I85
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C21 | sing | 1.39Å | 1.41Å | |
| N1 | C23 | sing | 1.35Å | 1.36Å | |
| N2 | C3 | sing | 1.47Å | 1.47Å | |
| N2 | C12 | sing | 1.47Å | 1.47Å | |
| C3 | C11 | sing | 1.53Å | 1.52Å | |
| C4 | C18 | doub | 1.40Å | 1.41Å | Aromatic |
| C4 | C21 | sing | 1.39Å | 1.40Å | Aromatic |
| N5 | C20 | sing | 1.32Å | 1.32Å | Aromatic |
| N5 | C21 | doub | 1.32Å | 1.32Å | Aromatic |
| N6 | C14 | sing | 1.33Å | 1.33Å | Aromatic |
| N6 | C17 | sing | 1.38Å | 1.37Å | Aromatic |
| C7 | C10 | sing | 1.53Å | 1.54Å | |
| C7 | C12 | sing | 1.53Å | 1.53Å | |
| C7 | C14 | sing | 1.51Å | 1.51Å | |
| C7 | C22 | sing | 1.53Å | 1.52Å | |
| N8 | C9 | sing | 1.35Å | 1.35Å | |
| N8 | C22 | sing | 1.46Å | 1.46Å | |
| C9 | O13 | doub | 1.22Å | 1.22Å | |
| C9 | C15 | sing | 1.47Å | 1.48Å | |
| C10 | C11 | sing | 1.53Å | 1.53Å | |
| C14 | C15 | doub | 1.39Å | 1.39Å | Aromatic |
| C15 | C16 | sing | 1.40Å | 1.40Å | Aromatic |
| C16 | C17 | doub | 1.36Å | 1.37Å | Aromatic |
| C17 | C18 | sing | 1.48Å | 1.48Å | |
| C18 | C19 | sing | 1.40Å | 1.40Å | Aromatic |
| C19 | C20 | doub | 1.38Å | 1.37Å | Aromatic |
| C23 | C24 | sing | 1.48Å | 1.49Å | |
| C23 | O30 | doub | 1.22Å | 1.21Å | |
| C24 | C25 | doub | 1.40Å | 1.40Å | Aromatic |
| C24 | C29 | sing | 1.40Å | 1.40Å | Aromatic |
| C25 | C26 | sing | 1.38Å | 1.38Å | Aromatic |
| C26 | C27 | doub | 1.38Å | 1.38Å | Aromatic |
| C27 | C28 | sing | 1.38Å | 1.39Å | Aromatic |
| C28 | C29 | doub | 1.38Å | 1.39Å | Aromatic |
| C28 | C31 | sing | 1.51Å | 1.51Å | |
| C31 | F32 | sing | 1.40Å | 1.40Å | |
| C31 | F33 | sing | 1.40Å | 1.40Å | |
| C31 | F34 | sing | 1.40Å | 1.40Å | |
| N1 | HN1 | sing | 0.97Å | 1.00Å | |
| N2 | HN2 | sing | 1.01Å | 1.00Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H3A | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| N6 | HN6 | sing | 0.97Å | 1.00Å | |
| N8 | HN8 | sing | 0.97Å | 1.00Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H10A | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H11A | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H22A | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C27 | H27 | sing | 1.08Å | 1.08Å | |
| C29 | H29 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C21 | N1 | C23 | 127.1° | 120.0° |
| N1 | C21 | C4 | 125.7° | 119.7° |
| N1 | C21 | N5 | 115.3° | 119.6° |
| C21 | N1 | HN1 | 116.4° | 120.0° |
| N1 | C23 | C24 | 119.4° | 120.0° |
| N1 | C23 | O30 | 121.8° | 120.0° |
| C23 | N1 | HN1 | 116.4° | 120.0° |
