AKX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C40 | C2 | doub | 1.31Å | 1.33Å | |
| O1 | C1 | sing | 1.43Å | 1.41Å | |
| C2 | C1 | sing | 1.51Å | 1.48Å | |
| C2 | C3 | sing | 1.51Å | 1.51Å | |
| C1 | C10 | sing | 1.53Å | 1.53Å | |
| C3 | O2 | sing | 1.43Å | 1.43Å | |
| C3 | C4 | sing | 1.53Å | 1.54Å | |
| C10 | C5 | sing | 1.51Å | 1.51Å | |
| C4 | C5 | sing | 1.51Å | 1.52Å | |
| C5 | C6 | doub | 1.33Å | 1.35Å | |
| C6 | C7 | sing | 1.47Å | 1.49Å | |
| C7 | C8 | doub | 1.33Å | 1.37Å | |
| C8 | C9 | sing | 1.52Å | 1.51Å | |
| C8 | C14 | sing | 1.50Å | 1.52Å | |
| C15 | C14 | sing | 1.53Å | 1.49Å | |
| C15 | C16 | sing | 1.56Å | 1.55Å | |
| C9 | C11 | sing | 1.53Å | 1.54Å | |
| C18 | C13 | sing | 1.53Å | 1.52Å | |
| C14 | C13 | sing | 1.55Å | 1.54Å | |
| C37 | C38 | doub | 1.38Å | 1.40Å | Aromatic |
| C37 | C36 | sing | 1.38Å | 1.39Å | Aromatic |
| C38 | C39 | sing | 1.38Å | 1.40Å | Aromatic |
| C16 | C17 | sing | 1.55Å | 1.54Å | |
| C11 | C12 | sing | 1.54Å | 1.56Å | |
| C13 | C17 | sing | 1.52Å | 1.54Å | |
| C13 | C12 | sing | 1.51Å | 1.53Å | |
| C36 | C35 | doub | 1.38Å | 1.37Å | Aromatic |
| C39 | C34 | doub | 1.38Å | 1.40Å | Aromatic |
| C17 | C20 | sing | 1.53Å | 1.57Å | |
| C21 | C20 | sing | 1.53Å | 1.54Å | |
| C20 | C22 | sing | 1.53Å | 1.49Å | |
| C35 | C34 | sing | 1.38Å | 1.38Å | Aromatic |
| C34 | C27 | sing | 1.51Å | 1.50Å | |
| C22 | C23 | sing | 1.53Å | 1.55Å | |
| C24 | C23 | sing | 1.53Å | 1.53Å | |
| C24 | C25 | sing | 1.53Å | 1.55Å | |
| C27 | C25 | sing | 1.53Å | 1.53Å | |
| O3 | C25 | sing | 1.43Å | 1.47Å | |
| C25 | C26 | sing | 1.53Å | 1.55Å | |
| C26 | C28 | sing | 1.51Å | 1.54Å | |
| C28 | C33 | doub | 1.38Å | 1.40Å | Aromatic |
| C28 | C29 | sing | 1.38Å | 1.39Å | Aromatic |
| C33 | C32 | sing | 1.38Å | 1.39Å | Aromatic |
| C29 | C30 | doub | 1.38Å | 1.38Å | Aromatic |
| C32 | C31 | doub | 1.38Å | 1.39Å | Aromatic |
| C30 | C31 | sing | 1.38Å | 1.39Å | Aromatic |
| O3 | H1 | sing | 0.97Å | 0.95Å | |
| C27 | H2 | sing | 1.09Å | 1.10Å | |
| C27 | H3 | sing | 1.09Å | 1.10Å | |
| C39 | H4 | sing | 1.08Å | 1.08Å | |
| C38 | H5 | sing | 1.08Å | 1.08Å | |
| C37 | H6 | sing | 1.08Å | 1.08Å | |
| C36 | H7 | sing | 1.08Å | 1.08Å | |
| C35 | H8 | sing | 1.08Å | 1.08Å | |
| C26 | H9 | sing | 1.09Å | 1.10Å | |
| C26 | H10 | sing | 1.09Å | 1.10Å | |
| C33 | H11 | sing | 1.08Å | 1.08Å | |
| C32 | H12 | sing | 1.08Å | 1.08Å | |
| C31 | H13 | sing | 1.08Å | 1.08Å | |
| C30 | H14 | sing | 1.08Å | 1.08Å | |
| C29 | H15 | sing | 1.08Å | 1.08Å | |
| C24 | H16 | sing | 1.09Å | 1.10Å | |
| C24 | H17 | sing | 1.09Å | 1.10Å | |
| C23 | H18 | sing | 1.09Å | 1.10Å | |
| C23 | H19 | sing | 1.09Å | 1.10Å | |
| C22 | H20 | sing | 1.09Å | 1.10Å | |
| C22 | H21 | sing | 1.09Å | 1.10Å | |
| C20 | H22 | sing | 1.09Å | 1.10Å | |
| C21 | H23 | sing | 1.09Å | 1.10Å | |
| C21 | H24 | sing | 1.09Å | 1.10Å | |
| C21 | H25 | sing | 1.09Å | 1.10Å | |
| C17 | H26 | sing | 1.09Å | 1.10Å | |
| C18 | H27 | sing | 1.09Å | 1.10Å | |
| C18 | H28 | sing | 1.09Å | 1.10Å | |
| C18 | H29 | sing | 1.09Å | 1.10Å | |
| C12 | H30 | sing | 1.09Å | 1.10Å | |
| C12 | H31 | sing | 1.09Å | 1.10Å | |
| C11 | H32 | sing | 1.09Å | 1.10Å | |
| C11 | H33 | sing | 1.09Å | 1.10Å | |
| C9 | H34 | sing | 1.09Å | 1.10Å | |
| C9 | H35 | sing | 1.09Å | 1.10Å | |
| C16 | H36 | sing | 1.09Å | 1.10Å | |
| C16 | H37 | sing | 1.09Å | 1.10Å | |
| C15 | H38 | sing | 1.09Å | 1.10Å | |
| C15 | H39 | sing | 1.09Å | 1.10Å | |
