119.3° | 120.1° |
| C11 | C35 | C36 | O7 | 94.5° | 0.0° |
| C11 | C35 | C36 | O6 | 87.2° | 180.0° |
| H11 | C11 | O3 | HO3 | 93.4° | 180.0° |
| H11 | C11 | C35 | C36 | 53.3° | 55.0° |
| H11 | C11 | C35 | H35 | 173.3° | 175.0° |
| H11 | C11 | C35 | H35A | 65.9° | 64.9° |
| C36 | C35 | H35 | H35A | 119.3° | 120.0° |
| C35 | C36 | O7 | O6 | 178.3° | 180.0° |
| C35 | C36 | O6 | HO6 | 178.3° | 180.0° |
| H35 | C35 | C36 | O7 | 25.5° | 120.0° |
| H35 | C35 | C36 | O6 | 152.8° | 60.0° |
| H35A | C35 | C36 | O7 | 146.3° | 120.0° |
| H35A | C35 | C36 | O6 | 32.0° | 60.0° |
| O7 | C36 | O6 | HO6 | 0.0° | 0.1° |
