EK6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.53Å | |
| N1 | C4 | sing | 1.47Å | 1.48Å | |
| N1 | C5 | sing | 1.47Å | 1.50Å | |
| C7 | C8 | doub | 1.38Å | 1.41Å | Aromatic |
| C7 | C6 | sing | 1.38Å | 1.41Å | Aromatic |
| C4 | C3 | sing | 1.51Å | 1.53Å | |
| C8 | C9 | sing | 1.39Å | 1.41Å | Aromatic |
| C5 | C6 | sing | 1.51Å | 1.51Å | |
| O1 | C2 | sing | 1.45Å | 1.42Å | |
| O1 | C3 | sing | 1.34Å | 1.37Å | |
| O4 | C18 | sing | 1.43Å | 1.40Å | |
| C6 | C27 | doub | 1.38Å | 1.43Å | Aromatic |
| C3 | O2 | doub | 1.21Å | 1.23Å | |
| C18 | C17 | sing | 1.53Å | 1.56Å | |
| C9 | C10 | sing | 1.48Å | 1.45Å | |
| C9 | C26 | doub | 1.39Å | 1.41Å | Aromatic |
| C11 | C10 | sing | 1.41Å | 1.40Å | Aromatic |
| C11 | N2 | doub | 1.31Å | 1.38Å | Aromatic |
| C10 | C12 | doub | 1.39Å | 1.44Å | Aromatic |
| C27 | C26 | sing | 1.38Å | 1.40Å | Aromatic |
| C27 | CL2 | sing | 1.74Å | 1.74Å | |
| N2 | N3 | sing | 1.40Å | 1.36Å | Aromatic |
| C12 | N3 | sing | 1.36Å | 1.37Å | Aromatic |
| C12 | C13 | sing | 1.48Å | 1.44Å | |
| C25 | C13 | sing | 1.41Å | 1.43Å | Aromatic |
| C25 | C15 | doub | 1.37Å | 1.39Å | Aromatic |
| C17 | N5 | sing | 1.46Å | 1.48Å | |
| C17 | C19 | sing | 1.51Å | 1.52Å | |
| N5 | C16 | sing | 1.35Å | 1.40Å | |
| C13 | C14 | doub | 1.38Å | 1.40Å | Aromatic |
| C15 | C16 | sing | 1.47Å | 1.47Å | |
| C15 | N4 | sing | 1.38Å | 1.39Å | Aromatic |
| C16 | O3 | doub | 1.22Å | 1.23Å | |
| C19 | C24 | doub | 1.38Å | 1.42Å | Aromatic |
| C19 | C20 | sing | 1.38Å | 1.42Å | Aromatic |
| C14 | N4 | sing | 1.35Å | 1.38Å | Aromatic |
| C24 | C23 | sing | 1.38Å | 1.40Å | Aromatic |
| C20 | C21 | doub | 1.38Å | 1.41Å | Aromatic |
| C23 | CL1 | sing | 1.74Å | 1.70Å | |
| C23 | C22 | doub | 1.39Å | 1.41Å | Aromatic |
| C21 | C22 | sing | 1.38Å | 1.42Å | Aromatic |
| C22 | F | sing | 1.35Å | 1.32Å | |
| C5 | H1 | sing | 1.09Å | 1.10Å | |
| C5 | H2 | sing | 1.09Å | 1.10Å | |
| N1 | H3 | sing | 1.01Å | 1.00Å | |
| C4 | H5 | sing | 1.09Å | 1.10Å | |
| C4 | H6 | sing | 1.09Å | 1.10Å | |
| C2 | H7 | sing | 1.09Å | 1.10Å | |
| C2 | H8 | sing | 1.09Å | 1.10Å | |
| C1 | H9 | sing | 1.09Å | 1.10Å | |
| C1 | H10 | sing | 1.09Å | 1.10Å | |
| C1 | H11 | sing | 1.09Å | 1.10Å | |
| C26 | H12 | sing | 1.08Å | 1.08Å | |