| C14 | H40 | sing | 1.09Å | 1.10Å | |
| C7 | H41 | sing | 1.08Å | 1.08Å | |
| C6 | H42 | sing | 1.08Å | 1.08Å | |
| C10 | H43 | sing | 1.09Å | 1.10Å | |
| C10 | H44 | sing | 1.09Å | 1.10Å | |
| C1 | H45 | sing | 1.09Å | 1.10Å | |
| O1 | H46 | sing | 0.97Å | 0.95Å | |
| C4 | H47 | sing | 1.09Å | 1.10Å | |
| C4 | H48 | sing | 1.09Å | 1.10Å | |
| C3 | H49 | sing | 1.09Å | 1.10Å | |
| O2 | H50 | sing | 0.97Å | 0.95Å | |
| C40 | H51 | sing | 1.08Å | 1.08Å | |
| C40 | H52 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C40 | C2 | C1 | 122.8° | 120.6° |
| C40 | C2 | C3 | 123.6° | 120.7° |
| C2 | C40 | H51 | 120.0° | 120.0° |
| C2 | C40 | H52 | 120.0° | 120.0° |
| O1 | C1 | C2 | 110.9° | 109.7° |
| O1 | C1 | C10 | 110.6° | 109.7° |
| O1 | C1 | H45 | 108.9° | 109.6° |
| C1 | O1 | H46 | 109.5° | 114.1° |
| C1 | C2 | C3 | 113.6° | 118.7° |
| C2 | C1 | C10 | 110.9° | 108.6° |
| C2 | C1 | H45 | 108.0° | 109.6° |
| C2 | C3 | O2 | 107.9° | 109.5° |
| C2 | C3 | C4 | 109.6° | 108.7° |
| C2 | C3 | H49 | 109.1° | 109.8° |
| C1 | C10 | C5 | 115.5° | 108.6° |
| C1 | C10 | H43 | 107.9° | 109.7° |
| C1 | C10 | H44 | 107.9° | 109.8° |
| C10 | C1 | H45 | 107.5° | 109.6° |
| O2 | C3 | C4 | 111.3° | 109.6° |
| O2 | C3 | H49 | 110.2° | 109.6° |
| C3 | O2 | H50 | 109.5° | 114.0° |
| C3 | C4 | C5 | 111.5° | 108.6° |
| C3 | C4 | H47 | 108.9° | 109.6° |
| C3 | C4 | H48 | 109.0° | 109.7° |
| C4 | C3 | H49 | 108.7° | 109.6° |
| C10 | C5 | C4 | 118.9° | 118.8° |
| C10 | C5 | C6 | 121.2° | 120.6° |
| C5 | C10 | H43 | 107.9° | 109.6° |
| C5 | C10 | H44 | 108.0° | 109.6° |
| C4 | C5 | C6 | 119.8° | 120.5° |
| C5 | C4 | H47 | 109.0° | 109.7° |
| C5 | C4 | H48 | 109.0° | 109.6° |
| C5 | C6 | C7 | 124.6° | 120.1° |
| C5 | C6 | H42 | 117.7° | 119.9° |
| C6 | C7 | C8 | 120.7° | 120.0° |
| C6 | C7 | H41 | 119.6° | 120.0° |
| C7 | C6 | H42 | 117.7° | 120.0° |
| C7 | C8 | C9 | 123.1° | 122.4° |
| C7 | C8 | C14 | 126.1° | 122.4° |
| C8 | C7 | H41 | 119.7° | 120.0° |
| C9 | C8 | C14 | 110.7° | 115.2° |
| C8 | C9 | C11 | 107.9° | 110.7° |
| C8 | C9 | H34 | 109.9° | 109.2° |
| C8 | C9 | H35 | 109.9° | 109.2° |
| C8 | C14 | C15 | 120.5° | 116.7° |
| C8 | C14 | C13 | 113.2° | 105.5° |
| C8 | C14 | H40 | 104.7° | 111.1° |
| C14 | C15 | C16 | 101.2° | 102.8° |
| C15 | C14 | C13 | 107.5° | 101.3° |
| C14 | C15 | H38 | 111.5° | 110.8° |
| C14 | C15 | H39 | 111.5° | 110.8° |
| C15 | C14 | H40 | 104.9° | 110.7° |
| C15 | C16 | C17 | 109.6° | 106.3° |
| C15 | C16 | H36 | 109.4° | 110.1° |
| C15 | C16 | H37 | 109.4° | 110.2° |
| C16 | C15 | H38 | 111.5° | 110.8° |
| C16 | C15 | H39 | 111.5° | 110.7° |
| C9 | C11 | C12 | 111.4° | 111.7° |
| C9 | C11 | H32 | 109.0° | 109.0° |
| C9 | C11 | H33 | 109.0° | 109.0° |
| C11 | C9 | H34 | 109.9° | 109.2° |
| C11 | C9 | H35 | 109.9° | 109.2° |
| C18 | C13 | C14 | 107.9° | 108.6° |
| C18 | C13 | C17 | 114.9° | 109.2° |
| C18 | C13 | C12 | 108.6° | 109.3° |
| C13 | C18 | H27 | 109.5° | 109.5° |
| C13 | C18 | H28 | 109.5° | 109.5° |
| C13 | C18 | H29 | 109.5° | 109.5° |
| C14 | C13 | C17 | 99.9° | 103.2° |
| C14 | C13 | C12 | 107.5° | 107.6° |
| C13 | C14 | H40 | 104.5° | 110.9° |
| C38 | C37 | C36 | 120.2° | 120.0° |
| C37 | C38 | C39 | 119.1° | 120.0° |
| C37 | C38 | H5 | 120.5° | 120.0° |
| C38 | C37 | H6 | 119.9° | 120.0° |
| C37 | C36 | C35 | 120.3° | 120.0° |
| C36 | C37 | H6 | 119.9° | 120.0° |
| C37 | C36 | H7 | 119.8° | 120.0° |
| C38 | C39 | C34 | 119.7° | 120.1° |
