A1EB6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C26 | O1 | sing | 1.44Å | 1.80Å | |
| C26 | C27 | sing | 1.54Å | 1.56Å | |
| C30 | C27 | sing | 1.55Å | 1.63Å | |
| C30 | C31 | sing | 1.51Å | 1.40Å | |
| O1 | C25 | sing | 1.43Å | 1.83Å | |
| C27 | N | sing | 1.48Å | 1.41Å | |
| C31 | C24 | sing | 1.55Å | 1.60Å | |
| C25 | C24 | sing | 1.54Å | 1.56Å | |
| N | C24 | sing | 1.48Å | 1.46Å | |
| N | C12 | doub | 1.32Å | 1.58Å | |
| C37 | C36 | sing | 1.53Å | 1.62Å | |
| C37 | O6 | sing | 1.43Å | 1.49Å | |
| C36 | O5 | sing | 1.43Å | 1.53Å | |
| C38 | O6 | sing | 1.43Å | 1.50Å | |
| C38 | C39 | sing | 1.53Å | 1.61Å | |
| C11 | C12 | sing | 1.46Å | 1.45Å | |
| C11 | C10 | doub | 1.35Å | 1.46Å | |
| C12 | C13 | sing | 1.46Å | 1.48Å | |
| C39 | C40 | sing | 1.53Å | 1.63Å | |
| C40 | C41 | sing | 1.53Å | 1.63Å | |
| O5 | C35 | sing | 1.43Å | 1.45Å | |
| C41 | C42 | sing | 1.53Å | 1.62Å | |
| C35 | C34 | sing | 1.53Å | 1.63Å | |
| C10 | C7 | sing | 1.42Å | 1.47Å | |
| C13 | C8 | doub | 1.35Å | 1.48Å | |
| C42 | C43 | sing | 1.53Å | 1.60Å | |
| C7 | C8 | sing | 1.41Å | 1.43Å | |
| C7 | C6 | doub | 1.40Å | 1.52Å | |
| C8 | C9 | sing | 1.51Å | 1.72Å | |
| C34 | N2 | sing | 1.47Å | 1.50Å | |
| N2 | C33 | sing | 1.35Å | 1.51Å | |
| C33 | O4 | doub | 1.22Å | 1.27Å | |
| C33 | C16 | sing | 1.48Å | 1.60Å | |
| C16 | C15 | doub | 1.39Å | 1.58Å | Aromatic |
| C16 | C17 | sing | 1.40Å | 1.39Å | Aromatic |
| C15 | C14 | sing | 1.40Å | 1.37Å | Aromatic |
| O3 | C32 | doub | 1.21Å | 1.32Å | |
| C17 | C18 | doub | 1.38Å | 1.62Å | Aromatic |
| C14 | C6 | sing | 1.47Å | 1.60Å | |
| C14 | C19 | doub | 1.41Å | 1.60Å | Aromatic |
| C6 | C3 | sing | 1.47Å | 1.51Å | |
| C18 | C19 | sing | 1.39Å | 1.40Å | Aromatic |
| C19 | C32 | sing | 1.48Å | 1.58Å | |
| C45 | C9 | sing | 1.53Å | 1.60Å | |
| C9 | C44 | sing | 1.53Å | 1.61Å | |
| C9 | C4 | sing | 1.51Å | 1.68Å | |
| C32 | O2 | sing | 1.35Å | 1.31Å | |
| C3 | C4 | sing | 1.40Å | 1.46Å | Aromatic |
| C3 | C2 | doub | 1.40Å | 1.47Å | Aromatic |
| C4 | C5 | doub | 1.36Å | 1.46Å | Aromatic |
| C2 | C1 | sing | 1.37Å | 1.46Å | Aromatic |
| C5 | C | sing | 1.39Å | 1.47Å | Aromatic |
| C1 | C | doub | 1.39Å | 1.47Å | Aromatic |
| C | N1 | sing | 1.39Å | 1.55Å | |
| C23 | N1 | sing | 1.49Å | 1.44Å | |
| C23 | C28 | sing | 1.55Å | 1.61Å | |
| C23 | C22 | sing | 1.54Å | 1.57Å | |
| N1 | C20 | sing | 1.49Å | 1.45Å | |
| C28 | C29 | sing | 1.54Å | 1.42Å | |
| C22 | O | sing | 1.43Å | 1.80Å | |
| C20 | C29 | sing | 1.55Å | 1.61Å | |
| C20 | C21 | sing | 1.54Å | 1.57Å | |
| C21 | O | sing | 1.43Å | 1.81Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C10 | H2 | sing | 1.08Å | 1.08Å | |
| C11 | H3 | sing | 1.08Å | 1.08Å | |
| C13 | H4 | sing | 1.08Å | 1.08Å | |
| C15 | H5 | sing | 1.08Å | 1.08Å | |
| C17 | H6 | sing | 1.08Å | 1.08Å | |
| C18 | H7 | sing | 1.08Å | 1.08Å | |
| C2 | H8 | sing | 1.08Å | 1.08Å | |
| C20 | H9 | sing | 1.09Å | 1.10Å | |
| C21 | H10 | sing | 1.09Å | 1.10Å | |
| C21 | H11 | sing | 1.09Å | 1.10Å | |
| C22 | H12 | sing | 1.09Å | 1.10Å | |
| C22 | H13 | sing | 1.09Å | 1.10Å | |
| C23 | H14 | sing | 1.09Å | 1.10Å | |
| C24 | H15 | sing | 1.09Å | 1.10Å | |
| C25 | H16 | sing | 1.09Å | 1.10Å | |
| C25 | H17 | sing | 1.09Å | 1.10Å | |
| C26 | H18 | sing | 1.09Å | 1.10Å | |
| C26 | H19 | sing | 1.09Å | 1.10Å | |
| C27 | H20 | sing | 1.09Å | 1.10Å | |
| C28 | H21 | sing | 1.09Å | 1.10Å | |
| C28 | H22 | sing | 1.09Å | 1.10Å | |
| C29 | H23 | sing | 1.09Å | 1.10Å | |
| C29 | H24 | sing | 1.09Å | 1.10Å | |
| C30 | H25 | sing | 1.09Å | 1.10Å | |
| C30 | H26 | sing | 1.09Å | 1.10Å | |
| C31 | H27 | sing | 1.09Å | 1.10Å | |
| C31 | H28 | sing | 1.09Å | 1.10Å | |
| C34 | H29 | sing | 1.09Å | 1.10Å | |
| C34 | H30 | sing | 1.09Å | 1.10Å | |
| C35 | H31 | sing | 1.09Å | 1.10Å | |
| C35 | H32 | sing | 1.09Å | 1.10Å | |
| C36 | H33 | sing | 1.09Å | 1.10Å | |
| C36 | H34 | sing | 1.09Å | 1.10Å | |
| C37 | H35 | sing | 1.09Å | 1.10Å | |
| C37 | H36 | sing | 1.09Å | 1.10Å | |
| C38 | H37 | sing | 1.09Å | 1.10Å | |
| C38 | H38 | sing | 1.09Å | 1.10Å | |
| C39 | H39 | sing | 1.09Å | 1.10Å | |
