A1B0I
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C13 | C14 | sing | 1.53Å | 1.56Å | |
| C13 | O1 | sing | 1.43Å | 1.43Å | |
| C14 | O2 | sing | 1.43Å | 1.41Å | |
| C12 | O1 | sing | 1.43Å | 1.44Å | |
| C12 | C11 | sing | 1.53Å | 1.53Å | |
| O4 | C27 | doub | 1.21Å | 1.31Å | |
| C11 | C10 | sing | 1.53Å | 1.55Å | |
| C10 | C9 | sing | 1.53Å | 1.53Å | |
| O2 | C15 | sing | 1.36Å | 1.39Å | |
| N1 | C15 | doub | 1.31Å | 1.33Å | Aromatic |
| N1 | C16 | sing | 1.34Å | 1.42Å | Aromatic |
| C9 | N | sing | 1.47Å | 1.48Å | |
| N | C8 | sing | 1.47Å | 1.49Å | |
| C17 | C16 | doub | 1.40Å | 1.42Å | Aromatic |
| C17 | C18 | sing | 1.39Å | 1.38Å | Aromatic |
| C15 | C26 | sing | 1.40Å | 1.46Å | Aromatic |
| C27 | C18 | sing | 1.48Å | 1.45Å | |
| C27 | O3 | sing | 1.35Å | 1.23Å | |
| C16 | C21 | sing | 1.42Å | 1.41Å | Aromatic |
| C18 | C19 | doub | 1.41Å | 1.40Å | Aromatic |
| C8 | C3 | sing | 1.51Å | 1.50Å | |
| C2 | C3 | doub | 1.38Å | 1.40Å | Aromatic |
| C2 | C1 | sing | 1.38Å | 1.39Å | Aromatic |
| C | C1 | sing | 1.51Å | 1.46Å | |
| C3 | C4 | sing | 1.38Å | 1.39Å | Aromatic |
| C1 | C6 | doub | 1.39Å | 1.42Å | Aromatic |
| C26 | C25 | sing | 1.50Å | 1.42Å | |
| C26 | C22 | doub | 1.36Å | 1.40Å | Aromatic |
| C4 | C5 | doub | 1.38Å | 1.39Å | Aromatic |
| C21 | C22 | sing | 1.41Å | 1.46Å | Aromatic |
| C21 | C20 | doub | 1.40Å | 1.38Å | Aromatic |
| C19 | C20 | sing | 1.36Å | 1.40Å | Aromatic |
| C6 | C5 | sing | 1.39Å | 1.40Å | Aromatic |
| C6 | O | sing | 1.36Å | 1.40Å | |
| C25 | C24 | sing | 1.50Å | 1.39Å | |
| C22 | C23 | sing | 1.50Å | 1.44Å | |
| O | C7 | sing | 1.43Å | 1.40Å | |
| C24 | N2 | doub | 1.26Å | 1.38Å | |
| C23 | N2 | sing | 1.45Å | 1.38Å | |
| C7 | F | sing | 1.40Å | 1.33Å | |
| C7 | F1 | sing | 1.40Å | 1.34Å | |
| C7 | F2 | sing | 1.40Å | 1.31Å | |
| C19 | H1 | sing | 1.08Å | 1.08Å | |
| C20 | H2 | sing | 1.08Å | 1.08Å | |
| C23 | H3 | sing | 1.09Å | 1.10Å | |
| C23 | H4 | sing | 1.09Å | 1.10Å | |
| C17 | H5 | sing | 1.08Å | 1.08Å | |
| C14 | H6 | sing | 1.09Å | 1.10Å | |
| C14 | H7 | sing | 1.09Å | 1.10Å | |
| C12 | H8 | sing | 1.09Å | 1.10Å | |
| C12 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H10 | sing | 1.09Å | 1.10Å | |
| C9 | H11 | sing | 1.09Å | 1.10Å | |
| O3 | H12 | sing | 0.97Å | 0.95Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H14 | sing | 1.09Å | 1.10Å | |
| C11 | H15 | sing | 1.09Å | 1.10Å | |
| C11 | H16 | sing | 1.09Å | 1.10Å | |
