4DV
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C20 | C19 | doub | 1.38Å | 1.40Å | Aromatic |
| C20 | C21 | sing | 1.38Å | 1.41Å | Aromatic |
| C19 | C18 | sing | 1.38Å | 1.39Å | Aromatic |
| C22 | C21 | sing | 1.51Å | 1.51Å | |
| C21 | C16 | doub | 1.39Å | 1.42Å | Aromatic |
| C18 | C17 | doub | 1.38Å | 1.40Å | Aromatic |
| C16 | C17 | sing | 1.39Å | 1.41Å | Aromatic |
| C16 | C13 | sing | 1.48Å | 1.47Å | |
| C13 | C14 | doub | 1.39Å | 1.40Å | Aromatic |
| C13 | C12 | sing | 1.40Å | 1.40Å | Aromatic |
| F1 | C12 | sing | 1.35Å | 1.34Å | |
| C14 | C15 | sing | 1.38Å | 1.40Å | Aromatic |
| C12 | C11 | doub | 1.38Å | 1.40Å | Aromatic |
| C15 | C10 | doub | 1.39Å | 1.40Å | Aromatic |
| C11 | C10 | sing | 1.39Å | 1.40Å | Aromatic |
| C10 | C6 | sing | 1.48Å | 1.47Å | |
| C6 | C5 | doub | 1.39Å | 1.41Å | Aromatic |
| C6 | C7 | sing | 1.40Å | 1.41Å | Aromatic |
| C5 | C4 | sing | 1.39Å | 1.41Å | Aromatic |
| C3 | C2 | sing | 1.51Å | 1.50Å | |
| C7 | C8 | doub | 1.36Å | 1.40Å | Aromatic |
| C4 | C2 | sing | 1.47Å | 1.42Å | Aromatic |
| C4 | C9 | doub | 1.41Å | 1.39Å | Aromatic |
| C2 | C1 | doub | 1.34Å | 1.39Å | Aromatic |
| C8 | C9 | sing | 1.39Å | 1.41Å | Aromatic |
| C9 | N1 | sing | 1.38Å | 1.39Å | Aromatic |
| C25 | C24 | sing | 1.53Å | 1.55Å | |
| C1 | N1 | sing | 1.37Å | 1.40Å | Aromatic |
| C1 | C23 | sing | 1.51Å | 1.51Å | |
| N1 | C28 | sing | 1.46Å | 1.47Å | |
| C23 | C24 | sing | 1.53Å | 1.55Å | |
| C24 | C26 | sing | 1.53Å | 1.54Å | |
| C24 | C27 | sing | 1.51Å | 1.53Å | |
| C28 | C29 | sing | 1.51Å | 1.51Å | |
| C27 | O1 | doub | 1.21Å | 1.22Å | |
| C27 | O2 | sing | 1.34Å | 1.35Å | |
| C30 | C29 | doub | 1.38Å | 1.41Å | Aromatic |
| C30 | C31 | sing | 1.38Å | 1.40Å | Aromatic |
| C29 | C34 | sing | 1.38Å | 1.41Å | Aromatic |
| C31 | C32 | doub | 1.38Å | 1.39Å | Aromatic |
| C34 | C33 | doub | 1.38Å | 1.40Å | Aromatic |
| C32 | C33 | sing | 1.38Å | 1.40Å | Aromatic |
| C32 | CL1 | sing | 1.74Å | 1.71Å | |
| C7 | H1 | sing | 1.08Å | 1.08Å | |
| O2 | H2 | sing | 0.97Å | 0.95Å | |
| C5 | H3 | sing | 1.08Å | 1.08Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C3 | H6 | sing | 1.09Å | 1.10Å | |
| C31 | H7 | sing | 1.08Å | 1.08Å | |
| C30 | H8 | sing | 1.08Å | 1.08Å | |