| C8 | H13 | sing | 1.08Å | 1.08Å | |
| C7 | H14 | sing | 1.08Å | 1.08Å | |
| N3 | H15 | sing | 0.97Å | 1.00Å | |
| C11 | H16 | sing | 1.08Å | 1.08Å | |
| C25 | H17 | sing | 1.08Å | 1.08Å | |
| N4 | H18 | sing | 0.97Å | 1.00Å | |
| C14 | H19 | sing | 1.08Å | 1.08Å | |
| N5 | H20 | sing | 0.97Å | 1.00Å | |
| C17 | H21 | sing | 1.09Å | 1.10Å | |
| C18 | H22 | sing | 1.09Å | 1.10Å | |
| C18 | H23 | sing | 1.09Å | 1.10Å | |
| O4 | H24 | sing | 0.97Å | 0.95Å | |
| C24 | H25 | sing | 1.08Å | 1.08Å | |
| C21 | H26 | sing | 1.08Å | 1.08Å | |
| C20 | H27 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | C2 | O1 | 104.2° | 109.5° |
| C1 | C2 | H7 | 110.8° | 109.5° |
| C1 | C2 | H8 | 110.8° | 109.4° |
| C2 | C1 | H9 | 109.5° | 109.4° |
| C2 | C1 | H10 | 109.5° | 109.5° |
| C2 | C1 | H11 | 109.5° | 109.5° |
| C4 | N1 | C5 | 115.9° | 111.0° |
| N1 | C4 | C3 | 117.0° | 109.5° |
| C4 | N1 | H3 | 107.9° | 111.0° |
| N1 | C4 | H5 | 107.6° | 109.5° |
| N1 | C4 | H6 | 107.6° | 109.5° |
| N1 | C5 | C6 | 109.6° | 109.5° |
| N1 | C5 | H1 | 109.4° | 109.4° |
| N1 | C5 | H2 | 109.4° | 109.5° |
| C5 | N1 | H3 | 107.8° | 111.0° |
| C8 | C7 | C6 | 120.8° | 120.1° |
| C7 | C8 | C9 | 120.9° | 119.9° |
| C7 | C8 | H13 | 119.6° | 120.1° |
| C8 | C7 | H14 | 119.6° | 119.9° |
| C7 | C6 | C5 | 121.8° | 119.9° |
| C7 | C6 | C27 | 117.2° | 120.2° |
| C6 | C7 | H14 | 119.6° | 120.0° |
| C4 | C3 | O1 | 111.3° | 120.0° |
| C4 | C3 | O2 | 125.8° | 120.0° |
| C3 | C4 | H5 | 107.6° | 109.4° |
| C3 | C4 | H6 | 107.5° | 109.4° |
| C8 | C9 | C10 | 120.2° | 120.2° |
| C8 | C9 | C26 | 119.7° | 119.7° |
| C9 | C8 | H13 | 119.5° | 120.0° |
| C5 | C6 | C27 | 121.0° | 119.9° |
| C6 | C5 | H1 | 109.4° | 109.5° |
| C6 | C5 | H2 | 109.4° | 109.5° |
| C2 | O1 | C3 | 122.3° | 117.0° |
| O1 | C2 | H7 | 110.7° | 109.4° |
| O1 | C2 | H8 | 110.8° | 109.5° |
| O1 | C3 | O2 | 123.0° | 120.0° |
| O4 | C18 | C17 | 107.5° | 109.5° |
| O4 | C18 | H22 | 110.0° | 109.5° |
| O4 | C18 | H23 | 110.0° | 109.5° |
| C18 | O4 | H24 | 109.5° | 114.0° |
| C6 | C27 | C26 | 122.6° | 120.1° |
| C6 | C27 | CL2 | 121.9° | 119.9° |
| C18 | C17 | N5 | 110.9° | 109.4° |
| C18 | C17 | C19 | 107.5° | 109.5° |
| C18 | C17 | H21 | 108.5° | 109.5° |
| C17 | C18 | H22 | 109.9° | 109.5° |