| C10 | H17 | sing | 1.09Å | 1.10Å | |
| C10 | H18 | sing | 1.09Å | 1.10Å | |
| C8 | H19 | sing | 1.09Å | 1.10Å | |
| C8 | H20 | sing | 1.09Å | 1.10Å | |
| C2 | H21 | sing | 1.08Å | 1.08Å | |
| C4 | H22 | sing | 1.08Å | 1.08Å | |
| C5 | H23 | sing | 1.08Å | 1.08Å | |
| C24 | H24 | sing | 1.08Å | 1.08Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C25 | H26 | sing | 1.09Å | 1.10Å | |
| N | H27 | sing | 1.01Å | 1.00Å | |
| C | H29 | sing | 1.09Å | 1.10Å | |
| C | H30 | sing | 1.09Å | 1.10Å | |
| C | H31 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C14 | C13 | O1 | 107.6° | 109.5° |
| C13 | C14 | O2 | 112.6° | 109.5° |
| C13 | C14 | H6 | 108.7° | 109.5° |
| C13 | C14 | H7 | 108.7° | 109.5° |
| C14 | C13 | H13 | 110.0° | 109.5° |
| C14 | C13 | H14 | 109.9° | 109.5° |
| C13 | O1 | C12 | 107.1° | 114.0° |
| O1 | C13 | H13 | 109.9° | 109.5° |
| O1 | C13 | H14 | 109.9° | 109.5° |
| C14 | O2 | C15 | 120.1° | 117.0° |
| O2 | C14 | H6 | 108.7° | 109.5° |
| O2 | C14 | H7 | 108.7° | 109.5° |
| O1 | C12 | C11 | 107.2° | 109.5° |
| O1 | C12 | H8 | 110.0° | 109.5° |
| O1 | C12 | H9 | 110.1° | 109.5° |
| C12 | C11 | C10 | 108.2° | 109.5° |
| C11 | C12 | H8 | 110.0° | 109.5° |
| C11 | C12 | H9 | 110.0° | 109.5° |
| C12 | C11 | H15 | 109.8° | 109.5° |
| C12 | C11 | H16 | 109.8° | 109.5° |
| O4 | C27 | C18 | 116.0° | 120.0° |
| O4 | C27 | O3 | 118.8° | 120.0° |
| C11 | C10 | C9 | 107.8° | 109.5° |
| C10 | C11 | H15 | 109.8° | 109.5° |
| C10 | C11 | H16 | 109.8° | 109.5° |
| C11 | C10 | H17 | 109.9° | 109.5° |
| C11 | C10 | H18 | 109.9° | 109.5° |
| C10 | C9 | N | 111.1° | 109.5° |
| C10 | C9 | H10 | 109.1° | 109.5° |
| C10 | C9 | H11 | 109.1° | 109.5° |
| C9 | C10 | H17 | 109.9° | 109.5° |
| C9 | C10 | H18 | 109.9° | 109.5° |
| O2 | C15 | N1 | 118.4° | 119.2° |
| O2 | C15 | C26 | 114.3° | 119.2° |
| C15 | N1 | C16 | 115.1° | 121.3° |
| N1 | C15 | C26 | 127.4° | 121.7° |
| N1 | C16 | C17 | 115.2° | 120.9° |
| N1 | C16 | C21 | 122.9° | 119.8° |
| C9 | N | C8 | 104.9° | 111.0° |
| N | C9 | H10 | 109.1° | 109.5° |
| N | C9 | H11 | 109.1° | 109.5° |
| C9 | N | H27 | 110.6° | 111.0° |
| N | C8 | C3 | 114.3° | 109.5° |
| N | C8 | H19 | 108.2° | 109.5° |
| N | C8 | H20 | 108.2° | 109.5° |
| C8 | N | H27 | 110.6° | 111.0° |
| C16 | C17 | C18 | 116.5° | 119.5° |
| C17 | C16 | C21 | 122.0° | 119.3° |
| C16 | C17 | H5 | 121.8° | 120.2° |
| C17 | C18 | C27 | 121.0° | 119.7° |
| C17 | C18 | C19 | 122.5° | 120.5° |
