KZO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O10 | C41 | sing | 1.43Å | 1.42Å | |
| C41 | C40 | sing | 1.53Å | 1.51Å | |
| O12 | C39 | sing | 1.43Å | 1.42Å | |
| C40 | C39 | sing | 1.53Å | 1.52Å | |
| C40 | O11 | sing | 1.43Å | 1.44Å | |
| C39 | C38 | sing | 1.53Å | 1.52Å | |
| O11 | C36 | sing | 1.43Å | 1.41Å | |
| C38 | O13 | sing | 1.43Å | 1.43Å | |
| C38 | C37 | sing | 1.53Å | 1.51Å | |
| C31 | C29 | sing | 1.53Å | 1.52Å | |
| O8 | C23 | sing | 1.43Å | 1.42Å | |
| C36 | C37 | sing | 1.53Å | 1.52Å | |
| C36 | O9 | sing | 1.43Å | 1.40Å | |
| C22 | C23 | sing | 1.55Å | 1.53Å | |
| C22 | C21 | sing | 1.53Å | 1.54Å | |
| C23 | C24 | sing | 1.55Å | 1.55Å | |
| C37 | O14 | sing | 1.43Å | 1.42Å | |
| C15 | C14 | sing | 1.51Å | 1.54Å | |
| C15 | C16 | sing | 1.51Å | 1.54Å | |
| C29 | C28 | sing | 1.53Å | 1.53Å | |
| C29 | C30 | sing | 1.53Å | 1.52Å | |
| C29 | O6 | sing | 1.43Å | 1.43Å | |
| C28 | C27 | sing | 1.55Å | 1.52Å | |
| C28 | O7 | sing | 1.44Å | 1.44Å | |
| C27 | C26 | sing | 1.55Å | 1.52Å | |
| C34 | C20 | sing | 1.53Å | 1.54Å | |
| O9 | C14 | sing | 1.43Å | 1.44Å | |
| C26 | C25 | sing | 1.54Å | 1.54Å | |
| C14 | C10 | sing | 1.52Å | 1.55Å | |
| C16 | C21 | sing | 1.51Å | 1.55Å | |
| C16 | C17 | sing | 1.52Å | 1.54Å | |
| C21 | C20 | sing | 1.55Å | 1.56Å | |
| C21 | C33 | sing | 1.53Å | 1.55Å | |
| C24 | C20 | sing | 1.53Å | 1.56Å | |
| C24 | C25 | sing | 1.53Å | 1.54Å | |
| O7 | C25 | sing | 1.43Å | 1.46Å | |
| C20 | C19 | sing | 1.52Å | 1.53Å | |
| C25 | C32 | sing | 1.53Å | 1.52Å | |
| C12 | C11 | sing | 1.53Å | 1.53Å | |
| C35 | C17 | sing | 1.55Å | 1.52Å | |
| C35 | C9 | sing | 1.53Å | 1.51Å | |
| C17 | C9 | sing | 1.52Å | 1.54Å | |
| C17 | C18 | sing | 1.54Å | 1.53Å | |
| C10 | C11 | sing | 1.53Å | 1.56Å | |
| C10 | C9 | sing | 1.53Å | 1.54Å | |
| C13 | C11 | sing | 1.53Å | 1.54Å | |
| C11 | C6 | sing | 1.53Å | 1.53Å | |
| C9 | C8 | sing | 1.53Å | 1.51Å | |
| C18 | C19 | sing | 1.53Å | 1.55Å | |
| C6 | O5 | sing | 1.43Å | 1.44Å | |
| C6 | C7 | sing | 1.53Å | 1.52Å | |
| C8 | C7 | sing | 1.53Å | 1.52Å | |
| O5 | C1 | sing | 1.43Å | 1.40Å | |
| O4 | C2 | sing | 1.43Å | 1.42Å | |
| C1 | C2 | sing | 1.53Å | 1.52Å | |
| C1 | O1 | sing | 1.43Å | 1.43Å | |
| C2 | C3 | sing | 1.53Å | 1.52Å | |
| O1 | C5 | sing | 1.43Å | 1.44Å | |
| C3 | O3 | sing | 1.43Å | 1.42Å | |
| C3 | C4 | sing | 1.53Å | 1.52Å | |
| C5 | C4 | sing | 1.53Å | 1.52Å | |
| C4 | O2 | sing | 1.43Å | 1.43Å | |
| C4 | H1 | sing | 1.09Å | 1.10Å | |
| C5 | H2 | sing | 1.09Å | 1.10Å | |
| C5 | H3 | sing | 1.09Å | 1.10Å | |
| C6 | H4 | sing | 1.09Å | 1.10Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C7 | H6 | sing | 1.09Å | 1.10Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.09Å | 1.10Å | |
| C13 | H10 | sing | 1.09Å | 1.10Å | |
| C13 | H11 | sing | 1.09Å | 1.10Å | |
| C13 | H12 | sing | 1.09Å | 1.10Å | |
| C15 | H13 | sing | 1.09Å | 1.10Å | |
| C15 | H14 | sing | 1.09Å | 1.10Å | |
| C22 | H15 | sing | 1.09Å | 1.10Å | |
| C22 | H16 | sing | 1.09Å | 1.10Å | |
| C24 | H17 | sing | 1.09Å | 1.10Å | |
| C26 | H18 | sing | 1.09Å | 1.10Å | |
| C26 | H19 | sing | 1.09Å | 1.10Å | |
| C28 | H20 | sing | 1.09Å | 1.10Å | |
| C1 | H21 | sing | 1.09Å | 1.10Å | |
| C12 | H22 | sing | 1.09Å | 1.10Å | |
| C12 | H23 | sing | 1.09Å | 1.10Å | |
| C12 | H24 | sing | 1.09Å | 1.10Å | |
| C14 | H25 | sing | 1.09Å | 1.10Å | |
| C16 | H26 | sing | 1.09Å | 1.10Å | |
| C18 | H27 | sing | 1.09Å | 1.10Å | |
| C18 | H28 | sing | 1.09Å | 1.10Å | |
| C19 | H29 | sing | 1.09Å | 1.10Å | |
| C19 | H30 | sing | 1.09Å | 1.10Å | |
| C2 | H31 | sing | 1.09Å | 1.10Å | |
| C23 | H32 | sing | 1.09Å | 1.10Å | |
| C27 | H33 | sing | 1.09Å | 1.10Å | |
| C27 | H34 | sing | 1.09Å | 1.10Å | |
| C3 | H35 | sing | 1.09Å | 1.10Å | |
| C30 | H36 | sing | 1.09Å | 1.10Å | |
| C30 | H37 | sing | 1.09Å | 1.10Å | |
| C30 | H38 | sing | 1.09Å | 1.10Å | |
| C31 | H39 | sing | 1.09Å | 1.10Å | |
| C31 | H40 | sing | 1.09Å | 1.10Å | |
| C31 | H41 | sing | 1.09Å | 1.10Å | |
| C32 | H42 | sing | 1.09Å | 1.10Å | |
| C32 | H43 | sing | 1.09Å | 1.10Å | |
| C32 | H44 | sing | 1.09Å | 1.10Å | |
| C33 | H45 | sing | 1.09Å | 1.10Å | |
| C33 | H46 | sing | 1.09Å | 1.10Å | |
| C33 | H47 | sing | 1.09Å | 1.10Å | |
| C34 | H48 | sing | 1.09Å | 1.10Å | |
| C34 | H49 | sing | 1.09Å | 1.10Å | |
| C34 | H50 | sing | 1.09Å | 1.10Å | |
| C35 | H51 | sing | 1.09Å | 1.10Å | |
| C35 | H52 | sing | 1.09Å | 1.10Å | |
| C36 | H53 | sing | 1.09Å | 1.10Å | |
| C37 | H54 | sing | 1.09Å | 1.10Å | |
| C38 | H55 | sing | 1.09Å | 1.10Å | |
| C39 | H56 | sing | 1.09Å | 1.10Å | |
| C40 | H57 | sing | 1.09Å | 1.10Å | |
| C41 | H58 | sing | 1.09Å | 1.10Å | |
| C41 | H59 | sing | 1.09Å | 1.10Å | |
| O10 | H60 | sing | 0.97Å | 0.95Å | |
| O12 | H61 | sing | 0.97Å | 0.95Å | |
| O13 | H62 | sing | 0.97Å | 0.95Å | |
| O14 | H63 | sing | 0.97Å | 0.95Å | |
| O2 | H64 | sing | 0.97Å | 0.95Å | |
| O3 | H65 | sing | 0.97Å | 0.95Å | |
| O4 | H66 | sing | 0.97Å | 0.95Å | |