| C3 | N2 | C12 | 119.1° | 111.1° |
| N2 | C3 | C11 | 107.0° | 109.5° |
| C3 | N2 | HN2 | 106.4° | 111.0° |
| N2 | C3 | H3 | 110.3° | 109.5° |
| N2 | C3 | H3A | 110.3° | 109.4° |
| N2 | C12 | C7 | 110.3° | 109.6° |
| C12 | N2 | HN2 | 106.4° | 111.0° |
| N2 | C12 | H12 | 109.2° | 109.4° |
| N2 | C12 | H12A | 109.2° | 109.5° |
| C3 | C11 | C10 | 108.8° | 109.3° |
| C11 | C3 | H3 | 110.3° | 109.4° |
| C11 | C3 | H3A | 110.3° | 109.5° |
| C3 | C11 | H11 | 109.7° | 109.5° |
| C3 | C11 | H11A | 109.7° | 109.5° |
| C18 | C4 | C21 | 119.4° | 119.0° |
| C4 | C18 | C17 | 121.5° | 120.9° |
| C4 | C18 | C19 | 118.2° | 118.2° |
| C18 | C4 | H4 | 120.3° | 120.5° |
| C4 | C21 | N5 | 119.0° | 120.7° |
| C21 | C4 | H4 | 120.3° | 120.5° |
| C20 | N5 | C21 | 123.0° | 122.0° |
| N5 | C20 | C19 | 121.4° | 121.0° |
| N5 | C20 | H20 | 119.3° | 119.5° |
| C14 | N6 | C17 | 109.8° | 109.2° |
| N6 | C14 | C7 | 129.3° | 130.9° |
| N6 | C14 | C15 | 108.1° | 108.1° |
| C14 | N6 | HN6 | 125.1° | 125.4° |
| N6 | C17 | C16 | 108.1° | 108.5° |
| N6 | C17 | C18 | 124.2° | 125.7° |
| C17 | N6 | HN6 | 125.1° | 125.4° |
| C10 | C7 | C12 | 111.4° | 109.4° |
| C10 | C7 | C14 | 108.4° | 109.6° |
| C10 | C7 | C22 | 110.5° | 109.7° |
| C7 | C10 | C11 | 113.0° | 109.2° |
| C7 | C10 | H10 | 108.3° | 109.5° |
| C7 | C10 | H10A | 108.3° | 109.5° |
| C12 | C7 | C14 | 108.9° | 109.6° |
| C12 | C7 | C22 | 109.1° | 109.7° |
| C7 | C12 | H12 | 109.2° | 109.4° |
| C7 | C12 | H12A | 109.2° | 109.4° |
| C14 | C7 | C22 | 108.5° | 109.0° |
| C7 | C14 | C15 | 122.6° | 121.0° |
| C7 | C22 | N8 | 114.8° | 113.0° |
| C7 | C22 | H22 | 107.7° | 108.8° |
| C7 | C22 | H22A | 107.7° | 108.8° |
| C9 | N8 | C22 | 123.6° | 122.7° |
| N8 | C9 | O13 | 120.7° | 121.7° |
| N8 | C9 | C15 | 116.3° | 116.7° |
| C9 | N8 | HN8 | 118.2° | 118.7° |
| C22 | N8 | HN8 | 118.2° | 118.7° |
| N8 | C22 | H22 | 107.7° | 108.8° |
| N8 | C22 | H22A | 107.7° | 108.8° |
| O13 | C9 | C15 | 123.0° | 121.6° |
| C9 | C15 | C14 | 120.5° | 120.7° |
| C9 | C15 | C16 | 132.3° | 131.8° |
| C11 | C10 | H10 | 108.3° | 109.5° |
| C11 | C10 | H10A | 108.3° | 109.5° |
| C10 | C11 | H11 | 109.7° | 109.5° |
| C10 | C11 | H11A | 109.7° | 109.6° |
| C14 | C15 | C16 | 107.1° | 107.5° |
| C15 | C16 | C17 | 106.9° | 106.7° |
| C15 | C16 | H16 | 126.6° | 126.7° |
| C16 | C17 | C18 | 127.6° | 125.7° |
| C17 | C16 | H16 | 126.5° | 126.6° |
| C17 | C18 | C19 | 120.3° | 120.9° |
| C18 | C19 | C20 | 118.9° | 119.1° |
| C18 | C19 | H19 | 120.5° | 120.4° |
| C20 | C19 | H19 | 120.5° | 120.4° |
