74A
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | N1 | sing | 1.35Å | 1.37Å | |
| C1 | O1 | doub | 1.22Å | 1.22Å | |
| C1 | C15 | sing | 1.48Å | 1.50Å | |
| F1 | C17 | sing | 1.35Å | 1.32Å | |
| N1 | C9 | sing | 1.47Å | 1.46Å | |
| N1 | C22 | sing | 1.47Å | 1.47Å | |
| C2 | C3 | sing | 1.48Å | 1.47Å | |
| C2 | C10 | doub | 1.39Å | 1.46Å | Aromatic |
| C2 | C13 | sing | 1.40Å | 1.43Å | Aromatic |
| F2 | C18 | sing | 1.35Å | 1.37Å | |
| N2 | C4 | sing | 1.35Å | 1.31Å | |
| N2 | C6 | sing | 1.46Å | 1.50Å | |
| O2 | C3 | doub | 1.22Å | 1.25Å | |
| C3 | N4 | sing | 1.35Å | 1.36Å | |
| N3 | C5 | sing | 1.47Å | 1.50Å | |
| N3 | C23 | sing | 1.47Å | 1.49Å | |
| O3 | C4 | doub | 1.22Å | 1.24Å | |
| C4 | C7 | sing | 1.48Å | 1.48Å | |
| N4 | C24 | sing | 1.46Å | 1.46Å | |
| N4 | C25 | sing | 1.46Å | 1.49Å | |
| O4 | C8 | sing | 1.43Å | 1.44Å | |
| C5 | C8 | sing | 1.53Å | 1.55Å | |
| C5 | C9 | sing | 1.53Å | 1.54Å | |
| C6 | C8 | sing | 1.53Å | 1.52Å | |
| C6 | C12 | sing | 1.53Å | 1.55Å | |
| C7 | C10 | sing | 1.39Å | 1.44Å | Aromatic |
| C7 | C14 | doub | 1.40Å | 1.43Å | Aromatic |
| C11 | C12 | sing | 1.51Å | 1.52Å | |
| C11 | C20 | doub | 1.38Å | 1.43Å | Aromatic |
| C11 | C21 | sing | 1.38Å | 1.45Å | Aromatic |
| C13 | C19 | doub | 1.38Å | 1.43Å | Aromatic |
| C14 | C19 | sing | 1.38Å | 1.45Å | Aromatic |
| C15 | C26 | doub | 1.40Å | 1.42Å | Aromatic |
| C15 | C27 | sing | 1.40Å | 1.44Å | Aromatic |
| C16 | C17 | doub | 1.38Å | 1.41Å | Aromatic |
| C16 | C18 | sing | 1.38Å | 1.41Å | Aromatic |
| C17 | C20 | sing | 1.38Å | 1.44Å | Aromatic |
| C18 | C21 | doub | 1.39Å | 1.43Å | Aromatic |
| C19 | C28 | sing | 1.51Å | 1.54Å | |
| C22 | C23 | sing | 1.53Å | 1.57Å | |
| C24 | C29 | sing | 1.53Å | 1.52Å | |
| C25 | C30 | sing | 1.53Å | 1.55Å | |
| C26 | C34 | sing | 1.38Å | 1.44Å | Aromatic |
| C27 | C33 | doub | 1.38Å | 1.43Å | Aromatic |
| C29 | C31 | sing | 1.53Å | 1.51Å | |
| C30 | C32 | sing | 1.53Å | 1.55Å | |
| C33 | C35 | sing | 1.38Å | 1.42Å | Aromatic |
| C34 | C35 | doub | 1.38Å | 1.42Å | Aromatic |
| N2 | HN2 | sing | 0.97Å | 1.00Å | |
| N3 | HN3 | sing | 1.01Å | 1.00Å | |
| O4 | HO4 | sing | 0.97Å | 0.95Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H9A | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C21 | H21 | sing | 1.08Å | 1.08Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H22A | sing | 1.09Å | 1.10Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H23A | sing | 1.09Å | 1.10Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C24 | H24A | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C25 | H25A | sing | 1.09Å | 1.10Å | |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C27 | H27 | sing | 1.08Å | 1.08Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| C28 | H28A | sing | 1.09Å | 1.10Å | |
| C28 | H28B | sing | 1.09Å | 1.10Å | |
