D84
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O2 | C19 | doub | 1.21Å | 1.22Å | |
| C13 | C12 | doub | 1.38Å | 1.40Å | Aromatic |
| C13 | C14 | sing | 1.39Å | 1.39Å | Aromatic |
| C12 | C11 | sing | 1.38Å | 1.39Å | Aromatic |
| C19 | C18 | sing | 1.52Å | 1.51Å | |
| C19 | N1 | sing | 1.34Å | 1.32Å | |
| C18 | C17 | sing | 1.55Å | 1.53Å | |
| C11 | C10 | doub | 1.39Å | 1.39Å | Aromatic |
| C14 | N1 | sing | 1.40Å | 1.40Å | |
| C14 | C15 | doub | 1.39Å | 1.39Å | Aromatic |
| N1 | C16 | sing | 1.47Å | 1.46Å | |
| C17 | C16 | sing | 1.54Å | 1.53Å | |
| C10 | C15 | sing | 1.39Å | 1.39Å | Aromatic |
| C10 | O1 | sing | 1.36Å | 1.38Å | |
| N2 | C8 | doub | 1.30Å | 1.34Å | Aromatic |
| N2 | C20 | sing | 1.36Å | 1.35Å | Aromatic |
| O1 | C9 | sing | 1.43Å | 1.42Å | |
| C9 | C8 | sing | 1.51Å | 1.51Å | |
| C21 | C20 | doub | 1.40Å | 1.39Å | Aromatic |
| C21 | C22 | sing | 1.36Å | 1.39Å | Aromatic |
| C8 | N | sing | 1.36Å | 1.34Å | Aromatic |
| C20 | C25 | sing | 1.41Å | 1.39Å | Aromatic |
| C22 | C23 | doub | 1.40Å | 1.38Å | Aromatic |
| N | C25 | sing | 1.38Å | 1.34Å | Aromatic |
| N | C7 | sing | 1.46Å | 1.46Å | |
| C25 | C24 | doub | 1.39Å | 1.40Å | Aromatic |
| C5 | C4 | doub | 1.38Å | 1.39Å | Aromatic |
| C5 | C6 | sing | 1.38Å | 1.39Å | Aromatic |
| C4 | C3 | sing | 1.38Å | 1.39Å | Aromatic |
| C23 | C24 | sing | 1.39Å | 1.41Å | Aromatic |
| C23 | C26 | sing | 1.48Å | 1.49Å | |
| C7 | C6 | sing | 1.51Å | 1.52Å | |
| C6 | C1 | doub | 1.39Å | 1.38Å | Aromatic |
| C26 | C27 | doub | 1.36Å | 1.40Å | |
| C26 | C30 | sing | 1.41Å | 1.39Å | |
| C27 | N3 | sing | 1.36Å | 1.34Å | |
| C3 | C2 | doub | 1.38Å | 1.39Å | Aromatic |
| C1 | C2 | sing | 1.39Å | 1.39Å | Aromatic |
| C1 | O | sing | 1.36Å | 1.37Å | |
| C30 | C29 | doub | 1.36Å | 1.39Å | |
| N3 | C28 | sing | 1.35Å | 1.34Å | |
| O | C | sing | 1.43Å | 1.42Å | |
| C28 | C29 | sing | 1.41Å | 1.40Å | |
| C28 | O3 | doub | 1.22Å | 1.25Å | |
| C | F1 | sing | 1.40Å | 1.37Å | |
| C | F | sing | 1.40Å | 1.36Å | |
| C11 | H1 | sing | 1.08Å | 1.08Å | |
| C12 | H2 | sing | 1.08Å | 1.08Å | |
| C13 | H3 | sing | 1.08Å | 1.08Å | |
| C15 | H4 | sing | 1.08Å | 1.08Å | |
| C16 | H5 | sing | 1.09Å | 1.10Å | |
| C16 | H6 | sing | 1.09Å | 1.10Å | |
| C17 | H7 | sing | 1.09Å | 1.10Å | |
| C17 | H8 | sing | 1.09Å | 1.10Å | |
| C27 | H9 | sing | 1.08Å | 1.08Å | |
| C29 | H10 | sing | 1.08Å | 1.08Å | |
| C30 | H11 | sing | 1.08Å | 1.08Å | |