| C38 | C39 | H4 | 120.1° | 120.0° |
| C39 | C38 | H5 | 120.4° | 120.1° |
| C16 | C17 | C13 | 101.6° | 105.1° |
| C16 | C17 | C20 | 109.5° | 110.3° |
| C16 | C17 | H26 | 106.2° | 110.4° |
| C17 | C16 | H36 | 109.4° | 110.1° |
| C17 | C16 | H37 | 109.4° | 110.1° |
| C11 | C12 | C13 | 111.4° | 107.5° |
| C11 | C12 | H30 | 109.0° | 109.8° |
| C11 | C12 | H31 | 109.0° | 109.9° |
| C12 | C11 | H32 | 109.0° | 109.0° |
| C12 | C11 | H33 | 109.0° | 109.0° |
| C17 | C13 | C12 | 117.0° | 118.3° |
| C13 | C17 | C20 | 126.2° | 110.3° |
| C13 | C17 | H26 | 106.1° | 110.3° |
| C13 | C12 | H30 | 109.0° | 109.9° |
| C13 | C12 | H31 | 109.0° | 109.8° |
| C36 | C35 | C34 | 120.6° | 120.0° |
| C35 | C36 | H7 | 119.8° | 120.0° |
| C36 | C35 | H8 | 119.7° | 120.0° |
| C39 | C34 | C35 | 120.1° | 120.0° |
| C39 | C34 | C27 | 122.3° | 120.0° |
| C34 | C39 | H4 | 120.2° | 120.0° |
| C17 | C20 | C21 | 113.7° | 109.5° |
| C17 | C20 | C22 | 116.8° | 109.4° |
| C17 | C20 | H22 | 105.7° | 109.5° |
| C20 | C17 | H26 | 105.8° | 110.3° |
| C21 | C20 | C22 | 107.4° | 109.5° |
| C21 | C20 | H22 | 106.0° | 109.5° |
| C20 | C21 | H23 | 109.5° | 109.5° |
| C20 | C21 | H24 | 109.4° | 109.5° |
| C20 | C21 | H25 | 109.5° | 109.5° |
| C20 | C22 | C23 | 109.8° | 109.4° |
| C20 | C22 | H20 | 109.4° | 109.5° |
| C20 | C22 | H21 | 109.4° | 109.5° |
| C22 | C20 | H22 | 106.5° | 109.5° |
| C35 | C34 | C27 | 117.6° | 120.0° |
| C34 | C35 | H8 | 119.7° | 120.0° |
| C34 | C27 | C25 | 116.7° | 109.4° |
| C34 | C27 | H2 | 107.6° | 109.4° |
| C34 | C27 | H3 | 107.6° | 109.5° |
| C22 | C23 | C24 | 112.3° | 109.5° |
| C22 | C23 | H18 | 108.8° | 109.5° |
| C22 | C23 | H19 | 108.7° | 109.5° |
| C23 | C22 | H20 | 109.4° | 109.4° |
| C23 | C22 | H21 | 109.4° | 109.4° |
| C23 | C24 | C25 | 114.4° | 109.5° |
| C23 | C24 | H16 | 108.3° | 109.5° |
| C23 | C24 | H17 | 108.2° | 109.4° |
| C24 | C23 | H18 | 108.8° | 109.5° |
| C24 | C23 | H19 | 108.8° | 109.5° |
| C24 | C25 | C27 | 107.6° | 109.4° |
| C24 | C25 | O3 | 111.2° | 109.4° |
| C24 | C25 | C26 | 113.8° | 109.5° |
| C25 | C24 | H16 | 108.2° | 109.5° |
| C25 | C24 | H17 | 108.2° | 109.5° |
| C27 | C25 | O3 | 106.2° | 109.5° |
| C27 | C25 | C26 | 107.5° | 109.5° |
| C25 | C27 | H2 | 107.7° | 109.5° |
| C25 | C27 | H3 | 107.6° | 109.5° |
| O3 | C25 | C26 | 110.1° | 109.4° |
| C25 | O3 | H1 | 109.5° | 114.0° |
| C25 | C26 | C28 | 118.7° | 109.5° |
| C25 | C26 | H9 | 107.1° | 109.4° |
| C25 | C26 | H10 | 107.1° | 109.5° |
| C26 | C28 | C33 | 121.2° | 120.0° |
| C26 | C28 | C29 | 120.8° | 120.0° |
| C28 | C26 | H9 | 107.1° | 109.4° |
| C28 | C26 | H10 | 107.1° | 109.5° |
| C33 | C28 | C29 | 117.9° | 120.0° |
| C28 | C33 | C32 | 121.0° | 120.0° |
| C28 | C33 | H11 | 119.5° | 120.0° |
| C28 | C29 | C30 | 121.4° | 120.0° |
| C28 | C29 | H15 | 119.3° | 120.0° |
| C33 | C32 | C31 | 120.1° | 120.0° |
| C32 | C33 | H11 | 119.5° | 120.0° |
| C33 | C32 | H12 | 120.0° | 120.0° |
| C29 | C30 | C31 | 120.3° | 120.0° |
| C29 | C30 | H14 | 119.8° | 120.0° |
| C30 | C29 | H15 | 119.3° | 119.9° |
| C32 | C31 | C30 | 119.3° | 120.0° |
| C31 | C32 | H12 | 119.9° | 119.9° |
| C32 | C31 | H13 | 120.4° | 120.0° |
| C30 | C31 | H13 | 120.4° | 120.0° |
| C31 | C30 | H14 | 119.9° | 120.0° |
| H2 | C27 | H3 | 109.5° | 109.5° |
| H9 | C26 | H10 | 109.5° | 109.5° |
| H16 | C24 | H17 | 109.5° | 109.5° |
| H18 | C23 | H19 | 109.5° | 109.5° |
| H20 | C22 | H21 | 109.5° | 109.5° |