| C18 | C17 | H5 | 121.8° | 120.2° |
| C15 | C26 | C25 | 122.7° | 119.4° |
| C15 | C26 | C22 | 116.9° | 119.7° |
| C18 | C27 | O3 | 125.1° | 120.0° |
| C27 | C18 | C19 | 116.2° | 119.7° |
| C27 | O3 | H12 | 109.5° | 117.0° |
| C16 | C21 | C22 | 119.6° | 119.1° |
| C16 | C21 | C20 | 119.8° | 119.9° |
| C18 | C19 | C20 | 119.9° | 120.8° |
| C18 | C19 | H1 | 120.1° | 119.6° |
| C8 | C3 | C2 | 122.0° | 119.9° |
| C8 | C3 | C4 | 117.2° | 119.9° |
| C3 | C8 | H19 | 108.2° | 109.5° |
| C3 | C8 | H20 | 108.3° | 109.5° |
| C3 | C2 | C1 | 119.8° | 120.0° |
| C2 | C3 | C4 | 120.7° | 120.2° |
| C3 | C2 | H21 | 120.1° | 120.0° |
| C2 | C1 | C | 118.6° | 120.0° |
| C2 | C1 | C6 | 118.8° | 119.9° |
| C1 | C2 | H21 | 120.1° | 120.0° |
| C | C1 | C6 | 122.6° | 120.0° |
| C1 | C | H29 | 109.5° | 109.4° |
| C1 | C | H30 | 109.5° | 109.4° |
| C1 | C | H31 | 109.5° | 109.5° |
| C3 | C4 | C5 | 120.8° | 120.0° |
| C3 | C4 | H22 | 119.6° | 120.0° |
| C1 | C6 | C5 | 121.6° | 119.9° |
| C1 | C6 | O | 120.1° | 120.1° |
| C25 | C26 | C22 | 120.5° | 120.9° |
| C26 | C25 | C24 | 116.7° | 111.0° |
| C26 | C25 | H25 | 107.6° | 109.2° |
| C26 | C25 | H26 | 107.6° | 109.2° |
| C26 | C22 | C21 | 118.2° | 118.5° |
| C26 | C22 | C23 | 119.4° | 121.6° |
| C4 | C5 | C6 | 118.3° | 120.0° |
| C5 | C4 | H22 | 119.6° | 120.0° |
| C4 | C5 | H23 | 120.9° | 120.0° |
| C22 | C21 | C20 | 120.5° | 121.0° |
| C21 | C22 | C23 | 122.4° | 119.9° |
| C21 | C20 | C19 | 119.4° | 119.9° |
| C21 | C20 | H2 | 120.3° | 120.1° |
| C20 | C19 | H1 | 120.1° | 119.6° |
| C19 | C20 | H2 | 120.3° | 120.0° |
| C5 | C6 | O | 118.3° | 120.0° |
| C6 | C5 | H23 | 120.9° | 120.0° |
| C6 | O | C7 | 119.4° | 117.0° |
| C25 | C24 | N2 | 124.6° | 123.7° |
| C25 | C24 | H24 | 117.7° | 118.2° |
| C24 | C25 | H25 | 107.7° | 109.3° |
| C24 | C25 | H26 | 107.7° | 109.0° |
| C22 | C23 | N2 | 120.2° | 111.8° |
| C22 | C23 | H3 | 106.7° | 109.0° |
| C22 | C23 | H4 | 106.7° | 109.0° |
| O | C7 | F | 112.7° | 109.5° |
| O | C7 | F1 | 109.3° | 109.5° |
| O | C7 | F2 | 112.2° | 109.5° |
| C24 | N2 | C23 | 118.6° | 124.4° |
| N2 | C24 | H24 | 117.7° | 118.1° |
| N2 | C23 | H3 | 106.7° | 109.0° |
| N2 | C23 | H4 | 106.7° | 109.0° |
| F | C7 | F1 | 107.6° | 109.4° |
| F | C7 | F2 | 106.6° | 109.5° |
| F1 | C7 | F2 | 108.2° | 109.5° |
| H3 | C23 | H4 | 109.4° | 108.9° |
| H6 | C14 | H7 | 109.5° | 109.4° |
| H8 | C12 | H9 | 109.5° | 109.5° |
| H10 | C9 | H11 | 109.5° | 109.4° |
| H13 | C13 | H14 | 109.4° | 109.4° |