| C22 | H13 | sing | 1.08Å | 1.08Å | |
| C21 | H14 | sing | 1.08Å | 1.08Å | |
| C24 | H15 | sing | 1.08Å | 1.08Å | |
| C7 | H16 | sing | 1.09Å | 1.10Å | |
| C7 | H17 | sing | 1.09Å | 1.10Å | |
| C5 | H18 | sing | 1.08Å | 1.08Å | |
| C4 | H19 | sing | 1.08Å | 1.08Å | |
| C3 | H20 | sing | 1.08Å | 1.08Å | |
| C2 | H21 | sing | 1.08Å | 1.08Å | |
| C | H22 | sing | 1.09Å | 1.10Å | |
| C9 | H23 | sing | 1.09Å | 1.10Å | |
| C9 | H24 | sing | 1.09Å | 1.10Å | |
| C18 | H25 | sing | 1.09Å | 1.10Å | |
| C18 | H26 | sing | 1.09Å | 1.10Å | |
| N3 | H27 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O2 | C19 | C18 | 123.5° | 125.0° |
| O2 | C19 | N1 | 126.9° | 125.0° |
| C12 | C13 | C14 | 120.1° | 120.0° |
| C13 | C12 | C11 | 120.7° | 120.2° |
| C13 | C12 | H2 | 119.7° | 119.9° |
| C12 | C13 | H3 | 120.0° | 120.0° |
| C13 | C14 | N1 | 122.8° | 120.1° |
| C13 | C14 | C15 | 118.8° | 119.9° |
| C14 | C13 | H3 | 119.9° | 120.0° |
| C12 | C11 | C10 | 119.4° | 120.1° |
| C12 | C11 | H1 | 120.3° | 120.0° |
| C11 | C12 | H2 | 119.6° | 120.0° |
| C18 | C19 | N1 | 109.6° | 110.0° |
| C19 | C18 | C17 | 102.9° | 104.2° |
| C19 | C18 | H25 | 111.1° | 110.5° |
| C19 | C18 | H26 | 111.1° | 110.5° |
| C19 | N1 | C14 | 124.0° | 124.3° |
| C19 | N1 | C16 | 116.1° | 111.3° |
| C18 | C17 | C16 | 107.9° | 101.8° |
| C18 | C17 | H7 | 109.8° | 111.0° |
| C18 | C17 | H8 | 109.9° | 111.0° |
| C17 | C18 | H25 | 111.1° | 110.5° |
| C17 | C18 | H26 | 111.1° | 110.5° |
| C11 | C10 | C15 | 119.6° | 120.0° |
| C11 | C10 | O1 | 123.1° | 120.0° |
| C10 | C11 | H1 | 120.3° | 120.0° |
| N1 | C14 | C15 | 118.3° | 120.1° |
| C14 | N1 | C16 | 119.8° | 124.3° |
| C14 | C15 | C10 | 121.2° | 119.9° |
| C14 | C15 | H4 | 119.4° | 120.0° |
| N1 | C16 | C17 | 101.5° | 105.5° |
| N1 | C16 | H5 | 111.4° | 110.2° |
| N1 | C16 | H6 | 111.4° | 110.3° |
| C17 | C16 | H5 | 111.4° | 110.2° |
| C17 | C16 | H6 | 111.4° | 110.3° |
| C16 | C17 | H7 | 109.9° | 111.0° |
| C16 | C17 | H8 | 109.9° | 111.0° |
| C15 | C10 | O1 | 117.3° | 120.0° |
| C10 | C15 | H4 | 119.3° | 120.1° |
| C10 | O1 | C9 | 124.4° | 117.0° |
| C8 | N2 | C20 | 107.7° | 109.7° |
| N2 | C8 | C9 | 123.8° | 125.0° |
| N2 | C8 | N | 108.8° | 110.1° |
| N2 | C20 | C21 | 131.1° | 133.4° |
| N2 | C20 | C25 | 108.1° | 106.9° |
| O1 | C9 | C8 | 110.0° | 109.5° |
| O1 | C9 | H23 | 109.3° | 109.5° |
| O1 | C9 | H24 | 109.4° | 109.5° |
| C9 | C8 | N | 127.4° | 124.9° |