| C39 | H40 | sing | 1.09Å | 1.10Å | |
| C40 | H41 | sing | 1.09Å | 1.10Å | |
| C40 | H42 | sing | 1.09Å | 1.10Å | |
| C41 | H43 | sing | 1.09Å | 1.10Å | |
| C41 | H44 | sing | 1.09Å | 1.10Å | |
| C42 | H45 | sing | 1.09Å | 1.10Å | |
| C42 | H46 | sing | 1.09Å | 1.10Å | |
| C43 | H47 | sing | 1.09Å | 1.10Å | |
| C43 | H48 | sing | 1.09Å | 1.10Å | |
| C44 | H50 | sing | 1.09Å | 1.10Å | |
| C44 | H51 | sing | 1.09Å | 1.10Å | |
| C44 | H52 | sing | 1.09Å | 1.10Å | |
| C45 | H53 | sing | 1.09Å | 1.10Å | |
| C45 | H54 | sing | 1.09Å | 1.10Å | |
| C45 | H55 | sing | 1.09Å | 1.10Å | |
| C5 | H56 | sing | 1.08Å | 1.08Å | |
| N2 | H58 | sing | 0.97Å | 1.00Å | |
| O2 | H59 | sing | 0.97Å | 0.95Å | |
| C43 | CL1 | sing | 1.80Å | 1.38Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C26 | C27 | 108.6° | 109.5° |
| C26 | O1 | C25 | 108.9° | 115.1° |
| O1 | C26 | H18 | 109.7° | 109.5° |
| O1 | C26 | H19 | 109.7° | 109.6° |
| C26 | C27 | C30 | 111.0° | 107.5° |
| C26 | C27 | N | 106.4° | 106.8° |
| C27 | C26 | H18 | 109.7° | 110.9° |
| C27 | C26 | H19 | 109.7° | 107.6° |
| C26 | C27 | H20 | 110.7° | 112.4° |
| C27 | C30 | C31 | 106.2° | 106.3° |
| C30 | C27 | N | 105.9° | 102.7° |
| C30 | C27 | H20 | 109.8° | 113.0° |
| C27 | C30 | H25 | 110.3° | 110.4° |
| C27 | C30 | H26 | 110.3° | 110.4° |
| C30 | C31 | C24 | 106.0° | 104.4° |
| C31 | C30 | H25 | 110.3° | 110.2° |
| C31 | C30 | H26 | 110.3° | 108.9° |
| C30 | C31 | H27 | 110.4° | 110.4° |
| C30 | C31 | H28 | 110.3° | 110.4° |
| O1 | C25 | C24 | 107.2° | 108.9° |
| O1 | C25 | H16 | 110.0° | 109.6° |
| O1 | C25 | H17 | 110.0° | 109.7° |
| C27 | N | C24 | 106.2° | 103.0° |
| C27 | N | C12 | 122.2° | 128.5° |
| N | C27 | H20 | 113.0° | 113.7° |
| C31 | C24 | C25 | 111.0° | 108.2° |
| C31 | C24 | N | 105.9° | 104.0° |
| C31 | C24 | H15 | 109.9° | 112.4° |
| C24 | C31 | H27 | 110.3° | 110.9° |
| C24 | C31 | H28 | 110.4° | 110.2° |
| C25 | C24 | N | 107.7° | 106.8° |
| C25 | C24 | H15 | 110.4° | 112.4° |
| C24 | C25 | H16 | 110.1° | 109.6° |
| C24 | C25 | H17 | 110.1° | 109.6° |
| C24 | N | C12 | 119.1° | 128.5° |
| N | C24 | H15 | 111.9° | 112.5° |
| N | C12 | C11 | 122.9° | 120.7° |
| N | C12 | C13 | 117.2° | 120.7° |
| C36 | C37 | O6 | 106.2° | 109.5° |
| C37 | C36 | O5 | 105.6° | 109.5° |
| C37 | C36 | H33 | 110.4° | 109.5° |
| C37 | C36 | H34 | 110.4° | 109.4° |
| C36 | C37 | H35 | 110.3° | 109.4° |
| C36 | C37 | H36 | 110.3° | 109.4° |
| C37 | O6 | C38 | 113.3° | 114.0° |
| O6 | C37 | H35 | 110.3° | 109.5° |
| O6 | C37 | H36 | 110.3° | 109.5° |
| C36 | O5 | C35 | 111.1° | 114.0° |
| O5 | C36 | H33 | 110.4° | 109.5° |
| O5 | C36 | H34 | 110.5° | 109.5° |
| O6 | C38 | C39 | 107.2° | 109.5° |
| O6 | C38 | H37 | 110.0° | 109.5° |
| O6 | C38 | H38 | 110.1° | 109.5° |
| C38 | C39 | C40 | 109.1° | 109.5° |
| C39 | C38 | H37 | 110.0° | 109.5° |
| C39 | C38 | H38 | 110.0° | 109.5° |
| C38 | C39 | H39 | 109.6° | 109.4° |
| C38 | C39 | H40 | 109.6° | 109.5° |
| C12 | C11 | C10 | 119.6° | 119.4° |
| C11 | C12 | C13 | 119.9° | 118.6° |
| C12 | C11 | H3 | 120.2° | 120.3° |
| C11 | C10 | C7 | 119.8° | 121.0° |
| C11 | C10 | H2 | 120.1° | 119.5° |
| C10 | C11 | H3 | 120.2° | 120.3° |
| C12 | C13 | C8 | 120.5° | 119.5° |
| C12 | C13 | H4 | 119.8° | 120.3° |
| C39 | C40 | C41 | 105.1° | 109.5° |
| C40 | C39 | H39 | 109.6° | 109.5° |
| C40 | C39 | H40 | 109.6° | 109.5° |
| C39 | C40 | H41 | 110.5° | 109.5° |
| C39 | C40 | H42 | 110.5° | 109.5° |
| C40 | C41 | C42 | 109.5° | 109.5° |
| C41 | C40 | H41 | 110.5° | 109.5° |
| C41 | C40 | H42 | 110.5° | 109.5° |
| C40 | C41 | H43 | 109.5° | 109.5° |
| C40 | C41 | H44 | 109.5° | 109.4° |
| O5 | C35 | C34 | 105.7° | 109.5° |
| O5 | C35 | H31 | 110.4° | 109.4° |
| O5 | C35 | H32 | 110.4° | 109.5° |
| C41 | C42 | C43 | 106.7° | 109.5° |
| C42 | C41 | H43 | 109.5° | 109.5° |
| C42 | C41 | H44 | 109.5° | 109.5° |
| C41 | C42 | H45 | 110.1° | 109.4° |
| C41 | C42 | H46 | 110.2° | 109.5° |
| C35 | C34 | N2 | 100.7° | 109.4° |
| C35 | C34 | H29 | 111.6° | 109.5° |
| C35 | C34 | H30 | 111.6° | 109.5° |
| C34 | C35 | H31 | 110.4° | 109.5° |
| C34 | C35 | H32 | 110.4° | 109.5° |