| C17 | C18 | H23 | 109.9° | 109.5° |
| C10 | C9 | C26 | 120.1° | 120.1° |
| C9 | C10 | C11 | 123.3° | 126.4° |
| C9 | C10 | C12 | 131.2° | 126.4° |
| C9 | C26 | C27 | 118.8° | 119.9° |
| C9 | C26 | H12 | 120.6° | 120.0° |
| C10 | C11 | N2 | 106.5° | 108.5° |
| C11 | C10 | C12 | 105.4° | 107.3° |
| C10 | C11 | H16 | 126.7° | 125.7° |
| C11 | N2 | N3 | 112.5° | 109.1° |
| N2 | C11 | H16 | 126.8° | 125.7° |
| C10 | C12 | N3 | 109.3° | 107.0° |
| C10 | C12 | C13 | 131.5° | 126.5° |
| C26 | C27 | CL2 | 115.5° | 120.0° |
| C27 | C26 | H12 | 120.6° | 120.1° |
| N2 | N3 | C12 | 106.2° | 108.1° |
| N2 | N3 | H15 | 126.9° | 126.0° |
| N3 | C12 | C13 | 119.2° | 126.5° |
| C12 | N3 | H15 | 126.9° | 125.9° |
| C12 | C13 | C25 | 127.5° | 126.4° |
| C12 | C13 | C14 | 124.8° | 126.4° |
| C13 | C25 | C15 | 106.8° | 107.1° |
| C25 | C13 | C14 | 107.6° | 107.2° |
| C13 | C25 | H17 | 126.6° | 126.5° |
| C25 | C15 | C16 | 127.9° | 125.9° |
| C25 | C15 | N4 | 108.3° | 108.2° |
| C15 | C25 | H17 | 126.6° | 126.4° |
| N5 | C17 | C19 | 111.4° | 109.5° |
| C17 | N5 | C16 | 123.3° | 120.0° |
| C17 | N5 | H20 | 118.3° | 120.0° |
| N5 | C17 | H21 | 109.5° | 109.5° |
| C17 | C19 | C24 | 120.3° | 120.0° |
| C17 | C19 | C20 | 119.8° | 120.0° |
| C19 | C17 | H21 | 109.0° | 109.5° |
| N5 | C16 | C15 | 116.1° | 120.0° |
| N5 | C16 | O3 | 122.9° | 120.0° |
| C16 | N5 | H20 | 118.3° | 120.0° |
| C13 | C14 | N4 | 108.2° | 108.4° |
| C13 | C14 | H19 | 125.9° | 125.8° |
| C16 | C15 | N4 | 123.6° | 125.9° |
| C15 | C16 | O3 | 121.0° | 120.0° |
| C15 | N4 | C14 | 109.0° | 109.1° |
| C15 | N4 | H18 | 125.5° | 125.5° |
| C24 | C19 | C20 | 119.9° | 120.0° |
| C19 | C24 | C23 | 119.1° | 120.0° |
| C19 | C24 | H25 | 120.4° | 120.0° |
| C19 | C20 | C21 | 120.8° | 120.1° |
| C19 | C20 | H27 | 119.6° | 120.0° |
| C14 | N4 | H18 | 125.5° | 125.4° |
| N4 | C14 | H19 | 125.9° | 125.8° |
| C24 | C23 | CL1 | 118.9° | 120.0° |
| C24 | C23 | C22 | 121.1° | 120.0° |
| C23 | C24 | H25 | 120.4° | 120.0° |
| C20 | C21 | C22 | 118.9° | 119.9° |
| C20 | C21 | H26 | 120.5° | 120.0° |
| C21 | C20 | H27 | 119.6° | 120.0° |
| CL1 | C23 | C22 | 119.9° | 120.0° |
| C23 | C22 | C21 | 120.1° | 120.0° |
| C23 | C22 | F | 120.2° | 120.0° |
| C21 | C22 | F | 119.7° | 120.0° |