| C33 | H9 | sing | 1.08Å | 1.08Å | |
| C34 | H10 | sing | 1.08Å | 1.08Å | |
| C28 | H11 | sing | 1.09Å | 1.10Å | |
| C28 | H12 | sing | 1.09Å | 1.10Å | |
| C23 | H13 | sing | 1.09Å | 1.10Å | |
| C23 | H14 | sing | 1.09Å | 1.10Å | |
| C26 | H15 | sing | 1.09Å | 1.10Å | |
| C26 | H16 | sing | 1.09Å | 1.10Å | |
| C26 | H17 | sing | 1.09Å | 1.10Å | |
| C25 | H18 | sing | 1.09Å | 1.10Å | |
| C25 | H19 | sing | 1.09Å | 1.10Å | |
| C25 | H20 | sing | 1.09Å | 1.10Å | |
| C8 | H21 | sing | 1.08Å | 1.08Å | |
| C15 | H22 | sing | 1.08Å | 1.08Å | |
| C14 | H23 | sing | 1.08Å | 1.08Å | |
| C11 | H24 | sing | 1.08Å | 1.08Å | |
| C22 | H25 | sing | 1.09Å | 1.10Å | |
| C22 | H26 | sing | 1.09Å | 1.10Å | |
| C22 | H27 | sing | 1.09Å | 1.10Å | |
| C20 | H28 | sing | 1.08Å | 1.08Å | |
| C19 | H29 | sing | 1.08Å | 1.08Å | |
| C18 | H30 | sing | 1.08Å | 1.08Å | |
| C17 | H31 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C19 | C20 | C21 | 121.6° | 120.1° |
| C20 | C19 | C18 | 119.7° | 120.3° |
| C19 | C20 | H28 | 119.2° | 119.9° |
| C20 | C19 | H29 | 120.2° | 119.9° |
| C20 | C21 | C22 | 117.6° | 120.0° |
| C20 | C21 | C16 | 118.9° | 119.9° |
| C21 | C20 | H28 | 119.2° | 120.0° |
| C19 | C18 | C17 | 119.6° | 120.1° |
| C18 | C19 | H29 | 120.1° | 119.8° |
| C19 | C18 | H30 | 120.2° | 120.0° |
| C22 | C21 | C16 | 123.5° | 120.1° |
| C21 | C22 | H25 | 109.5° | 109.5° |
| C21 | C22 | H26 | 109.4° | 109.5° |
| C21 | C22 | H27 | 109.5° | 109.5° |
| C21 | C16 | C17 | 118.4° | 119.8° |
| C21 | C16 | C13 | 123.8° | 120.1° |
| C18 | C17 | C16 | 121.8° | 119.9° |
| C17 | C18 | H30 | 120.2° | 119.9° |
| C18 | C17 | H31 | 119.1° | 120.1° |
| C17 | C16 | C13 | 117.8° | 120.1° |
| C16 | C17 | H31 | 119.1° | 120.1° |
| C16 | C13 | C14 | 118.7° | 120.0° |
| C16 | C13 | C12 | 123.5° | 120.0° |
| C14 | C13 | C12 | 117.8° | 120.0° |
| C13 | C14 | C15 | 120.8° | 120.0° |
| C13 | C14 | H23 | 119.6° | 120.0° |
| C13 | C12 | F1 | 120.6° | 120.0° |
| C13 | C12 | C11 | 121.6° | 120.0° |
| F1 | C12 | C11 | 117.7° | 120.0° |
| C14 | C15 | C10 | 121.6° | 120.1° |
| C14 | C15 | H22 | 119.2° | 120.0° |
| C15 | C14 | H23 | 119.6° | 120.0° |
| C12 | C11 | C10 | 120.5° | 120.0° |
| C12 | C11 | H24 | 119.7° | 120.0° |
| C15 | C10 | C11 | 117.6° | 120.0° |