| H23 | C21 | H24 | 109.5° | 109.5° |
| H23 | C21 | H25 | 109.5° | 109.5° |
| H24 | C21 | H25 | 109.5° | 109.5° |
| H27 | C18 | H28 | 109.4° | 109.4° |
| H27 | C18 | H29 | 109.5° | 109.4° |
| H28 | C18 | H29 | 109.5° | 109.4° |
| H30 | C12 | H31 | 109.5° | 109.8° |
| H32 | C11 | H33 | 109.4° | 109.1° |
| H34 | C9 | H35 | 109.5° | 109.2° |
| H36 | C16 | H37 | 109.5° | 110.0° |
| H38 | C15 | H39 | 109.4° | 110.8° |
| H43 | C10 | H44 | 109.4° | 109.6° |
| H47 | C4 | H48 | 109.5° | 109.6° |
| H51 | C40 | H52 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C40 | C2 | C1 | O1 | 0.7° | 115.4° |
| C40 | C2 | C1 | C3 | 179.8° | 179.7° |
| C40 | C2 | C1 | C10 | 122.5° | 124.7° |
| C40 | C2 | C3 | O2 | 121.7° | 5.0° |
| C40 | C2 | C3 | C4 | 117.0° | 124.7° |
| C40 | C2 | C1 | H45 | 120.0° | 5.0° |
| C40 | C2 | C3 | H49 | 1.9° | 115.4° |
| C2 | C40 | H51 | H52 | 180.0° | 180.0° |
| O1 | C1 | C2 | C10 | 123.3° | 119.9° |
| O1 | C1 | C2 | H45 | 119.3° | 120.4° |
| O1 | C1 | C2 | C3 | 179.4° | 64.3° |
| O1 | C1 | C10 | H45 | 118.8° | 120.4° |
| O1 | C1 | C10 | C5 | 164.3° | 70.4° |
| O1 | C1 | C10 | H43 | 43.4° | 169.8° |
| O1 | C1 | C10 | H44 | 74.8° | 49.4° |
| C2 | C1 | C10 | H45 | 117.8° | 119.7° |
| C1 | C2 | C3 | O2 | 58.5° | 175.3° |
| C1 | C2 | C3 | C4 | 62.8° | 55.6° |
| C2 | C1 | C10 | C5 | 40.8° | 49.5° |
| C2 | C1 | C10 | H43 | 80.1° | 70.2° |
| C2 | C1 | C10 | H44 | 161.7° | 169.3° |
| C2 | C1 | O1 | H46 | 180.0° | 60.8° |
| C1 | C2 | C3 | H49 | 178.3° | 64.3° |
| C1 | C2 | C40 | H51 | 179.8° | 0.0° |
| C1 | C2 | C40 | H52 | 0.2° | 180.0° |
| C3 | C2 | C1 | C10 | 57.3° | 55.6° |
| C2 | C3 | O2 | C4 | 120.3° | 119.1° |
| C2 | C3 | O2 | H49 | 119.1° | 120.6° |
| C2 | C3 | C4 | H49 | 119.2° | 120.0° |
| C2 | C3 | C4 | C5 | 50.1° | 49.5° |
| C3 | C2 | C1 | H45 | 60.2° | 175.3° |
| C2 | C3 | C4 | H47 | 170.4° | 169.3° |
| C2 | C3 | C4 | H48 | 70.3° | 70.3° |
| C2 | C3 | O2 | H50 | 180.0° | 60.9° |
| C3 | C2 | C40 | H51 | 0.0° | 179.7° |
| C3 | C2 | C40 | H52 | 180.0° | 0.3° |
| C1 | C10 | C5 | H43 | 120.9° | 119.8° |
| C1 | C10 | C5 | H44 | 120.9° | 119.9° |
| C1 | C10 | C5 | C4 | 33.2° | 55.0° |
| C1 | C10 | C5 | C6 | 149.0° | 124.7° |
| C1 | C10 | H43 | H44 | 117.2° | 120.6° |
| C10 | C1 | O1 | H46 | 56.6° | 180.0° |
| O2 | C3 | C4 | H49 | 121.5° | 120.3° |
| O2 | C3 | C4 | C5 | 69.2° | 169.1° |
| O2 | C3 | C4 | H47 | 51.1° | 71.1° |
| O2 | C3 | C4 | H48 | 170.4° | 49.4° |
| C3 | C4 | C5 | C10 | 37.6° | 55.0° |
| C3 | C4 | C5 | H47 | 120.3° | 119.8° |
| C3 | C4 | C5 | H48 | 120.3° | 119.8° |
| C3 | C4 | C5 | C6 | 144.6° | 124.7° |
| C3 | C4 | H47 | H48 | 119.0° | 120.5° |
| C4 | C3 | O2 | H50 | 59.7° | 180.0° |
| C10 | C5 | C4 | C6 | 177.8° | 179.7° |
| C10 | C5 | C6 | C7 | 1.6° | 174.2° |
| C10 | C5 | C6 | H42 | 178.4° | 5.8° |
| C5 | C10 | H43 | H44 | 117.3° | 120.3° |
| C5 | C10 | C1 | H45 | 76.9° | 169.2° |
| C10 | C5 | C4 | H47 | 157.9° | 174.7° |
| C10 | C5 | C4 | H48 | 82.7° | 64.9° |
| C4 | C5 | C6 | C7 | 179.3° | 5.5° |
| C4 | C5 | C6 | H42 | 0.7° | 174.5° |
| C4 | C5 | C10 | H43 | 87.7° | 64.8° |
| C4 | C5 | C10 | H44 | 154.1° | 174.9° |
| C5 | C4 | H47 | H48 | 119.1° | 120.4° |
| C5 | C4 | C3 | H49 | 169.2° | 70.5° |
| C5 | C6 | C7 | H42 | 180.0° | 180.0° |
| C5 | C6 | C7 | C8 | 171.9° | 174.2° |
| C5 | C6 | C7 | H41 | 8.1° | 5.7° |
| C6 | C5 | C10 | H43 | 90.1° | 115.5° |
| C6 | C5 | C10 | H44 | 28.1° | 4.8° |
| C6 | C5 | C4 | H47 | 24.3° | 5.0° |