| C19 | C20 | H20 | 119.3° | 119.5° |
| C24 | C23 | O30 | 118.8° | 119.9° |
| C23 | C24 | C25 | 119.8° | 120.1° |
| C23 | C24 | C29 | 121.4° | 120.2° |
| C25 | C24 | C29 | 118.8° | 119.7° |
| C24 | C25 | C26 | 120.5° | 119.9° |
| C24 | C25 | H25 | 119.7° | 120.0° |
| C24 | C29 | C28 | 120.4° | 119.9° |
| C24 | C29 | H29 | 119.8° | 120.1° |
| C25 | C26 | C27 | 120.2° | 120.1° |
| C26 | C25 | H25 | 119.8° | 120.1° |
| C25 | C26 | H26 | 119.9° | 119.9° |
| C26 | C27 | C28 | 120.3° | 120.3° |
| C27 | C26 | H26 | 119.9° | 119.9° |
| C26 | C27 | H27 | 119.8° | 119.9° |
| C27 | C28 | C29 | 119.7° | 120.1° |
| C27 | C28 | C31 | 120.7° | 119.9° |
| C28 | C27 | H27 | 119.8° | 119.8° |
| C29 | C28 | C31 | 119.6° | 119.9° |
| C28 | C29 | H29 | 119.8° | 120.1° |
| C28 | C31 | F32 | 109.3° | 109.5° |
| C28 | C31 | F33 | 109.3° | 109.5° |
| C28 | C31 | F34 | 112.2° | 109.5° |
| F32 | C31 | F33 | 109.0° | 109.4° |
| F32 | C31 | F34 | 108.2° | 109.5° |
| F33 | C31 | F34 | 108.8° | 109.5° |
| H3 | C3 | H3A | 108.7° | 109.4° |
| H10 | C10 | H10A | 110.6° | 109.6° |
| H11 | C11 | H11A | 109.2° | 109.5° |
| H12 | C12 | H12A | 109.7° | 109.5° |
| H22 | C22 | H22A | 111.2° | 108.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C21 | N1 | C23 | HN1 | 180.0° | 179.7° |
| N1 | C21 | C4 | C18 | 179.8° | 180.0° |
| N1 | C21 | C4 | N5 | 180.0° | 179.9° |
| N1 | C21 | N5 | C20 | 179.7° | 180.0° |
| C21 | N1 | C23 | C24 | 180.0° | 174.9° |
| C21 | N1 | C23 | O30 | 1.2° | 5.1° |
| N1 | C21 | C4 | H4 | 0.2° | 0.2° |
| C23 | N1 | C21 | C4 | 4.1° | 175.0° |
| C23 | N1 | C21 | N5 | 175.9° | 5.1° |
| N1 | C23 | C24 | O30 | 178.8° | 180.0° |
| N1 | C23 | C24 | C25 | 40.2° | 0.0° |
| N1 | C23 | C24 | C29 | 140.7° | 179.7° |
| C3 | N2 | C12 | HN2 | 120.0° | 124.0° |
| N2 | C3 | C11 | H3 | 120.0° | 120.0° |
| N2 | C3 | C11 | H3A | 120.0° | 120.0° |
| C3 | N2 | C12 | C7 | 52.6° | 61.6° |
| N2 | C3 | C11 | C10 | 58.2° | 59.3° |
| N2 | C3 | H3 | H3A | 121.0° | 119.9° |
| N2 | C3 | C11 | H11 | 178.2° | 179.2° |
| N2 | C3 | C11 | H11A | 61.8° | 60.7° |
| C3 | N2 | C12 | H12 | 172.6° | 178.4° |
| C3 | N2 | C12 | H12A | 67.4° | 58.4° |
| C12 | N2 | C3 | C11 | 59.3° | 61.8° |
| N2 | C12 | C7 | C10 | 44.9° | 59.0° |
| N2 | C12 | C7 | H12 | 120.0° | 120.0° |
| N2 | C12 | C7 | H12A | 120.0° | 120.1° |
| N2 | C12 | C7 | C14 | 164.3° | 179.1° |
| N2 | C12 | C7 | C22 | 77.5° | 61.4° |
| C12 | N2 | C3 | H3 | 60.6° | 58.2° |
| C12 | N2 | C3 | H3A | 179.3° | 178.1° |
| N2 | C12 | H12 | H12A | 119.7° | 120.0° |
| C3 | C11 | C10 | C7 | 58.2° | 57.5° |