| C15 | C10 | C6 | 119.2° | 120.0° |
| C10 | C15 | H22 | 119.2° | 120.0° |
| C11 | C10 | C6 | 123.1° | 120.0° |
| C10 | C11 | H24 | 119.7° | 120.0° |
| C10 | C6 | C5 | 120.5° | 119.9° |
| C10 | C6 | C7 | 121.6° | 120.0° |
| C5 | C6 | C7 | 117.9° | 120.1° |
| C6 | C5 | C4 | 121.3° | 119.4° |
| C6 | C5 | H3 | 119.3° | 120.2° |
| C6 | C7 | C8 | 122.0° | 120.7° |
| C6 | C7 | H1 | 119.0° | 119.7° |
| C5 | C4 | C2 | 132.8° | 134.0° |
| C5 | C4 | C9 | 118.8° | 120.0° |
| C4 | C5 | H3 | 119.4° | 120.3° |
| C3 | C2 | C4 | 124.4° | 126.5° |
| C3 | C2 | C1 | 128.4° | 126.6° |
| C2 | C3 | H4 | 109.5° | 109.5° |
| C2 | C3 | H5 | 109.4° | 109.4° |
| C2 | C3 | H6 | 109.4° | 109.5° |
| C7 | C8 | C9 | 118.4° | 120.2° |
| C8 | C7 | H1 | 119.0° | 119.6° |
| C7 | C8 | H21 | 120.8° | 119.9° |
| C2 | C4 | C9 | 108.3° | 106.0° |
| C4 | C2 | C1 | 107.2° | 107.0° |
| C4 | C9 | C8 | 121.5° | 119.6° |
| C4 | C9 | N1 | 107.1° | 107.1° |
| C2 | C1 | N1 | 107.7° | 110.0° |
| C2 | C1 | C23 | 128.4° | 125.0° |
| C8 | C9 | N1 | 131.4° | 133.3° |
| C9 | C8 | H21 | 120.8° | 119.9° |
| C9 | N1 | C1 | 109.7° | 109.9° |
| C9 | N1 | C28 | 121.7° | 125.0° |
| C25 | C24 | C23 | 107.8° | 109.5° |
| C25 | C24 | C26 | 106.1° | 109.5° |
| C25 | C24 | C27 | 106.9° | 109.5° |
| C24 | C25 | H18 | 109.5° | 109.5° |
| C24 | C25 | H19 | 109.5° | 109.5° |
| C24 | C25 | H20 | 109.5° | 109.5° |
| N1 | C1 | C23 | 124.0° | 125.0° |
| C1 | N1 | C28 | 125.2° | 125.1° |
| C1 | C23 | C24 | 117.9° | 109.5° |
| C1 | C23 | H13 | 107.3° | 109.5° |
| C1 | C23 | H14 | 107.3° | 109.5° |
| N1 | C28 | C29 | 113.7° | 109.5° |
| N1 | C28 | H11 | 108.4° | 109.4° |
| N1 | C28 | H12 | 108.4° | 109.4° |
| C23 | C24 | C26 | 114.8° | 109.5° |
| C23 | C24 | C27 | 110.8° | 109.5° |
| C24 | C23 | H13 | 107.3° | 109.5° |
| C24 | C23 | H14 | 107.3° | 109.5° |
| C26 | C24 | C27 | 110.1° | 109.5° |
| C24 | C26 | H15 | 109.5° | 109.5° |
| C24 | C26 | H16 | 109.5° | 109.5° |
| C24 | C26 | H17 | 109.5° | 109.4° |
| C24 | C27 | O1 | 124.2° | 120.0° |
| C24 | C27 | O2 | 115.8° | 120.0° |
| C28 | C29 | C30 | 121.4° | 120.0° |
| C28 | C29 | C34 | 119.5° | 120.0° |
| C29 | C28 | H11 | 108.4° | 109.5° |
| C29 | C28 | H12 | 108.4° | 109.5° |
| O1 | C27 | O2 | 120.0° | 120.0° |