| C29 | H29 | sing | 1.09Å | 1.10Å | |
| C29 | H29A | sing | 1.09Å | 1.10Å | |
| C30 | H30 | sing | 1.09Å | 1.10Å | |
| C30 | H30A | sing | 1.09Å | 1.10Å | |
| C31 | H31 | sing | 1.09Å | 1.10Å | |
| C31 | H31A | sing | 1.09Å | 1.10Å | |
| C31 | H31B | sing | 1.09Å | 1.10Å | |
| C32 | H32 | sing | 1.09Å | 1.10Å | |
| C32 | H32A | sing | 1.09Å | 1.10Å | |
| C32 | H32B | sing | 1.09Å | 1.10Å | |
| C33 | H33 | sing | 1.08Å | 1.08Å | |
| C34 | H34 | sing | 1.08Å | 1.08Å | |
| C35 | H35 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N1 | C1 | O1 | 123.2° | 120.0° |
| N1 | C1 | C15 | 122.1° | 120.0° |
| C1 | N1 | C9 | 119.1° | 120.9° |
| C1 | N1 | C22 | 126.9° | 120.8° |
| O1 | C1 | C15 | 114.7° | 120.0° |
| C1 | C15 | C26 | 120.9° | 120.1° |
| C1 | C15 | C27 | 118.5° | 120.1° |
| F1 | C17 | C16 | 121.8° | 120.0° |
| F1 | C17 | C20 | 117.0° | 120.0° |
| C9 | N1 | C22 | 114.0° | 118.3° |
| N1 | C9 | C5 | 116.7° | 108.5° |
| N1 | C9 | H9 | 107.1° | 109.7° |
| N1 | C9 | H9A | 107.2° | 109.7° |
| N1 | C22 | C23 | 111.4° | 108.5° |
| N1 | C22 | H22 | 108.8° | 109.7° |
| N1 | C22 | H22A | 108.8° | 109.6° |
| C3 | C2 | C10 | 118.9° | 120.0° |
| C3 | C2 | C13 | 120.3° | 120.1° |
| C2 | C3 | O2 | 114.8° | 120.0° |
| C2 | C3 | N4 | 122.1° | 120.0° |
| C10 | C2 | C13 | 120.8° | 119.9° |
| C2 | C10 | C7 | 118.9° | 119.6° |
| C2 | C10 | H10 | 120.6° | 120.2° |
| C2 | C13 | C19 | 119.9° | 120.1° |
| C2 | C13 | H13 | 120.0° | 119.9° |
| F2 | C18 | C16 | 120.0° | 120.0° |
| F2 | C18 | C21 | 118.6° | 120.0° |
| C4 | N2 | C6 | 125.9° | 120.0° |
| N2 | C4 | O3 | 123.7° | 119.9° |
| N2 | C4 | C7 | 115.4° | 120.0° |
| C4 | N2 | HN2 | 117.0° | 119.9° |
| N2 | C6 | C8 | 116.7° | 109.5° |
| N2 | C6 | C12 | 109.9° | 109.5° |
| C6 | N2 | HN2 | 117.1° | 120.0° |
| N2 | C6 | H6 | 105.4° | 109.5° |
| O2 | C3 | N4 | 123.0° | 120.0° |
| C3 | N4 | C24 | 118.0° | 120.0° |
| C3 | N4 | C25 | 123.3° | 120.0° |
| C5 | N3 | C23 | 112.3° | 111.1° |
| N3 | C5 | C8 | 109.6° | 109.5° |
| N3 | C5 | C9 | 112.2° | 109.4° |
| C5 | N3 | HN3 | 108.5° | 111.0° |
| N3 | C5 | H5 | 107.1° | 109.5° |
| N3 | C23 | C22 | 109.9° | 109.4° |
| C23 | N3 | HN3 | 108.5° | 111.3° |
| N3 | C23 | H23 | 109.3° | 109.5° |
| N3 | C23 | H23A | 109.3° | 109.5° |
| O3 | C4 | C7 | 120.9° | 120.0° |
| C4 | C7 | C10 | 120.3° | 120.0° |
| C4 | C7 | C14 | 119.8° | 120.1° |
| C24 | N4 | C25 | 118.2° | 120.0° |
| N4 | C24 | C29 | 112.4° | 109.5° |
| N4 | C24 | H24 | 108.5° | 109.5° |
| N4 | C24 | H24A | 108.5° | 109.5° |
| N4 | C25 | C30 | 111.7° | 109.5° |
| N4 | C25 | H25 | 108.8° | 109.5° |
| N4 | C25 | H25A | 108.8° | 109.5° |
| O4 | C8 | C5 | 108.0° | 109.5° |
| O4 | C8 | C6 | 110.1° | 109.4° |
| C8 | O4 | HO4 | 109.5° | 114.1° |
| O4 | C8 | H8 | 112.1° | 109.5° |
| C8 | C5 | C9 | 108.2° | 109.3° |
| C5 | C8 | C6 | 114.9° | 109.5° |