| C6 | C5 | C4 | H48 | 95.1° | 115.4° |
| C6 | C7 | C8 | H41 | 180.0° | 179.9° |
| C6 | C7 | C8 | C9 | 0.2° | 0.0° |
| C6 | C7 | C8 | C14 | 177.9° | 180.0° |
| C7 | C8 | C9 | C14 | 178.0° | 180.0° |
| C7 | C8 | C14 | C15 | 12.2° | 10.3° |
| C7 | C8 | C9 | C11 | 119.0° | 129.7° |
| C7 | C8 | C14 | C13 | 117.0° | 121.8° |
| C7 | C8 | C9 | H34 | 121.3° | 9.5° |
| C7 | C8 | C9 | H35 | 0.8° | 109.9° |
| C7 | C8 | C14 | H40 | 129.8° | 117.9° |
| C8 | C7 | C6 | H42 | 8.1° | 5.8° |
| C9 | C8 | C14 | C15 | 169.9° | 169.7° |
| C8 | C9 | C11 | H34 | 119.7° | 120.3° |
| C8 | C9 | C11 | H35 | 119.7° | 120.3° |
| C9 | C8 | C14 | C13 | 60.9° | 58.2° |
| C8 | C9 | C11 | C12 | 58.1° | 48.6° |
| C8 | C9 | C11 | H32 | 178.4° | 71.9° |
| C8 | C9 | C11 | H33 | 62.2° | 169.1° |
| C8 | C9 | H34 | H35 | 120.7° | 119.4° |
| C9 | C8 | C14 | H40 | 52.3° | 62.1° |
| C9 | C8 | C7 | H41 | 179.9° | 180.0° |
| C8 | C14 | C15 | C13 | 131.7° | 113.9° |
| C8 | C14 | C15 | H40 | 117.5° | 128.4° |
| C8 | C14 | C15 | C16 | 161.2° | 156.2° |
| C14 | C8 | C9 | C11 | 59.1° | 50.3° |
| C8 | C14 | C13 | C18 | 60.4° | 51.7° |
| C8 | C14 | C13 | H40 | 113.3° | 120.3° |
| C8 | C14 | C13 | C17 | 179.2° | 167.6° |
| C8 | C14 | C13 | C12 | 56.6° | 66.6° |
| C14 | C8 | C9 | H34 | 60.7° | 170.5° |
| C14 | C8 | C9 | H35 | 178.8° | 70.0° |
| C8 | C14 | C15 | H38 | 42.6° | 85.4° |
| C8 | C14 | C15 | H39 | 80.1° | 37.9° |
| C14 | C8 | C7 | H41 | 2.2° | 0.0° |
| C14 | C15 | C16 | H38 | 118.7° | 118.4° |
| C14 | C15 | C16 | H39 | 118.7° | 118.3° |
| C15 | C14 | C13 | C18 | 75.2° | 70.4° |
| C15 | C14 | C13 | H40 | 111.1° | 117.6° |
| C14 | C15 | C16 | C17 | 2.7° | 24.1° |
| C15 | C14 | C13 | C17 | 45.2° | 45.5° |
| C15 | C14 | C13 | C12 | 167.8° | 171.3° |
| C14 | C15 | C16 | H36 | 122.7° | 95.1° |
| C14 | C15 | C16 | H37 | 117.3° | 143.4° |
| C14 | C15 | H38 | H39 | 123.9° | 123.4° |
| C16 | C15 | C14 | C13 | 29.5° | 42.2° |
| C15 | C16 | C17 | H36 | 120.0° | 119.2° |
| C15 | C16 | C17 | H37 | 120.0° | 119.4° |
| C15 | C16 | C17 | C13 | 24.2° | 4.0° |
| C15 | C16 | C17 | C20 | 159.6° | 122.9° |
| C15 | C16 | C17 | H26 | 86.6° | 114.9° |
| C15 | C16 | H36 | H37 | 120.0° | 121.6° |
| C16 | C15 | H38 | H39 | 123.8° | 123.2° |
| C16 | C15 | C14 | H40 | 81.3° | 75.4° |
| C9 | C11 | C12 | H32 | 120.3° | 120.6° |
| C9 | C11 | C12 | H33 | 120.3° | 120.5° |
| C9 | C11 | C12 | C13 | 57.7° | 59.0° |
| C9 | C11 | C12 | H30 | 62.6° | 178.6° |
| C9 | C11 | C12 | H31 | 178.0° | 60.5° |
| C9 | C11 | H32 | H33 | 119.1° | 118.9° |
| C11 | C9 | H34 | H35 | 120.8° | 119.4° |
| C18 | C13 | C14 | C17 | 120.4° | 115.9° |
| C18 | C13 | C14 | C12 | 117.0° | 118.3° |
| C18 | C13 | C17 | C16 | 75.1° | 85.2° |
| C18 | C13 | C12 | C11 | 62.3° | 49.7° |
| C18 | C13 | C17 | C12 | 129.3° | 125.9° |
| C18 | C13 | C17 | C20 | 49.9° | 33.7° |
| C18 | C13 | C17 | H26 | 174.1° | 155.8° |
| C13 | C18 | H27 | H28 | 120.0° | 120.0° |
| C13 | C18 | H27 | H29 | 120.0° | 120.1° |
| C13 | C18 | H28 | H29 | 120.0° | 120.1° |
| C18 | C13 | C12 | H30 | 177.4° | 69.8° |
| C18 | C13 | C12 | H31 | 58.0° | 169.3° |
| C18 | C13 | C14 | H40 | 173.6° | 172.1° |
| C14 | C13 | C17 | C16 | 40.1° | 30.2° |
| C14 | C13 | C12 | C11 | 54.2° | 68.1° |
| C14 | C13 | C17 | C12 | 115.6° | 118.7° |
| C14 | C13 | C17 | C20 | 165.0° | 149.2° |
| C14 | C13 | C17 | H26 | 70.7° | 88.8° |
| C14 | C13 | C18 | H27 | 180.0° | 178.9° |
| C14 | C13 | C18 | H28 | 60.0° | 61.1° |