| H15 | C11 | H16 | 109.5° | 109.5° |
| H17 | C10 | H18 | 109.5° | 109.5° |
| H19 | C8 | H20 | 109.5° | 109.4° |
| H25 | C25 | H26 | 109.4° | 109.2° |
| H29 | C | H30 | 109.5° | 109.5° |
| H29 | C | H31 | 109.5° | 109.5° |
| H30 | C | H31 | 109.5° | 109.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C14 | C13 | O1 | H13 | 119.8° | 120.0° |
| C14 | C13 | O1 | H14 | 119.7° | 120.0° |
| C13 | C14 | O2 | H6 | 120.5° | 120.0° |
| C13 | C14 | O2 | H7 | 120.5° | 120.0° |
| C14 | C13 | O1 | C12 | 176.1° | 180.0° |
| C13 | C14 | O2 | C15 | 75.9° | 180.0° |
| C13 | C14 | H6 | H7 | 118.6° | 120.0° |
| C14 | C13 | H13 | H14 | 120.9° | 120.0° |
| O1 | C13 | C14 | O2 | 63.8° | 65.0° |
| C13 | O1 | C12 | C11 | 170.2° | 180.0° |
| O1 | C13 | C14 | H6 | 56.7° | 175.0° |
| O1 | C13 | C14 | H7 | 175.7° | 55.0° |
| C13 | O1 | C12 | H8 | 50.6° | 60.0° |
| C13 | O1 | C12 | H9 | 70.1° | 60.0° |
| O1 | C13 | H13 | H14 | 120.8° | 120.0° |
| C14 | O2 | C15 | N1 | 4.5° | 0.2° |
| C14 | O2 | C15 | C26 | 174.8° | 180.0° |
| O2 | C14 | H6 | H7 | 118.6° | 120.0° |
| O2 | C14 | C13 | H13 | 56.0° | 175.0° |
| O2 | C14 | C13 | H14 | 176.5° | 55.0° |
| O1 | C12 | C11 | H8 | 119.6° | 120.0° |
| O1 | C12 | C11 | H9 | 119.6° | 120.0° |
| O1 | C12 | C11 | C10 | 172.8° | 180.0° |
| O1 | C12 | H8 | H9 | 121.1° | 120.0° |
| C12 | O1 | C13 | H13 | 56.4° | 60.0° |
| C12 | O1 | C13 | H14 | 64.2° | 60.0° |
| O1 | C12 | C11 | H15 | 67.4° | 60.0° |
| O1 | C12 | C11 | H16 | 53.0° | 60.0° |
| C12 | C11 | C10 | H15 | 119.8° | 120.0° |
| C12 | C11 | C10 | H16 | 119.8° | 120.0° |
| C12 | C11 | C10 | C9 | 177.4° | 180.0° |
| C11 | C12 | H8 | H9 | 121.1° | 120.0° |
| C12 | C11 | H15 | H16 | 120.6° | 120.0° |
| C12 | C11 | C10 | H17 | 57.6° | 60.0° |
| C12 | C11 | C10 | H18 | 62.9° | 60.0° |
| O4 | C27 | C18 | C17 | 25.0° | 0.1° |
| O4 | C27 | C18 | O3 | 177.5° | 179.9° |
| O4 | C27 | C18 | C19 | 161.5° | 180.0° |
| O4 | C27 | O3 | H12 | 0.0° | 0.1° |
| C11 | C10 | C9 | H17 | 119.8° | 120.0° |
| C11 | C10 | C9 | H18 | 119.7° | 120.0° |
| C11 | C10 | C9 | N | 178.3° | 180.0° |
| C10 | C11 | C12 | H8 | 53.2° | 60.0° |
| C10 | C11 | C12 | H9 | 67.5° | 60.0° |
| C11 | C10 | C9 | H10 | 58.1° | 60.0° |
| C11 | C10 | C9 | H11 | 61.5° | 60.0° |
| C10 | C11 | H15 | H16 | 120.6° | 120.0° |
| C11 | C10 | H17 | H18 | 120.8° | 120.0° |
| C10 | C9 | N | H10 | 120.2° | 120.0° |
| C10 | C9 | N | H11 | 120.2° | 120.0° |
| C10 | C9 | N | C8 | 173.6° | 180.0° |