| C22 | C21 | H26 | 120.6° | 120.1° |
| H1 | C5 | H2 | 109.5° | 109.5° |
| H5 | C4 | H6 | 109.5° | 109.4° |
| H7 | C2 | H8 | 109.5° | 109.5° |
| H9 | C1 | H10 | 109.5° | 109.4° |
| H9 | C1 | H11 | 109.5° | 109.5° |
| H10 | C1 | H11 | 109.5° | 109.5° |
| H22 | C18 | H23 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | C2 | O1 | H7 | 119.1° | 120.1° |
| C1 | C2 | O1 | H8 | 119.2° | 120.0° |
| C1 | C2 | O1 | C3 | 132.3° | 180.0° |
| C1 | C2 | H7 | H8 | 122.5° | 120.0° |
| C2 | C1 | H9 | H10 | 120.0° | 120.0° |
| C2 | C1 | H9 | H11 | 120.0° | 120.0° |
| C2 | C1 | H10 | H11 | 120.0° | 120.0° |
| C4 | N1 | C5 | H3 | 121.0° | 123.9° |
| N1 | C4 | C3 | H5 | 121.1° | 120.0° |
| N1 | C4 | C3 | H6 | 121.1° | 120.1° |
| C4 | N1 | C5 | C6 | 80.6° | 180.0° |
| N1 | C4 | C3 | O1 | 15.3° | 180.0° |
| N1 | C4 | C3 | O2 | 165.2° | 0.0° |
| C4 | N1 | C5 | H1 | 159.3° | 60.0° |
| C4 | N1 | C5 | H2 | 39.4° | 60.0° |
| N1 | C4 | H5 | H6 | 116.6° | 120.1° |
| N1 | C5 | C6 | C7 | 77.0° | 100.0° |
| C5 | N1 | C4 | C3 | 77.9° | 180.0° |
| N1 | C5 | C6 | H1 | 120.0° | 120.0° |
| N1 | C5 | C6 | H2 | 120.0° | 120.0° |
| N1 | C5 | C6 | C27 | 101.9° | 80.0° |
| N1 | C5 | H1 | H2 | 119.9° | 120.0° |
| C5 | N1 | C4 | H5 | 161.0° | 60.0° |
| C5 | N1 | C4 | H6 | 43.2° | 60.0° |
| C8 | C7 | C6 | H14 | 180.0° | 179.2° |
| C7 | C8 | C9 | H13 | 180.0° | 179.5° |
| C8 | C7 | C6 | C5 | 178.1° | 179.5° |
| C8 | C7 | C6 | C27 | 0.8° | 0.5° |
| C7 | C8 | C9 | C10 | 178.7° | 179.4° |
| C7 | C8 | C9 | C26 | 0.2° | 0.5° |
| C6 | C7 | C8 | C9 | 1.0° | 0.8° |
| C7 | C6 | C5 | C27 | 178.8° | 180.0° |
| C7 | C6 | C27 | C26 | 0.3° | 0.0° |
| C7 | C6 | C27 | CL2 | 178.3° | 179.7° |
| C7 | C6 | C5 | H1 | 43.1° | 20.0° |
| C7 | C6 | C5 | H2 | 163.0° | 140.0° |
| C6 | C7 | C8 | H13 | 179.0° | 179.8° |
| C4 | C3 | O1 | C2 | 179.7° | 180.0° |
| C4 | C3 | O1 | O2 | 179.5° | 179.9° |
| C3 | C4 | N1 | H3 | 161.2° | 56.1° |
| C3 | C4 | H5 | H6 | 116.6° | 119.9° |
| C8 | C9 | C10 | C26 | 178.9° | 179.9° |
| C8 | C9 | C10 | C11 | 46.2° | 124.4° |
| C8 | C9 | C10 | C12 | 133.7° | 55.8° |
| C8 | C9 | C26 | C27 | 0.9° | 0.0° |
| C8 | C9 | C26 | H12 | 179.1° | 179.9° |
| C9 | C8 | C7 | H14 | 179.0° | 180.0° |
| C5 | C6 | C27 | C26 | 179.2° | 180.0° |