| O6 | H67 | sing | 0.97Å | 0.95Å | |
| O8 | H68 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O10 | C41 | C40 | 109.2° | 109.4° |
| O10 | C41 | H58 | 109.6° | 109.5° |
| O10 | C41 | H59 | 109.5° | 109.5° |
| C41 | O10 | H60 | 109.5° | 114.0° |
| C41 | C40 | C39 | 113.5° | 109.4° |
| C41 | C40 | O11 | 106.4° | 109.5° |
| C41 | C40 | H57 | 108.7° | 109.5° |
| C40 | C41 | H58 | 109.5° | 109.4° |
| C40 | C41 | H59 | 109.6° | 109.5° |
| O12 | C39 | C40 | 108.8° | 109.6° |
| O12 | C39 | C38 | 109.3° | 109.5° |
| O12 | C39 | H56 | 110.5° | 109.5° |
| C39 | O12 | H61 | 109.5° | 114.1° |
| C39 | C40 | O11 | 110.2° | 109.4° |
| C40 | C39 | C38 | 110.1° | 109.2° |
| C40 | C39 | H56 | 109.0° | 109.6° |
| C39 | C40 | H57 | 108.5° | 109.5° |
| C40 | O11 | C36 | 113.6° | 114.1° |
| O11 | C40 | H57 | 109.5° | 109.5° |
| C39 | C38 | O13 | 110.4° | 109.6° |
| C39 | C38 | C37 | 110.7° | 109.0° |
| C39 | C38 | H55 | 108.4° | 109.6° |
| C38 | C39 | H56 | 109.2° | 109.5° |
| O11 | C36 | C37 | 109.8° | 109.4° |
| O11 | C36 | O9 | 109.7° | 109.4° |
| O11 | C36 | H53 | 110.6° | 109.5° |
| O13 | C38 | C37 | 109.3° | 109.6° |
| O13 | C38 | H55 | 109.5° | 109.5° |
| C38 | O13 | H62 | 109.5° | 114.0° |
| C38 | C37 | C36 | 110.4° | 109.2° |
| C38 | C37 | O14 | 110.1° | 109.5° |
| C38 | C37 | H54 | 108.5° | 109.5° |
| C37 | C38 | H55 | 108.5° | 109.5° |
| C31 | C29 | C28 | 111.0° | 109.5° |
| C31 | C29 | C30 | 110.5° | 109.5° |
| C31 | C29 | O6 | 108.1° | 109.4° |
| C29 | C31 | H39 | 109.5° | 109.5° |
| C29 | C31 | H40 | 109.4° | 109.5° |
| C29 | C31 | H41 | 109.5° | 109.4° |
| O8 | C23 | C22 | 112.0° | 110.1° |
| O8 | C23 | C24 | 119.2° | 110.1° |
| O8 | C23 | H32 | 107.7° | 110.0° |
| C23 | O8 | H68 | 109.5° | 114.0° |
| C37 | C36 | O9 | 106.7° | 109.5° |
| C36 | C37 | O14 | 109.8° | 109.5° |
| C37 | C36 | H53 | 109.1° | 109.5° |
| C36 | C37 | H54 | 108.3° | 109.5° |
| C36 | O9 | C14 | 119.4° | 114.0° |
| O9 | C36 | H53 | 110.8° | 109.5° |
| C23 | C22 | C21 | 105.4° | 103.0° |
| C22 | C23 | C24 | 104.7° | 106.4° |
| C23 | C22 | H15 | 110.5° | 110.8° |
| C23 | C22 | H16 | 110.5° | 110.7° |
| C22 | C23 | H32 | 106.3° | 110.1° |
| C22 | C21 | C16 | 115.2° | 115.9° |
| C22 | C21 | C20 | 103.0° | 102.2° |
| C22 | C21 | C33 | 106.9° | 109.7° |
| C21 | C22 | H15 | 110.5° | 110.7° |
| C21 | C22 | H16 | 110.5° | 110.7° |
| C23 | C24 | C20 | 97.3° | 105.5° |
| C23 | C24 | C25 | 115.2° | 110.3° |
| C23 | C24 | H17 | 106.4° | 110.4° |
| C24 | C23 | H32 | 106.2° | 110.1° |
| O14 | C37 | H54 | 109.7° | 109.5° |
| C37 | O14 | H63 | 109.5° | 114.0° |
| C14 | C15 | C16 | 117.8° | 116.5° |
| C15 | C14 | O9 | 110.5° | 109.1° |
| C15 | C14 | C10 | 115.6° | 111.6° |
| C14 | C15 | H13 | 107.4° | 108.0° |
| C14 | C15 | H14 | 107.4° | 108.0° |
| C15 | C14 | H25 | 106.3° | 109.1° |
| C15 | C16 | C21 | 117.9° | 109.8° |
| C15 | C16 | C17 | 113.7° | 115.5° |
| C16 | C15 | H13 | 107.4° | 108.1° |
| C16 | C15 | H14 | 107.3° | 108.1° |
| C15 | C16 | H26 | 104.3° | 106.7° |
| C28 | C29 | C30 | 112.1° | 109.5° |
| C28 | C29 | O6 | 105.1° | 109.5° |
| C29 | C28 | C27 | 116.8° | 110.3° |
| C29 | C28 | O7 | 109.6° | 110.3° |
| C29 | C28 | H20 | 108.7° | 110.4° |
| C30 | C29 | O6 | 109.8° | 109.5° |
| C29 | C30 | H36 | 109.5° | 109.4° |
| C29 | C30 | H37 | 109.5° | 109.5° |
| C29 | C30 | H38 | 109.4° | 109.5° |
| C29 | O6 | H67 | 109.5° | 114.0° |
| C27 | C28 | O7 | 102.9° | 105.1° |
| C28 | C27 | C26 | 98.5° | 101.0° |
| C27 | C28 | H20 | 108.8° | 110.3° |
| C28 | C27 | H33 | 112.2° | 111.1° |
| C28 | C27 | H34 | 112.1° | 111.2° |
| C28 | O7 | C25 | 109.0° | 110.0° |
| O7 | C28 | H20 | 109.8° | 110.3° |
| C27 | C26 | C25 | 104.7° | 102.3° |
| C27 | C26 | H18 | 110.7° | 110.8° |
| C27 | C26 | H19 | 110.7° | 111.0° |
| C26 | C27 | H33 | 112.1° | 111.1° |
| C26 | C27 | H34 | 112.2° | 111.2° |
| C34 | C20 | C21 | 110.5° | 110.5° |
| C34 | C20 | C24 | 109.7° | 110.9° |
| C34 | C20 | C19 | 109.4° | 110.3° |
| C20 | C34 | H48 | 109.5° | 109.4° |
| C20 | C34 | H49 | 109.5° | 109.4° |
| C20 | C34 | H50 | 109.5° | 109.5° |
| O9 | C14 | C10 | 110.3° | 109.1° |
| O9 | C14 | H25 | 107.5° | 109.0° |
| C26 | C25 | C24 | 113.8° | 109.8° |
| C26 | C25 | O7 | 103.4° | 107.6° |
| C26 | C25 | C32 | 110.4° | 109.8° |
| C25 | C26 | H18 | 110.6° | 110.9° |
| C25 | C26 | H19 | 110.6° | 110.9° |
| C14 | C10 | C11 | 111.5° | 110.8° |
| C14 | C10 | C9 | 117.9° | 108.9° |
| C14 | C10 | H9 | 104.5° | 109.4° |
| C10 | C14 | H25 | 106.2° | 109.1° |
| C21 | C16 | C17 | 110.6° | 111.7° |
| C16 | C21 | C20 | 108.2° | 109.5° |
| C16 | C21 | C33 | 112.5° | 109.5° |
| C21 | C16 | H26 | 104.3° | 106.4° |
| C16 | C17 | C35 | 116.4° | 114.6° |
| C16 | C17 | C9 | 117.2° | 120.0° |
| C16 | C17 | C18 | 116.1° | 118.9° |
| C17 | C16 | H26 | 104.4° | 106.1° |
| C20 | C21 | C33 | 110.6° | 109.7° |
| C21 | C20 | C24 | 99.6° | 103.4° |
| C21 | C20 | C19 | 107.3° | 106.1° |
| C21 | C33 | H45 | 109.5° | 109.5° |
| C21 | C33 | H46 | 109.5° | 109.4° |
| C21 | C33 | H47 | 109.5° | 109.5° |