| C27 | O2 | H2 | 109.5° | 117.0° |
| C29 | C30 | C31 | 120.6° | 120.0° |
| C30 | C29 | C34 | 119.0° | 120.1° |
| C29 | C30 | H8 | 119.7° | 120.0° |
| C30 | C31 | C32 | 119.3° | 120.0° |
| C30 | C31 | H7 | 120.3° | 120.0° |
| C31 | C30 | H8 | 119.7° | 120.0° |
| C29 | C34 | C33 | 120.4° | 120.0° |
| C29 | C34 | H10 | 119.8° | 120.0° |
| C31 | C32 | C33 | 121.1° | 120.0° |
| C31 | C32 | CL1 | 119.1° | 120.0° |
| C32 | C31 | H7 | 120.3° | 120.0° |
| C34 | C33 | C32 | 119.4° | 120.0° |
| C34 | C33 | H9 | 120.3° | 120.0° |
| C33 | C34 | H10 | 119.8° | 120.0° |
| C33 | C32 | CL1 | 119.7° | 120.0° |
| C32 | C33 | H9 | 120.3° | 120.0° |
| H4 | C3 | H5 | 109.4° | 109.4° |
| H4 | C3 | H6 | 109.5° | 109.5° |
| H5 | C3 | H6 | 109.5° | 109.5° |
| H11 | C28 | H12 | 109.5° | 109.5° |
| H13 | C23 | H14 | 109.5° | 109.5° |
| H15 | C26 | H16 | 109.5° | 109.5° |
| H15 | C26 | H17 | 109.4° | 109.5° |
| H16 | C26 | H17 | 109.5° | 109.4° |
| H18 | C25 | H19 | 109.5° | 109.5° |
| H18 | C25 | H20 | 109.5° | 109.5° |
| H19 | C25 | H20 | 109.5° | 109.4° |
| H25 | C22 | H26 | 109.5° | 109.5° |
| H25 | C22 | H27 | 109.4° | 109.5° |
| H26 | C22 | H27 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C19 | C20 | C21 | H28 | 180.0° | 179.9° |
| C20 | C19 | C18 | H29 | 180.0° | 179.9° |
| C19 | C20 | C21 | C22 | 180.0° | 179.9° |
| C19 | C20 | C21 | C16 | 0.3° | 0.1° |
| C20 | C19 | C18 | C17 | 0.1° | 0.1° |
| C20 | C19 | C18 | H30 | 179.9° | 179.9° |
| C21 | C20 | C19 | C18 | 0.1° | 0.1° |
| C20 | C21 | C22 | C16 | 179.6° | 180.0° |
| C20 | C21 | C16 | C17 | 0.7° | 0.1° |
| C20 | C21 | C16 | C13 | 179.6° | 179.8° |
| C20 | C21 | C22 | H25 | 89.8° | 90.0° |
| C20 | C21 | C22 | H26 | 150.2° | 30.0° |
| C20 | C21 | C22 | H27 | 30.1° | 150.0° |
| C21 | C20 | C19 | H29 | 179.9° | 180.0° |
| C19 | C18 | C17 | H30 | 180.0° | 180.0° |
| C19 | C18 | C17 | C16 | 0.2° | 0.1° |
| C18 | C19 | C20 | H28 | 179.9° | 180.0° |
| C19 | C18 | C17 | H31 | 179.8° | 179.7° |
| C22 | C21 | C16 | C17 | 179.7° | 179.9° |
| C22 | C21 | C16 | C13 | 0.8° | 0.3° |
| C21 | C22 | H25 | H26 | 120.0° | 120.0° |
| C21 | C22 | H25 | H27 | 120.0° | 120.0° |
| C21 | C22 | H26 | H27 | 120.0° | 120.0° |
| C22 | C21 | C20 | H28 | 0.1° | 0.0° |
| C21 | C16 | C17 | C18 | 0.7° | 0.1° |