| C5 | C6 | C27 | CL2 | 0.6° | 0.3° |
| C6 | C5 | H1 | H2 | 119.9° | 120.0° |
| C6 | C5 | N1 | H3 | 40.3° | 56.1° |
| C5 | C6 | C7 | H14 | 1.9° | 0.3° |
| C2 | O1 | C3 | O2 | 0.2° | 0.1° |
| O1 | C2 | H7 | H8 | 122.4° | 120.0° |
| O1 | C2 | C1 | H9 | 180.0° | 60.0° |
| O1 | C2 | C1 | H10 | 60.0° | 180.0° |
| O1 | C2 | C1 | H11 | 60.0° | 59.9° |
| O1 | C3 | C4 | H5 | 105.8° | 60.0° |
| O1 | C3 | C4 | H6 | 136.4° | 60.0° |
| C3 | O1 | C2 | H7 | 108.5° | 59.9° |
| C3 | O1 | C2 | H8 | 13.1° | 60.0° |
| O4 | C18 | C17 | H22 | 119.7° | 120.0° |
| O4 | C18 | C17 | H23 | 119.7° | 120.0° |
| O4 | C18 | C17 | N5 | 50.5° | 65.0° |
| O4 | C18 | C17 | C19 | 172.5° | 55.0° |
| O4 | C18 | C17 | H21 | 69.8° | 175.0° |
| O4 | C18 | H22 | H23 | 120.9° | 120.0° |
| C6 | C27 | C26 | C9 | 1.1° | 0.3° |
| C6 | C27 | C26 | CL2 | 178.7° | 179.7° |
| C27 | C6 | C5 | H1 | 138.1° | 160.0° |
| C27 | C6 | C5 | H2 | 18.1° | 40.0° |
| C6 | C27 | C26 | H12 | 178.9° | 179.7° |
| C27 | C6 | C7 | H14 | 179.2° | 179.8° |
| O2 | C3 | C4 | H5 | 73.7° | 120.0° |
| O2 | C3 | C4 | H6 | 44.1° | 120.1° |
| C18 | C17 | N5 | C19 | 119.7° | 120.0° |
| C18 | C17 | N5 | H21 | 119.6° | 120.0° |
| C18 | C17 | C19 | H21 | 117.4° | 120.0° |
| C18 | C17 | N5 | C16 | 158.9° | 85.0° |
| C18 | C17 | C19 | C24 | 84.4° | 100.0° |
| C18 | C17 | C19 | C20 | 97.3° | 80.3° |
| C18 | C17 | N5 | H20 | 21.1° | 95.0° |
| C17 | C18 | H22 | H23 | 120.8° | 120.0° |
| C17 | C18 | O4 | H24 | 180.0° | 180.0° |
| C9 | C10 | C11 | C12 | 179.9° | 179.8° |
| C9 | C10 | C11 | N2 | 179.6° | 179.9° |
| C10 | C9 | C26 | C27 | 179.8° | 180.0° |
| C9 | C10 | C12 | N3 | 179.4° | 180.0° |
| C9 | C10 | C12 | C13 | 3.7° | 0.0° |
| C10 | C9 | C26 | H12 | 0.2° | 0.0° |
| C10 | C9 | C8 | H13 | 1.3° | 0.0° |
| C9 | C10 | C11 | H16 | 0.4° | 0.0° |
| C26 | C9 | C10 | C11 | 132.6° | 55.7° |
| C26 | C9 | C10 | C12 | 47.5° | 124.1° |
| C9 | C26 | C27 | H12 | 180.0° | 180.0° |
| C9 | C26 | C27 | CL2 | 177.6° | 180.0° |
| C26 | C9 | C8 | H13 | 179.9° | 180.0° |
| C10 | C11 | N2 | H16 | 180.0° | 179.9° |
| C10 | C11 | N2 | N3 | 0.1° | 0.3° |
| C11 | C10 | C12 | N3 | 0.5° | 0.2° |
| C11 | C10 | C12 | C13 | 176.3° | 179.8° |
| N2 | C11 | C10 | C12 | 0.4° | 0.3° |
| C11 | N2 | N3 | C12 | 0.2° | 0.2° |