| C10 | C9 | H10 | H11 | 119.3° | 120.0° |
| C9 | C10 | C11 | H15 | 62.8° | 60.0° |
| C9 | C10 | C11 | H16 | 57.6° | 60.0° |
| C9 | C10 | H17 | H18 | 120.8° | 120.0° |
| C10 | C9 | N | H27 | 54.4° | 56.0° |
| O2 | C15 | N1 | C26 | 179.1° | 179.8° |
| O2 | C15 | N1 | C16 | 178.0° | 179.7° |
| O2 | C15 | C26 | C25 | 2.4° | 0.0° |
| O2 | C15 | C26 | C22 | 178.2° | 179.4° |
| C15 | O2 | C14 | H6 | 163.6° | 60.0° |
| C15 | O2 | C14 | H7 | 44.6° | 60.0° |
| C15 | N1 | C16 | C17 | 179.1° | 179.9° |
| C15 | N1 | C16 | C21 | 1.2° | 0.1° |
| N1 | C15 | C26 | C25 | 178.5° | 179.8° |
| N1 | C15 | C26 | C22 | 1.0° | 0.4° |
| N1 | C16 | C17 | C21 | 179.6° | 180.0° |
| N1 | C16 | C17 | C18 | 179.5° | 180.0° |
| C16 | N1 | C15 | C26 | 1.1° | 0.1° |
| N1 | C16 | C21 | C22 | 1.3° | 0.1° |
| N1 | C16 | C21 | C20 | 178.6° | 179.9° |
| N1 | C16 | C17 | H5 | 0.5° | 0.0° |
| C9 | N | C8 | H27 | 119.2° | 123.9° |
| C9 | N | C8 | C3 | 169.2° | 180.0° |
| N | C9 | H10 | H11 | 119.3° | 120.0° |
| N | C9 | C10 | H17 | 62.0° | 60.0° |
| N | C9 | C10 | H18 | 58.6° | 60.0° |
| C9 | N | C8 | H19 | 70.0° | 60.0° |
| C9 | N | C8 | H20 | 48.5° | 60.0° |
| N | C8 | C3 | H19 | 120.7° | 120.1° |
| N | C8 | C3 | H20 | 120.7° | 120.0° |
| N | C8 | C3 | C2 | 13.5° | 89.7° |
| N | C8 | C3 | C4 | 169.2° | 90.0° |
| C8 | N | C9 | H10 | 66.1° | 60.0° |
| C8 | N | C9 | H11 | 53.4° | 60.0° |
| N | C8 | H19 | H20 | 117.8° | 120.0° |
| C16 | C17 | C18 | H5 | 180.0° | 180.0° |
| C16 | C17 | C18 | C27 | 171.1° | 179.9° |
| C16 | C17 | C18 | C19 | 2.0° | 0.0° |
| C17 | C16 | C21 | C22 | 179.1° | 179.9° |
| C17 | C16 | C21 | C20 | 1.0° | 0.1° |
| C17 | C18 | C27 | C19 | 173.6° | 180.0° |
| C17 | C18 | C27 | O3 | 152.5° | 179.9° |
| C18 | C17 | C16 | C21 | 0.9° | 0.0° |
| C17 | C18 | C19 | C20 | 1.3° | 0.0° |
| C17 | C18 | C19 | H1 | 178.7° | 179.9° |
| C15 | C26 | C25 | C22 | 179.4° | 179.4° |
| C15 | C26 | C22 | C21 | 0.8° | 0.4° |
| C15 | C26 | C25 | C24 | 178.8° | 160.1° |
| C15 | C26 | C22 | C23 | 179.9° | 179.9° |
| C15 | C26 | C25 | H25 | 60.2° | 79.3° |
| C15 | C26 | C25 | H26 | 57.7° | 39.9° |
| C27 | C18 | C19 | C20 | 172.1° | 179.9° |
| C27 | C18 | C19 | H1 | 7.9° | 0.1° |
| C27 | C18 | C17 | H5 | 8.9° | 0.0° |
| C18 | C27 | O3 | H12 | 177.4° | 180.0° |
| O3 | C27 | C18 | C19 | 21.1° | 0.1° |
| C16 | C21 | C22 | C26 | 1.0° | 0.2° |
| C16 | C21 | C22 | C20 | 179.9° | 179.9° |
| C16 | C21 | C20 | C19 | 1.8° | 0.1° |
| C16 | C21 | C22 | C23 | 179.7° | 179.8° |