| C8 | C9 | H23 | 109.4° | 109.4° |
| C8 | C9 | H24 | 109.3° | 109.5° |
| C20 | C21 | C22 | 120.1° | 120.1° |
| C21 | C20 | C25 | 120.8° | 119.6° |
| C20 | C21 | H14 | 119.9° | 120.0° |
| C21 | C22 | C23 | 119.7° | 120.5° |
| C21 | C22 | H13 | 120.1° | 119.8° |
| C22 | C21 | H14 | 119.9° | 120.0° |
| C8 | N | C25 | 109.2° | 107.2° |
| C8 | N | C7 | 124.2° | 126.4° |
| C20 | C25 | N | 106.2° | 106.0° |
| C20 | C25 | C24 | 119.1° | 120.0° |
| C22 | C23 | C24 | 120.5° | 120.2° |
| C22 | C23 | C26 | 115.8° | 119.9° |
| C23 | C22 | H13 | 120.2° | 119.7° |
| C25 | N | C7 | 126.5° | 126.4° |
| N | C25 | C24 | 134.6° | 134.0° |
| N | C7 | C6 | 110.2° | 109.5° |
| N | C7 | H16 | 109.3° | 109.5° |
| N | C7 | H17 | 109.3° | 109.5° |
| C25 | C24 | C23 | 119.7° | 119.6° |
| C25 | C24 | H15 | 120.1° | 120.2° |
| C4 | C5 | C6 | 120.4° | 120.1° |
| C5 | C4 | C3 | 120.2° | 120.1° |
| C4 | C5 | H18 | 119.8° | 119.9° |
| C5 | C4 | H19 | 119.9° | 120.0° |
| C5 | C6 | C7 | 121.2° | 120.0° |
| C5 | C6 | C1 | 119.2° | 120.0° |
| C6 | C5 | H18 | 119.8° | 120.0° |
| C4 | C3 | C2 | 119.2° | 120.1° |
| C3 | C4 | H19 | 119.9° | 120.0° |
| C4 | C3 | H20 | 120.4° | 120.0° |
| C24 | C23 | C26 | 123.7° | 119.9° |
| C23 | C24 | H15 | 120.1° | 120.2° |
| C23 | C26 | C27 | 118.4° | 120.2° |
| C23 | C26 | C30 | 122.4° | 120.1° |
| C7 | C6 | C1 | 119.6° | 120.0° |
| C6 | C7 | H16 | 109.3° | 109.4° |
| C6 | C7 | H17 | 109.3° | 109.4° |
| C6 | C1 | C2 | 120.9° | 119.8° |
| C6 | C1 | O | 117.9° | 120.1° |
| C27 | C26 | C30 | 119.2° | 119.7° |
| C26 | C27 | N3 | 121.2° | 120.6° |
| C26 | C27 | H9 | 119.4° | 119.7° |
| C26 | C30 | C29 | 118.4° | 119.1° |
| C26 | C30 | H11 | 120.8° | 120.4° |
| C27 | N3 | C28 | 120.6° | 120.8° |
| N3 | C27 | H9 | 119.4° | 119.7° |
| C27 | N3 | H27 | 119.7° | 119.6° |
| C3 | C2 | C1 | 120.2° | 119.9° |
| C2 | C3 | H20 | 120.4° | 119.9° |
| C3 | C2 | H21 | 119.9° | 120.0° |
| C2 | C1 | O | 121.1° | 120.1° |
| C1 | C2 | H21 | 119.9° | 120.0° |
| C1 | O | C | 124.3° | 117.0° |
| C30 | C29 | C28 | 120.0° | 119.5° |
| C30 | C29 | H10 | 120.0° | 120.3° |
| C29 | C30 | H11 | 120.8° | 120.4° |
| N3 | C28 | C29 | 120.6° | 120.3° |
| N3 | C28 | O3 | 119.0° | 119.8° |
| C28 | N3 | H27 | 119.7° | 119.6° |
| O | C | F1 | 107.4° | 109.5° |
| O | C | F | 108.0° | 109.5° |
| O | C | H22 | 110.3° | 109.5° |
| C29 | C28 | O3 | 120.5° | 119.9° |
| C28 | C29 | H10 | 119.9° | 120.3° |
| F1 | C | F | 108.5° | 109.5° |