| C20 | C24 | C25 | 123.8° | 110.2° |
| C24 | C20 | C19 | 119.7° | 115.3° |
| C20 | C24 | H17 | 106.3° | 110.2° |
| C24 | C25 | O7 | 107.6° | 109.8° |
| C24 | C25 | C32 | 114.4° | 109.9° |
| C25 | C24 | H17 | 106.5° | 110.2° |
| O7 | C25 | C32 | 106.4° | 109.9° |
| C20 | C19 | C18 | 110.5° | 107.2° |
| C20 | C19 | H29 | 109.2° | 109.9° |
| C20 | C19 | H30 | 109.2° | 109.9° |
| C25 | C32 | H42 | 109.5° | 109.4° |
| C25 | C32 | H43 | 109.5° | 109.5° |
| C25 | C32 | H44 | 109.5° | 109.4° |
| C12 | C11 | C10 | 111.6° | 109.5° |
| C12 | C11 | C13 | 108.1° | 109.6° |
| C12 | C11 | C6 | 108.4° | 109.6° |
| C11 | C12 | H22 | 109.5° | 109.5° |
| C11 | C12 | H23 | 109.4° | 109.5° |
| C11 | C12 | H24 | 109.5° | 109.5° |
| C17 | C35 | C9 | 60.9° | 59.2° |
| C35 | C17 | C9 | 59.3° | 59.8° |
| C35 | C17 | C18 | 116.9° | 112.8° |
| C17 | C35 | H51 | 119.8° | 117.6° |
| C17 | C35 | H52 | 119.9° | 117.6° |
| C35 | C9 | C17 | 59.8° | 61.0° |
| C35 | C9 | C10 | 122.2° | 115.8° |
| C35 | C9 | C8 | 117.0° | 116.8° |
| C9 | C35 | H51 | 119.8° | 117.6° |
| C9 | C35 | H52 | 119.8° | 117.6° |
| C9 | C17 | C18 | 118.9° | 116.2° |
| C17 | C9 | C10 | 119.9° | 119.1° |
| C17 | C9 | C8 | 119.8° | 118.8° |
| C17 | C18 | C19 | 115.9° | 113.8° |
| C17 | C18 | H27 | 107.9° | 108.6° |
| C17 | C18 | H28 | 107.9° | 108.6° |
| C11 | C10 | C9 | 112.5° | 108.9° |
| C10 | C11 | C13 | 111.8° | 109.5° |
| C10 | C11 | C6 | 108.1° | 109.1° |
| C11 | C10 | H9 | 104.3° | 109.5° |
| C10 | C9 | C8 | 110.2° | 114.7° |
| C9 | C10 | H9 | 104.5° | 109.4° |
| C13 | C11 | C6 | 108.7° | 109.5° |
| C11 | C13 | H10 | 109.5° | 109.4° |
| C11 | C13 | H11 | 109.5° | 109.4° |
| C11 | C13 | H12 | 109.4° | 109.5° |
| C11 | C6 | O5 | 107.8° | 109.4° |
| C11 | C6 | C7 | 113.7° | 110.1° |
| C11 | C6 | H4 | 107.2° | 109.3° |
| C9 | C8 | C7 | 109.9° | 108.5° |
| C9 | C8 | H7 | 109.3° | 109.6° |
| C9 | C8 | H8 | 109.4° | 109.8° |
| C19 | C18 | H27 | 107.8° | 108.6° |
| C19 | C18 | H28 | 107.9° | 108.7° |
| C18 | C19 | H29 | 109.2° | 109.9° |
| C18 | C19 | H30 | 109.2° | 109.9° |
| O5 | C6 | C7 | 112.2° | 109.4° |
| C6 | O5 | C1 | 119.9° | 114.0° |
| O5 | C6 | H4 | 108.4° | 109.4° |
| C6 | C7 | C8 | 111.6° | 109.8° |
| C7 | C6 | H4 | 107.3° | 109.4° |
| C6 | C7 | H5 | 108.9° | 109.5° |
| C6 | C7 | H6 | 108.9° | 109.4° |
| C8 | C7 | H5 | 108.9° | 109.4° |
| C8 | C7 | H6 | 108.9° | 109.4° |
| C7 | C8 | H7 | 109.4° | 109.7° |
| C7 | C8 | H8 | 109.4° | 109.6° |
| O5 | C1 | C2 | 107.7° | 109.5° |
| O5 | C1 | O1 | 110.8° | 109.5° |
| O5 | C1 | H21 | 110.2° | 109.5° |
| O4 | C2 | C1 | 109.3° | 109.5° |
| O4 | C2 | C3 | 110.0° | 109.5° |
| O4 | C2 | H31 | 110.8° | 109.6° |
| C2 | O4 | H66 | 109.5° | 114.0° |
| C2 | C1 | O1 | 109.6° | 109.4° |
| C1 | C2 | C3 | 107.9° | 109.2° |
| C2 | C1 | H21 | 108.6° | 109.5° |
| C1 | C2 | H31 | 109.4° | 109.5° |
| C1 | O1 | C5 | 112.1° | 114.1° |
| O1 | C1 | H21 | 109.9° | 109.5° |
| C2 | C3 | O3 | 111.0° | 109.5° |
| C2 | C3 | C4 | 109.0° | 109.0° |
| C3 | C2 | H31 | 109.4° | 109.6° |
| C2 | C3 | H35 | 108.1° | 109.6° |
| O1 | C5 | C4 | 111.1° | 109.4° |
| O1 | C5 | H2 | 109.1° | 109.4° |
| O1 | C5 | H3 | 109.1° | 109.5° |
| O3 | C3 | C4 | 111.0° | 109.5° |
| O3 | C3 | H35 | 109.5° | 109.7° |
| C3 | O3 | H65 | 109.5° | 114.0° |
| C3 | C4 | C5 | 109.0° | 109.2° |
| C3 | C4 | O2 | 109.9° | 109.5° |
| C3 | C4 | H1 | 109.0° | 109.6° |
| C4 | C3 | H35 | 108.1° | 109.5° |
| C5 | C4 | O2 | 109.6° | 109.5° |
| C5 | C4 | H1 | 109.1° | 109.5° |
| C4 | C5 | H2 | 109.1° | 109.5° |
| C4 | C5 | H3 | 109.1° | 109.5° |
| O2 | C4 | H1 | 110.3° | 109.5° |
| C4 | O2 | H64 | 109.5° | 114.0° |
| H2 | C5 | H3 | 109.4° | 109.5° |
| H5 | C7 | H6 | 109.5° | 109.4° |
| H7 | C8 | H8 | 109.5° | 109.6° |
| H10 | C13 | H11 | 109.5° | 109.5° |
| H10 | C13 | H12 | 109.5° | 109.5° |
| H11 | C13 | H12 | 109.5° | 109.5° |
| H13 | C15 | H14 | 109.5° | 107.9° |
| H15 | C22 | H16 | 109.5° | 110.8° |
| H18 | C26 | H19 | 109.5° | 110.7° |
| H22 | C12 | H23 | 109.5° | 109.4° |
| H22 | C12 | H24 | 109.5° | 109.5° |
| H23 | C12 | H24 | 109.5° | 109.5° |
| H27 | C18 | H28 | 109.4° | 108.4° |
| H29 | C19 | H30 | 109.5° | 110.0° |
| H33 | C27 | H34 | 109.5° | 111.0° |
| H36 | C30 | H37 | 109.5° | 109.4° |
| H36 | C30 | H38 | 109.5° | 109.5° |
| H37 | C30 | H38 | 109.5° | 109.5° |
| H39 | C31 | H40 | 109.5° | 109.5° |
| H39 | C31 | H41 | 109.4° | 109.4° |
| H40 | C31 | H41 | 109.5° | 109.5° |
| H42 | C32 | H43 | 109.5° | 109.5° |
| H42 | C32 | H44 | 109.5° | 109.5° |
| H43 | C32 | H44 | 109.4° | 109.5° |
| H45 | C33 | H46 | 109.5° | 109.5° |
| H45 | C33 | H47 | 109.5° | 109.5° |
| H46 | C33 | H47 | 109.4° | 109.5° |
| H48 | C34 | H49 | 109.5° | 109.5° |
| H48 | C34 | H50 | 109.4° | 109.5° |
| H49 | C34 | H50 | 109.5° | 109.5° |
| H51 | C35 | H52 | 109.5° | 115.7° |
| H58 | C41 | H59 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O10 | C41 | C40 | H58 | 120.0° | 120.0° |
| O10 | C41 | C40 | H59 | 120.0° | 120.0° |
| O10 | C41 | C40 | C39 | 178.6° | 175.0° |