| C8 | C5 | H5 | 111.1° | 109.5° |
| C5 | C8 | H8 | 107.0° | 109.4° |
| C9 | C5 | H5 | 108.6° | 109.7° |
| C5 | C9 | H9 | 107.1° | 109.6° |
| C5 | C9 | H9A | 107.1° | 109.6° |
| C8 | C6 | C12 | 113.4° | 109.5° |
| C8 | C6 | H6 | 101.2° | 109.4° |
| C6 | C8 | H8 | 104.7° | 109.5° |
| C6 | C12 | C11 | 112.1° | 109.5° |
| C12 | C6 | H6 | 109.3° | 109.4° |
| C6 | C12 | H12 | 108.6° | 109.5° |
| C6 | C12 | H12A | 108.6° | 109.5° |
| C10 | C7 | C14 | 119.9° | 119.9° |
| C7 | C10 | H10 | 120.5° | 120.2° |
| C7 | C14 | C19 | 120.9° | 120.1° |
| C7 | C14 | H14 | 119.5° | 120.0° |
| C12 | C11 | C20 | 119.3° | 120.0° |
| C12 | C11 | C21 | 120.1° | 120.0° |
| C11 | C12 | H12 | 108.6° | 109.5° |
| C11 | C12 | H12A | 108.6° | 109.4° |
| C20 | C11 | C21 | 120.6° | 120.0° |
| C11 | C20 | C17 | 118.6° | 120.0° |
| C11 | C20 | H20 | 120.7° | 120.0° |
| C11 | C21 | C18 | 118.4° | 120.0° |
| C11 | C21 | H21 | 120.8° | 120.0° |
| C13 | C19 | C14 | 119.5° | 120.3° |
| C13 | C19 | C28 | 121.2° | 119.9° |
| C19 | C13 | H13 | 120.1° | 119.9° |
| C14 | C19 | C28 | 119.3° | 119.8° |
| C19 | C14 | H14 | 119.5° | 119.9° |
| C26 | C15 | C27 | 120.6° | 119.7° |
| C15 | C26 | C34 | 118.6° | 119.8° |
| C15 | C26 | H26 | 120.7° | 120.1° |
| C15 | C27 | C33 | 119.8° | 119.8° |
| C15 | C27 | H27 | 120.1° | 120.0° |
| C17 | C16 | C18 | 119.8° | 119.9° |
| C16 | C17 | C20 | 121.2° | 120.0° |
| C17 | C16 | H16 | 120.1° | 120.0° |
| C16 | C18 | C21 | 121.4° | 120.0° |
| C18 | C16 | H16 | 120.1° | 120.0° |
| C17 | C20 | H20 | 120.7° | 120.0° |
| C18 | C21 | H21 | 120.8° | 120.0° |
| C19 | C28 | H28 | 109.5° | 109.5° |
| C19 | C28 | H28A | 109.5° | 109.5° |
| C19 | C28 | H28B | 109.5° | 109.5° |
| C23 | C22 | H22 | 108.8° | 109.6° |
| C23 | C22 | H22A | 108.8° | 109.6° |
| C22 | C23 | H23 | 109.3° | 109.3° |
| C22 | C23 | H23A | 109.3° | 109.7° |
| C24 | C29 | C31 | 111.0° | 109.5° |
| C29 | C24 | H24 | 108.5° | 109.5° |
| C29 | C24 | H24A | 108.5° | 109.4° |
| C24 | C29 | H29 | 109.0° | 109.5° |
| C24 | C29 | H29A | 109.0° | 109.5° |
| C25 | C30 | C32 | 111.5° | 109.5° |
| C30 | C25 | H25 | 108.8° | 109.4° |
| C30 | C25 | H25A | 108.7° | 109.5° |
| C25 | C30 | H30 | 108.8° | 109.5° |
| C25 | C30 | H30A | 108.8° | 109.5° |
| C26 | C34 | C35 | 121.0° | 120.2° |
| C34 | C26 | H26 | 120.7° | 120.1° |
| C26 | C34 | H34 | 119.5° | 119.9° |
| C27 | C33 | C35 | 119.5° | 120.2° |
| C33 | C27 | H27 | 120.1° | 120.1° |
| C27 | C33 | H33 | 120.2° | 119.9° |
| C31 | C29 | H29 | 109.0° | 109.4° |
| C31 | C29 | H29A | 109.0° | 109.4° |
| C29 | C31 | H31 | 109.5° | 109.5° |
| C29 | C31 | H31A | 109.5° | 109.5° |
| C29 | C31 | H31B | 109.5° | 109.5° |
| C32 | C30 | H30 | 108.8° | 109.5° |
| C32 | C30 | H30A | 108.8° | 109.5° |
| C30 | C32 | H32 | 109.5° | 109.5° |
| C30 | C32 | H32A | 109.5° | 109.5° |