| F1 | C | H22 | 111.1° | 109.4° |
| F | C | H22 | 111.3° | 109.4° |
| H5 | C16 | H6 | 109.5° | 110.2° |
| H7 | C17 | H8 | 109.4° | 110.8° |
| H16 | C7 | H17 | 109.4° | 109.5° |
| H23 | C9 | H24 | 109.5° | 109.5° |
| H25 | C18 | H26 | 109.5° | 110.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O2 | C19 | C18 | N1 | 179.3° | 179.9° |
| O2 | C19 | C18 | C17 | 172.0° | 163.7° |
| O2 | C19 | N1 | C14 | 2.4° | 0.3° |
| O2 | C19 | N1 | C16 | 179.5° | 179.7° |
| O2 | C19 | C18 | H25 | 69.1° | 44.9° |
| O2 | C19 | C18 | H26 | 53.1° | 77.6° |
| C12 | C13 | C14 | H3 | 180.0° | 179.9° |
| C13 | C12 | C11 | H2 | 180.0° | 179.9° |
| C13 | C12 | C11 | C10 | 1.5° | 0.1° |
| C12 | C13 | C14 | N1 | 179.4° | 179.9° |
| C12 | C13 | C14 | C15 | 2.6° | 0.0° |
| C13 | C12 | C11 | H1 | 178.5° | 180.0° |
| C14 | C13 | C12 | C11 | 3.0° | 0.1° |
| C13 | C14 | N1 | C19 | 15.4° | 174.8° |
| C13 | C14 | N1 | C15 | 176.8° | 180.0° |
| C13 | C14 | N1 | C16 | 162.6° | 5.2° |
| C13 | C14 | C15 | C10 | 0.8° | 0.0° |
| C14 | C13 | C12 | H2 | 177.0° | 180.0° |
| C13 | C14 | C15 | H4 | 179.2° | 179.7° |
| C12 | C11 | C10 | H1 | 180.0° | 180.0° |
| C12 | C11 | C10 | C15 | 0.3° | 0.0° |
| C12 | C11 | C10 | O1 | 179.4° | 179.7° |
| C11 | C12 | C13 | H3 | 177.0° | 180.0° |
| C19 | C18 | C17 | H25 | 119.0° | 118.7° |
| C19 | C18 | C17 | H26 | 118.9° | 118.6° |
| C18 | C19 | N1 | C14 | 178.3° | 179.5° |
| C18 | C19 | N1 | C16 | 0.3° | 0.4° |
| C19 | C18 | C17 | C16 | 13.5° | 24.8° |
| C19 | C18 | C17 | H7 | 133.3° | 93.4° |
| C19 | C18 | C17 | H8 | 106.2° | 142.9° |
| C19 | C18 | H25 | H26 | 123.1° | 122.5° |
| N1 | C19 | C18 | C17 | 8.7° | 16.2° |
| C19 | N1 | C14 | C16 | 178.0° | 180.0° |
| C19 | N1 | C14 | C15 | 167.8° | 5.2° |
| C19 | N1 | C16 | C17 | 8.3° | 17.0° |
| C19 | N1 | C16 | H5 | 126.9° | 101.9° |
| C19 | N1 | C16 | H6 | 110.4° | 136.2° |
| N1 | C19 | C18 | H25 | 110.2° | 134.9° |
| N1 | C19 | C18 | H26 | 127.6° | 102.5° |
| C18 | C17 | C16 | N1 | 13.2° | 25.5° |
| C18 | C17 | C16 | H7 | 119.8° | 118.2° |
| C18 | C17 | C16 | H8 | 119.8° | 118.2° |
| C18 | C17 | C16 | H5 | 131.9° | 93.5° |
| C18 | C17 | C16 | H6 | 105.5° | 144.5° |
| C18 | C17 | H7 | H8 | 120.7° | 123.8° |
| C17 | C18 | H25 | H26 | 123.1° | 122.7° |
| C11 | C10 | C15 | C14 | 0.7° | 0.0° |
| C11 | C10 | C15 | O1 | 179.2° | 179.7° |
| C11 | C10 | O1 | C9 | 9.7° | 0.3° |
| C10 | C11 | C12 | H2 | 178.5° | 180.0° |