| C10 | C7 | C8 | 121.9° | 120.5° |
| C10 | C7 | C6 | 118.6° | 118.8° |
| C7 | C10 | H2 | 120.1° | 119.4° |
| C13 | C8 | C7 | 118.3° | 121.0° |
| C13 | C8 | C9 | 119.9° | 119.5° |
| C8 | C13 | H4 | 119.8° | 120.2° |
| C43 | C42 | H45 | 110.2° | 109.4° |
| C43 | C42 | H46 | 110.1° | 109.5° |
| C42 | C43 | H47 | 109.4° | 109.5° |
| C42 | C43 | H48 | 109.4° | 109.5° |
| C42 | C43 | CL1 | 109.6° | 109.5° |
| C8 | C7 | C6 | 119.5° | 120.7° |
| C7 | C8 | C9 | 121.8° | 119.5° |
| C7 | C6 | C14 | 119.4° | 118.9° |
| C7 | C6 | C3 | 125.4° | 122.2° |
| C8 | C9 | C45 | 109.6° | 107.7° |
| C8 | C9 | C44 | 110.0° | 107.7° |
| C8 | C9 | C4 | 110.9° | 118.2° |
| C34 | N2 | C33 | 113.6° | 120.0° |
| N2 | C34 | H29 | 111.6° | 109.4° |
| N2 | C34 | H30 | 111.6° | 109.4° |
| C34 | N2 | H58 | 123.2° | 120.0° |
| N2 | C33 | O4 | 126.0° | 120.0° |
| N2 | C33 | C16 | 114.4° | 120.0° |
| C33 | N2 | H58 | 123.2° | 120.0° |
| O4 | C33 | C16 | 119.6° | 120.0° |
| C33 | C16 | C15 | 111.9° | 120.0° |
| C33 | C16 | C17 | 123.2° | 119.9° |
| C15 | C16 | C17 | 125.0° | 120.2° |
| C16 | C15 | C14 | 115.1° | 119.9° |
| C16 | C15 | H5 | 122.4° | 120.1° |
| C16 | C17 | C18 | 118.3° | 120.3° |
| C16 | C17 | H6 | 120.9° | 119.9° |
| C15 | C14 | C6 | 114.0° | 120.2° |
| C15 | C14 | C19 | 123.4° | 119.6° |
| C14 | C15 | H5 | 122.5° | 120.1° |
| O3 | C32 | C19 | 117.8° | 120.0° |
| O3 | C32 | O2 | 121.8° | 120.0° |
| C17 | C18 | C19 | 117.6° | 120.2° |
| C18 | C17 | H6 | 120.8° | 119.8° |
| C17 | C18 | H7 | 121.2° | 119.9° |
| C6 | C14 | C19 | 122.6° | 120.2° |
| C14 | C6 | C3 | 114.6° | 118.9° |
| C14 | C19 | C18 | 120.6° | 119.8° |
| C14 | C19 | C32 | 117.9° | 120.1° |
| C6 | C3 | C4 | 119.0° | 120.4° |
| C6 | C3 | C2 | 122.1° | 120.1° |
| C18 | C19 | C32 | 121.5° | 120.1° |
| C19 | C18 | H7 | 121.2° | 119.9° |
| C19 | C32 | O2 | 120.4° | 120.0° |
| C45 | C9 | C44 | 110.9° | 107.4° |
| C45 | C9 | C4 | 107.9° | 107.5° |
| C9 | C45 | H53 | 109.5° | 109.5° |
| C9 | C45 | H54 | 109.5° | 109.5° |
| C9 | C45 | H55 | 109.5° | 109.4° |
| C44 | C9 | C4 | 107.5° | 107.8° |
| C9 | C44 | H50 | 109.5° | 109.5° |
| C9 | C44 | H51 | 109.5° | 109.5° |
| C9 | C44 | H52 | 109.5° | 109.5° |
| C9 | C4 | C3 | 122.5° | 119.0° |
| C9 | C4 | C5 | 116.7° | 120.7° |
| C32 | O2 | H59 | 109.5° | 116.9° |
| C4 | C3 | C2 | 118.9° | 119.5° |
| C3 | C4 | C5 | 120.8° | 120.3° |
| C3 | C2 | C1 | 120.4° | 119.9° |
| C3 | C2 | H8 | 119.8° | 120.1° |
| C4 | C5 | C | 120.5° | 119.9° |
| C4 | C5 | H56 | 119.8° | 120.0° |
| C2 | C1 | C | 120.8° | 120.3° |
| C2 | C1 | H1 | 119.6° | 119.9° |
| C1 | C2 | H8 | 119.8° | 120.1° |
| C5 | C | C1 | 118.6° | 120.1° |
| C5 | C | N1 | 117.1° | 119.9° |
| C | C5 | H56 | 119.8° | 120.1° |
| C1 | C | N1 | 124.2° | 119.9° |
| C | C1 | H1 | 119.6° | 119.9° |
| C | N1 | C23 | 117.8° | 111.0° |
| C | N1 | C20 | 121.9° | 111.0° |
| N1 | C23 | C28 | 106.8° | 103.9° |
| N1 | C23 | C22 | 106.8° | 106.8° |
| C23 | N1 | C20 | 106.0° | 102.8° |
| N1 | C23 | H14 | 112.3° | 112.5° |
| C28 | C23 | C22 | 110.7° | 107.6° |
| C23 | C28 | C29 | 106.4° | 104.7° |
| C28 | C23 | H14 | 109.8° | 112.5° |
| C23 | C28 | H21 | 110.3° | 110.4° |
| C23 | C28 | H22 | 110.2° | 110.4° |
| C23 | C22 | O | 105.8° | 108.8° |
| C23 | C22 | H12 | 110.4° | 109.6° |
| C23 | C22 | H13 | 110.4° | 109.6° |
| C22 | C23 | H14 | 110.3° | 112.9° |
| N1 | C20 | C29 | 107.3° | 103.9° |
| N1 | C20 | C21 | 106.3° | 106.8° |
| N1 | C20 | H9 | 112.9° | 113.1° |
| C28 | C29 | C20 | 105.5° | 104.7° |
| C29 | C28 | H21 | 110.3° | 110.4° |
| C29 | C28 | H22 | 110.2° | 110.4° |
| C28 | C29 | H23 | 110.5° | 110.4° |
| C28 | C29 | H24 | 110.4° | 110.4° |
| C22 | O | C21 | 112.6° | 114.6° |
| O | C22 | H12 | 110.4° | 109.6° |
| O | C22 | H13 | 110.4° | 109.6° |
| C29 | C20 | C21 | 108.8° | 107.6° |
| C29 | C20 | H9 | 110.4° | 112.5° |
| C20 | C29 | H23 | 110.4° | 110.4° |
| C20 | C29 | H24 | 110.5° | 110.4° |
| C20 | C21 | O | 107.6° | 108.8° |
| C21 | C20 | H9 | 111.0° | 112.4° |
| C20 | C21 | H10 | 110.0° | 109.5° |
| C20 | C21 | H11 | 110.0° | 109.6° |
| O | C21 | H10 | 109.9° | 109.6° |
| O | C21 | H11 | 109.9° | 109.6° |