| C30 | C32 | H32B | 109.5° | 109.5° |
| C33 | C35 | C34 | 120.4° | 120.3° |
| C35 | C33 | H33 | 120.2° | 119.9° |
| C33 | C35 | H35 | 119.8° | 119.9° |
| C35 | C34 | H34 | 119.5° | 120.0° |
| C34 | C35 | H35 | 119.8° | 119.8° |
| H9 | C9 | H9A | 111.7° | 109.7° |
| H12 | C12 | H12A | 110.4° | 109.4° |
| H22 | C22 | H22A | 110.1° | 109.8° |
| H23 | C23 | H23A | 109.6° | 109.5° |
| H24 | C24 | H24A | 110.4° | 109.5° |
| H25 | C25 | H25A | 110.1° | 109.5° |
| H28 | C28 | H28A | 109.4° | 109.5° |
| H28 | C28 | H28B | 109.5° | 109.4° |
| H28A | C28 | H28B | 109.5° | 109.5° |
| H29 | C29 | H29A | 110.0° | 109.5° |
| H30 | C30 | H30A | 110.1° | 109.4° |
| H31 | C31 | H31A | 109.5° | 109.4° |
| H31 | C31 | H31B | 109.4° | 109.5° |
| H31A | C31 | H31B | 109.5° | 109.4° |
| H32 | C32 | H32A | 109.4° | 109.4° |
| H32 | C32 | H32B | 109.5° | 109.5° |
| H32A | C32 | H32B | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N1 | C1 | O1 | C15 | 179.0° | 179.8° |
| C1 | N1 | C9 | C22 | 177.7° | 179.7° |
| C1 | N1 | C9 | C5 | 133.3° | 128.8° |
| N1 | C1 | C15 | C26 | 93.2° | 145.8° |
| N1 | C1 | C15 | C27 | 88.1° | 34.5° |
| C1 | N1 | C22 | C23 | 126.7° | 128.8° |
| C1 | N1 | C9 | H9 | 106.8° | 111.5° |
| C1 | N1 | C9 | H9A | 13.3° | 9.1° |
| C1 | N1 | C22 | H22 | 6.7° | 9.1° |
| C1 | N1 | C22 | H22A | 113.3° | 111.5° |
| O1 | C1 | N1 | C9 | 3.0° | 4.6° |
| O1 | C1 | N1 | C22 | 174.4° | 175.1° |
| O1 | C1 | C15 | C26 | 85.8° | 34.4° |
| O1 | C1 | C15 | C27 | 92.9° | 145.3° |
| C15 | C1 | N1 | C9 | 178.1° | 175.1° |
| C15 | C1 | N1 | C22 | 4.6° | 5.1° |
| C1 | C15 | C26 | C27 | 178.7° | 179.7° |
| C1 | C15 | C26 | C34 | 179.5° | 180.0° |
| C1 | C15 | C27 | C33 | 179.4° | 180.0° |
| C1 | C15 | C26 | H26 | 0.5° | 0.1° |
| C1 | C15 | C27 | H27 | 0.6° | 0.0° |
| F1 | C17 | C20 | C11 | 179.2° | 179.9° |
| F1 | C17 | C16 | C20 | 179.8° | 179.9° |
| F1 | C17 | C16 | C18 | 178.5° | 179.7° |
| F1 | C17 | C16 | H16 | 1.5° | 0.1° |
| F1 | C17 | C20 | H20 | 0.8° | 0.1° |
| N1 | C9 | C5 | N3 | 42.8° | 53.9° |
| N1 | C9 | C5 | C8 | 163.9° | 173.8° |
| N1 | C9 | C5 | H9 | 120.0° | 119.7° |
| N1 | C9 | C5 | H9A | 120.0° | 119.8° |
| C9 | N1 | C22 | C23 | 50.8° | 50.9° |
| N1 | C9 | C5 | H5 | 75.4° | 66.2° |
| N1 | C9 | H9 | H9A | 117.1° | 120.5° |
| C9 | N1 | C22 | H22 | 170.8° | 170.6° |
| C9 | N1 | C22 | H22A | 69.2° | 68.7° |
| N1 | C22 | C23 | N3 | 57.3° | 53.8° |
| C22 | N1 | C9 | C5 | 44.4° | 50.9° |
| N1 | C22 | C23 | H22 | 120.0° | 119.8° |
| N1 | C22 | C23 | H22A | 120.0° | 119.6° |
| C22 | N1 | C9 | H9 | 75.5° | 68.8° |
| C22 | N1 | C9 | H9A | 164.4° | 170.7° |
| N1 | C22 | H22 | H22A | 119.2° | 120.5° |
| N1 | C22 | C23 | H23 | 177.3° | 173.6° |
| N1 | C22 | C23 | H23A | 62.6° | 66.3° |
| C3 | C2 | C10 | C13 | 178.5° | 179.6° |
| C2 | C3 | O2 | N4 | 175.7° | 179.9° |