| O10 | C41 | C40 | O11 | 60.1° | 65.1° |
| O10 | C41 | C40 | H57 | 57.8° | 54.9° |
| O10 | C41 | H58 | H59 | 120.1° | 120.1° |
| C41 | C40 | C39 | O12 | 66.7° | 62.5° |
| C41 | C40 | C39 | O11 | 119.2° | 119.9° |
| C41 | C40 | C39 | H57 | 120.9° | 120.0° |
| C41 | C40 | O11 | H57 | 117.3° | 120.1° |
| C41 | C40 | C39 | C38 | 173.6° | 177.6° |
| C41 | C40 | O11 | C36 | 176.5° | 178.9° |
| C41 | C40 | C39 | H56 | 53.9° | 57.7° |
| C40 | C41 | H58 | H59 | 120.1° | 120.0° |
| C40 | C41 | O10 | H60 | 180.0° | 180.0° |
| O12 | C39 | C40 | C38 | 119.7° | 119.9° |
| O12 | C39 | C40 | H56 | 120.6° | 120.2° |
| O12 | C39 | C40 | O11 | 174.2° | 177.6° |
| O12 | C39 | C38 | H56 | 121.0° | 120.0° |
| O12 | C39 | C38 | O13 | 66.6° | 63.1° |
| O12 | C39 | C38 | C37 | 172.3° | 177.0° |
| O12 | C39 | C38 | H55 | 53.4° | 57.1° |
| O12 | C39 | C40 | H57 | 54.2° | 57.5° |
| C39 | C40 | O11 | H57 | 119.3° | 120.0° |
| C40 | C39 | C38 | H56 | 119.7° | 119.9° |
| C39 | C40 | O11 | C36 | 60.1° | 61.2° |
| C40 | C39 | C38 | O13 | 174.0° | 176.9° |
| C40 | C39 | C38 | C37 | 52.9° | 56.9° |
| C40 | C39 | C38 | H55 | 66.0° | 62.9° |
| C39 | C40 | C41 | H58 | 61.4° | 55.1° |
| C39 | C40 | C41 | H59 | 58.6° | 65.0° |
| C40 | C39 | O12 | H61 | 180.0° | 179.7° |
| O11 | C40 | C39 | C38 | 54.5° | 57.6° |
| C40 | O11 | C36 | C37 | 60.9° | 61.2° |
| C40 | O11 | C36 | O9 | 177.9° | 178.8° |
| C40 | O11 | C36 | H53 | 59.6° | 58.9° |
| O11 | C40 | C39 | H56 | 65.3° | 62.3° |
| O11 | C40 | C41 | H58 | 59.9° | 174.9° |
| O11 | C40 | C41 | H59 | 179.9° | 54.9° |
| C39 | C38 | O13 | C37 | 122.0° | 119.6° |
| C39 | C38 | O13 | H55 | 119.3° | 120.2° |
| C39 | C38 | C37 | H55 | 118.8° | 119.9° |
| C39 | C38 | C37 | C36 | 54.0° | 56.9° |
| C39 | C38 | C37 | O14 | 175.4° | 176.9° |
| C39 | C38 | C37 | H54 | 64.6° | 63.0° |
| C38 | C39 | C40 | H57 | 65.5° | 62.4° |
| C38 | C39 | O12 | H61 | 59.8° | 60.0° |
| C39 | C38 | O13 | H62 | 180.0° | 179.6° |
| O11 | C36 | C37 | C38 | 56.9° | 57.6° |
| O11 | C36 | C37 | O9 | 118.8° | 119.9° |
| O11 | C36 | C37 | H53 | 121.4° | 120.0° |
| O11 | C36 | O9 | H53 | 122.4° | 120.0° |
| O11 | C36 | C37 | O14 | 178.5° | 177.5° |
| O11 | C36 | O9 | C14 | 73.6° | 64.3° |
| O11 | C36 | C37 | H54 | 61.8° | 62.3° |
| C36 | O11 | C40 | H57 | 59.2° | 58.8° |
| O13 | C38 | C37 | H55 | 119.4° | 120.2° |
| O13 | C38 | C37 | C36 | 175.7° | 176.9° |
| O13 | C38 | C37 | O14 | 62.9° | 63.2° |
| O13 | C38 | C37 | H54 | 57.2° | 56.9° |
| O13 | C38 | C39 | H56 | 54.4° | 57.0° |
| C38 | C37 | C36 | O14 | 121.6° | 119.9° |
| C38 | C37 | C36 | H54 | 118.6° | 120.0° |
| C38 | C37 | C36 | O9 | 175.7° | 177.5° |
| C38 | C37 | O14 | H54 | 119.3° | 120.1° |
| C38 | C37 | C36 | H53 | 64.5° | 62.4° |
| C37 | C38 | C39 | H56 | 66.8° | 63.0° |
| C37 | C38 | O13 | H62 | 57.9° | 59.9° |
| C38 | C37 | O14 | H63 | 180.0° | 172.0° |
| C31 | C29 | C28 | C30 | 124.1° | 120.0° |
| C31 | C29 | C28 | O6 | 116.7° | 120.0° |
| C31 | C29 | C30 | O6 | 119.2° | 120.0° |
| C31 | C29 | C28 | C27 | 62.4° | 55.0° |
| C31 | C29 | C28 | O7 | 178.9° | 60.7° |
| C31 | C29 | C28 | H20 | 61.1° | 177.1° |
| C31 | C29 | C30 | H36 | 180.0° | 60.0° |
| C31 | C29 | C30 | H37 | 60.0° | 60.0° |
| C31 | C29 | C30 | H38 | 60.0° | 180.0° |
| C29 | C31 | H39 | H40 | 120.0° | 120.0° |
| C29 | C31 | H39 | H41 | 120.0° | 119.9° |
| C29 | C31 | H40 | H41 | 120.0° | 120.0° |
| C31 | C29 | O6 | H67 | 180.0° | 60.0° |
| O8 | C23 | C22 | C24 | 130.5° | 119.2° |
| O8 | C23 | C22 | H32 | 117.4° | 121.5° |
| O8 | C23 | C22 | C21 | 149.8° | 95.6° |
| O8 | C23 | C24 | H32 | 121.7° | 121.5° |
| O8 | C23 | C24 | C20 | 171.3° | 122.3° |
| O8 | C23 | C24 | C25 | 55.9° | 118.7° |
| O8 | C23 | C22 | H15 | 30.4° | 145.9° |
| O8 | C23 | C22 | H16 | 90.8° | 22.7° |
| O8 | C23 | C24 | H17 | 61.9° | 3.3° |
| C37 | C36 | O9 | H53 | 118.7° | 120.1° |
| C36 | C37 | O14 | H54 | 118.9° | 120.1° |
| C37 | C36 | O9 | C14 | 167.4° | 175.8° |
| C36 | C37 | C38 | H55 | 64.9° | 63.0° |
| C36 | C37 | O14 | H63 | 58.2° | 68.3° |
| O9 | C36 | C37 | O14 | 62.7° | 62.5° |
| C36 | O9 | C14 | C15 | 89.7° | 89.5° |
| C36 | O9 | C14 | C10 | 141.3° | 148.5° |
| C36 | O9 | C14 | H25 | 25.9° | 29.5° |
| O9 | C36 | C37 | H54 | 57.1° | 57.6° |
| C23 | C22 | C21 | H15 | 119.4° | 118.5° |
| C23 | C22 | C21 | H16 | 119.4° | 118.3° |
| C22 | C23 | C24 | H32 | 112.3° | 119.3° |
| C23 | C22 | C21 | C16 | 132.2° | 159.9° |
| C23 | C22 | C21 | C20 | 14.7° | 40.9° |
| C23 | C22 | C21 | C33 | 101.9° | 75.4° |
| C22 | C23 | C24 | C20 | 45.2° | 3.1° |
| C22 | C23 | C24 | C25 | 178.0° | 122.0° |
| C23 | C22 | H15 | H16 | 121.9° | 123.2° |
| C22 | C23 | C24 | H17 | 64.2° | 116.0° |
| C22 | C23 | O8 | H68 | 180.0° | 61.4° |
| C21 | C22 | C23 | C24 | 19.3° | 23.6° |
| C22 | C21 | C16 | C15 | 53.0° | 64.7° |
| C22 | C21 | C20 | C34 | 72.7° | 75.3° |
| C22 | C21 | C16 | C20 | 114.5° | 114.9° |
| C22 | C21 | C16 | C33 | 122.9° | 124.8° |
| C22 | C21 | C16 | C17 | 173.8° | 165.8° |
| C22 | C21 | C20 | C33 | 113.9° | 116.4° |