| C14 | C13 | C18 | H29 | 60.0° | 58.9° |
| C14 | C13 | C12 | H30 | 66.1° | 172.4° |
| C14 | C13 | C12 | H31 | 174.5° | 51.5° |
| C13 | C14 | C15 | H38 | 89.1° | 160.6° |
| C13 | C14 | C15 | H39 | 148.2° | 76.0° |
| C38 | C37 | C36 | H6 | 180.0° | 180.0° |
| C37 | C38 | C39 | H5 | 180.0° | 179.9° |
| C38 | C37 | C36 | C35 | 0.5° | 0.2° |
| C37 | C38 | C39 | C34 | 0.2° | 0.0° |
| C37 | C38 | C39 | H4 | 179.8° | 180.0° |
| C38 | C37 | C36 | H7 | 179.5° | 179.9° |
| C36 | C37 | C38 | C39 | 0.1° | 0.1° |
| C37 | C36 | C35 | H7 | 180.0° | 179.9° |
| C37 | C36 | C35 | C34 | 0.5° | 0.5° |
| C36 | C37 | C38 | H5 | 179.9° | 180.0° |
| C37 | C36 | C35 | H8 | 179.5° | 180.0° |
| C38 | C39 | C34 | H4 | 180.0° | 180.0° |
| C38 | C39 | C34 | C35 | 0.2° | 0.3° |
| C38 | C39 | C34 | C27 | 179.5° | 180.0° |
| C39 | C38 | C37 | H6 | 179.9° | 179.9° |
| C16 | C17 | C13 | C20 | 124.9° | 118.9° |
| C16 | C17 | C13 | H26 | 110.8° | 119.0° |
| C16 | C17 | C13 | C12 | 155.7° | 148.9° |
| C16 | C17 | C20 | H26 | 114.0° | 122.2° |
| C16 | C17 | C20 | C21 | 39.7° | 177.1° |
| C16 | C17 | C20 | C22 | 165.7° | 62.9° |
| C16 | C17 | C20 | H22 | 76.1° | 57.1° |
| C17 | C16 | H36 | H37 | 119.9° | 121.5° |
| C17 | C16 | C15 | H38 | 116.0° | 142.5° |
| C17 | C16 | C15 | H39 | 121.4° | 94.2° |
| C11 | C12 | C13 | C17 | 165.5° | 175.6° |
| C11 | C12 | C13 | H30 | 120.3° | 119.5° |
| C11 | C12 | C13 | H31 | 120.3° | 119.6° |
| C11 | C12 | H30 | H31 | 119.1° | 121.0° |
| C12 | C11 | H32 | H33 | 119.1° | 118.9° |
| C12 | C11 | C9 | H34 | 61.6° | 168.9° |
| C12 | C11 | C9 | H35 | 177.9° | 71.7° |
| C13 | C17 | C20 | H26 | 124.4° | 122.1° |
| C13 | C17 | C20 | C21 | 81.8° | 61.4° |
| C13 | C17 | C20 | C22 | 44.1° | 178.6° |
| C13 | C17 | C20 | H22 | 162.4° | 58.6° |
| C17 | C13 | C18 | H27 | 69.6° | 67.0° |
| C17 | C13 | C18 | H28 | 170.5° | 173.0° |
| C17 | C13 | C18 | H29 | 50.5° | 53.0° |
| C17 | C13 | C12 | H30 | 45.2° | 56.1° |
| C17 | C13 | C12 | H31 | 74.2° | 64.8° |
| C13 | C17 | C16 | H36 | 95.8° | 123.1° |
| C13 | C17 | C16 | H37 | 144.2° | 115.4° |
| C17 | C13 | C14 | H40 | 65.9° | 72.1° |
| C12 | C13 | C17 | C20 | 79.4° | 92.2° |
| C12 | C13 | C17 | H26 | 44.9° | 29.9° |
| C12 | C13 | C18 | H27 | 63.7° | 63.9° |
| C12 | C13 | C18 | H28 | 56.3° | 56.1° |
| C12 | C13 | C18 | H29 | 176.3° | 176.1° |
| C13 | C12 | H30 | H31 | 119.1° | 120.9° |
| C13 | C12 | C11 | H32 | 178.0° | 61.5° |
| C13 | C12 | C11 | H33 | 62.6° | 179.5° |
| C12 | C13 | C14 | H40 | 56.7° | 53.8° |
| C36 | C35 | C34 | C39 | 0.2° | 0.5° |
| C36 | C35 | C34 | H8 | 180.0° | 179.6° |
| C36 | C35 | C34 | C27 | 179.9° | 179.8° |
| C35 | C36 | C37 | H6 | 179.5° | 179.8° |
| C39 | C34 | C35 | C27 | 179.7° | 179.7° |
| C39 | C34 | C27 | C25 | 95.1° | 90.0° |
| C39 | C34 | C27 | H2 | 25.9° | 30.0° |
| C39 | C34 | C27 | H3 | 143.9° | 150.0° |
| C34 | C39 | C38 | H5 | 179.8° | 179.9° |
| C39 | C34 | C35 | H8 | 179.8° | 179.9° |
| C17 | C20 | C21 | C22 | 130.8° | 120.0° |
| C17 | C20 | C21 | H22 | 115.6° | 120.0° |
| C17 | C20 | C22 | H22 | 117.8° | 120.0° |
| C17 | C20 | C22 | C23 | 176.5° | 175.0° |
| C17 | C20 | C22 | H20 | 56.5° | 65.1° |
| C17 | C20 | C22 | H21 | 63.4° | 55.0° |
| C17 | C20 | C21 | H23 | 180.0° | 60.0° |
| C17 | C20 | C21 | H24 | 60.0° | 180.0° |
| C17 | C20 | C21 | H25 | 60.0° | 60.0° |
| C20 | C17 | C16 | H36 | 39.6° | 117.9° |
| C20 | C17 | C16 | H37 | 80.4° | 3.5° |
| C21 | C20 | C22 | H22 | 113.2° | 120.0° |