| C2 | C3 | N4 | C24 | 170.4° | 175.7° |
| C2 | C3 | N4 | C25 | 17.5° | 4.3° |
| C3 | C2 | C10 | C7 | 175.9° | 179.9° |
| C3 | C2 | C13 | C19 | 175.2° | 180.0° |
| C3 | C2 | C10 | H10 | 4.1° | 0.1° |
| C3 | C2 | C13 | H13 | 4.9° | 0.1° |
| C10 | C2 | C3 | O2 | 123.3° | 33.7° |
| C10 | C2 | C3 | N4 | 52.5° | 146.2° |
| C2 | C10 | C7 | C4 | 179.8° | 180.0° |
| C2 | C10 | C7 | H10 | 180.0° | 180.0° |
| C2 | C10 | C7 | C14 | 0.9° | 0.0° |
| C10 | C2 | C13 | C19 | 3.3° | 0.4° |
| C10 | C2 | C13 | H13 | 176.6° | 179.8° |
| C13 | C2 | C3 | O2 | 55.3° | 145.9° |
| C13 | C2 | C3 | N4 | 129.0° | 34.2° |
| C13 | C2 | C10 | C7 | 2.6° | 0.3° |
| C2 | C13 | C19 | H13 | 180.0° | 179.9° |
| C2 | C13 | C19 | C14 | 2.3° | 0.1° |
| C2 | C13 | C19 | C28 | 177.9° | 180.0° |
| C13 | C2 | C10 | H10 | 177.3° | 179.7° |
| F2 | C18 | C21 | C11 | 178.5° | 179.7° |
| F2 | C18 | C16 | C17 | 179.5° | 180.0° |
| F2 | C18 | C16 | C21 | 178.0° | 179.7° |
| F2 | C18 | C16 | H16 | 0.6° | 0.3° |
| F2 | C18 | C21 | H21 | 1.5° | 0.3° |
| C4 | N2 | C6 | HN2 | 180.0° | 179.9° |
| N2 | C4 | O3 | C7 | 179.0° | 179.9° |
| C4 | N2 | C6 | C8 | 99.1° | 154.9° |
| C4 | N2 | C6 | C12 | 130.0° | 85.0° |
| N2 | C4 | C7 | C10 | 29.6° | 180.0° |
| N2 | C4 | C7 | C14 | 151.1° | 0.1° |
| C4 | N2 | C6 | H6 | 12.2° | 35.0° |
| C6 | N2 | C4 | O3 | 1.7° | 0.1° |
| C6 | N2 | C4 | C7 | 177.4° | 180.0° |
| N2 | C6 | C8 | O4 | 179.5° | 65.0° |
| N2 | C6 | C8 | C5 | 58.2° | 175.0° |
| N2 | C6 | C8 | C12 | 129.3° | 120.0° |
| N2 | C6 | C8 | H6 | 113.7° | 120.0° |
| N2 | C6 | C12 | H6 | 115.2° | 120.0° |
| N2 | C6 | C12 | C11 | 42.5° | 65.0° |
| N2 | C6 | C8 | H8 | 58.8° | 55.0° |
| N2 | C6 | C12 | H12 | 77.5° | 55.0° |
| N2 | C6 | C12 | H12A | 162.5° | 175.0° |
| O2 | C3 | N4 | C24 | 5.0° | 4.4° |
| O2 | C3 | N4 | C25 | 167.1° | 175.6° |
| C3 | N4 | C24 | C25 | 172.5° | 180.0° |
| C3 | N4 | C24 | C29 | 117.6° | 90.0° |
| C3 | N4 | C25 | C30 | 109.9° | 104.0° |
| C3 | N4 | C24 | H24 | 122.4° | 150.0° |
| C3 | N4 | C24 | H24A | 2.4° | 30.0° |
| C3 | N4 | C25 | H25 | 130.1° | 136.0° |
| C3 | N4 | C25 | H25A | 10.1° | 16.0° |
| C5 | N3 | C23 | HN3 | 120.0° | 124.2° |
| N3 | C5 | C8 | O4 | 66.5° | 180.0° |
| N3 | C5 | C8 | C9 | 122.7° | 119.8° |
| N3 | C5 | C8 | H5 | 118.2° | 120.0° |
| N3 | C5 | C9 | H5 | 118.2° | 120.1° |
| N3 | C5 | C8 | C6 | 170.1° | 60.0° |
| C5 | N3 | C23 | C22 | 56.9° | 63.3° |
| N3 | C5 | C8 | H8 | 54.4° | 60.1° |
| N3 | C5 | C9 | H9 | 77.2° | 65.8° |
| N3 | C5 | C9 | H9A | 162.8° | 173.7° |
| C5 | N3 | C23 | H23 | 176.9° | 177.0° |
| C5 | N3 | C23 | H23A | 63.1° | 56.9° |
| C23 | N3 | C5 | C8 | 169.6° | 176.9° |
| C23 | N3 | C5 | C9 | 49.3° | 63.3° |
| N3 | C23 | C22 | H23 | 120.0° | 119.8° |
| N3 | C23 | C22 | H23A | 120.0° | 120.1° |
| C23 | N3 | C5 | H5 | 69.7° | 56.9° |
| N3 | C23 | C22 | H22 | 177.3° | 173.6° |
