F8L
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C18 | C17 | sing | 1.51Å | 1.55Å | |
| C17 | C19 | doub | 1.31Å | 1.35Å | |
| C17 | C16 | sing | 1.51Å | 1.56Å | |
| C19 | C20 | sing | 1.51Å | 1.56Å | |
| C20 | C21 | sing | 1.53Å | 1.56Å | |
| C21 | C22 | sing | 1.51Å | 1.56Å | |
| C23 | C22 | sing | 1.51Å | 1.55Å | |
| C22 | C24 | doub | 1.31Å | 1.35Å | |
| O60 | C59 | sing | 1.43Å | 1.42Å | |
| C25 | C24 | sing | 1.51Å | 1.56Å | |
| C25 | C26 | sing | 1.53Å | 1.56Å | |
| C28 | C27 | sing | 1.51Å | 1.55Å | |
| C38 | C37 | sing | 1.51Å | 1.55Å | |
| C48 | C47 | sing | 1.51Å | 1.54Å | |
| C43 | C42 | sing | 1.51Å | 1.54Å | |
| C59 | C57 | sing | 1.55Å | 1.63Å | |
| C59 | C61 | sing | 1.54Å | 1.37Å | |
| C27 | C26 | sing | 1.51Å | 1.56Å | |
| C27 | C29 | doub | 1.31Å | 1.35Å | |
| C57 | O58 | sing | 1.43Å | 1.44Å | |
| C57 | C55 | sing | 1.55Å | 1.33Å | |
| C61 | O56 | sing | 1.44Å | 1.53Å | |
| C61 | C62 | sing | 1.53Å | 1.52Å | |
| C40 | C39 | sing | 1.51Å | 1.56Å | |
| C40 | C41 | sing | 1.53Å | 1.56Å | |
| C37 | C36 | sing | 1.51Å | 1.56Å | |
| C37 | C39 | doub | 1.31Å | 1.35Å | |
| C30 | C29 | sing | 1.51Å | 1.56Å | |
| C30 | C31 | sing | 1.53Å | 1.56Å | |
| C47 | C49 | doub | 1.31Å | 1.34Å | |
| C47 | C46 | sing | 1.51Å | 1.55Å | |
| O56 | C55 | sing | 1.44Å | 1.60Å | |
| C55 | O54 | sing | 1.43Å | 1.39Å | |
| C42 | C41 | sing | 1.51Å | 1.56Å | |
| C42 | C44 | doub | 1.31Å | 1.35Å | |
| C45 | C44 | sing | 1.51Å | 1.55Å | |
| C45 | C46 | sing | 1.53Å | 1.56Å | |
| C49 | C50 | sing | 1.51Å | 1.55Å | |
| C36 | C35 | sing | 1.53Å | 1.56Å | |
| C62 | O63 | sing | 1.43Å | 1.41Å | |
| C31 | C32 | sing | 1.51Å | 1.56Å | |
| C35 | C34 | sing | 1.51Å | 1.56Å | |
| O54 | P52 | sing | 1.61Å | 1.66Å | |
| C50 | O51 | sing | 1.43Å | 1.42Å | |
| C32 | C34 | doub | 1.31Å | 1.36Å | |
| C32 | C33 | sing | 1.51Å | 1.55Å | |
| O51 | P52 | sing | 1.61Å | 1.66Å | |
| P52 | O64 | doub | 1.48Å | 1.51Å | |
| P52 | O53 | sing | 1.61Å | 1.51Å | |
| C16 | H1 | sing | 1.09Å | 1.10Å | |
| C16 | H2 | sing | 1.09Å | 1.10Å | |
| C18 | H5 | sing | 1.09Å | 1.10Å | |
| C18 | H6 | sing | 1.09Å | 1.10Å | |
| C18 | H7 | sing | 1.09Å | 1.10Å | |
| C19 | H8 | sing | 1.08Å | 1.08Å | |
| C20 | H10 | sing | 1.09Å | 1.10Å | |