| H10 | C21 | H11 | 109.4° | 109.7° |
| H12 | C22 | H13 | 109.5° | 109.6° |
| H16 | C25 | H17 | 109.5° | 109.5° |
| H18 | C26 | H19 | 109.5° | 109.7° |
| H21 | C28 | H22 | 109.5° | 110.4° |
| H23 | C29 | H24 | 109.5° | 110.4° |
| H25 | C30 | H26 | 109.5° | 110.4° |
| H27 | C31 | H28 | 109.5° | 110.4° |
| H29 | C34 | H30 | 109.5° | 109.5° |
| H31 | C35 | H32 | 109.5° | 109.4° |
| H33 | C36 | H34 | 109.5° | 109.4° |
| H35 | C37 | H36 | 109.5° | 109.5° |
| H37 | C38 | H38 | 109.5° | 109.5° |
| H39 | C39 | H40 | 109.5° | 109.5° |
| H41 | C40 | H42 | 109.5° | 109.5° |
| H43 | C41 | H44 | 109.5° | 109.5° |
| H45 | C42 | H46 | 109.5° | 109.5° |
| H47 | C43 | H48 | 109.5° | 109.5° |
| H47 | C43 | CL1 | 109.5° | 109.5° |
| H48 | C43 | CL1 | 109.4° | 109.5° |
| H50 | C44 | H51 | 109.5° | 109.4° |
| H50 | C44 | H52 | 109.4° | 109.4° |
| H51 | C44 | H52 | 109.5° | 109.5° |
| H53 | C45 | H54 | 109.4° | 109.5° |
| H53 | C45 | H55 | 109.5° | 109.5° |
| H54 | C45 | H55 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C26 | C27 | H18 | 119.9° | 121.0° |
| O1 | C26 | C27 | H19 | 119.9° | 119.0° |
| O1 | C26 | C27 | C30 | 95.2° | 49.1° |
| O1 | C26 | C27 | N | 19.5° | 60.6° |
| C26 | O1 | C25 | C24 | 33.7° | 52.8° |
| C26 | O1 | C25 | H16 | 86.0° | 67.1° |
| C26 | O1 | C25 | H17 | 153.3° | 172.6° |
| O1 | C26 | H18 | H19 | 120.4° | 120.3° |
| O1 | C26 | C27 | H20 | 142.6° | 174.1° |
| C26 | C27 | C30 | N | 115.0° | 112.5° |
| C26 | C27 | C30 | H20 | 122.7° | 124.6° |
| C26 | C27 | C30 | C31 | 96.9° | 86.2° |
| C27 | C26 | O1 | C25 | 33.6° | 52.3° |
| C26 | C27 | N | H20 | 121.7° | 124.5° |
| C26 | C27 | N | C24 | 87.7° | 70.4° |
| C26 | C27 | N | C12 | 131.0° | 109.9° |
| C27 | C26 | H18 | H19 | 120.4° | 118.7° |
| C26 | C27 | C30 | H25 | 143.6° | 154.3° |
| C26 | C27 | C30 | H26 | 22.6° | 31.9° |
| C27 | C30 | C31 | H25 | 119.5° | 119.6° |
| C27 | C30 | C31 | H26 | 119.5° | 119.0° |
| C30 | C27 | N | H20 | 120.2° | 122.5° |
| C27 | C30 | C31 | C24 | 0.9° | 0.4° |
| C30 | C27 | N | C24 | 30.4° | 42.6° |
| C30 | C27 | N | C12 | 110.9° | 137.1° |
| C30 | C27 | C26 | H18 | 144.9° | 71.9° |
| C30 | C27 | C26 | H19 | 24.6° | 168.1° |
| C27 | C30 | H25 | H26 | 121.5° | 122.4° |
| C27 | C30 | C31 | H27 | 118.5° | 118.8° |
| C27 | C30 | C31 | H28 | 120.4° | 118.8° |
| C31 | C30 | C27 | N | 18.1° | 26.3° |
| C30 | C31 | C24 | H27 | 119.5° | 118.9° |
| C30 | C31 | C24 | H28 | 119.5° | 118.5° |
| C30 | C31 | C24 | C25 | 97.4° | 87.6° |
| C30 | C31 | C24 | N | 19.2° | 25.7° |
| C30 | C31 | C24 | H15 | 140.3° | 147.7° |
| C31 | C30 | C27 | H20 | 140.4° | 149.2° |
| C31 | C30 | H25 | H26 | 121.5° | 120.4° |
| C30 | C31 | H27 | H28 | 121.6° | 122.4° |
| O1 | C25 | C24 | C31 | 97.7° | 49.4° |
| O1 | C25 | C24 | H16 | 119.6° | 119.9° |
| O1 | C25 | C24 | H17 | 119.6° | 119.9° |
| O1 | C25 | C24 | N | 17.8° | 62.0° |
| O1 | C25 | C24 | H15 | 140.3° | 174.1° |
| O1 | C25 | H16 | H17 | 121.0° | 120.3° |
| C25 | O1 | C26 | H18 | 153.5° | 174.2° |
| C25 | O1 | C26 | H19 | 86.3° | 65.5° |
| C27 | N | C24 | C31 | 31.2° | 42.9° |
| C27 | N | C24 | C25 | 87.6° | 71.4° |
| C27 | N | C24 | C12 | 142.7° | 179.7° |
| C27 | N | C12 | C11 | 24.5° | 179.6° |
| C27 | N | C12 | C13 | 154.4° | 0.4° |
| C27 | N | C24 | H15 | 150.9° | 164.9° |
| N | C27 | C26 | H18 | 100.4° | 178.4° |
| N | C27 | C26 | H19 | 139.3° | 58.5° |
| N | C27 | C30 | H25 | 101.4° | 93.3° |
| N | C27 | C30 | H26 | 137.6° | 144.3° |
| C31 | C24 | C25 | N | 115.5° | 111.4° |
| C31 | C24 | C25 | H15 | 122.0° | 124.7° |
| C31 | C24 | N | H15 | 119.7° | 121.9° |
| C31 | C24 | N | C12 | 111.5° | 136.8° |
| C31 | C24 | C25 | H16 | 21.9° | 169.2° |
| C31 | C24 | C25 | H17 | 142.7° | 70.6° |
| C24 | C31 | C30 | H25 | 120.4° | 119.2° |
| C24 | C31 | C30 | H26 | 118.5° | 119.5° |
| C24 | C31 | H27 | H28 | 121.6° | 122.4° |
| C25 | C24 | N | H15 | 121.5° | 123.8° |
| C25 | C24 | N | C12 | 129.7° | 109.0° |
| C24 | C25 | H16 | H17 | 121.1° | 120.2° |
| C25 | C24 | C31 | H27 | 143.1° | 31.3° |
| C25 | C24 | C31 | H28 | 22.0° | 153.9° |
| C24 | N | C12 | C11 | 161.1° | 0.0° |
| C24 | N | C12 | C13 | 17.8° | 180.0° |