| C21 | C20 | C22 | C23 | 54.4° | 65.0° |
| C21 | C20 | C22 | H20 | 174.4° | 54.9° |
| C21 | C20 | C22 | H21 | 65.7° | 175.0° |
| C20 | C21 | H23 | H24 | 120.0° | 120.0° |
| C20 | C21 | H23 | H25 | 120.0° | 120.0° |
| C20 | C21 | H24 | H25 | 120.0° | 120.0° |
| C21 | C20 | C17 | H26 | 153.8° | 60.6° |
| C20 | C22 | C23 | H20 | 120.0° | 120.0° |
| C20 | C22 | C23 | H21 | 120.1° | 120.0° |
| C20 | C22 | C23 | C24 | 111.9° | 180.0° |
| C20 | C22 | C23 | H18 | 8.5° | 60.0° |
| C20 | C22 | C23 | H19 | 127.7° | 60.0° |
| C20 | C22 | H20 | H21 | 119.9° | 120.1° |
| C22 | C20 | C21 | H23 | 49.2° | 180.0° |
| C22 | C20 | C21 | H24 | 70.8° | 60.0° |
| C22 | C20 | C21 | H25 | 169.2° | 60.0° |
| C22 | C20 | C17 | H26 | 80.3° | 59.4° |
| C35 | C34 | C27 | C25 | 85.2° | 90.3° |
| C35 | C34 | C27 | H2 | 153.8° | 149.8° |
| C35 | C34 | C27 | H3 | 35.8° | 29.7° |
| C35 | C34 | C39 | H4 | 179.8° | 179.7° |
| C34 | C35 | C36 | H7 | 179.5° | 179.6° |
| C34 | C27 | C25 | C24 | 59.7° | 175.0° |
| C34 | C27 | C25 | H2 | 121.0° | 119.9° |
| C34 | C27 | C25 | H3 | 121.0° | 120.0° |
| C34 | C27 | C25 | O3 | 59.5° | 65.0° |
| C34 | C27 | C25 | C26 | 177.3° | 55.0° |
| C34 | C27 | H2 | H3 | 116.7° | 120.0° |
| C27 | C34 | C39 | H4 | 0.5° | 0.0° |
| C27 | C34 | C35 | H8 | 0.1° | 0.2° |
| C22 | C23 | C24 | H18 | 120.4° | 120.0° |
| C22 | C23 | C24 | H19 | 120.4° | 120.0° |
| C22 | C23 | C24 | C25 | 174.9° | 175.5° |
| C22 | C23 | C24 | H16 | 54.1° | 55.4° |
| C22 | C23 | C24 | H17 | 64.4° | 64.6° |
| C22 | C23 | H18 | H19 | 118.7° | 120.0° |
| C23 | C22 | H20 | H21 | 119.8° | 120.0° |
| C23 | C22 | C20 | H22 | 58.8° | 55.0° |
| C23 | C24 | C25 | H16 | 120.7° | 120.0° |
| C23 | C24 | C25 | H17 | 120.7° | 119.9° |
| C23 | C24 | C25 | C27 | 173.8° | 161.7° |
| C23 | C24 | C25 | O3 | 57.9° | 41.7° |
| C23 | C24 | C25 | C26 | 67.2° | 78.2° |
| C23 | C24 | H16 | H17 | 117.8° | 119.9° |
| C24 | C23 | H18 | H19 | 118.7° | 120.0° |
| C24 | C23 | C22 | H20 | 128.1° | 60.0° |
| C24 | C23 | C22 | H21 | 8.2° | 60.0° |
| C24 | C25 | C27 | O3 | 119.1° | 120.0° |
| C24 | C25 | C27 | C26 | 123.0° | 120.0° |
| C24 | C25 | O3 | C26 | 127.1° | 120.0° |
| C24 | C25 | C26 | C28 | 51.3° | 61.1° |
| C24 | C25 | O3 | H1 | 180.0° | 60.0° |
| C24 | C25 | C27 | H2 | 61.4° | 55.1° |
| C24 | C25 | C27 | H3 | 179.3° | 65.0° |
| C24 | C25 | C26 | H9 | 172.6° | 58.8° |
| C24 | C25 | C26 | H10 | 70.0° | 178.8° |
| C25 | C24 | H16 | H17 | 117.8° | 120.0° |
| C25 | C24 | C23 | H18 | 64.7° | 64.6° |
| C25 | C24 | C23 | H19 | 54.5° | 55.4° |
| C27 | C25 | O3 | C26 | 116.1° | 120.0° |
| C27 | C25 | C26 | C28 | 67.8° | 178.9° |
| C27 | C25 | O3 | H1 | 63.2° | 59.9° |
| C25 | C27 | H2 | H3 | 116.7° | 120.1° |
| C27 | C25 | C26 | H9 | 53.5° | 61.2° |
| C27 | C25 | C26 | H10 | 170.9° | 58.8° |
| C27 | C25 | C24 | H16 | 65.5° | 41.7° |
| C27 | C25 | C24 | H17 | 53.1° | 78.3° |
| O3 | C25 | C26 | C28 | 176.9° | 58.8° |
| O3 | C25 | C27 | H2 | 179.5° | 175.0° |
| O3 | C25 | C27 | H3 | 61.6° | 54.9° |
| O3 | C25 | C26 | H9 | 61.8° | 178.8° |
| O3 | C25 | C26 | H10 | 55.6° | 61.2° |
| O3 | C25 | C24 | H16 | 178.6° | 78.3° |
| O3 | C25 | C24 | H17 | 62.8° | 161.7° |
| C25 | C26 | C28 | H9 | 121.3° | 119.9° |
| C25 | C26 | C28 | H10 | 121.3° | 120.1° |
| C25 | C26 | C28 | C33 | 87.6° | 105.6° |
| C25 | C26 | C28 | C29 | 94.7° | 74.7° |
| C26 | C25 | O3 | H1 | 52.9° | 180.0° |
| C26 | C25 | C27 | H2 | 61.6° | 64.9° |
| C26 | C25 | C27 | H3 | 56.3° | 174.9° |