| C20 | H11 | sing | 1.09Å | 1.10Å | |
| C21 | H12 | sing | 1.09Å | 1.10Å | |
| C21 | H13 | sing | 1.09Å | 1.10Å | |
| C23 | H15 | sing | 1.09Å | 1.10Å | |
| C23 | H16 | sing | 1.09Å | 1.10Å | |
| C23 | H17 | sing | 1.09Å | 1.10Å | |
| C24 | H18 | sing | 1.08Å | 1.08Å | |
| C25 | H20 | sing | 1.09Å | 1.10Å | |
| C25 | H21 | sing | 1.09Å | 1.10Å | |
| C26 | H22 | sing | 1.09Å | 1.10Å | |
| C26 | H23 | sing | 1.09Å | 1.10Å | |
| C28 | H25 | sing | 1.09Å | 1.10Å | |
| C28 | H26 | sing | 1.09Å | 1.10Å | |
| C28 | H27 | sing | 1.09Å | 1.10Å | |
| C29 | H28 | sing | 1.08Å | 1.08Å | |
| C30 | H30 | sing | 1.09Å | 1.10Å | |
| C30 | H31 | sing | 1.09Å | 1.10Å | |
| C31 | H32 | sing | 1.09Å | 1.10Å | |
| C31 | H33 | sing | 1.09Å | 1.10Å | |
| C33 | H35 | sing | 1.09Å | 1.10Å | |
| C33 | H36 | sing | 1.09Å | 1.10Å | |
| C33 | H37 | sing | 1.09Å | 1.10Å | |
| C34 | H38 | sing | 1.08Å | 1.08Å | |
| C35 | H40 | sing | 1.09Å | 1.10Å | |
| C35 | H41 | sing | 1.09Å | 1.10Å | |
| C36 | H42 | sing | 1.09Å | 1.10Å | |
| C36 | H43 | sing | 1.09Å | 1.10Å | |
| C38 | H45 | sing | 1.09Å | 1.10Å | |
| C38 | H46 | sing | 1.09Å | 1.10Å | |
| C38 | H47 | sing | 1.09Å | 1.10Å | |
| C39 | H48 | sing | 1.08Å | 1.08Å | |
| C40 | H50 | sing | 1.09Å | 1.10Å | |
| C40 | H51 | sing | 1.09Å | 1.10Å | |
| C41 | H52 | sing | 1.09Å | 1.10Å | |
| C41 | H53 | sing | 1.09Å | 1.10Å | |
| C43 | H55 | sing | 1.09Å | 1.10Å | |
| C43 | H56 | sing | 1.09Å | 1.10Å | |
| C43 | H57 | sing | 1.09Å | 1.10Å | |
| C44 | H58 | sing | 1.08Å | 1.08Å | |
| C45 | H60 | sing | 1.09Å | 1.10Å | |
| C45 | H61 | sing | 1.09Å | 1.10Å | |
| C46 | H62 | sing | 1.09Å | 1.10Å | |
| C46 | H63 | sing | 1.09Å | 1.10Å | |
| C48 | H65 | sing | 1.09Å | 1.10Å | |
| C48 | H66 | sing | 1.09Å | 1.10Å | |
| C48 | H67 | sing | 1.09Å | 1.10Å | |
| C49 | H68 | sing | 1.08Å | 1.08Å | |
| C50 | H70 | sing | 1.09Å | 1.10Å | |
| C50 | H71 | sing | 1.09Å | 1.10Å | |
| C55 | H72 | sing | 1.09Å | 1.10Å | |
| C57 | H73 | sing | 1.09Å | 1.10Å | |
| C59 | H74 | sing | 1.09Å | 1.10Å | |
| C61 | H75 | sing | 1.09Å | 1.10Å | |
| C62 | H76 | sing | 1.09Å | 1.10Å | |
| C62 | H77 | sing | 1.09Å | 1.10Å | |
| O53 | H78 | sing | 0.97Å | 0.95Å | |
| O58 | H79 | sing | 0.97Å | 0.95Å | |