| C16 | C21 | C20 | H2 | 178.2° | 179.9° |
| C21 | C16 | C17 | H5 | 179.1° | 180.0° |
| C18 | C19 | C20 | C21 | 0.7° | 0.0° |
| C18 | C19 | C20 | H1 | 180.0° | 180.0° |
| C18 | C19 | C20 | H2 | 179.4° | 180.0° |
| C19 | C18 | C17 | H5 | 178.0° | 180.0° |
| C8 | C3 | C2 | C4 | 177.2° | 179.7° |
| C8 | C3 | C2 | C1 | 176.7° | 180.0° |
| C8 | C3 | C4 | C5 | 177.3° | 180.0° |
| C3 | C8 | H19 | H20 | 117.8° | 119.9° |
| C8 | C3 | C2 | H21 | 3.3° | 0.0° |
| C8 | C3 | C4 | H22 | 2.7° | 0.0° |
| C3 | C8 | N | H27 | 50.0° | 56.1° |
| C3 | C2 | C1 | H21 | 180.0° | 180.0° |
| C3 | C2 | C1 | C | 178.8° | 179.7° |
| C3 | C2 | C1 | C6 | 0.3° | 0.1° |
| C2 | C3 | C4 | C5 | 0.1° | 0.3° |
| C2 | C3 | C8 | H19 | 134.3° | 30.3° |
| C2 | C3 | C8 | H20 | 107.2° | 150.2° |
| C2 | C3 | C4 | H22 | 180.0° | 179.7° |
| C2 | C1 | C | C6 | 178.4° | 179.6° |
| C1 | C2 | C3 | C4 | 0.5° | 0.3° |
| C2 | C1 | C6 | C5 | 0.2° | 0.4° |
| C2 | C1 | C6 | O | 178.6° | 180.0° |
| C2 | C1 | C | H29 | 89.3° | 89.7° |
| C2 | C1 | C | H30 | 150.7° | 30.3° |
| C2 | C1 | C | H31 | 30.8° | 150.3° |
| C | C1 | C6 | C5 | 178.2° | 180.0° |
| C | C1 | C6 | O | 0.2° | 0.4° |
| C | C1 | C2 | H21 | 1.2° | 0.3° |
| C1 | C | H29 | H30 | 120.0° | 119.9° |
| C1 | C | H29 | H31 | 120.0° | 120.0° |
| C1 | C | H30 | H31 | 120.0° | 120.0° |
| C3 | C4 | C5 | H22 | 180.0° | 180.0° |
| C3 | C4 | C5 | C6 | 0.5° | 0.0° |
| C4 | C3 | C8 | H19 | 48.5° | 150.0° |
| C4 | C3 | C8 | H20 | 70.1° | 30.1° |
| C4 | C3 | C2 | H21 | 179.5° | 179.7° |
| C3 | C4 | C5 | H23 | 179.5° | 180.0° |
| C1 | C6 | C5 | C4 | 0.7° | 0.3° |
| C1 | C6 | C5 | O | 178.4° | 179.6° |
| C1 | C6 | O | C7 | 95.4° | 179.9° |
| C6 | C1 | C2 | H21 | 179.6° | 180.0° |
| C1 | C6 | C5 | H23 | 179.3° | 179.7° |
| C6 | C1 | C | H29 | 89.1° | 90.0° |
| C6 | C1 | C | H30 | 30.9° | 150.1° |
| C6 | C1 | C | H31 | 150.8° | 30.0° |
| C25 | C26 | C22 | C21 | 178.6° | 179.8° |
| C26 | C25 | C24 | H25 | 121.1° | 120.5° |
| C26 | C25 | C24 | H26 | 121.0° | 120.2° |
| C25 | C26 | C22 | C23 | 0.7° | 0.5° |
| C26 | C25 | C24 | N2 | 1.3° | 20.4° |
| C26 | C25 | C24 | H24 | 178.7° | 159.7° |
| C26 | C25 | H25 | H26 | 116.7° | 119.3° |
| C26 | C22 | C21 | C23 | 179.2° | 179.7° |
| C26 | C22 | C21 | C20 | 178.8° | 179.8° |
| C22 | C26 | C25 | C24 | 0.6° | 19.3° |
| C26 | C22 | C23 | N2 | 1.4° | 20.5° |
| C26 | C22 | C23 | H3 | 122.9° | 100.1° |
| C26 | C22 | C23 | H4 | 120.1° | 141.0° |