| C25 | C26 | H9 | H10 | 115.8° | 120.0° |
| C26 | C25 | C24 | H16 | 53.6° | 161.8° |
| C26 | C25 | C24 | H17 | 172.1° | 41.7° |
| C26 | C28 | C33 | C29 | 177.7° | 179.7° |
| C26 | C28 | C33 | C32 | 178.8° | 180.0° |
| C26 | C28 | C29 | C30 | 177.4° | 179.8° |
| C28 | C26 | H9 | H10 | 115.8° | 120.0° |
| C26 | C28 | C33 | H11 | 1.2° | 0.0° |
| C26 | C28 | C29 | H15 | 2.6° | 0.0° |
| C28 | C33 | C32 | H11 | 180.0° | 180.0° |
| C33 | C28 | C29 | C30 | 0.3° | 0.5° |
| C28 | C33 | C32 | C31 | 1.6° | 0.0° |
| C33 | C28 | C26 | H9 | 33.7° | 14.4° |
| C33 | C28 | C26 | H10 | 151.1° | 134.4° |
| C28 | C33 | C32 | H12 | 178.4° | 179.9° |
| C33 | C28 | C29 | H15 | 179.7° | 179.7° |
| C29 | C28 | C33 | C32 | 1.1° | 0.3° |
| C28 | C29 | C30 | H15 | 180.0° | 179.7° |
| C28 | C29 | C30 | C31 | 1.1° | 0.5° |
| C29 | C28 | C26 | H9 | 144.0° | 165.3° |
| C29 | C28 | C26 | H10 | 26.6° | 45.4° |
| C29 | C28 | C33 | H11 | 178.9° | 179.7° |
| C28 | C29 | C30 | H14 | 178.9° | 179.7° |
| C33 | C32 | C31 | H12 | 180.0° | 179.9° |
| C33 | C32 | C31 | C30 | 0.8° | 0.0° |
| C33 | C32 | C31 | H13 | 179.2° | 179.9° |
| C29 | C30 | C31 | C32 | 0.6° | 0.2° |
| C29 | C30 | C31 | H14 | 180.0° | 179.8° |
| C29 | C30 | C31 | H13 | 179.4° | 179.8° |
| C32 | C31 | C30 | H13 | 180.0° | 180.0° |
| C31 | C32 | C33 | H11 | 178.4° | 180.0° |
| C32 | C31 | C30 | H14 | 179.5° | 180.0° |
| C30 | C31 | C32 | H12 | 179.2° | 179.9° |
| C31 | C30 | C29 | H15 | 178.9° | 179.8° |
| H4 | C39 | C38 | H5 | 0.2° | 0.1° |
| H5 | C38 | C37 | H6 | 0.2° | 0.0° |
| H6 | C37 | C36 | H7 | 0.5° | 0.1° |
| H7 | C36 | C35 | H8 | 0.5° | 0.1° |
| H11 | C33 | C32 | H12 | 1.6° | 0.1° |
| H12 | C32 | C31 | H13 | 0.8° | 0.0° |
| H13 | C31 | C30 | H14 | 0.5° | 0.0° |
| H14 | C30 | C29 | H15 | 1.1° | 0.0° |
| H16 | C24 | C23 | H18 | 174.6° | 175.4° |
| H16 | C24 | C23 | H19 | 66.2° | 64.6° |
| H17 | C24 | C23 | H18 | 56.0° | 55.4° |
| H17 | C24 | C23 | H19 | 175.2° | 175.4° |
| H18 | C23 | C22 | H20 | 111.5° | 180.0° |
| H18 | C23 | C22 | H21 | 128.6° | 60.0° |
| H19 | C23 | C22 | H20 | 7.6° | 60.0° |
| H19 | C23 | C22 | H21 | 112.3° | 180.0° |
| H20 | C22 | C20 | H22 | 61.3° | 175.0° |
| H21 | C22 | C20 | H22 | 178.8° | 65.0° |
| H22 | C20 | C21 | H23 | 64.4° | 60.0° |
| H22 | C20 | C21 | H24 | 175.6° | 60.0° |
| H22 | C20 | C21 | H25 | 55.6° | 180.0° |
| H22 | C20 | C17 | H26 | 38.0° | 179.4° |
| H23 | C21 | H24 | H25 | 120.0° | 120.0° |
| H26 | C17 | C16 | H36 | 153.4° | 4.2° |
| H26 | C17 | C16 | H37 | 33.5° | 125.7° |
| H27 | C18 | H28 | H29 | 120.0° | 119.9° |
| H30 | C12 | C11 | H32 | 57.7° | 58.0° |
| H30 | C12 | C11 | H33 | 177.1° | 60.9° |
| H31 | C12 | C11 | H32 | 61.7° | 179.0° |
| H31 | C12 | C11 | H33 | 57.7° | 60.0° |
| H32 | C11 | C9 | H34 | 58.7° | 48.4° |
| H32 | C11 | C9 | H35 | 61.8° | 167.8° |
| H33 | C11 | C9 | H34 | 178.1° | 70.6° |
| H33 | C11 | C9 | H35 | 57.6° | 48.8° |
| H36 | C16 | C15 | H38 | 4.1° | 23.3° |
| H36 | C16 | C15 | H39 | 118.6° | 146.6° |
| H37 | C16 | C15 | H38 | 124.0° | 98.2° |
| H37 | C16 | C15 | H39 | 1.4° | 25.1° |
| H38 | C15 | C14 | H40 | 160.0° | 43.0° |
| H39 | C15 | C14 | H40 | 37.4° | 166.3° |
| H41 | C7 | C6 | H42 | 171.8° | 174.3° |
| H43 | C10 | C1 | H45 | 162.2° | 49.4° |
| H44 | C10 | C1 | H45 | 44.0° | 71.1° |
| H45 | C1 | O1 | H46 | 61.3° | 59.6° |
| H47 | C4 | C3 | H49 | 70.5° | 49.3° |
| H48 | C4 | C3 | H49 | 48.9° | 169.7° |
| H49 | C3 | O2 | H50 | 60.9° | 59.6° |