| N | C24 | C25 | H16 | 137.5° | 57.8° |
| N | C24 | C25 | H17 | 101.8° | 178.1° |
| C24 | N | C27 | H20 | 150.6° | 165.1° |
| N | C24 | C31 | H27 | 100.3° | 144.6° |
| N | C24 | C31 | H28 | 138.6° | 92.8° |
| N | C12 | C11 | C13 | 178.8° | 180.0° |
| N | C12 | C11 | C10 | 179.3° | 180.0° |
| N | C12 | C13 | C8 | 179.5° | 180.0° |
| N | C12 | C11 | H3 | 0.6° | 0.1° |
| N | C12 | C13 | H4 | 0.5° | 0.0° |
| C12 | N | C24 | H15 | 8.2° | 14.8° |
| C12 | N | C27 | H20 | 9.3° | 14.6° |
| C36 | C37 | O6 | H35 | 119.5° | 120.0° |
| C36 | C37 | O6 | H36 | 119.5° | 120.0° |
| C37 | C36 | O5 | H33 | 119.4° | 120.1° |
| C37 | C36 | O5 | H34 | 119.4° | 120.0° |
| C36 | C37 | O6 | C38 | 85.6° | 180.0° |
| C37 | C36 | O5 | C35 | 168.0° | 180.0° |
| C37 | C36 | H33 | H34 | 121.8° | 120.0° |
| C36 | C37 | H35 | H36 | 121.5° | 119.9° |
| O6 | C37 | C36 | O5 | 64.0° | 65.0° |
| C37 | O6 | C38 | C39 | 160.4° | 180.0° |
| O6 | C37 | C36 | H33 | 176.6° | 175.0° |
| O6 | C37 | C36 | H34 | 55.4° | 55.0° |
| O6 | C37 | H35 | H36 | 121.5° | 120.1° |
| C37 | O6 | C38 | H37 | 80.0° | 60.0° |
| C37 | O6 | C38 | H38 | 40.7° | 60.0° |
| C36 | O5 | C35 | C34 | 178.5° | 180.0° |
| C36 | O5 | C35 | H31 | 62.1° | 60.0° |
| C36 | O5 | C35 | H32 | 59.1° | 59.9° |
| O5 | C36 | H33 | H34 | 121.8° | 120.0° |
| O5 | C36 | C37 | H35 | 176.5° | 175.0° |
| O5 | C36 | C37 | H36 | 55.5° | 55.1° |
| O6 | C38 | C39 | H37 | 119.6° | 120.0° |
| O6 | C38 | C39 | H38 | 119.7° | 120.0° |
| O6 | C38 | C39 | C40 | 40.6° | 180.0° |
| C38 | O6 | C37 | H35 | 33.9° | 60.0° |
| C38 | O6 | C37 | H36 | 154.9° | 60.0° |
| O6 | C38 | H37 | H38 | 121.1° | 120.0° |
| O6 | C38 | C39 | H39 | 79.3° | 60.0° |
| O6 | C38 | C39 | H40 | 160.6° | 60.0° |
| C38 | C39 | C40 | H39 | 119.9° | 120.0° |
| C38 | C39 | C40 | H40 | 119.9° | 120.0° |
| C38 | C39 | C40 | C41 | 166.3° | 180.0° |
| C39 | C38 | H37 | H38 | 121.0° | 120.0° |
| C38 | C39 | H39 | H40 | 120.2° | 120.0° |
| C38 | C39 | C40 | H41 | 47.0° | 60.0° |
| C38 | C39 | C40 | H42 | 74.3° | 60.0° |
| C12 | C11 | C10 | H3 | 180.0° | 179.9° |
| C12 | C11 | C10 | C7 | 0.2° | 0.0° |
| C11 | C12 | C13 | C8 | 0.6° | 0.1° |
| C12 | C11 | C10 | H2 | 179.8° | 180.0° |
| C11 | C12 | C13 | H4 | 179.4° | 180.0° |
| C10 | C11 | C12 | C13 | 0.5° | 0.0° |
| C11 | C10 | C7 | H2 | 180.0° | 180.0° |
| C11 | C10 | C7 | C8 | 0.0° | 0.0° |
| C11 | C10 | C7 | C6 | 179.7° | 180.0° |
| C12 | C13 | C8 | H4 | 180.0° | 179.9° |
| C12 | C13 | C8 | C7 | 0.4° | 0.0° |
| C12 | C13 | C8 | C9 | 179.5° | 179.8° |
| C13 | C12 | C11 | H3 | 179.5° | 180.0° |
| C39 | C40 | C41 | H41 | 119.3° | 120.0° |
| C39 | C40 | C41 | H42 | 119.3° | 120.0° |
| C39 | C40 | C41 | C42 | 166.6° | NaN° |
| C40 | C39 | C38 | H37 | 160.3° | 60.0° |
| C40 | C39 | C38 | H38 | 79.0° | 60.0° |
| C40 | C39 | H39 | H40 | 120.2° | 120.0° |
| C39 | C40 | H41 | H42 | 122.0° | 120.0° |
| C39 | C40 | C41 | H43 | 46.6° | 60.0° |
| C39 | C40 | C41 | H44 | 73.4° | 60.0° |
| C40 | C41 | C42 | H43 | 120.0° | 120.0° |
| C40 | C41 | C42 | H44 | 120.0° | 120.0° |
| C40 | C41 | C42 | C43 | 168.3° | 180.0° |
| C41 | C40 | C39 | H39 | 73.7° | 60.0° |
| C41 | C40 | C39 | H40 | 46.4° | 60.0° |
| C41 | C40 | H41 | H42 | 122.0° | 120.0° |
| C40 | C41 | H43 | H44 | 120.0° | 119.9° |
| C40 | C41 | C42 | H45 | 48.7° | 60.0° |
| C40 | C41 | C42 | H46 | 72.2° | 60.0° |
| O5 | C35 | C34 | H31 | 119.4° | 120.0° |
| O5 | C35 | C34 | H32 | 119.4° | 120.1° |
| O5 | C35 | C34 | N2 | 155.6° | 65.0° |
| O5 | C35 | C34 | H29 | 85.8° | 175.0° |
| O5 | C35 | C34 | H30 | 37.0° | 54.9° |
| O5 | C35 | H31 | H32 | 121.8° | 120.0° |
| C35 | O5 | C36 | H33 | 72.6° | 59.9° |
| C35 | O5 | C36 | H34 | 48.6° | 60.0° |
| C41 | C42 | C43 | H45 | 119.6° | 120.0° |
| C41 | C42 | C43 | H46 | 119.6° | 120.0° |
| C42 | C41 | C40 | H41 | 74.1° | 60.0° |
| C42 | C41 | C40 | H42 | 47.3° | 60.0° |
| C42 | C41 | H43 | H44 | 120.0° | 120.1° |
| C41 | C42 | H45 | H46 | 121.3° | 120.0° |
| C41 | C42 | C43 | H47 | 172.2° | 60.0° |
| C41 | C42 | C43 | H48 | 52.3° | 60.0° |
| C41 | C42 | C43 | CL1 | 67.7° | 180.0° |
| C35 | C34 | N2 | H29 | 118.6° | 120.0° |