| N3 | C23 | C22 | H22A | 62.7° | 65.8° |
| N3 | C23 | H23 | H23A | 119.8° | 120.1° |
| O3 | C4 | C7 | C10 | 149.5° | 0.1° |
| O3 | C4 | C7 | C14 | 29.8° | 180.0° |
| O3 | C4 | N2 | HN2 | 178.3° | 180.0° |
| C4 | C7 | C10 | C14 | 179.3° | 179.9° |
| C4 | C7 | C14 | C19 | 179.2° | 179.7° |
| C7 | C4 | N2 | HN2 | 2.6° | 0.1° |
| C4 | C7 | C10 | H10 | 0.2° | 0.0° |
| C4 | C7 | C14 | H14 | 0.8° | 0.1° |
| N4 | C24 | C29 | H24 | 120.0° | 120.0° |
| N4 | C24 | C29 | H24A | 120.0° | 120.0° |
| C24 | N4 | C25 | C30 | 62.2° | 76.0° |
| N4 | C24 | C29 | C31 | 59.7° | 180.0° |
| N4 | C24 | H24 | H24A | 118.8° | 120.1° |
| C24 | N4 | C25 | H25 | 57.8° | 44.0° |
| C24 | N4 | C25 | H25A | 177.8° | 164.0° |
| N4 | C24 | C29 | H29 | 60.3° | 60.0° |
| N4 | C24 | C29 | H29A | 179.7° | 60.0° |
| C25 | N4 | C24 | C29 | 69.8° | 90.0° |
| N4 | C25 | C30 | H25 | 120.0° | 120.0° |
| N4 | C25 | C30 | H25A | 120.0° | 120.0° |
| N4 | C25 | C30 | C32 | 54.7° | 174.6° |
| C25 | N4 | C24 | H24 | 50.2° | 30.0° |
| C25 | N4 | C24 | H24A | 170.2° | 150.0° |
| N4 | C25 | H25 | H25A | 119.1° | 120.0° |
| N4 | C25 | C30 | H30 | 65.2° | 54.7° |
| N4 | C25 | C30 | H30A | 174.8° | 65.3° |
| O4 | C8 | C5 | C6 | 123.4° | 120.0° |
| O4 | C8 | C5 | H8 | 120.8° | 120.0° |
| O4 | C8 | C5 | C9 | 56.2° | 60.2° |
| O4 | C8 | C6 | H8 | 120.7° | 120.0° |
| O4 | C8 | C6 | C12 | 50.2° | 55.0° |
| O4 | C8 | C5 | H5 | 175.3° | 59.9° |
| O4 | C8 | C6 | H6 | 66.7° | 175.0° |
| C8 | C5 | C9 | H5 | 120.7° | 120.0° |
| C5 | C8 | C6 | H8 | 117.1° | 120.0° |
| C5 | C8 | C6 | C12 | 172.5° | 65.0° |
| C8 | C5 | N3 | HN3 | 49.6° | 58.7° |
| C5 | C8 | O4 | HO4 | 180.0° | 60.0° |
| C5 | C8 | C6 | H6 | 55.5° | 55.0° |
| C8 | C5 | C9 | H9 | 43.9° | 54.0° |
| C8 | C5 | C9 | H9A | 76.1° | 66.5° |
| C9 | C5 | C8 | C6 | 67.2° | 179.8° |
| C9 | C5 | N3 | HN3 | 70.7° | 61.0° |
| C9 | C5 | C8 | H8 | 177.0° | 59.7° |
| C5 | C9 | H9 | H9A | 117.0° | 120.4° |
| C8 | C6 | C12 | H6 | 112.1° | 119.9° |
| C8 | C6 | C12 | C11 | 175.2° | 175.0° |
| C8 | C6 | N2 | HN2 | 80.9° | 25.0° |
| C6 | C8 | O4 | HO4 | 53.7° | 60.0° |
| C6 | C8 | C5 | H5 | 51.9° | 60.1° |
| C8 | C6 | C12 | H12 | 55.2° | 65.0° |
| C8 | C6 | C12 | H12A | 64.8° | 55.0° |
| C6 | C12 | C11 | H12 | 120.0° | 120.0° |
| C6 | C12 | C11 | H12A | 120.0° | 120.0° |
| C6 | C12 | C11 | C20 | 125.4° | 90.0° |
| C6 | C12 | C11 | C21 | 55.5° | 90.3° |
| C12 | C6 | N2 | HN2 | 50.0° | 95.0° |
| C12 | C6 | C8 | H8 | 70.5° | 175.0° |
| C6 | C12 | H12 | H12A | 118.9° | 120.0° |
| C10 | C7 | C14 | C19 | 0.0° | 0.3° |
| C10 | C7 | C14 | H14 | 180.0° | 180.0° |
| C7 | C14 | C19 | C13 | 0.6° | 0.3° |
| C7 | C14 | C19 | H14 | 180.0° | 179.7° |
| C7 | C14 | C19 | C28 | 179.5° | 179.6° |
| C14 | C7 | C10 | H10 | 179.0° | 179.9° |
| C12 | C11 | C20 | C21 | 179.2° | 179.7° |
| C12 | C11 | C20 | C17 | 179.1° | 180.0° |