| C22 | C26 | C25 | H25 | 120.4° | 101.3° |
| C22 | C26 | C25 | H26 | 121.7° | 139.4° |
| C4 | C5 | C6 | H23 | 180.0° | 180.0° |
| C4 | C5 | C6 | O | 179.0° | 180.0° |
| C22 | C21 | C20 | C19 | 178.4° | 179.9° |
| C21 | C22 | C23 | N2 | 177.8° | 159.9° |
| C22 | C21 | C20 | H2 | 1.6° | 0.1° |
| C21 | C22 | C23 | H3 | 56.3° | 79.5° |
| C21 | C22 | C23 | H4 | 60.7° | 39.3° |
| C21 | C20 | C19 | H2 | 180.0° | 180.0° |
| C20 | C21 | C22 | C23 | 0.4° | 0.1° |
| C21 | C20 | C19 | H1 | 179.3° | 180.0° |
| C5 | C6 | O | C7 | 86.2° | 0.3° |
| C6 | C5 | C4 | H22 | 179.5° | 180.0° |
| C6 | O | C7 | F | 172.0° | 60.0° |
| C6 | O | C7 | F1 | 52.3° | 179.9° |
| C6 | O | C7 | F2 | 67.7° | 60.0° |
| O | C6 | C5 | H23 | 1.0° | 0.0° |
| C25 | C24 | N2 | H24 | 180.0° | 179.9° |
| C25 | C24 | N2 | C23 | 0.6° | 0.1° |
| C24 | C25 | H25 | H26 | 116.7° | 119.1° |
| C22 | C23 | N2 | C24 | 0.8° | 20.7° |
| C22 | C23 | N2 | H3 | 121.5° | 120.6° |
| C22 | C23 | N2 | H4 | 121.5° | 120.6° |
| C22 | C23 | H3 | H4 | 115.2° | 118.8° |
| O | C7 | F | F1 | 120.6° | 120.0° |
| O | C7 | F | F2 | 123.5° | 120.0° |
| O | C7 | F1 | F2 | 122.5° | 120.0° |
| C24 | N2 | C23 | H3 | 122.3° | 99.9° |
| C24 | N2 | C23 | H4 | 120.7° | 141.3° |
| N2 | C24 | C25 | H25 | 119.7° | 100.2° |
| N2 | C24 | C25 | H26 | 122.4° | 140.6° |
| N2 | C23 | H3 | H4 | 115.1° | 118.8° |
| C23 | N2 | C24 | H24 | 179.4° | 179.9° |
| F | C7 | F1 | F2 | 114.8° | 120.0° |
| H1 | C19 | C20 | H2 | 0.6° | 0.0° |
| H6 | C14 | C13 | H13 | 176.4° | 55.0° |
| H6 | C14 | C13 | H14 | 63.0° | 65.0° |
| H7 | C14 | C13 | H13 | 64.5° | 65.0° |
| H7 | C14 | C13 | H14 | 56.0° | 175.0° |
| H8 | C12 | C11 | H15 | 173.0° | 60.0° |
| H8 | C12 | C11 | H16 | 66.6° | NaN° |
| H9 | C12 | C11 | H15 | 52.3° | 180.0° |
| H9 | C12 | C11 | H16 | 172.7° | 60.0° |
| H10 | C9 | C10 | H17 | 177.8° | 60.0° |
| H10 | C9 | C10 | H18 | 61.7° | 180.0° |
| H10 | C9 | N | H27 | 174.6° | 176.1° |
| H11 | C9 | C10 | H17 | 58.3° | NaN° |
| H11 | C9 | C10 | H18 | 178.8° | 60.0° |
| H11 | C9 | N | H27 | 65.9° | 64.0° |
| H15 | C11 | C10 | H17 | 177.4° | 60.0° |
| H15 | C11 | C10 | H18 | 56.9° | NaN° |
| H16 | C11 | C10 | H17 | 62.2° | 180.0° |
| H16 | C11 | C10 | H18 | 177.3° | 60.0° |
| H19 | C8 | N | H27 | 170.7° | 64.0° |
| H20 | C8 | N | H27 | 70.7° | 176.1° |
| H22 | C4 | C5 | H23 | 0.5° | 0.0° |
| H24 | C24 | C25 | H25 | 60.3° | 79.8° |
| H24 | C24 | C25 | H26 | 57.6° | 39.5° |
| H29 | C | H30 | H31 | 120.0° | 120.1° |