| C11 | N2 | N3 | H15 | 179.8° | 179.8° |
| C10 | C12 | N3 | N2 | 0.4° | 0.0° |
| C10 | C12 | N3 | C13 | 177.3° | 180.0° |
| C10 | C12 | C13 | C25 | 32.6° | 133.4° |
| C10 | C12 | C13 | C14 | 145.2° | 46.3° |
| C10 | C12 | N3 | H15 | 179.6° | 180.0° |
| C12 | C10 | C11 | H16 | 179.7° | 179.8° |
| CL2 | C27 | C26 | H12 | 2.4° | 0.0° |
| N2 | N3 | C12 | H15 | 180.0° | 180.0° |
| N2 | N3 | C12 | C13 | 176.9° | 180.0° |
| N3 | N2 | C11 | H16 | 179.9° | 179.8° |
| N3 | C12 | C13 | C25 | 150.8° | 46.7° |
| N3 | C12 | C13 | C14 | 31.4° | 133.7° |
| C12 | C13 | C25 | C14 | 178.1° | 179.7° |
| C12 | C13 | C25 | C15 | 177.3° | 179.9° |
| C12 | C13 | C14 | N4 | 177.9° | 179.8° |
| C13 | C12 | N3 | H15 | 3.1° | 0.0° |
| C12 | C13 | C25 | H17 | 2.7° | 0.0° |
| C12 | C13 | C14 | H19 | 2.1° | 0.1° |
| C13 | C25 | C15 | H17 | 180.0° | 179.9° |
| C13 | C25 | C15 | C16 | 174.9° | 180.0° |
| C13 | C25 | C15 | N4 | 1.1° | 0.1° |
| C25 | C13 | C14 | N4 | 0.2° | 0.5° |
| C25 | C13 | C14 | H19 | 179.8° | 179.8° |
| C25 | C15 | C16 | N5 | 12.9° | 179.9° |
| C15 | C25 | C13 | C14 | 0.8° | 0.2° |
| C25 | C15 | C16 | N4 | 175.4° | 179.9° |
| C25 | C15 | C16 | O3 | 168.0° | 0.0° |
| C25 | C15 | N4 | C14 | 1.0° | 0.4° |
| C25 | C15 | N4 | H18 | 179.0° | 180.0° |
| N5 | C17 | C19 | H21 | 121.0° | 120.0° |
| C17 | N5 | C16 | H20 | 180.0° | 180.0° |
| C17 | N5 | C16 | C15 | 179.3° | 180.0° |
| C17 | N5 | C16 | O3 | 0.2° | 0.1° |
| N5 | C17 | C19 | C24 | 37.3° | 140.0° |
| N5 | C17 | C19 | C20 | 141.0° | 39.7° |
| N5 | C17 | C18 | H22 | 69.2° | 55.0° |
| N5 | C17 | C18 | H23 | 170.2° | 175.0° |
| C19 | C17 | N5 | C16 | 81.5° | 155.0° |
| C17 | C19 | C24 | C20 | 178.3° | 179.8° |
| C17 | C19 | C24 | C23 | 177.7° | 180.0° |
| C17 | C19 | C20 | C21 | 178.1° | 179.7° |
| C19 | C17 | N5 | H20 | 98.6° | 25.0° |
| C19 | C17 | C18 | H22 | 52.8° | 175.0° |
| C19 | C17 | C18 | H23 | 67.8° | 65.0° |
| C17 | C19 | C24 | H25 | 2.3° | 0.0° |
| C17 | C19 | C20 | H27 | 1.9° | 0.0° |
| N5 | C16 | C15 | O3 | 179.1° | 179.9° |
| N5 | C16 | C15 | N4 | 162.5° | 0.0° |
| C16 | N5 | C17 | H21 | 39.2° | 34.9° |
| C13 | C14 | N4 | C15 | 0.4° | 0.5° |
| C13 | C14 | N4 | H19 | 180.0° | 179.8° |
| C14 | C13 | C25 | H17 | 179.2° | 179.7° |
| C13 | C14 | N4 | H18 | 179.6° | 179.9° |