| C12 | C11 | C21 | C18 | 179.4° | 180.0° |
| C11 | C12 | C6 | H6 | 72.7° | 55.0° |
| C11 | C12 | H12 | H12A | 118.9° | 119.9° |
| C12 | C11 | C20 | H20 | 0.9° | 0.0° |
| C12 | C11 | C21 | H21 | 0.6° | 0.0° |
| C11 | C20 | C17 | C16 | 1.1° | 0.0° |
| C11 | C20 | C17 | H20 | 180.0° | 180.0° |
| C20 | C11 | C21 | C18 | 0.2° | 0.2° |
| C20 | C11 | C12 | H12 | 5.4° | 30.1° |
| C20 | C11 | C12 | H12A | 114.6° | 150.0° |
| C20 | C11 | C21 | H21 | 179.8° | 179.8° |
| C11 | C21 | C18 | C16 | 0.5° | 0.0° |
| C21 | C11 | C20 | C17 | 0.1° | 0.3° |
| C11 | C21 | C18 | H21 | 180.0° | 180.0° |
| C21 | C11 | C12 | H12 | 175.4° | 149.7° |
| C21 | C11 | C12 | H12A | 64.5° | 29.7° |
| C21 | C11 | C20 | H20 | 179.9° | 179.7° |
| C13 | C19 | C14 | C28 | 179.8° | 179.9° |
| C13 | C19 | C14 | H14 | 179.4° | 179.9° |
| C13 | C19 | C28 | H28 | 89.9° | 90.0° |
| C13 | C19 | C28 | H28A | 150.1° | 150.0° |
| C13 | C19 | C28 | H28B | 30.1° | 29.9° |
| C14 | C19 | C13 | H13 | 177.7° | 179.9° |
| C14 | C19 | C28 | H28 | 89.9° | 90.1° |
| C14 | C19 | C28 | H28A | 30.1° | 30.0° |
| C14 | C19 | C28 | H28B | 150.1° | 150.0° |
| C15 | C26 | C34 | H26 | 180.0° | 179.9° |
| C26 | C15 | C27 | C33 | 0.7° | 0.3° |
| C15 | C26 | C34 | C35 | 0.3° | 0.0° |
| C26 | C15 | C27 | H27 | 179.3° | 179.7° |
| C15 | C26 | C34 | H34 | 179.7° | 180.0° |
| C27 | C15 | C26 | C34 | 0.9° | 0.3° |
| C15 | C27 | C33 | H27 | 180.0° | 180.0° |
| C15 | C27 | C33 | C35 | 0.0° | 0.0° |
| C27 | C15 | C26 | H26 | 179.2° | 179.8° |
| C15 | C27 | C33 | H33 | 179.9° | 180.0° |
| C17 | C16 | C18 | H16 | 180.0° | 179.7° |
| C17 | C16 | C18 | C21 | 1.4° | 0.3° |
| C16 | C17 | C20 | H20 | 178.9° | 180.0° |
| C18 | C16 | C17 | C20 | 1.7° | 0.2° |
| C16 | C18 | C21 | H21 | 179.6° | 180.0° |
| C20 | C17 | C16 | H16 | 178.3° | 180.0° |
| C21 | C18 | C16 | H16 | 178.6° | 180.0° |
| C28 | C19 | C13 | H13 | 2.2° | 0.1° |
| C28 | C19 | C14 | H14 | 0.5° | 0.0° |
| C19 | C28 | H28 | H28A | 120.0° | 120.0° |
| C19 | C28 | H28 | H28B | 120.0° | 120.0° |
| C19 | C28 | H28A | H28B | 120.0° | 120.0° |
| C22 | C23 | N3 | HN3 | 63.1° | 60.9° |
| C23 | C22 | H22 | H22A | 119.2° | 120.5° |
| C22 | C23 | H23 | H23A | 119.8° | 120.2° |
| C24 | C29 | C31 | H29 | 120.0° | 120.0° |
| C24 | C29 | C31 | H29A | 120.0° | 120.0° |
| C29 | C24 | H24 | H24A | 118.8° | 119.9° |
| C24 | C29 | H29 | H29A | 119.4° | 120.0° |
| C24 | C29 | C31 | H31 | 180.0° | 180.0° |
| C24 | C29 | C31 | H31A | 60.0° | 60.0° |
| C24 | C29 | C31 | H31B | 60.0° | 60.0° |
| C25 | C30 | C32 | H30 | 120.0° | 120.0° |
| C25 | C30 | C32 | H30A | 120.0° | 120.0° |
| C30 | C25 | H25 | H25A | 119.1° | 120.0° |
| C25 | C30 | H30 | H30A | 119.2° | 120.0° |
| C25 | C30 | C32 | H32 | 180.0° | 60.0° |
| C25 | C30 | C32 | H32A | 60.0° | 60.0° |
| C25 | C30 | C32 | H32B | 60.0° | 180.0° |