| C11 | C10 | C15 | H4 | 179.3° | 179.7° |
| C14 | N1 | C16 | C17 | 169.9° | 162.9° |
| N1 | C14 | C15 | C10 | 177.7° | 180.0° |
| N1 | C14 | C13 | H3 | 0.6° | 0.0° |
| N1 | C14 | C15 | H4 | 2.3° | 0.2° |
| C14 | N1 | C16 | H5 | 51.2° | 78.1° |
| C14 | N1 | C16 | H6 | 71.4° | 43.8° |
| C15 | C14 | N1 | C16 | 14.2° | 174.8° |
| C14 | C15 | C10 | H4 | 180.0° | 179.7° |
| C14 | C15 | C10 | O1 | 179.8° | 179.7° |
| C15 | C14 | C13 | H3 | 177.4° | 180.0° |
| N1 | C16 | C17 | H5 | 118.7° | 119.0° |
| N1 | C16 | C17 | H6 | 118.7° | 119.1° |
| N1 | C16 | H5 | H6 | 123.7° | 122.0° |
| N1 | C16 | C17 | H7 | 133.0° | 92.7° |
| N1 | C16 | C17 | H8 | 106.6° | 143.6° |
| C17 | C16 | H5 | H6 | 123.7° | 122.0° |
| C16 | C17 | H7 | H8 | 120.7° | 123.8° |
| C16 | C17 | C18 | H25 | 105.4° | 143.4° |
| C16 | C17 | C18 | H26 | 132.5° | 93.9° |
| C15 | C10 | O1 | C9 | 171.2° | 180.0° |
| C15 | C10 | C11 | H1 | 179.7° | 180.0° |
| C10 | O1 | C9 | C8 | 87.2° | 180.0° |
| O1 | C10 | C11 | H1 | 0.6° | 0.3° |
| O1 | C10 | C15 | H4 | 0.2° | 0.0° |
| C10 | O1 | C9 | H23 | 152.7° | 60.0° |
| C10 | O1 | C9 | H24 | 32.9° | 60.0° |
| N2 | C8 | C9 | O1 | 113.5° | 83.3° |
| N2 | C8 | C9 | N | 179.9° | 179.1° |
| C8 | N2 | C20 | C21 | 179.1° | 179.3° |
| C8 | N2 | C20 | C25 | 0.9° | 0.5° |
| N2 | C8 | N | C25 | 1.0° | 0.9° |
| N2 | C8 | N | C7 | 178.1° | 179.2° |
| N2 | C8 | C9 | H23 | 126.4° | 36.7° |
| N2 | C8 | C9 | H24 | 6.6° | 156.7° |
| C20 | N2 | C8 | C9 | 179.8° | 180.0° |
| N2 | C20 | C21 | C25 | 178.0° | 179.8° |
| N2 | C20 | C21 | C22 | 179.6° | 179.9° |
| C20 | N2 | C8 | N | 0.1° | 0.9° |
| N2 | C20 | C25 | N | 1.5° | 0.0° |
| N2 | C20 | C25 | C24 | 179.3° | 179.6° |
| N2 | C20 | C21 | H14 | 0.4° | 0.1° |
| O1 | C9 | C8 | H23 | 120.1° | 120.0° |
| O1 | C9 | C8 | H24 | 120.1° | 120.0° |
| O1 | C9 | C8 | N | 66.6° | 95.8° |
| O1 | C9 | H23 | H24 | 119.8° | 120.0° |
| C9 | C8 | N | C25 | 178.9° | 180.0° |
| C9 | C8 | N | C7 | 2.0° | 0.0° |
| C8 | C9 | H23 | H24 | 119.8° | 120.0° |
| C20 | C21 | C22 | H14 | 180.0° | 180.0° |
| C20 | C21 | C22 | C23 | 0.4° | 0.0° |
| C21 | C20 | C25 | N | 179.9° | 179.9° |
| C21 | C20 | C25 | C24 | 2.3° | 0.5° |
| C20 | C21 | C22 | H13 | 179.6° | 179.9° |
| C22 | C21 | C20 | C25 | 2.4° | 0.2° |
| C21 | C22 | C23 | H13 | 180.0° | 180.0° |
| C21 | C22 | C23 | C24 | 1.7° | 0.0° |
| C21 | C22 | C23 | C26 | 178.4° | 179.7° |
| C8 | N | C25 | C20 | 1.5° | 0.5° |
| C8 | N | C25 | C7 | 179.1° | 179.9° |