| C16 | C15 | N4 | C14 | 175.2° | 179.7° |
| C16 | C15 | C25 | H17 | 5.1° | 0.1° |
| C16 | C15 | N4 | H18 | 4.8° | 0.1° |
| C15 | C16 | N5 | H20 | 0.8° | 0.0° |
| N4 | C15 | C16 | O3 | 16.6° | 179.9° |
| C15 | N4 | C14 | H18 | 180.0° | 179.6° |
| N4 | C15 | C25 | H17 | 178.9° | 180.0° |
| C15 | N4 | C14 | H19 | 179.5° | 179.7° |
| O3 | C16 | N5 | H20 | 179.8° | 179.9° |
| C19 | C24 | C23 | H25 | 180.0° | 180.0° |
| C24 | C19 | C20 | C21 | 0.2° | 0.5° |
| C19 | C24 | C23 | CL1 | 178.6° | 180.0° |
| C19 | C24 | C23 | C22 | 0.6° | 0.0° |
| C24 | C19 | C17 | H21 | 158.3° | 20.0° |
| C24 | C19 | C20 | H27 | 179.7° | 179.7° |
| C20 | C19 | C24 | C23 | 0.6° | 0.3° |
| C19 | C20 | C21 | H27 | 180.0° | 179.7° |
| C19 | C20 | C21 | C22 | 0.2° | 0.5° |
| C20 | C19 | C17 | H21 | 20.0° | 159.8° |
| C20 | C19 | C24 | H25 | 179.4° | 179.7° |
| C19 | C20 | C21 | H26 | 179.8° | 179.8° |
| C24 | C23 | CL1 | C22 | 179.1° | 179.9° |
| C24 | C23 | C22 | C21 | 0.1° | 0.0° |
| C24 | C23 | C22 | F | 179.4° | 180.0° |
| C20 | C21 | C22 | C23 | 0.3° | 0.3° |
| C20 | C21 | C22 | H26 | 180.0° | 179.7° |
| C20 | C21 | C22 | F | 179.0° | 179.7° |
| CL1 | C23 | C22 | C21 | 179.0° | 180.0° |
| CL1 | C23 | C22 | F | 0.3° | 0.0° |
| CL1 | C23 | C24 | H25 | 1.5° | 0.0° |
| C23 | C22 | C21 | F | 179.2° | 180.0° |
| C22 | C23 | C24 | H25 | 179.4° | 180.0° |
| C23 | C22 | C21 | H26 | 179.7° | 180.0° |
| C22 | C21 | C20 | H27 | 179.8° | 179.7° |
| F | C22 | C21 | H26 | 1.0° | 0.0° |
| H1 | C5 | N1 | H3 | 79.7° | 63.9° |
| H2 | C5 | N1 | H3 | 160.4° | 176.1° |
| H3 | N1 | C4 | H5 | 40.1° | 63.9° |
| H3 | N1 | C4 | H6 | 77.7° | 176.1° |
| H7 | C2 | C1 | H9 | 60.9° | 60.0° |
| H7 | C2 | C1 | H10 | 59.2° | 60.0° |
| H7 | C2 | C1 | H11 | 179.1° | 180.0° |
| H8 | C2 | C1 | H9 | 60.9° | 180.0° |
| H8 | C2 | C1 | H10 | 179.1° | 60.1° |
| H8 | C2 | C1 | H11 | 59.1° | 60.0° |
| H9 | C1 | H10 | H11 | 120.0° | 120.0° |
| H13 | C8 | C7 | H14 | 1.0° | 0.5° |
| H18 | N4 | C14 | H19 | 0.5° | 0.1° |
| H20 | N5 | C17 | H21 | 140.8° | 145.1° |
| H21 | C17 | C18 | H22 | 170.5° | 65.0° |
| H21 | C17 | C18 | H23 | 49.9° | 55.0° |
| H22 | C18 | O4 | H24 | 60.3° | 60.0° |
| H23 | C18 | O4 | H24 | 60.3° | 60.0° |
| H26 | C21 | C20 | H27 | 0.2° | 0.0° |