| C3 | C11 | C10 | H11 | 120.0° | 119.9° |
| C3 | C11 | C10 | H11A | 120.0° | 119.9° |
| C11 | C3 | N2 | HN2 | 60.7° | 62.2° |
| C11 | C3 | H3 | H3A | 121.0° | 120.0° |
| C3 | C11 | C10 | H10 | 178.2° | 177.4° |
| C3 | C11 | C10 | H10A | 61.8° | 62.4° |
| C3 | C11 | H11 | H11A | 120.3° | 120.0° |
| C18 | C4 | C21 | H4 | 180.0° | 179.8° |
| C18 | C4 | C21 | N5 | 0.2° | 0.1° |
| C4 | C18 | C17 | N6 | 8.1° | 180.0° |
| C4 | C18 | C17 | C16 | 172.2° | 0.1° |
| C4 | C18 | C17 | C19 | 179.4° | 179.9° |
| C4 | C18 | C19 | C20 | 0.1° | 0.0° |
| C4 | C18 | C19 | H19 | 179.9° | 180.0° |
| C4 | C21 | N5 | C20 | 0.3° | 0.1° |
| C21 | C4 | C18 | C17 | 179.4° | 180.0° |
| C21 | C4 | C18 | C19 | 0.0° | 0.1° |
| C4 | C21 | N1 | HN1 | 175.9° | 5.3° |
| N5 | C20 | C19 | C18 | 0.1° | 0.0° |
| N5 | C20 | C19 | H20 | 180.0° | 180.0° |
| N5 | C20 | C19 | H19 | 179.9° | 180.0° |
| C21 | N5 | C20 | C19 | 0.2° | 0.0° |
| N5 | C21 | N1 | HN1 | 4.1° | 174.6° |
| N5 | C21 | C4 | H4 | 179.8° | 179.7° |
| C21 | N5 | C20 | H20 | 179.8° | 180.0° |
| C14 | N6 | C17 | HN6 | 180.0° | 179.9° |
| N6 | C14 | C7 | C10 | 33.7° | 89.1° |
| N6 | C14 | C7 | C12 | 87.6° | 31.0° |
| N6 | C14 | C7 | C15 | 179.8° | 179.7° |
| N6 | C14 | C7 | C22 | 153.7° | 151.0° |
| N6 | C14 | C15 | C9 | 179.6° | 179.8° |
| N6 | C14 | C15 | C16 | 0.2° | 0.1° |
| C14 | N6 | C17 | C16 | 0.1° | 0.0° |
| C14 | N6 | C17 | C18 | 179.7° | 179.9° |
| C17 | N6 | C14 | C7 | 180.0° | 179.6° |
| C17 | N6 | C14 | C15 | 0.2° | 0.1° |
| N6 | C17 | C16 | C15 | 0.1° | 0.1° |
| N6 | C17 | C16 | C18 | 179.7° | 179.9° |
| N6 | C17 | C18 | C19 | 171.3° | 0.1° |
| N6 | C17 | C16 | H16 | 179.9° | 179.9° |
| C10 | C7 | C12 | C14 | 119.4° | 120.1° |
| C10 | C7 | C12 | C22 | 122.4° | 120.3° |
| C10 | C7 | C14 | C22 | 120.0° | 120.0° |
| C10 | C7 | C22 | N8 | 160.1° | 73.8° |
| C7 | C10 | C11 | H10 | 120.0° | 119.9° |
| C7 | C10 | C11 | H10A | 120.0° | 120.0° |
| C10 | C7 | C14 | C15 | 146.1° | 91.2° |
| C7 | C10 | H10 | H10A | 118.6° | 120.1° |
| C7 | C10 | C11 | H11 | 178.2° | 177.5° |
| C7 | C10 | C11 | H11A | 61.8° | 62.4° |
| C10 | C7 | C12 | H12 | 164.9° | 179.0° |
| C10 | C7 | C12 | H12A | 75.1° | 61.1° |
| C10 | C7 | C22 | H22 | 40.1° | 47.2° |
| C10 | C7 | C22 | H22A | 79.9° | 165.4° |
| C12 | C7 | C14 | C22 | 118.7° | 120.0° |
| C12 | C7 | C22 | N8 | 77.0° | 166.0° |
| C12 | C7 | C10 | C11 | 51.2° | 57.4° |
| C12 | C7 | C14 | C15 | 92.5° | 148.7° |
| C7 | C12 | N2 | HN2 | 67.4° | 62.4° |
| C12 | C7 | C10 | H10 | 171.2° | 177.3° |