| C35 | C34 | N2 | H30 | 118.6° | 119.9° |
| C35 | C34 | N2 | C33 | 79.2° | 180.0° |
| C35 | C34 | H29 | H30 | 124.1° | 120.1° |
| C34 | C35 | H31 | H32 | 121.8° | 120.0° |
| C35 | C34 | N2 | H58 | 100.8° | 0.0° |
| C10 | C7 | C8 | C13 | 0.1° | 0.0° |
| C10 | C7 | C8 | C6 | 179.6° | 180.0° |
| C10 | C7 | C8 | C9 | 179.8° | 179.7° |
| C10 | C7 | C6 | C14 | 1.0° | 0.0° |
| C10 | C7 | C6 | C3 | 172.0° | 180.0° |
| C7 | C10 | C11 | H3 | 179.8° | 179.9° |
| C13 | C8 | C7 | C9 | 179.9° | 179.7° |
| C13 | C8 | C7 | C6 | 179.8° | 180.0° |
| C13 | C8 | C9 | C45 | 54.3° | 57.8° |
| C13 | C8 | C9 | C44 | 67.8° | 57.8° |
| C13 | C8 | C9 | C4 | 173.4° | 179.7° |
| C43 | C42 | C41 | H43 | 71.7° | 60.0° |
| C43 | C42 | C41 | H44 | 48.3° | 60.0° |
| C43 | C42 | H45 | H46 | 121.3° | 120.0° |
| C42 | C43 | H47 | H48 | 119.9° | 120.0° |
| C42 | C43 | H47 | CL1 | 120.1° | 120.0° |
| C42 | C43 | H48 | CL1 | 120.1° | 120.0° |
| C8 | C7 | C6 | C14 | 179.4° | 180.0° |
| C8 | C7 | C6 | C3 | 8.4° | 0.0° |
| C7 | C8 | C9 | C45 | 125.7° | 122.5° |
| C7 | C8 | C9 | C44 | 112.1° | 121.9° |
| C7 | C8 | C9 | C4 | 6.7° | 0.5° |
| C8 | C7 | C10 | H2 | 180.0° | 180.0° |
| C7 | C8 | C13 | H4 | 179.6° | 180.0° |
| C6 | C7 | C8 | C9 | 0.2° | 0.3° |
| C7 | C6 | C14 | C15 | 77.0° | 105.3° |
| C7 | C6 | C14 | C3 | 172.0° | 180.0° |
| C7 | C6 | C14 | C19 | 104.2° | 75.0° |
| C7 | C6 | C3 | C4 | 8.1° | 0.0° |
| C7 | C6 | C3 | C2 | 170.9° | 179.7° |
| C6 | C7 | C10 | H2 | 0.3° | 0.0° |
| C8 | C9 | C45 | C44 | 121.7° | 115.8° |
| C8 | C9 | C45 | C4 | 120.9° | 128.4° |
| C8 | C9 | C44 | C4 | 120.9° | 128.6° |
| C8 | C9 | C4 | C3 | 7.0° | 0.6° |
| C8 | C9 | C4 | C5 | 172.7° | 179.7° |
| C9 | C8 | C13 | H4 | 0.5° | 0.3° |
| C8 | C9 | C44 | H50 | 180.0° | 55.8° |
| C8 | C9 | C44 | H51 | 60.0° | 64.2° |
| C8 | C9 | C44 | H52 | 60.0° | 175.8° |
| C8 | C9 | C45 | H53 | 180.0° | 60.0° |
| C8 | C9 | C45 | H54 | 60.0° | 180.0° |
| C8 | C9 | C45 | H55 | 60.0° | 60.0° |
| C34 | N2 | C33 | H58 | 180.0° | 180.0° |
| C34 | N2 | C33 | O4 | 1.7° | 0.0° |
| C34 | N2 | C33 | C16 | 179.6° | 180.0° |
| N2 | C34 | H29 | H30 | 124.1° | 120.0° |
| N2 | C34 | C35 | H31 | 36.2° | 175.0° |
| N2 | C34 | C35 | H32 | 85.0° | 55.1° |
| N2 | C33 | O4 | C16 | 177.9° | 180.0° |
| N2 | C33 | C16 | C15 | 166.8° | 180.0° |
| N2 | C33 | C16 | C17 | 13.8° | 0.0° |
| C33 | N2 | C34 | H29 | 39.4° | 60.0° |
| C33 | N2 | C34 | H30 | 162.3° | 60.1° |
| O4 | C33 | C16 | C15 | 15.1° | 0.0° |
| O4 | C33 | C16 | C17 | 164.3° | 180.0° |
| O4 | C33 | N2 | H58 | 178.3° | 180.0° |
| C33 | C16 | C15 | C17 | 179.4° | 180.0° |
| C33 | C16 | C15 | C14 | 179.8° | 180.0° |
| C33 | C16 | C17 | C18 | 179.6° | 180.0° |
| C33 | C16 | C15 | H5 | 0.2° | 0.0° |
| C33 | C16 | C17 | H6 | 0.3° | 0.0° |
| C16 | C33 | N2 | H58 | 0.3° | 0.0° |
| C16 | C15 | C14 | H5 | 180.0° | 180.0° |
| C15 | C16 | C17 | C18 | 0.4° | 0.1° |
| C16 | C15 | C14 | C6 | 179.4° | 180.0° |
| C16 | C15 | C14 | C19 | 0.6° | 0.3° |
| C15 | C16 | C17 | H6 | 179.6° | 180.0° |
| C17 | C16 | C15 | C14 | 0.4° | 0.0° |
| C16 | C17 | C18 | H6 | 180.0° | 180.0° |
| C16 | C17 | C18 | C19 | 0.5° | 0.2° |
| C17 | C16 | C15 | H5 | 179.6° | 180.0° |
| C16 | C17 | C18 | H7 | 179.5° | 179.9° |
| C15 | C14 | C6 | C19 | 178.8° | 179.7° |
| C15 | C14 | C6 | C3 | 111.0° | 74.7° |
| C15 | C14 | C19 | C18 | 0.9° | 0.6° |
| C15 | C14 | C19 | C32 | 180.0° | 179.7° |
| O3 | C32 | C19 | C14 | 32.0° | 0.0° |
| O3 | C32 | C19 | C18 | 147.1° | 179.7° |
| O3 | C32 | C19 | O2 | 178.9° | 180.0° |
| O3 | C32 | O2 | H59 | 0.0° | 0.0° |
| C17 | C18 | C19 | C14 | 0.7° | 0.5° |
| C17 | C18 | C19 | H7 | 180.0° | 179.8° |
| C17 | C18 | C19 | C32 | 179.8° | 179.7° |
| C6 | C14 | C19 | C18 | 179.5° | 179.7° |
| C6 | C14 | C19 | C32 | 1.3° | 0.0° |
| C14 | C6 | C3 | C4 | 179.5° | 180.0° |
| C14 | C6 | C3 | C2 | 0.5° | 0.3° |
| C6 | C14 | C15 | H5 | 0.6° | 0.0° |
| C19 | C14 | C6 | C3 | 67.8° | 105.0° |
| C14 | C19 | C18 | C32 | 179.1° | 179.7° |
| C14 | C19 | C32 | O2 | 146.9° | 180.0° |
| C19 | C14 | C15 | H5 | 179.4° | 179.7° |
| C14 | C19 | C18 | H7 | 179.3° | 179.6° |