| C26 | C34 | C35 | C33 | 0.3° | 0.2° |
| C26 | C34 | C35 | H34 | 180.0° | 180.0° |
| C26 | C34 | C35 | H35 | 179.7° | 180.0° |
| C27 | C33 | C35 | H33 | 180.0° | 179.9° |
| C27 | C33 | C35 | C34 | 0.5° | 0.2° |
| C27 | C33 | C35 | H35 | 179.5° | 180.0° |
| C31 | C29 | C24 | H24 | 179.7° | 60.0° |
| C31 | C29 | C24 | H24A | 60.3° | 60.0° |
| C31 | C29 | H29 | H29A | 119.4° | 119.9° |
| C29 | C31 | H31 | H31A | 120.0° | 120.0° |
| C29 | C31 | H31 | H31B | 120.0° | 120.1° |
| C29 | C31 | H31A | H31B | 120.0° | 120.0° |
| C32 | C30 | C25 | H25 | 174.8° | 65.4° |
| C32 | C30 | C25 | H25A | 65.3° | 54.6° |
| C32 | C30 | H30 | H30A | 119.2° | 120.0° |
| C30 | C32 | H32 | H32A | 120.0° | 120.0° |
| C30 | C32 | H32 | H32B | 120.0° | 120.1° |
| C30 | C32 | H32A | H32B | 120.0° | 120.1° |
| C33 | C35 | C34 | H35 | 180.0° | 179.8° |
| C35 | C33 | C27 | H27 | 179.9° | 180.0° |
| C33 | C35 | C34 | H34 | 179.7° | 179.8° |
| C35 | C34 | C26 | H26 | 179.7° | 180.0° |
| C34 | C35 | C33 | H33 | 179.6° | 179.7° |
| HN2 | N2 | C6 | H6 | 167.8° | 145.0° |
| HN3 | N3 | C5 | H5 | 170.3° | 178.8° |
| HN3 | N3 | C23 | H23 | 56.9° | 58.8° |
| HN3 | N3 | C23 | H23A | 176.9° | 178.9° |
| HO4 | O4 | C8 | H8 | 62.4° | 180.0° |
| H5 | C5 | C8 | H8 | 63.8° | 179.9° |
| H5 | C5 | C9 | H9 | 164.6° | 174.1° |
| H5 | C5 | C9 | H9A | 44.6° | 53.6° |
| H6 | C6 | C8 | H8 | 172.6° | 65.1° |
| H6 | C6 | C12 | H12 | 167.3° | 175.0° |
| H6 | C6 | C12 | H12A | 47.3° | 65.0° |
| H22 | C22 | C23 | H23 | 62.7° | 66.6° |
| H22 | C22 | C23 | H23A | 57.3° | 53.5° |
| H22A | C22 | C23 | H23 | 57.4° | 54.0° |
| H22A | C22 | C23 | H23A | 177.4° | 174.1° |
| H24 | C24 | C29 | H29 | 59.7° | 180.0° |
| H24 | C24 | C29 | H29A | 60.3° | 60.0° |
| H24A | C24 | C29 | H29 | 179.7° | 60.0° |
| H24A | C24 | C29 | H29A | 59.7° | 179.9° |
| H25 | C25 | C30 | H30 | 54.8° | 174.6° |
| H25 | C25 | C30 | H30A | 65.2° | 54.7° |
| H25A | C25 | C30 | H30 | 174.8° | 65.4° |
| H25A | C25 | C30 | H30A | 54.7° | 174.7° |
| H26 | C26 | C34 | H34 | 0.3° | 0.1° |
| H27 | C27 | C33 | H33 | 0.1° | 0.0° |
| H28 | C28 | H28A | H28B | 120.0° | 119.9° |
| H29 | C29 | C31 | H31 | 60.0° | 60.0° |
| H29 | C29 | C31 | H31A | 180.0° | 180.0° |
| H29 | C29 | C31 | H31B | 60.0° | 60.1° |
| H29A | C29 | C31 | H31 | 60.0° | 59.9° |
| H29A | C29 | C31 | H31A | 60.0° | 60.0° |
| H29A | C29 | C31 | H31B | 180.0° | 180.0° |
| H30 | C30 | C32 | H32 | 60.0° | 180.0° |
| H30 | C30 | C32 | H32A | 180.0° | 60.0° |
| H30 | C30 | C32 | H32B | 60.0° | 60.0° |
| H30A | C30 | C32 | H32 | 60.0° | 60.0° |
| H30A | C30 | C32 | H32A | 60.0° | 180.0° |
| H30A | C30 | C32 | H32B | 180.0° | 60.0° |
| H31 | C31 | H31A | H31B | 120.0° | 120.0° |
| H32 | C32 | H32A | H32B | 120.0° | 119.9° |
| H33 | C33 | C35 | H35 | 0.5° | 0.0° |
| H34 | C34 | C35 | H35 | 0.3° | 0.0° |