| C8 | N | C25 | C24 | 178.9° | 180.0° |
| C8 | N | C7 | C6 | 113.2° | 84.0° |
| C8 | N | C7 | H16 | 6.9° | 156.0° |
| C8 | N | C7 | H17 | 126.7° | 35.9° |
| N | C8 | C9 | H23 | 53.5° | 144.3° |
| N | C8 | C9 | H24 | 173.3° | 24.2° |
| C20 | C25 | N | C24 | 177.3° | 179.5° |
| C20 | C25 | N | C7 | 177.6° | 179.6° |
| C20 | C25 | C24 | C23 | 0.2° | 0.5° |
| C25 | C20 | C21 | H14 | 177.6° | 179.8° |
| C20 | C25 | C24 | H15 | 179.8° | 179.4° |
| C22 | C23 | C24 | C25 | 1.8° | 0.3° |
| C22 | C23 | C24 | C26 | 176.5° | 179.7° |
| C22 | C23 | C26 | C27 | 37.3° | 64.7° |
| C22 | C23 | C26 | C30 | 142.1° | 115.1° |
| C23 | C22 | C21 | H14 | 179.6° | 180.0° |
| C22 | C23 | C24 | H15 | 178.2° | 179.6° |
| N | C25 | C24 | C23 | 177.2° | 180.0° |
| C25 | N | C7 | C6 | 65.8° | 96.0° |
| N | C25 | C24 | H15 | 2.8° | 0.1° |
| C25 | N | C7 | H16 | 174.1° | 23.9° |
| C25 | N | C7 | H17 | 54.4° | 144.0° |
| C7 | N | C25 | C24 | 0.3° | 0.0° |
| N | C7 | C6 | C5 | 54.5° | 93.3° |
| N | C7 | C6 | H16 | 120.1° | 120.0° |
| N | C7 | C6 | H17 | 120.1° | 120.0° |
| N | C7 | C6 | C1 | 125.6° | 86.6° |
| N | C7 | H16 | H17 | 119.7° | 120.1° |
| C25 | C24 | C23 | H15 | 180.0° | 179.9° |
| C25 | C24 | C23 | C26 | 178.3° | 180.0° |
| C4 | C5 | C6 | H18 | 180.0° | 179.9° |
| C5 | C4 | C3 | H19 | 180.0° | 179.9° |
| C4 | C5 | C6 | C7 | 179.6° | 180.0° |
| C4 | C5 | C6 | C1 | 0.6° | 0.0° |
| C5 | C4 | C3 | C2 | 0.3° | 0.0° |
| C5 | C4 | C3 | H20 | 179.8° | 180.0° |
| C6 | C5 | C4 | C3 | 0.6° | 0.1° |
| C5 | C6 | C7 | C1 | 179.8° | 180.0° |
| C5 | C6 | C1 | C2 | 2.1° | 0.1° |
| C5 | C6 | C1 | O | 177.1° | 179.7° |
| C5 | C6 | C7 | H16 | 65.6° | 146.6° |
| C5 | C6 | C7 | H17 | 174.7° | 26.7° |
| C6 | C5 | C4 | H19 | 179.4° | 180.0° |
| C4 | C3 | C2 | H20 | 180.0° | 180.0° |
| C4 | C3 | C2 | C1 | 1.3° | 0.0° |
| C3 | C4 | C5 | H18 | 179.4° | 180.0° |
| C4 | C3 | C2 | H21 | 178.7° | 179.7° |
| C24 | C23 | C26 | C27 | 139.3° | 115.0° |
| C24 | C23 | C26 | C30 | 41.3° | 65.3° |
| C24 | C23 | C22 | H13 | 178.3° | 180.0° |
| C23 | C26 | C27 | C30 | 179.4° | 179.8° |
| C23 | C26 | C27 | N3 | 179.2° | 179.9° |
| C23 | C26 | C30 | C29 | 179.9° | 179.8° |
| C23 | C26 | C27 | H9 | 0.8° | 0.0° |
| C23 | C26 | C30 | H11 | 0.1° | 0.3° |
| C26 | C23 | C22 | H13 | 1.6° | 0.4° |
| C26 | C23 | C24 | H15 | 1.7° | 0.0° |
| C7 | C6 | C1 | C2 | 178.0° | 180.0° |
| C7 | C6 | C1 | O | 3.1° | 0.2° |
| C6 | C7 | H16 | H17 | 119.6° | 119.9° |