| C6 | C3 | C4 | C9 | 0.4° | 0.3° |
| C6 | C3 | C4 | C2 | 179.0° | 179.7° |
| C6 | C3 | C4 | C5 | 179.3° | 179.9° |
| C6 | C3 | C2 | C1 | 179.0° | 179.7° |
| C6 | C3 | C2 | H8 | 0.9° | 0.3° |
| C18 | C19 | C32 | O2 | 34.0° | 0.2° |
| C19 | C18 | C17 | H6 | 179.5° | 179.8° |
| C32 | C19 | C18 | H7 | 0.2° | 0.1° |
| C19 | C32 | O2 | H59 | 178.9° | 180.0° |
| C45 | C9 | C44 | C4 | 117.7° | 115.6° |
| C45 | C9 | C4 | C3 | 127.1° | 122.6° |
| C45 | C9 | C4 | C5 | 52.6° | 57.6° |
| C45 | C9 | C44 | H50 | 58.6° | 60.0° |
| C45 | C9 | C44 | H51 | 61.5° | 180.0° |
| C45 | C9 | C44 | H52 | 178.5° | 60.0° |
| C9 | C45 | H53 | H54 | 120.0° | 120.0° |
| C9 | C45 | H53 | H55 | 120.0° | 119.9° |
| C9 | C45 | H54 | H55 | 120.0° | 119.9° |
| C44 | C9 | C4 | C3 | 113.3° | 121.8° |
| C44 | C9 | C4 | C5 | 67.0° | 57.9° |
| C9 | C44 | H50 | H51 | 120.0° | 120.0° |
| C9 | C44 | H50 | H52 | 120.0° | 120.0° |
| C9 | C44 | H51 | H52 | 120.0° | 120.1° |
| C44 | C9 | C45 | H53 | 58.4° | 55.8° |
| C44 | C9 | C45 | H54 | 178.3° | 64.3° |
| C44 | C9 | C45 | H55 | 61.7° | 175.8° |
| C9 | C4 | C3 | C5 | 179.7° | 179.7° |
| C9 | C4 | C3 | C2 | 179.4° | 180.0° |
| C9 | C4 | C5 | C | 179.9° | 179.7° |
| C4 | C9 | C44 | H50 | 59.1° | 175.6° |
| C4 | C9 | C44 | H51 | 179.1° | 64.5° |
| C4 | C9 | C44 | H52 | 60.9° | 55.6° |
| C4 | C9 | C45 | H53 | 59.1° | 171.6° |
| C4 | C9 | C45 | H54 | 60.9° | 51.5° |
| C4 | C9 | C45 | H55 | 179.1° | 68.4° |
| C9 | C4 | C5 | H56 | 0.1° | 0.2° |
| C4 | C3 | C2 | C1 | 0.1° | 0.0° |
| C3 | C4 | C5 | C | 0.2° | 0.5° |
| C4 | C3 | C2 | H8 | 179.9° | 180.0° |
| C3 | C4 | C5 | H56 | 179.8° | 180.0° |
| C2 | C3 | C4 | C5 | 0.3° | 0.3° |
| C3 | C2 | C1 | H8 | 180.0° | 180.0° |
| C3 | C2 | C1 | C | 0.6° | 0.0° |
| C3 | C2 | C1 | H1 | 179.4° | 180.0° |
| C4 | C5 | C | H56 | 180.0° | 179.5° |
| C4 | C5 | C | C1 | 0.8° | 0.5° |
| C4 | C5 | C | N1 | 178.8° | 179.7° |
| C2 | C1 | C | C5 | 1.0° | 0.3° |
| C2 | C1 | C | H1 | 180.0° | 180.0° |
| C2 | C1 | C | N1 | 178.9° | 180.0° |
| C5 | C | C1 | N1 | 177.9° | 179.7° |
| C5 | C | N1 | C23 | 18.1° | 179.7° |
| C5 | C | N1 | C20 | 152.1° | 66.0° |
| C5 | C | C1 | H1 | 178.9° | 179.8° |
| C1 | C | N1 | C23 | 159.8° | 0.0° |
| C1 | C | N1 | C20 | 25.8° | 113.7° |
| C | C1 | C2 | H8 | 179.4° | 179.9° |
| C1 | C | C5 | H56 | 179.2° | 179.9° |
| C | N1 | C23 | C20 | 140.5° | 118.8° |
| C | N1 | C23 | C28 | 112.7° | 75.6° |
| C | N1 | C23 | C22 | 128.8° | 170.8° |
| C | N1 | C20 | C29 | 110.6° | 75.6° |
| C | N1 | C20 | C21 | 133.1° | 170.8° |
| N1 | C | C1 | H1 | 1.1° | 0.0° |
| C | N1 | C20 | H9 | 11.2° | 46.7° |
| C | N1 | C23 | H14 | 7.7° | 46.4° |
| N1 | C | C5 | H56 | 1.2° | 0.2° |
| N1 | C23 | C28 | C22 | 115.9° | 113.0° |
| N1 | C23 | C28 | H14 | 122.0° | 122.0° |
| N1 | C23 | C22 | H14 | 122.3° | 124.2° |
| N1 | C23 | C28 | C29 | 17.1° | 26.2° |
| N1 | C23 | C22 | O | 55.7° | 62.1° |
| C23 | N1 | C20 | C29 | 27.9° | 43.1° |
| C23 | N1 | C20 | C21 | 88.3° | 70.4° |
| C23 | N1 | C20 | H9 | 149.7° | 165.5° |
| N1 | C23 | C22 | H12 | 175.1° | 57.7° |
| N1 | C23 | C22 | H13 | 63.7° | 178.1° |
| N1 | C23 | C28 | H21 | 102.4° | 92.6° |
| N1 | C23 | C28 | H22 | 136.6° | 145.0° |
| C28 | C23 | C22 | H14 | 121.8° | 124.7° |
| C28 | C23 | N1 | C20 | 27.8° | 43.2° |
| C23 | C28 | C29 | H21 | 119.5° | 118.8° |
| C23 | C28 | C29 | H22 | 119.5° | 118.8° |
| C28 | C23 | C22 | O | 60.2° | 48.9° |
| C23 | C28 | C29 | C20 | 0.1° | 0.0° |
| C28 | C23 | C22 | H12 | 59.2° | 168.8° |
| C28 | C23 | C22 | H13 | 179.6° | 70.9° |
| C23 | C28 | H21 | H22 | 121.4° | 122.4° |
| C23 | C28 | C29 | H23 | 119.5° | 118.8° |
| C23 | C28 | C29 | H24 | 119.3° | 118.8° |
| C22 | C23 | N1 | C20 | 90.7° | 70.4° |
| C22 | C23 | C28 | C29 | 98.8° | 86.8° |
| C23 | C22 | O | H12 | 119.4° | 119.8° |
| C23 | C22 | O | H13 | 119.4° | 119.9° |
| C23 | C22 | O | C21 | 30.0° | 54.5° |
| C23 | C22 | H12 | H13 | 121.7° | 120.3° |
| C22 | C23 | C28 | H21 | 141.7° | 154.4° |
| C22 | C23 | C28 | H22 | 20.7° | 32.0° |
| N1 | C20 | C29 | C28 | 16.9° | 26.1° |
| N1 | C20 | C29 | C21 | 114.6° | 113.0° |
| N1 | C20 | C29 | H9 | 123.3° | 122.7° |