| C22 | C21 | C20 | C24 | 42.7° | 43.3° |
| C22 | C21 | C20 | C19 | 168.1° | 165.1° |
| C21 | C22 | H15 | H16 | 121.9° | 123.2° |
| C22 | C21 | C16 | H26 | 62.1° | 50.4° |
| C21 | C22 | C23 | H32 | 92.8° | 142.9° |
| C22 | C21 | C33 | H45 | 180.0° | 61.9° |
| C22 | C21 | C33 | H46 | 60.0° | 58.1° |
| C22 | C21 | C33 | H47 | 60.0° | 178.1° |
| C23 | C24 | C20 | C34 | 62.6° | 90.0° |
| C23 | C24 | C25 | C26 | 49.2° | 53.5° |
| C23 | C24 | C20 | C21 | 53.4° | 28.4° |
| C23 | C24 | C20 | C25 | 127.0° | 119.0° |
| C23 | C24 | C20 | H17 | 109.5° | 119.2° |
| C23 | C24 | C25 | H17 | 117.7° | 122.1° |
| C23 | C24 | C25 | O7 | 64.7° | 64.5° |
| C23 | C24 | C20 | C19 | 169.7° | 143.7° |
| C23 | C24 | C25 | C32 | 177.4° | 174.5° |
| C24 | C23 | C22 | H15 | 100.1° | 94.8° |
| C24 | C23 | C22 | H16 | 138.7° | 141.9° |
| C24 | C23 | O8 | H68 | 57.4° | 178.4° |
| O14 | C37 | C36 | H53 | 57.1° | 57.5° |
| O14 | C37 | C38 | H55 | 56.5° | 57.0° |
| C14 | C15 | C16 | H13 | 121.2° | 121.7° |
| C14 | C15 | C16 | H14 | 121.2° | 121.8° |
| C15 | C14 | O9 | C10 | 129.0° | 122.1° |
| C15 | C14 | O9 | H25 | 115.6° | 119.0° |
| C15 | C14 | C10 | H25 | 117.6° | 120.6° |
| C14 | C15 | C16 | C21 | 83.3° | 148.8° |
| C14 | C15 | C16 | C17 | 48.6° | 21.4° |
| C15 | C14 | C10 | C11 | 138.7° | 179.4° |
| C15 | C14 | C10 | C9 | 6.3° | 59.7° |
| C15 | C14 | C10 | H9 | 109.1° | 59.8° |
| C14 | C15 | H13 | H14 | 116.2° | 116.5° |
| C14 | C15 | C16 | H26 | 161.7° | 96.2° |
| C16 | C15 | C14 | O9 | 95.9° | 176.2° |
| C16 | C15 | C14 | C10 | 30.2° | 55.7° |
| C15 | C16 | C21 | C17 | 133.2° | 129.5° |
| C15 | C16 | C21 | H26 | 115.1° | 115.1° |
| C15 | C16 | C17 | H26 | 113.1° | 118.0° |
| C15 | C16 | C21 | C20 | 167.5° | 179.6° |
| C15 | C16 | C21 | C33 | 69.9° | 60.1° |
| C15 | C16 | C17 | C35 | 38.0° | 63.1° |
| C15 | C16 | C17 | C9 | 29.3° | 4.9° |
| C15 | C16 | C17 | C18 | 178.3° | 159.3° |
| C16 | C15 | H13 | H14 | 116.2° | 116.6° |
| C16 | C15 | C14 | H25 | 147.7° | 64.9° |
| C28 | C29 | C30 | O6 | 116.4° | 120.0° |
| C29 | C28 | C27 | O7 | 120.1° | 118.9° |
| C29 | C28 | C27 | H20 | 123.4° | 122.2° |
| C29 | C28 | O7 | H20 | 119.3° | 122.2° |
| C29 | C28 | C27 | C26 | 165.7° | 155.3° |
| C29 | C28 | O7 | C25 | 161.0° | 143.4° |
| C29 | C28 | C27 | H33 | 76.2° | 37.4° |
| C29 | C28 | C27 | H34 | 47.5° | 86.7° |
| C28 | C29 | C30 | H36 | 55.6° | 60.0° |
| C28 | C29 | C30 | H37 | 175.7° | 180.0° |
| C28 | C29 | C30 | H38 | 64.4° | 60.0° |
| C28 | C29 | C31 | H39 | 180.0° | 59.9° |
| C28 | C29 | C31 | H40 | 60.0° | 180.0° |
| C28 | C29 | C31 | H41 | 60.0° | 60.0° |
| C28 | C29 | O6 | H67 | 61.4° | 59.9° |
| C30 | C29 | C28 | C27 | 173.5° | 175.0° |
| C30 | C29 | C28 | O7 | 57.0° | 59.3° |
| C30 | C29 | C28 | H20 | 63.0° | 62.8° |
| C29 | C30 | H36 | H37 | 120.0° | 120.0° |
| C29 | C30 | H36 | H38 | 120.0° | 120.0° |
| C29 | C30 | H37 | H38 | 120.0° | 120.0° |
| C30 | C29 | C31 | H39 | 55.0° | 179.9° |
| C30 | C29 | C31 | H40 | 175.0° | 60.0° |
| C30 | C29 | C31 | H41 | 65.0° | 60.0° |
| C30 | C29 | O6 | H67 | 59.3° | 180.0° |
| O6 | C29 | C28 | C27 | 54.3° | 65.0° |
| O6 | C29 | C28 | O7 | 62.2° | 179.3° |
| O6 | C29 | C28 | H20 | 177.8° | 57.2° |
| O6 | C29 | C30 | H36 | 60.8° | 180.0° |
| O6 | C29 | C30 | H37 | 59.2° | 60.0° |
| O6 | C29 | C30 | H38 | 179.2° | 60.0° |
| O6 | C29 | C31 | H39 | 65.2° | 60.0° |
| O6 | C29 | C31 | H40 | 54.8° | 60.0° |
| O6 | C29 | C31 | H41 | 174.8° | 180.0° |
| C27 | C28 | O7 | H20 | 115.7° | 118.9° |
| C28 | C27 | C26 | H33 | 118.2° | 117.9° |
| C28 | C27 | C26 | H34 | 118.2° | 118.0° |
| C28 | C27 | C26 | C25 | 39.2° | 34.1° |
| C27 | C28 | O7 | C25 | 36.1° | 24.4° |
| C28 | C27 | C26 | H18 | 80.0° | 152.4° |
| C28 | C27 | C26 | H19 | 158.4° | 84.2° |
| C28 | C27 | H33 | H34 | 125.1° | 124.2° |
| O7 | C28 | C27 | C26 | 45.6° | 36.4° |
| C28 | O7 | C25 | C26 | 10.5° | 1.7° |
| C28 | O7 | C25 | C24 | 110.2° | 117.8° |
| C28 | O7 | C25 | C32 | 126.8° | 121.2° |
| O7 | C28 | C27 | H33 | 163.7° | 81.5° |
| O7 | C28 | C27 | H34 | 72.6° | 154.4° |
| C27 | C26 | C25 | H18 | 119.2° | 118.2° |
| C27 | C26 | C25 | H19 | 119.3° | 118.4° |
| C27 | C26 | C25 | C24 | 135.5° | 140.8° |
| C27 | C26 | C25 | O7 | 19.1° | 21.3° |
| C27 | C26 | C25 | C32 | 94.3° | 98.2° |
| C27 | C26 | H18 | H19 | 122.3° | 123.6° |
| C26 | C27 | C28 | H20 | 70.9° | 82.5° |
| C26 | C27 | H33 | H34 | 125.1° | 124.2° |
| C34 | C20 | C21 | C16 | 49.7° | 48.1° |
| C34 | C20 | C21 | C24 | 115.4° | 118.7° |
| C34 | C20 | C21 | C19 | 119.3° | 119.6° |
| C34 | C20 | C21 | C33 | 173.4° | 168.3° |
| C34 | C20 | C24 | C19 | 127.7° | 126.3° |
| C34 | C20 | C24 | C25 | 64.4° | 29.0° |
| C34 | C20 | C19 | C18 | 58.9° | 50.3° |
| C34 | C20 | C24 | H17 | 172.1° | 150.9° |
| C34 | C20 | C19 | H29 | 61.3° | 69.1° |
| C34 | C20 | C19 | H30 | 179.0° | 169.7° |
| C20 | C34 | H48 | H49 | 120.0° | 119.9° |
| C20 | C34 | H48 | H50 | 120.0° | 120.1° |
| C20 | C34 | H49 | H50 | 120.0° | 120.0° |
| O9 | C14 | C10 | H25 | 116.2° | 118.9° |