| C12 | C7 | C10 | H10A | 68.8° | 62.5° |
| C7 | C12 | H12 | H12A | 119.6° | 119.9° |
| C12 | C7 | C22 | H22 | 162.9° | 73.0° |
| C12 | C7 | C22 | H22A | 43.0° | 45.2° |
| C14 | C7 | C22 | N8 | 41.4° | 46.1° |
| C7 | C14 | C15 | C9 | 0.6° | 0.4° |
| C14 | C7 | C10 | C11 | 170.9° | 177.5° |
| C7 | C14 | C15 | C16 | 179.9° | 179.6° |
| C7 | C14 | N6 | HN6 | 0.0° | 0.4° |
| C14 | C7 | C10 | H10 | 69.1° | 62.6° |
| C14 | C7 | C10 | H10A | 50.9° | 57.6° |
| C14 | C7 | C12 | H12 | 75.7° | 60.9° |
| C14 | C7 | C12 | H12A | 44.3° | 59.0° |
| C14 | C7 | C22 | H22 | 78.6° | 167.1° |
| C14 | C7 | C22 | H22A | 161.4° | 74.7° |
| C7 | C22 | N8 | C9 | 34.5° | 38.9° |
| C7 | C22 | N8 | H22 | 120.0° | 120.9° |
| C7 | C22 | N8 | H22A | 120.0° | 120.9° |
| C22 | C7 | C10 | C11 | 70.4° | 62.9° |
| C22 | C7 | C14 | C15 | 26.1° | 28.7° |
| C7 | C22 | N8 | HN8 | 145.6° | 141.1° |
| C22 | C7 | C10 | H10 | 49.6° | 57.0° |
| C22 | C7 | C10 | H10A | 169.6° | 177.1° |
| C22 | C7 | C12 | H12 | 42.6° | 58.6° |
| C22 | C7 | C12 | H12A | 162.5° | 178.6° |
| C7 | C22 | H22 | H22A | 117.8° | 118.3° |
| C9 | N8 | C22 | HN8 | 180.0° | 180.0° |
| N8 | C9 | O13 | C15 | 179.2° | 180.0° |
| N8 | C9 | C15 | C14 | 12.8° | 12.8° |
| N8 | C9 | C15 | C16 | 168.1° | 167.3° |
| C9 | N8 | C22 | H22 | 85.5° | 159.9° |
| C9 | N8 | C22 | H22A | 154.5° | 82.0° |
| C22 | N8 | C9 | O13 | 173.7° | 171.9° |
| C22 | N8 | C9 | C15 | 5.5° | 8.1° |
| N8 | C22 | H22 | H22A | 117.8° | 118.3° |
| O13 | C9 | C15 | C14 | 168.0° | 167.2° |
| O13 | C9 | C15 | C16 | 11.2° | 12.7° |
| O13 | C9 | N8 | HN8 | 6.2° | 8.1° |
| C9 | C15 | C14 | C16 | 179.3° | 179.9° |
| C9 | C15 | C16 | C17 | 179.4° | 179.8° |
| C15 | C9 | N8 | HN8 | 174.5° | 171.9° |
| C9 | C15 | C16 | H16 | 0.6° | 0.2° |
| C10 | C11 | C3 | H3 | 61.8° | 60.8° |
| C10 | C11 | C3 | H3A | 178.2° | 179.3° |
| C11 | C10 | H10 | H10A | 118.5° | 120.1° |
| C10 | C11 | H11 | H11A | 120.3° | 120.2° |
| C14 | C15 | C16 | C17 | 0.2° | 0.1° |
| C15 | C14 | N6 | HN6 | 179.8° | 179.8° |
| C14 | C15 | C16 | H16 | 179.8° | 179.9° |
| C15 | C16 | C17 | H16 | 180.0° | 180.0° |
| C15 | C16 | C17 | C18 | 179.8° | 180.0° |
| C16 | C17 | C18 | C19 | 8.4° | 180.0° |
| C16 | C17 | N6 | HN6 | 179.9° | 179.9° |
| C17 | C18 | C19 | C20 | 179.6° | 179.9° |
| C17 | C18 | C4 | H4 | 0.6° | 0.2° |
| C18 | C17 | N6 | HN6 | 0.3° | 0.2° |
| C18 | C17 | C16 | H16 | 0.2° | 0.0° |
| C17 | C18 | C19 | H19 | 0.4° | 0.0° |
| C18 | C19 | C20 | H19 | 180.0° | 179.9° |
| C19 | C18 | C4 | H4 | 180.0° | 179.8° |
| C18 | C19 | C20 | H20 | 179.9° | 180.0° |