| C21 | C16 | C17 | C13 | 179.0° | 179.7° |
| C21 | C16 | C13 | C14 | 99.7° | 114.7° |
| C21 | C16 | C13 | C12 | 80.5° | 65.3° |
| C16 | C21 | C22 | H25 | 89.8° | 90.0° |
| C16 | C21 | C22 | H26 | 30.2° | 150.0° |
| C16 | C21 | C22 | H27 | 150.2° | 30.0° |
| C16 | C21 | C20 | H28 | 179.7° | 180.0° |
| C21 | C16 | C17 | H31 | 179.4° | 179.8° |
| C18 | C17 | C16 | H31 | 180.0° | 179.8° |
| C18 | C17 | C16 | C13 | 179.6° | 179.8° |
| C17 | C18 | C19 | H29 | 179.9° | 180.0° |
| C17 | C16 | C13 | C14 | 79.2° | 65.0° |
| C17 | C16 | C13 | C12 | 100.6° | 115.0° |
| C16 | C17 | C18 | H30 | 179.7° | 179.9° |
| C16 | C13 | C14 | C12 | 179.7° | 180.0° |
| C16 | C13 | C12 | F1 | 0.4° | 0.0° |
| C16 | C13 | C14 | C15 | 179.8° | 180.0° |
| C16 | C13 | C12 | C11 | 179.8° | 179.8° |
| C16 | C13 | C14 | H23 | 0.2° | 0.0° |
| C13 | C16 | C17 | H31 | 0.4° | 0.1° |
| C14 | C13 | C12 | F1 | 179.9° | 180.0° |
| C13 | C14 | C15 | H23 | 180.0° | 180.0° |
| C14 | C13 | C12 | C11 | 0.1° | 0.2° |
| C13 | C14 | C15 | C10 | 0.2° | 0.0° |
| C13 | C14 | C15 | H22 | 179.9° | 180.0° |
| C13 | C12 | F1 | C11 | 179.8° | 179.8° |
| C12 | C13 | C14 | C15 | 0.1° | 0.1° |
| C13 | C12 | C11 | C10 | 0.1° | 0.5° |
| C12 | C13 | C14 | H23 | 179.9° | 180.0° |
| C13 | C12 | C11 | H24 | 179.9° | 180.0° |
| F1 | C12 | C11 | C10 | 179.7° | 179.7° |
| F1 | C12 | C11 | H24 | 0.3° | 0.2° |
| C14 | C15 | C10 | H22 | 180.0° | 180.0° |
| C14 | C15 | C10 | C11 | 0.4° | 0.2° |
| C14 | C15 | C10 | C6 | 179.5° | 180.0° |
| C12 | C11 | C10 | C15 | 0.3° | 0.5° |
| C12 | C11 | C10 | H24 | 180.0° | 179.5° |
| C12 | C11 | C10 | C6 | 179.4° | 179.7° |
| C15 | C10 | C11 | C6 | 179.1° | 179.8° |
| C15 | C10 | C6 | C5 | 38.1° | 180.0° |
| C15 | C10 | C6 | C7 | 140.0° | 0.1° |
| C10 | C15 | C14 | H23 | 179.8° | 180.0° |
| C15 | C10 | C11 | H24 | 179.7° | 180.0° |
| C11 | C10 | C6 | C5 | 142.8° | 0.2° |
| C11 | C10 | C6 | C7 | 39.0° | 179.7° |
| C11 | C10 | C15 | H22 | 179.7° | 179.7° |
| C10 | C6 | C5 | C7 | 178.2° | 179.9° |
| C10 | C6 | C5 | C4 | 179.1° | 180.0° |
| C10 | C6 | C7 | C8 | 179.2° | 180.0° |
| C10 | C6 | C7 | H1 | 0.8° | 0.2° |
| C10 | C6 | C5 | H3 | 0.9° | 0.1° |
| C6 | C10 | C15 | H22 | 0.6° | 0.0° |
| C6 | C10 | C11 | H24 | 0.6° | 0.2° |