| O9 | C14 | C10 | C11 | 95.1° | 60.0° |
| O9 | C14 | C10 | C9 | 132.5° | 179.8° |
| O9 | C14 | C10 | H9 | 17.1° | 60.7° |
| O9 | C14 | C15 | H13 | 142.9° | 62.0° |
| O9 | C14 | C15 | H14 | 25.3° | 54.4° |
| C14 | O9 | C36 | H53 | 48.8° | 55.7° |
| C26 | C25 | C24 | C20 | 69.7° | 62.5° |
| C26 | C25 | C24 | O7 | 113.9° | 118.1° |
| C26 | C25 | C24 | C32 | 128.2° | 120.9° |
| C26 | C25 | O7 | C32 | 116.3° | 119.5° |
| C26 | C25 | C24 | H17 | 166.9° | 175.6° |
| C25 | C26 | H18 | H19 | 122.2° | 123.5° |
| C25 | C26 | C27 | H33 | 157.3° | 83.8° |
| C25 | C26 | C27 | H34 | 79.0° | 152.1° |
| C26 | C25 | C32 | H42 | 180.0° | 70.3° |
| C26 | C25 | C32 | H43 | 60.0° | 49.7° |
| C26 | C25 | C32 | H44 | 60.0° | 169.7° |
| C14 | C10 | C11 | C12 | 69.5° | 57.0° |
| C14 | C10 | C9 | C35 | 46.5° | 35.6° |
| C14 | C10 | C9 | C17 | 24.6° | 34.0° |
| C14 | C10 | C11 | C9 | 135.0° | 119.7° |
| C14 | C10 | C11 | H9 | 112.2° | 120.7° |
| C14 | C10 | C9 | H9 | 115.5° | 119.5° |
| C14 | C10 | C11 | C13 | 51.8° | 63.2° |
| C14 | C10 | C11 | C6 | 171.4° | 176.9° |
| C14 | C10 | C9 | C8 | 170.1° | 176.2° |
| C10 | C14 | C15 | H13 | 91.0° | 177.5° |
| C10 | C14 | C15 | H14 | 151.3° | 66.1° |
| C21 | C16 | C17 | H26 | 111.6° | 115.6° |
| C16 | C21 | C20 | C33 | 123.7° | 120.2° |
| C16 | C21 | C20 | C24 | 165.1° | 166.8° |
| C16 | C21 | C20 | C19 | 69.5° | 71.5° |
| C21 | C16 | C17 | C35 | 173.3° | 170.5° |
| C21 | C16 | C17 | C9 | 106.1° | 121.5° |
| C21 | C16 | C17 | C18 | 42.9° | 32.8° |
| C21 | C16 | C15 | H13 | 155.5° | 89.4° |
| C21 | C16 | C15 | H14 | 37.9° | 27.1° |
| C16 | C21 | C22 | H15 | 108.5° | 41.4° |
| C16 | C21 | C22 | H16 | 12.8° | 81.8° |
| C16 | C21 | C33 | H45 | 52.5° | 169.8° |
| C16 | C21 | C33 | H46 | 172.6° | 70.2° |
| C16 | C21 | C33 | H47 | 67.5° | 49.8° |
| C17 | C16 | C21 | C20 | 59.2° | 50.9° |
| C17 | C16 | C21 | C33 | 63.3° | 69.4° |
| C16 | C17 | C35 | C9 | 107.3° | 111.7° |
| C16 | C17 | C35 | C18 | 143.4° | 140.2° |
| C16 | C17 | C9 | C18 | 148.1° | 155.0° |
| C16 | C17 | C9 | C10 | 6.0° | 2.4° |
| C16 | C17 | C9 | C8 | 148.3° | 150.9° |
| C16 | C17 | C18 | C19 | 36.1° | 33.1° |
| C17 | C16 | C15 | H13 | 72.6° | 143.2° |
| C17 | C16 | C15 | H14 | 169.8° | 100.3° |
| C16 | C17 | C18 | H27 | 157.0° | 154.2° |
| C16 | C17 | C18 | H28 | 84.9° | 88.0° |
| C16 | C17 | C35 | H51 | 2.4° | 4.4° |
| C16 | C17 | C35 | H52 | 142.9° | 141.0° |
| C21 | C20 | C24 | C19 | 116.4° | 115.3° |
| C21 | C20 | C24 | C25 | 179.6° | 147.4° |
| C21 | C20 | C19 | C18 | 61.1° | 69.4° |
| C20 | C21 | C22 | H15 | 134.0° | 77.5° |
| C20 | C21 | C22 | H16 | 104.7° | 159.3° |
| C21 | C20 | C24 | H17 | 56.2° | 90.8° |
| C20 | C21 | C16 | H26 | 52.4° | 64.5° |
| C21 | C20 | C19 | H29 | 178.8° | 171.3° |
| C21 | C20 | C19 | H30 | 59.1° | 50.1° |
| C20 | C21 | C33 | H45 | 68.6° | 49.6° |
| C20 | C21 | C33 | H46 | 51.4° | 169.6° |
| C20 | C21 | C33 | H47 | 171.4° | 70.4° |
| C21 | C20 | C34 | H48 | 180.0° | 62.5° |
| C21 | C20 | C34 | H49 | 60.0° | 57.5° |
| C21 | C20 | C34 | H50 | 60.0° | 177.5° |
| C33 | C21 | C20 | C24 | 71.2° | 73.0° |
| C33 | C21 | C20 | C19 | 54.2° | 48.7° |
| C33 | C21 | C22 | H15 | 17.4° | 166.1° |
| C33 | C21 | C22 | H16 | 138.7° | 42.9° |
| C33 | C21 | C16 | H26 | 175.0° | 175.2° |
| C21 | C33 | H45 | H46 | 120.0° | 120.0° |
| C21 | C33 | H45 | H47 | 120.0° | 120.0° |
| C21 | C33 | H46 | H47 | 120.0° | 120.0° |
| C20 | C24 | C25 | H17 | 123.4° | 121.9° |
| C20 | C24 | C25 | O7 | 176.4° | 179.4° |
| C20 | C24 | C25 | C32 | 58.5° | 58.4° |
| C24 | C20 | C19 | C18 | 173.3° | 176.9° |
| C24 | C20 | C19 | H29 | 66.5° | 57.5° |
| C24 | C20 | C19 | H30 | 53.2° | 63.7° |
| C20 | C24 | C23 | H32 | 67.1° | 116.2° |
| C24 | C20 | C34 | H48 | 71.1° | 176.5° |
| C24 | C20 | C34 | H49 | 168.9° | 56.5° |
| C24 | C20 | C34 | H50 | 48.8° | 63.5° |
| C24 | C25 | O7 | C32 | 123.0° | 121.0° |
| C25 | C24 | C20 | C19 | 63.3° | 97.3° |
| C24 | C25 | C26 | H18 | 16.2° | 101.0° |
| C24 | C25 | C26 | H19 | 105.2° | 22.4° |
| C25 | C24 | C23 | H32 | 65.8° | 2.8° |
| C24 | C25 | C32 | H42 | 50.1° | 50.6° |
| C24 | C25 | C32 | H43 | 69.9° | 170.6° |
| C24 | C25 | C32 | H44 | 170.1° | 69.3° |
| O7 | C25 | C24 | H17 | 53.0° | 57.5° |
| O7 | C25 | C26 | H18 | 100.1° | 139.5° |
| O7 | C25 | C26 | H19 | 138.4° | 97.1° |
| C25 | O7 | C28 | H20 | 79.6° | 94.5° |
| O7 | C25 | C32 | H42 | 68.5° | 171.5° |
| O7 | C25 | C32 | H43 | 171.5° | 68.5° |
| O7 | C25 | C32 | H44 | 51.5° | 51.6° |
| C20 | C19 | C18 | C17 | 45.1° | 50.4° |
| C20 | C19 | C18 | H29 | 120.2° | 119.4° |
| C20 | C19 | C18 | H30 | 120.1° | 119.4° |
| C19 | C20 | C24 | H17 | 60.2° | 24.6° |
| C20 | C19 | C18 | H27 | 166.0° | 171.6° |
| C20 | C19 | C18 | H28 | 75.9° | 70.7° |
| C20 | C19 | H29 | H30 | 119.5° | 121.1° |
| C19 | C20 | C34 | H48 | 62.0° | 54.5° |
| C19 | C20 | C34 | H49 | 58.0° | 174.5° |
| C19 | C20 | C34 | H50 | 178.0° | 65.5° |
| C32 | C25 | C24 | H17 | 64.9° | 63.5° |
| C32 | C25 | C26 | H18 | 146.5° | 20.0° |