| C7 | C6 | C5 | H18 | 0.4° | 0.0° |
| C6 | C1 | C2 | C3 | 2.5° | 0.1° |
| C6 | C1 | C2 | O | 174.8° | 179.8° |
| C6 | C1 | O | C | 125.1° | 179.7° |
| C1 | C6 | C7 | H16 | 114.2° | 33.4° |
| C1 | C6 | C7 | H17 | 5.5° | 153.3° |
| C1 | C6 | C5 | H18 | 179.4° | 179.9° |
| C6 | C1 | C2 | H21 | 177.5° | 179.7° |
| C26 | C27 | N3 | H9 | 180.0° | 179.9° |
| C27 | C26 | C30 | C29 | 0.8° | 0.5° |
| C26 | C27 | N3 | C28 | 0.1° | 0.1° |
| C27 | C26 | C30 | H11 | 179.2° | 180.0° |
| C26 | C27 | N3 | H27 | 180.0° | 180.0° |
| C30 | C26 | C27 | N3 | 0.2° | 0.1° |
| C26 | C30 | C29 | H11 | 180.0° | 179.5° |
| C26 | C30 | C29 | C28 | 1.9° | 0.5° |
| C30 | C26 | C27 | H9 | 179.8° | 179.7° |
| C26 | C30 | C29 | H10 | 178.1° | 179.5° |
| C27 | N3 | C28 | H27 | 180.0° | 179.9° |
| C27 | N3 | C28 | C29 | 1.1° | 0.1° |
| C27 | N3 | C28 | O3 | 179.5° | 179.7° |
| C3 | C2 | C1 | H21 | 180.0° | 179.6° |
| C3 | C2 | C1 | O | 177.3° | 179.7° |
| C2 | C3 | C4 | H19 | 179.7° | 180.0° |
| C2 | C1 | O | C | 59.9° | 0.1° |
| C1 | C2 | C3 | H20 | 178.7° | 180.0° |
| C1 | O | C | F1 | 156.5° | 60.0° |
| C1 | O | C | F | 86.6° | 60.0° |
| O | C1 | C2 | H21 | 2.7° | 0.1° |
| C1 | O | C | H22 | 35.2° | 180.0° |
| C30 | C29 | C28 | N3 | 2.1° | 0.2° |
| C30 | C29 | C28 | H10 | 180.0° | 180.0° |
| C30 | C29 | C28 | O3 | 179.5° | 180.0° |
| N3 | C28 | C29 | O3 | 178.4° | 179.8° |
| C28 | N3 | C27 | H9 | 179.9° | 180.0° |
| N3 | C28 | C29 | H10 | 177.9° | 179.7° |
| O | C | F1 | F | 116.5° | 120.1° |
| O | C | F1 | H22 | 120.8° | 120.0° |
| O | C | F | H22 | 121.2° | 120.0° |
| C28 | C29 | C30 | H11 | 178.1° | 180.0° |
| C29 | C28 | N3 | H27 | 178.9° | 180.0° |
| O3 | C28 | C29 | H10 | 0.5° | 0.0° |
| O3 | C28 | N3 | H27 | 0.4° | 0.2° |
| F1 | C | F | H22 | 122.6° | 119.9° |
| H1 | C11 | C12 | H2 | 1.5° | 0.1° |
| H2 | C12 | C13 | H3 | 3.0° | 0.1° |
| H5 | C16 | C17 | H7 | 108.3° | 148.3° |
| H5 | C16 | C17 | H8 | 12.1° | 24.6° |
| H6 | C16 | C17 | H7 | 14.2° | 26.4° |
| H6 | C16 | C17 | H8 | 134.7° | 97.3° |
| H7 | C17 | C18 | H25 | 14.4° | 25.3° |
| H7 | C17 | C18 | H26 | 107.7° | 148.0° |
| H8 | C17 | C18 | H25 | 134.8° | 98.4° |
| H8 | C17 | C18 | H26 | 12.7° | 24.3° |
| H9 | C27 | N3 | H27 | 0.0° | 0.1° |
| H10 | C29 | C30 | H11 | 1.9° | 0.0° |
| H13 | C22 | C21 | H14 | 0.4° | 0.1° |
| H18 | C5 | C4 | H19 | 0.6° | 0.1° |
| H19 | C4 | C3 | H20 | 0.3° | 0.0° |
| H20 | C3 | C2 | H21 | 1.3° | 0.3° |