| C6 | C5 | C4 | H3 | 180.0° | 179.9° |
| C5 | C6 | C7 | C8 | 0.9° | 0.1° |
| C6 | C5 | C4 | C2 | 179.6° | 179.9° |
| C6 | C5 | C4 | C9 | 0.3° | 0.0° |
| C5 | C6 | C7 | H1 | 179.1° | 179.7° |
| C7 | C6 | C5 | C4 | 0.8° | 0.1° |
| C6 | C7 | C8 | H1 | 180.0° | 179.8° |
| C6 | C7 | C8 | C9 | 0.5° | 0.1° |
| C7 | C6 | C5 | H3 | 179.2° | 180.0° |
| C6 | C7 | C8 | H21 | 179.5° | 179.8° |
| C5 | C4 | C2 | C3 | 0.0° | 0.0° |
| C5 | C4 | C2 | C9 | 179.9° | 180.0° |
| C5 | C4 | C2 | C1 | 179.9° | 180.0° |
| C5 | C4 | C9 | C8 | 0.1° | 0.0° |
| C5 | C4 | C9 | N1 | 179.9° | 180.0° |
| C3 | C2 | C4 | C1 | 179.9° | 180.0° |
| C3 | C2 | C4 | C9 | 180.0° | 180.0° |
| C3 | C2 | C1 | N1 | 179.9° | 180.0° |
| C3 | C2 | C1 | C23 | 0.1° | 0.0° |
| C2 | C3 | H4 | H5 | 120.0° | 119.9° |
| C2 | C3 | H4 | H6 | 120.0° | 120.1° |
| C2 | C3 | H5 | H6 | 120.0° | 120.0° |
| C7 | C8 | C9 | C4 | 0.0° | 0.0° |
| C7 | C8 | C9 | H21 | 180.0° | 179.7° |
| C7 | C8 | C9 | N1 | 179.8° | 180.0° |
| C2 | C4 | C9 | C8 | 179.9° | 180.0° |
| C2 | C4 | C9 | N1 | 0.1° | 0.0° |
| C4 | C2 | C1 | N1 | 0.2° | 0.1° |
| C4 | C2 | C1 | C23 | 179.9° | 180.0° |
| C2 | C4 | C5 | H3 | 0.4° | 0.0° |
| C4 | C2 | C3 | H4 | 90.0° | 90.0° |
| C4 | C2 | C3 | H5 | 150.0° | 150.1° |
| C4 | C2 | C3 | H6 | 30.0° | 30.1° |
| C9 | C4 | C2 | C1 | 0.0° | 0.0° |
| C4 | C9 | C8 | N1 | 179.8° | 179.9° |
| C4 | C9 | N1 | C1 | 0.2° | 0.0° |
| C4 | C9 | N1 | C28 | 159.9° | 180.0° |
| C9 | C4 | C5 | H3 | 179.7° | 180.0° |
| C4 | C9 | C8 | H21 | 179.9° | 179.8° |
| C2 | C1 | N1 | C9 | 0.3° | 0.1° |
| C2 | C1 | N1 | C23 | 179.8° | 180.0° |
| C2 | C1 | N1 | C28 | 159.0° | 180.0° |
| C2 | C1 | C23 | C24 | 93.3° | 90.0° |
| C1 | C2 | C3 | H4 | 89.9° | 90.0° |
| C1 | C2 | C3 | H5 | 30.1° | 30.0° |
| C1 | C2 | C3 | H6 | 150.0° | 150.0° |
| C2 | C1 | C23 | H13 | 145.5° | 30.0° |
| C2 | C1 | C23 | H14 | 27.9° | 150.0° |
| C8 | C9 | N1 | C1 | 180.0° | 180.0° |
| C8 | C9 | N1 | C28 | 19.9° | 0.1° |
| C9 | C8 | C7 | H1 | 179.5° | 179.7° |
| C9 | N1 | C1 | C28 | 159.2° | 179.9° |
| C9 | N1 | C1 | C23 | 180.0° | 180.0° |
| C9 | N1 | C28 | C29 | 74.1° | 89.9° |
| C9 | N1 | C28 | H11 | 165.2° | 30.0° |
| C9 | N1 | C28 | H12 | 46.5° | 150.1° |
| N1 | C9 | C8 | H21 | 0.2° | 0.3° |