| C32 | C25 | C26 | H19 | 25.0° | 143.4° |
| C25 | C32 | H42 | H43 | 120.0° | 120.0° |
| C25 | C32 | H42 | H44 | 120.0° | 119.9° |
| C25 | C32 | H43 | H44 | 120.0° | 120.0° |
| C12 | C11 | C10 | C13 | 121.3° | 120.2° |
| C12 | C11 | C10 | C6 | 119.1° | 119.9° |
| C12 | C11 | C10 | C9 | 65.6° | 62.8° |
| C12 | C11 | C13 | C6 | 117.5° | 120.3° |
| C12 | C11 | C6 | O5 | 56.6° | 62.8° |
| C12 | C11 | C6 | C7 | 68.5° | 57.4° |
| C12 | C11 | C6 | H4 | 173.1° | 177.5° |
| C12 | C11 | C10 | H9 | 178.3° | 177.6° |
| C12 | C11 | C13 | H10 | 180.0° | 44.6° |
| C12 | C11 | C13 | H11 | 60.0° | 75.4° |
| C12 | C11 | C13 | H12 | 60.0° | 164.6° |
| C11 | C12 | H22 | H23 | 120.0° | 120.0° |
| C11 | C12 | H22 | H24 | 120.0° | 120.0° |
| C11 | C12 | H23 | H24 | 120.0° | 120.0° |
| C17 | C35 | C9 | H51 | 109.7° | 107.2° |
| C17 | C35 | C9 | H52 | 109.8° | 107.2° |
| C35 | C17 | C9 | C18 | 105.9° | 102.3° |
| C35 | C17 | C9 | C10 | 112.1° | 105.1° |
| C17 | C35 | C9 | C8 | 110.5° | 109.7° |
| C35 | C17 | C18 | C19 | 179.6° | 171.5° |
| C35 | C17 | C16 | H26 | 75.1° | 54.9° |
| C35 | C17 | C18 | H27 | 59.4° | 67.4° |
| C35 | C17 | C18 | H28 | 58.7° | 50.3° |
| C17 | C35 | H51 | H52 | 144.3° | 146.0° |
| C35 | C9 | C10 | C11 | 85.4° | 85.3° |
| C35 | C9 | C10 | C8 | 143.4° | 140.6° |
| C35 | C9 | C8 | C7 | 87.4° | 85.6° |
| C35 | C9 | C8 | H7 | 32.7° | 154.7° |
| C35 | C9 | C8 | H8 | 152.5° | 34.2° |
| C35 | C9 | C10 | H9 | 162.0° | 155.1° |
| C9 | C35 | H51 | H52 | 144.2° | 146.2° |
| C17 | C9 | C10 | C11 | 156.5° | 154.9° |
| C17 | C9 | C10 | C8 | 145.5° | 149.8° |
| C9 | C17 | C18 | C19 | 112.3° | 122.2° |
| C17 | C9 | C8 | C7 | 156.3° | 155.5° |
| C17 | C9 | C8 | H7 | 36.3° | 84.7° |
| C17 | C9 | C8 | H8 | 83.6° | 35.8° |
| C17 | C9 | C10 | H9 | 90.9° | 85.5° |
| C9 | C17 | C16 | H26 | 142.3° | 122.9° |
| C9 | C17 | C18 | H27 | 8.6° | 1.0° |
| C9 | C17 | C18 | H28 | 126.7° | 116.7° |
| C18 | C17 | C9 | C10 | 142.1° | 152.6° |
| C18 | C17 | C9 | C8 | 0.2° | 4.1° |
| C17 | C18 | C19 | H27 | 120.9° | 121.1° |
| C17 | C18 | C19 | H28 | 121.0° | 121.1° |
| C18 | C17 | C16 | H26 | 68.7° | 82.8° |
| C17 | C18 | H27 | H28 | 117.1° | 117.8° |
| C17 | C18 | C19 | H29 | 165.2° | 169.8° |
| C17 | C18 | C19 | H30 | 75.1° | 69.0° |
| C18 | C17 | C35 | H51 | 141.1° | 144.6° |
| C18 | C17 | C35 | H52 | 0.5° | 0.8° |
| C11 | C10 | C9 | H9 | 112.6° | 119.6° |
| C10 | C11 | C13 | C6 | 119.2° | 119.6° |
| C11 | C10 | C9 | C8 | 58.0° | 55.3° |
| C10 | C11 | C6 | O5 | 177.7° | 177.3° |
| C10 | C11 | C6 | C7 | 52.6° | 62.5° |
| C10 | C11 | C6 | H4 | 65.8° | 57.6° |
| C10 | C11 | C13 | H10 | 56.8° | 75.6° |
| C10 | C11 | C13 | H11 | 63.2° | 164.4° |
| C10 | C11 | C13 | H12 | 176.8° | 44.4° |
| C10 | C11 | C12 | H22 | 180.0° | 60.0° |
| C10 | C11 | C12 | H23 | 60.0° | 180.0° |
| C10 | C11 | C12 | H24 | 60.0° | 60.1° |
| C11 | C10 | C14 | H25 | 21.1° | 58.9° |
| C9 | C10 | C11 | C13 | 173.2° | 177.0° |
| C9 | C10 | C11 | C6 | 53.5° | 57.2° |
| C10 | C9 | C8 | C7 | 58.1° | 54.6° |
| C10 | C9 | C8 | H7 | 178.2° | 65.2° |
| C10 | C9 | C8 | H8 | 62.0° | 174.4° |
| C9 | C10 | C14 | H25 | 111.3° | 60.9° |
| C10 | C9 | C35 | H51 | 1.3° | 3.3° |
| C10 | C9 | C35 | H52 | 141.8° | 142.3° |
| C13 | C11 | C6 | O5 | 60.8° | 57.4° |
| C13 | C11 | C6 | C7 | 174.2° | 177.6° |
| C13 | C11 | C6 | H4 | 55.7° | 62.2° |
| C13 | C11 | C10 | H9 | 60.4° | 57.4° |
| C11 | C13 | H10 | H11 | 120.0° | 120.0° |
| C11 | C13 | H10 | H12 | 120.0° | 120.0° |
| C11 | C13 | H11 | H12 | 120.0° | 120.0° |
| C13 | C11 | C12 | H22 | 56.6° | 179.8° |
| C13 | C11 | C12 | H23 | 63.4° | 59.9° |
| C13 | C11 | C12 | H24 | 176.7° | 60.1° |
| C11 | C6 | O5 | C7 | 125.9° | 120.6° |
| C11 | C6 | O5 | H4 | 115.7° | 119.6° |
| C11 | C6 | C7 | H4 | 118.4° | 120.1° |
| C11 | C6 | C7 | C8 | 56.1° | 62.4° |
| C11 | C6 | O5 | C1 | 174.4° | 149.4° |
| C11 | C6 | C7 | H5 | 176.4° | 177.5° |
| C11 | C6 | C7 | H6 | 64.2° | 57.6° |
| C6 | C11 | C10 | H9 | 59.2° | 62.4° |
| C6 | C11 | C13 | H10 | 62.5° | 164.8° |
| C6 | C11 | C13 | H11 | 177.5° | 44.8° |
| C6 | C11 | C13 | H12 | 57.5° | 75.2° |
| C6 | C11 | C12 | H22 | 61.1° | 59.6° |
| C6 | C11 | C12 | H23 | 178.9° | 60.3° |
| C6 | C11 | C12 | H24 | 58.9° | 179.7° |
| C9 | C8 | C7 | C6 | 57.4° | 56.3° |
| C9 | C8 | C7 | H7 | 120.1° | 119.7° |
| C9 | C8 | C7 | H8 | 120.1° | 119.9° |
| C9 | C8 | C7 | H5 | 177.7° | 176.4° |
| C9 | C8 | C7 | H6 | 63.0° | 63.7° |
| C9 | C8 | H7 | H8 | 119.8° | 120.6° |
| C8 | C9 | C10 | H9 | 54.7° | 64.3° |
| C8 | C9 | C35 | H51 | 139.8° | 143.0° |
| C8 | C9 | C35 | H52 | 0.7° | 2.5° |
| C19 | C18 | H27 | H28 | 117.1° | 117.9° |
| C18 | C19 | H29 | H30 | 119.5° | 121.2° |
| O5 | C6 | C7 | H4 | 118.9° | 119.7° |
| O5 | C6 | C7 | C8 | 178.8° | 177.4° |
| C6 | O5 | C1 | C2 | 151.4° | 175.0° |
| C6 | O5 | C1 | O1 | 88.7° | 65.1° |
| O5 | C6 | C7 | H5 | 60.9° | 57.3° |
| O5 | C6 | C7 | H6 | 58.5° | 62.5° |
| C6 | O5 | C1 | H21 | 33.1° | 55.0° |
| C6 | C7 | C8 | H5 | 120.3° | 120.1° |