| C23 | C24 | C25 | C29 | 179.1° | 179.8° |
| C23 | C24 | C25 | C26 | 179.7° | 180.0° |
| C23 | C24 | C29 | C28 | 179.6° | 179.7° |
| C24 | C23 | N1 | HN1 | 0.0° | 5.4° |
| C23 | C24 | C25 | H25 | 0.3° | 0.1° |
| C23 | C24 | C29 | H29 | 0.4° | 0.1° |
| O30 | C23 | C24 | C25 | 138.6° | 180.0° |
| O30 | C23 | C24 | C29 | 40.5° | 0.2° |
| O30 | C23 | N1 | HN1 | 178.8° | 174.6° |
| C24 | C25 | C26 | H25 | 180.0° | 179.9° |
| C24 | C25 | C26 | C27 | 0.3° | 0.1° |
| C25 | C24 | C29 | C28 | 0.5° | 0.5° |
| C24 | C25 | C26 | H26 | 179.7° | 180.0° |
| C25 | C24 | C29 | H29 | 179.5° | 179.7° |
| C29 | C24 | C25 | C26 | 0.5° | 0.2° |
| C24 | C29 | C28 | C27 | 0.1° | 0.5° |
| C24 | C29 | C28 | H29 | 180.0° | 179.7° |
| C24 | C29 | C28 | C31 | 179.8° | 179.7° |
| C29 | C24 | C25 | H25 | 179.5° | 179.7° |
| C25 | C26 | C27 | H26 | 180.0° | 179.9° |
| C25 | C26 | C27 | C28 | 0.1° | 0.1° |
| C25 | C26 | C27 | H27 | 179.9° | 180.0° |
| C26 | C27 | C28 | H27 | 180.0° | 180.0° |
| C26 | C27 | C28 | C29 | 0.1° | 0.2° |
| C26 | C27 | C28 | C31 | 180.0° | 180.0° |
| C27 | C26 | C25 | H25 | 179.7° | 180.0° |
| C27 | C28 | C29 | C31 | 179.9° | 179.8° |
| C27 | C28 | C31 | F32 | 106.0° | 0.0° |
| C27 | C28 | C31 | F33 | 134.8° | 120.0° |
| C27 | C28 | C31 | F34 | 14.1° | 120.0° |
| C28 | C27 | C26 | H26 | 180.0° | 179.9° |
| C27 | C28 | C29 | H29 | 179.9° | 179.7° |
| C29 | C28 | C31 | F32 | 73.9° | 179.7° |
| C29 | C28 | C31 | F33 | 45.3° | 59.8° |
| C29 | C28 | C31 | F34 | 166.0° | 60.2° |
| C29 | C28 | C27 | H27 | 179.9° | 179.7° |
| C28 | C31 | F32 | F33 | 119.4° | 120.0° |
| C28 | C31 | F32 | F34 | 122.4° | 120.0° |
| C28 | C31 | F33 | F34 | 122.8° | 120.0° |
| C31 | C28 | C27 | H27 | 0.0° | 0.0° |
| C31 | C28 | C29 | H29 | 0.2° | 0.0° |
| F32 | C31 | F33 | F34 | 117.8° | 120.0° |
| HN2 | N2 | C3 | H3 | 179.4° | 177.8° |
| HN2 | N2 | C3 | H3A | 59.3° | 57.8° |
| HN2 | N2 | C12 | H12 | 52.6° | 57.6° |
| HN2 | N2 | C12 | H12A | 172.6° | 177.5° |
| H3 | C3 | C11 | H11 | 58.3° | 59.2° |
| H3 | C3 | C11 | H11A | 178.2° | 179.2° |
| H3A | C3 | C11 | H11 | 61.8° | 60.8° |
| H3A | C3 | C11 | H11A | 58.2° | 59.3° |
| HN8 | N8 | C22 | H22 | 94.4° | 20.1° |
| HN8 | N8 | C22 | H22A | 25.6° | 98.1° |
| H10 | C10 | C11 | H11 | 61.8° | 62.6° |
| H10 | C10 | C11 | H11A | 58.2° | 57.5° |
| H10A | C10 | C11 | H11 | 58.2° | 57.5° |
| H10A | C10 | C11 | H11A | 178.2° | 177.7° |
| H19 | C19 | C20 | H20 | 0.1° | 0.0° |
| H25 | C25 | C26 | H26 | 0.3° | 0.1° |
| H26 | C26 | C27 | H27 | 0.0° | 0.1° |