| C25 | C24 | C23 | C1 | 68.4° | 60.0° |
| C25 | C24 | C23 | C26 | 117.9° | 120.0° |
| C25 | C24 | C23 | C27 | 116.6° | 120.0° |
| C25 | C24 | C26 | C27 | 115.3° | 120.0° |
| C25 | C24 | C27 | O1 | 41.2° | 120.0° |
| C25 | C24 | C27 | O2 | 139.5° | 59.9° |
| C25 | C24 | C23 | H13 | 170.4° | 60.0° |
| C25 | C24 | C23 | H14 | 52.8° | 180.0° |
| C25 | C24 | C26 | H15 | 180.0° | 60.0° |
| C25 | C24 | C26 | H16 | 60.0° | 60.0° |
| C25 | C24 | C26 | H17 | 60.0° | 180.0° |
| C24 | C25 | H18 | H19 | 120.0° | 120.0° |
| C24 | C25 | H18 | H20 | 120.0° | 120.0° |
| C24 | C25 | H19 | H20 | 120.0° | 120.0° |
| N1 | C1 | C23 | C24 | 87.0° | 90.0° |
| C1 | N1 | C28 | C29 | 82.8° | 90.0° |
| C1 | N1 | C28 | H11 | 37.9° | 150.1° |
| C1 | N1 | C28 | H12 | 156.6° | 30.0° |
| N1 | C1 | C23 | H13 | 34.2° | 150.0° |
| N1 | C1 | C23 | H14 | 151.8° | 30.0° |
| C23 | C1 | N1 | C28 | 20.8° | 0.1° |
| C1 | C23 | C24 | H13 | 121.2° | 120.0° |
| C1 | C23 | C24 | H14 | 121.2° | 120.1° |
| C1 | C23 | C24 | C26 | 49.5° | 60.0° |
| C1 | C23 | C24 | C27 | 175.0° | 180.0° |
| C1 | C23 | H13 | H14 | 116.2° | 120.0° |
| N1 | C28 | C29 | H11 | 120.6° | 120.0° |
| N1 | C28 | C29 | H12 | 120.6° | 120.0° |
| N1 | C28 | C29 | C30 | 90.0° | 90.0° |
| N1 | C28 | C29 | C34 | 90.0° | 90.3° |
| N1 | C28 | H11 | H12 | 118.1° | 120.0° |
| C23 | C24 | C26 | C27 | 125.8° | 120.0° |
| C23 | C24 | C27 | O1 | 158.4° | 0.0° |
| C23 | C24 | C27 | O2 | 22.3° | 180.0° |
| C24 | C23 | H13 | H14 | 116.2° | 120.0° |
| C23 | C24 | C26 | H15 | 61.1° | 60.0° |
| C23 | C24 | C26 | H16 | 178.9° | 180.0° |
| C23 | C24 | C26 | H17 | 58.9° | 60.0° |
| C23 | C24 | C25 | H18 | 180.0° | 60.0° |
| C23 | C24 | C25 | H19 | 60.0° | 179.9° |
| C23 | C24 | C25 | H20 | 60.0° | 60.0° |
| C26 | C24 | C27 | O1 | 73.6° | 120.0° |
| C26 | C24 | C27 | O2 | 105.7° | 60.0° |
| C26 | C24 | C23 | H13 | 71.7° | 180.0° |
| C26 | C24 | C23 | H14 | 170.7° | 60.0° |
| C24 | C26 | H15 | H16 | 120.0° | 120.0° |
| C24 | C26 | H15 | H17 | 120.0° | 120.0° |
| C24 | C26 | H16 | H17 | 120.0° | 120.0° |
| C26 | C24 | C25 | H18 | 56.6° | 180.0° |
| C26 | C24 | C25 | H19 | 176.6° | 59.9° |
| C26 | C24 | C25 | H20 | 63.4° | 60.0° |
| C24 | C27 | O1 | O2 | 179.3° | 179.9° |
| C24 | C27 | O2 | H2 | 179.3° | 180.0° |