| C6 | C7 | C8 | H6 | 120.3° | 120.1° |
| C7 | C6 | O5 | C1 | 59.7° | 90.0° |
| C6 | C7 | H5 | H6 | 119.0° | 119.9° |
| C6 | C7 | C8 | H7 | 177.4° | 63.4° |
| C6 | C7 | C8 | H8 | 62.7° | 176.2° |
| C8 | C7 | C6 | H4 | 62.3° | 57.7° |
| C8 | C7 | H5 | H6 | 119.0° | 119.8° |
| C7 | C8 | H7 | H8 | 119.8° | 120.4° |
| O5 | C1 | C2 | O4 | 58.3° | 62.5° |
| O5 | C1 | C2 | O1 | 120.6° | 120.0° |
| O5 | C1 | C2 | H21 | 119.3° | 120.0° |
| O5 | C1 | O1 | H21 | 122.0° | 120.0° |
| O5 | C1 | C2 | C3 | 177.9° | 177.6° |
| O5 | C1 | O1 | C5 | 179.2° | 178.8° |
| C1 | O5 | C6 | H4 | 58.7° | 29.8° |
| O5 | C1 | C2 | H31 | 63.2° | 57.7° |
| O4 | C2 | C1 | C3 | 119.6° | 119.8° |
| O4 | C2 | C1 | H31 | 121.5° | 120.2° |
| O4 | C2 | C1 | O1 | 178.9° | 177.5° |
| O4 | C2 | C3 | H31 | 121.9° | 120.2° |
| O4 | C2 | C3 | O3 | 58.9° | 63.3° |
| O4 | C2 | C3 | C4 | 178.5° | 176.9° |
| O4 | C2 | C1 | H21 | 61.0° | 57.5° |
| O4 | C2 | C3 | H35 | 61.2° | 57.0° |
| C2 | C1 | O1 | H21 | 119.3° | 120.0° |
| C1 | C2 | C3 | H31 | 119.0° | 119.9° |
| C2 | C1 | O1 | C5 | 62.1° | 61.2° |
| C1 | C2 | C3 | O3 | 178.0° | 176.8° |
| C1 | C2 | C3 | C4 | 59.4° | 57.0° |
| C1 | C2 | C3 | H35 | 57.9° | 62.9° |
| C1 | C2 | O4 | H66 | 180.0° | 60.0° |
| O1 | C1 | C2 | C3 | 61.5° | 57.7° |
| C1 | O1 | C5 | C4 | 59.5° | 61.1° |
| C1 | O1 | C5 | H2 | 179.8° | 58.8° |
| C1 | O1 | C5 | H3 | 60.8° | 178.8° |
| O1 | C1 | C2 | H31 | 57.5° | 62.3° |
| C2 | C3 | O3 | C4 | 121.4° | 119.5° |
| C2 | C3 | O3 | H35 | 119.3° | 120.3° |
| C2 | C3 | C4 | H35 | 117.3° | 119.8° |
| C2 | C3 | C4 | C5 | 56.7° | 57.0° |
| C2 | C3 | C4 | O2 | 176.8° | 176.9° |
| C2 | C3 | C4 | H1 | 62.2° | 63.0° |
| C3 | C2 | C1 | H21 | 58.6° | 62.3° |
| C2 | C3 | O3 | H65 | 180.0° | 180.0° |
| C3 | C2 | O4 | H66 | 61.7° | 179.6° |
| O1 | C5 | C4 | C3 | 56.0° | 57.6° |
| O1 | C5 | C4 | H2 | 120.3° | 119.9° |
| O1 | C5 | C4 | H3 | 120.2° | 120.0° |
| O1 | C5 | C4 | O2 | 176.2° | 177.5° |
| O1 | C5 | C4 | H1 | 63.0° | 62.4° |
| O1 | C5 | H2 | H3 | 119.2° | 120.0° |
| C5 | O1 | C1 | H21 | 57.2° | 58.8° |
| O3 | C3 | C4 | H35 | 120.1° | 120.3° |
| O3 | C3 | C4 | C5 | 179.3° | 176.8° |
| O3 | C3 | C4 | O2 | 60.6° | 63.3° |
| O3 | C3 | C4 | H1 | 60.4° | 56.8° |
| O3 | C3 | C2 | H31 | 63.0° | 56.8° |
| C3 | C4 | C5 | O2 | 120.3° | 119.9° |
| C3 | C4 | C5 | H1 | 118.9° | 120.0° |
| C3 | C4 | O2 | H1 | 120.2° | 120.2° |
| C3 | C4 | C5 | H2 | 176.2° | 62.3° |
| C3 | C4 | C5 | H3 | 64.3° | 177.6° |
| C4 | C3 | C2 | H31 | 59.6° | 63.0° |
| C3 | C4 | O2 | H64 | 180.0° | 179.8° |
| C4 | C3 | O3 | H65 | 58.7° | 60.5° |
| C5 | C4 | O2 | H1 | 120.1° | 120.0° |
| C4 | C5 | H2 | H3 | 119.3° | 120.1° |
| C5 | C4 | C3 | H35 | 60.6° | 62.9° |
| C5 | C4 | O2 | H64 | 60.3° | 60.1° |
| O2 | C4 | C5 | H2 | 63.5° | 57.6° |
| O2 | C4 | C5 | H3 | 56.0° | 62.4° |
| O2 | C4 | C3 | H35 | 59.5° | 57.0° |
| H1 | C4 | C5 | H2 | 57.3° | 177.7° |
| H1 | C4 | C5 | H3 | 176.8° | 57.6° |
| H1 | C4 | C3 | H35 | 179.6° | 177.2° |
| H1 | C4 | O2 | H64 | 59.8° | 60.0° |
| H4 | C6 | C7 | H5 | 58.0° | 62.4° |
| H4 | C6 | C7 | H6 | 177.4° | 177.7° |
| H5 | C7 | C8 | H7 | 62.3° | 56.7° |
| H5 | C7 | C8 | H8 | 57.6° | 63.7° |
| H6 | C7 | C8 | H7 | 57.1° | 176.5° |
| H6 | C7 | C8 | H8 | 176.9° | 56.1° |
| H9 | C10 | C14 | H25 | 133.3° | 179.6° |
| H10 | C13 | H11 | H12 | 120.0° | 120.1° |
| H13 | C15 | C14 | H25 | 26.5° | 56.9° |
| H13 | C15 | C16 | H26 | 40.4° | 25.5° |
| H14 | C15 | C14 | H25 | 91.1° | 173.3° |
| H14 | C15 | C16 | H26 | 77.2° | 142.0° |
| H15 | C22 | C23 | H32 | 147.8° | 24.5° |
| H16 | C22 | C23 | H32 | 26.5° | 98.8° |
| H17 | C24 | C23 | H32 | 176.5° | 124.7° |
| H18 | C26 | C27 | H33 | 38.1° | 34.5° |
| H18 | C26 | C27 | H34 | 161.8° | 89.6° |
| H19 | C26 | C27 | H33 | 83.4° | 157.9° |
| H19 | C26 | C27 | H34 | 40.2° | 33.8° |
| H20 | C28 | C27 | H33 | 47.2° | 159.6° |
| H20 | C28 | C27 | H34 | 170.9° | 35.5° |
| H21 | C1 | C2 | H31 | 177.6° | 177.7° |
| H22 | C12 | H23 | H24 | 120.0° | 120.0° |
| H27 | C18 | C19 | H29 | 73.8° | 69.0° |
| H27 | C18 | C19 | H30 | 45.8° | 52.2° |
| H28 | C18 | C19 | H29 | 44.3° | 48.7° |
| H28 | C18 | C19 | H30 | 164.0° | 169.9° |
| H31 | C2 | C3 | H35 | 176.9° | 177.2° |
| H31 | C2 | O4 | H66 | 59.4° | 60.2° |
| H32 | C23 | O8 | H68 | 63.4° | 60.1° |
| H35 | C3 | O3 | H65 | 60.6° | 59.7° |
| H36 | C30 | H37 | H38 | 120.0° | 120.1° |
| H39 | C31 | H40 | H41 | 120.0° | 120.0° |
| H42 | C32 | H43 | H44 | 120.0° | 120.0° |
| H45 | C33 | H46 | H47 | 120.0° | 120.0° |
| H48 | C34 | H49 | H50 | 120.0° | 120.0° |
| H53 | C36 | C37 | H54 | 176.8° | 177.6° |
| H54 | C37 | C38 | H55 | 176.5° | 177.1° |
| H54 | C37 | O14 | H63 | 60.7° | 51.9° |
| H55 | C38 | C39 | H56 | 174.4° | 177.1° |
| H55 | C38 | O13 | H62 | 60.8° | 60.2° |
| H56 | C39 | C40 | H57 | 174.8° | 177.7° |
| H56 | C39 | O12 | H61 | 60.3° | 60.1° |
| H57 | C40 | C41 | H58 | 177.7° | 65.0° |
| H57 | C40 | C41 | H59 | 62.2° | 174.9° |
| H58 | C41 | O10 | H60 | 60.0° | 60.1° |
| H59 | C41 | O10 | H60 | 60.0° | 60.0° |