| N1 | C20 | C21 | H9 | 123.1° | 124.6° |
| N1 | C20 | C21 | O | 53.3° | 62.1° |
| N1 | C20 | C21 | H10 | 66.4° | 178.1° |
| N1 | C20 | C21 | H11 | 173.0° | 57.7° |
| C20 | N1 | C23 | H14 | 148.3° | 165.2° |
| N1 | C20 | C29 | H23 | 102.5° | 145.0° |
| N1 | C20 | C29 | H24 | 136.3° | 92.7° |
| C28 | C29 | C20 | H23 | 119.4° | 118.9° |
| C28 | C29 | C20 | H24 | 119.4° | 118.8° |
| C28 | C29 | C20 | C21 | 97.7° | 86.9° |
| C28 | C29 | C20 | H9 | 140.2° | 148.8° |
| C29 | C28 | C23 | H14 | 139.1° | 148.2° |
| C29 | C28 | H21 | H22 | 121.4° | 122.4° |
| C28 | C29 | H23 | H24 | 121.8° | 122.3° |
| C22 | O | C21 | C20 | 29.4° | 54.5° |
| C22 | O | C21 | H10 | 90.4° | 174.3° |
| C22 | O | C21 | H11 | 149.1° | 65.3° |
| O | C22 | H12 | H13 | 121.7° | 120.3° |
| O | C22 | C23 | H14 | 178.0° | 173.7° |
| C29 | C20 | C21 | H9 | 121.7° | 124.4° |
| C29 | C20 | C21 | O | 61.9° | 48.9° |
| C29 | C20 | C21 | H10 | 178.4° | 70.8° |
| C29 | C20 | C21 | H11 | 57.8° | 168.7° |
| C20 | C29 | C28 | H21 | 119.4° | 118.8° |
| C20 | C29 | C28 | H22 | 119.6° | 118.8° |
| C20 | C29 | H23 | H24 | 121.8° | 122.3° |
| C20 | C21 | O | H10 | 119.7° | 119.8° |
| C20 | C21 | O | H11 | 119.7° | 119.8° |
| C20 | C21 | H10 | H11 | 120.9° | 120.3° |
| C21 | C20 | C29 | H23 | 143.0° | 32.0° |
| C21 | C20 | C29 | H24 | 21.7° | 154.3° |
| O | C21 | C20 | H9 | 176.3° | 173.3° |
| O | C21 | H10 | H11 | 120.8° | 120.3° |
| C21 | O | C22 | H12 | 149.4° | 65.3° |
| C21 | O | C22 | H13 | 89.5° | 174.3° |
| H1 | C1 | C2 | H8 | 0.6° | 0.0° |
| H2 | C10 | C11 | H3 | 0.2° | 0.1° |
| H6 | C17 | C18 | H7 | 0.5° | 0.1° |
| H9 | C20 | C21 | H10 | 56.6° | 53.6° |
| H9 | C20 | C21 | H11 | 63.9° | 66.9° |
| H9 | C20 | C29 | H23 | 20.8° | 92.3° |
| H9 | C20 | C29 | H24 | 100.4° | 30.0° |
| H12 | C22 | C23 | H14 | 62.6° | 66.5° |
| H13 | C22 | C23 | H14 | 58.6° | 53.8° |
| H14 | C23 | C28 | H21 | 19.6° | 29.4° |
| H14 | C23 | C28 | H22 | 101.3° | 93.0° |
| H15 | C24 | C25 | H16 | 100.1° | 66.1° |
| H15 | C24 | C25 | H17 | 20.6° | 54.2° |
| H15 | C24 | C31 | H27 | 20.8° | 93.4° |
| H15 | C24 | C31 | H28 | 100.3° | 29.2° |
| H18 | C26 | C27 | H20 | 22.7° | 53.1° |
| H19 | C26 | C27 | H20 | 97.6° | 66.9° |
| H20 | C27 | C30 | H25 | 20.9° | 29.7° |
| H20 | C27 | C30 | H26 | 100.1° | 92.8° |
| H21 | C28 | C29 | H23 | 0.0° | 122.3° |
| H21 | C28 | C29 | H24 | 121.2° | 0.0° |
| H22 | C28 | C29 | H23 | 121.0° | 0.0° |
| H22 | C28 | C29 | H24 | 0.2° | 122.4° |
| H25 | C30 | C31 | H27 | 1.0° | 121.5° |
| H25 | C30 | C31 | H28 | 120.1° | 0.9° |
| H26 | C30 | C31 | H27 | 122.0° | 0.2° |
| H26 | C30 | C31 | H28 | 0.9° | 122.2° |
| H29 | C34 | C35 | H31 | 154.8° | 55.0° |
| H29 | C34 | C35 | H32 | 33.6° | 64.9° |
| H29 | C34 | N2 | H58 | 140.6° | 120.0° |
| H30 | C34 | C35 | H31 | 82.4° | 65.1° |
| H30 | C34 | C35 | H32 | 156.5° | 175.0° |
| H30 | C34 | N2 | H58 | 17.7° | 119.9° |
| H33 | C36 | C37 | H35 | 57.1° | 55.0° |
| H33 | C36 | C37 | H36 | 63.9° | 65.0° |
| H34 | C36 | C37 | H35 | 64.1° | 65.0° |
| H34 | C36 | C37 | H36 | 174.9° | 175.1° |
| H37 | C38 | C39 | H39 | 40.3° | 60.0° |
| H37 | C38 | C39 | H40 | 79.8° | 180.0° |
| H38 | C38 | C39 | H39 | 161.0° | 180.0° |
| H38 | C38 | C39 | H40 | 40.9° | 60.0° |
| H39 | C39 | C40 | H41 | 167.0° | 180.0° |
| H39 | C39 | C40 | H42 | 45.6° | 60.0° |
| H40 | C39 | C40 | H41 | 72.9° | 60.0° |
| H40 | C39 | C40 | H42 | 165.7° | 180.0° |
| H41 | C40 | C41 | H43 | 165.9° | 180.0° |
| H41 | C40 | C41 | H44 | 45.9° | 60.0° |
| H42 | C40 | C41 | H43 | 72.7° | 60.0° |
| H42 | C40 | C41 | H44 | 167.3° | 179.9° |
| H43 | C41 | C42 | H45 | 168.7° | 180.0° |
| H43 | C41 | C42 | H46 | 47.8° | 60.0° |
| H44 | C41 | C42 | H45 | 71.3° | 59.9° |
| H44 | C41 | C42 | H46 | 167.9° | 180.0° |
| H45 | C42 | C43 | H47 | 68.2° | 180.0° |
| H45 | C42 | C43 | H48 | 171.9° | 60.0° |
| H45 | C42 | C43 | CL1 | 51.8° | 60.0° |
| H46 | C42 | C43 | H47 | 52.7° | 60.0° |
| H46 | C42 | C43 | H48 | 67.3° | 180.0° |
| H46 | C42 | C43 | CL1 | 172.7° | 60.0° |
| H47 | C43 | H48 | CL1 | 120.0° | 120.0° |
| H50 | C44 | H51 | H52 | 120.0° | 120.0° |
| H53 | C45 | H54 | H55 | 120.0° | 120.0° |