| C27 | C24 | C23 | H13 | 53.8° | 60.0° |
| C27 | C24 | C23 | H14 | 63.8° | 59.9° |
| C27 | C24 | C26 | H15 | 64.7° | 180.0° |
| C27 | C24 | C26 | H16 | 55.3° | 60.0° |
| C27 | C24 | C26 | H17 | 175.3° | 60.0° |
| C27 | C24 | C25 | H18 | 60.8° | 60.0° |
| C27 | C24 | C25 | H19 | 59.2° | 60.0° |
| C27 | C24 | C25 | H20 | 179.2° | 180.0° |
| C28 | C29 | C30 | C34 | 180.0° | 179.7° |
| C28 | C29 | C30 | C31 | 179.7° | 180.0° |
| C28 | C29 | C34 | C33 | 179.9° | 179.7° |
| C28 | C29 | C30 | H8 | 0.3° | 0.1° |
| C28 | C29 | C34 | H10 | 0.2° | 0.3° |
| C29 | C28 | H11 | H12 | 118.0° | 120.0° |
| O1 | C27 | O2 | H2 | 0.0° | 0.0° |
| C29 | C30 | C31 | H8 | 180.0° | 179.9° |
| C29 | C30 | C31 | C32 | 0.5° | 0.1° |
| C30 | C29 | C34 | C33 | 0.2° | 0.6° |
| C29 | C30 | C31 | H7 | 179.5° | 179.9° |
| C30 | C29 | C34 | H10 | 179.8° | 180.0° |
| C30 | C29 | C28 | H11 | 149.4° | 29.9° |
| C30 | C29 | C28 | H12 | 30.7° | 150.0° |
| C31 | C30 | C29 | C34 | 0.3° | 0.3° |
| C30 | C31 | C32 | H7 | 180.0° | 179.9° |
| C30 | C31 | C32 | C33 | 0.5° | 0.1° |
| C30 | C31 | C32 | CL1 | 180.0° | 179.8° |
| C29 | C34 | C33 | H10 | 180.0° | 179.4° |
| C29 | C34 | C33 | C32 | 0.1° | 0.6° |
| C34 | C29 | C30 | H8 | 179.7° | 179.7° |
| C29 | C34 | C33 | H9 | 179.9° | 179.5° |
| C34 | C29 | C28 | H11 | 30.6° | 149.7° |
| C34 | C29 | C28 | H12 | 149.4° | 29.7° |
| C31 | C32 | C33 | C34 | 0.3° | 0.4° |
| C31 | C32 | C33 | CL1 | 179.6° | 179.7° |
| C32 | C31 | C30 | H8 | 179.5° | 180.0° |
| C31 | C32 | C33 | H9 | 179.7° | 179.7° |
| C34 | C33 | C32 | H9 | 180.0° | 179.9° |
| C34 | C33 | C32 | CL1 | 179.9° | 180.0° |
| C33 | C32 | C31 | H7 | 179.5° | 180.0° |
| C32 | C33 | C34 | H10 | 179.9° | 180.0° |
| CL1 | C32 | C31 | H7 | 0.0° | 0.4° |
| CL1 | C32 | C33 | H9 | 0.2° | 0.1° |
| H1 | C7 | C8 | H21 | 0.5° | 0.0° |
| H4 | C3 | H5 | H6 | 120.0° | 120.0° |
| H7 | C31 | C30 | H8 | 0.5° | 0.1° |
| H9 | C33 | C34 | H10 | 0.1° | 0.1° |
| H15 | C26 | H16 | H17 | 120.0° | 120.0° |
| H18 | C25 | H19 | H20 | 120.0° | 120.0° |
| H22 | C15 | C14 | H23 | 0.1° | 0.0° |
| H25 | C22 | H26 | H27 | 120.0° | 120.0° |
| H28 | C20 | C19 | H29 | 0.1° | 0.0° |
| H29 | C19 | C18 | H30 | 0.1° | 0.0° |
| H30 | C18 | C17 | H31 | 0.2° | 0.2° |