| O60 | H80 | sing | 0.97Å | 0.95Å | |
| O63 | H81 | sing | 0.97Å | 0.95Å | |
| C16 | C15 | sing | 1.53Å | 259.79Å | |
| C15 | C14 | sing | 1.51Å | 0.00Å | |
| C14 | C12 | doub | 1.31Å | 0.00Å | |
| C12 | C11 | sing | 1.51Å | 0.00Å | |
| C11 | C10 | sing | 1.53Å | 0.00Å | |
| C10 | C9 | sing | 1.51Å | 0.00Å | |
| C9 | C7 | doub | 1.31Å | 0.00Å | |
| C7 | C6 | sing | 1.51Å | 0.00Å | |
| C6 | C5 | sing | 1.53Å | 0.00Å | |
| C5 | C4 | sing | 1.51Å | 0.00Å | |
| C4 | C3 | doub | 1.31Å | 0.00Å | |
| C3 | C2 | sing | 1.51Å | 0.00Å | |
| C12 | C13 | sing | 1.51Å | 0.00Å | |
| C7 | C8 | sing | 1.51Å | 0.00Å | |
| C3 | C1 | sing | 1.51Å | 0.00Å | |
| C15 | H3 | sing | 1.09Å | 0.00Å | |
| C15 | H4 | sing | 1.09Å | 0.00Å | |
| C14 | H9 | sing | 1.08Å | 0.00Å | |
| C11 | H14 | sing | 1.09Å | 0.00Å | |
| C11 | H19 | sing | 1.09Å | 0.00Å | |
| C10 | H24 | sing | 1.09Å | 0.00Å | |
| C10 | H29 | sing | 1.09Å | 0.00Å | |
| C9 | H34 | sing | 1.08Å | 0.00Å | |
| C6 | H39 | sing | 1.09Å | 0.00Å | |
| C6 | H44 | sing | 1.09Å | 0.00Å | |
| C5 | H49 | sing | 1.09Å | 0.00Å | |
| C5 | H54 | sing | 1.09Å | 0.00Å | |
| C4 | H59 | sing | 1.08Å | 0.00Å | |
| C2 | H64 | sing | 1.09Å | 0.00Å | |
| C2 | H69 | sing | 1.09Å | 0.00Å | |
| C2 | H82 | sing | 1.09Å | 0.00Å | |
| C13 | H83 | sing | 1.09Å | 0.00Å | |
| C13 | H84 | sing | 1.09Å | 0.00Å | |
| C13 | H85 | sing | 1.09Å | 0.00Å | |
| C8 | H86 | sing | 1.09Å | 0.00Å | |
| C8 | H87 | sing | 1.09Å | 0.00Å | |
| C8 | H88 | sing | 1.09Å | 0.00Å | |
| C1 | H89 | sing | 1.09Å | 0.00Å | |
| C1 | H90 | sing | 1.09Å | 0.00Å | |
| C1 | H91 | sing | 1.09Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C18 | C17 | C19 | 119.7° | 120.0° |
| C18 | C17 | C16 | 119.4° | 120.0° |
| C17 | C18 | H5 | 109.5° | 109.5° |
| C17 | C18 | H6 | 109.5° | 109.4° |
| C17 | C18 | H7 | 109.5° | 109.5° |
| C19 | C17 | C16 | 120.9° | 120.0° |
| C17 | C19 | C20 | 112.1° | 120.0° |
| C17 | C19 | H8 | 123.9° | 120.0° |
| C17 | C16 | H1 | 125.1° | 109.5° |
| C17 | C16 | H2 | 125.1° | 109.5° |
| C17 | C16 | C15 | 11.8° | 109.5° |
| C19 | C20 | C21 | 110.5° | 109.5° |
| C20 | C19 | H8 | 124.0° | 120.0° |
| C19 | C20 | H10 | 109.2° | 109.5° |
| C19 | C20 | H11 | 109.2° | 109.5° |
| C20 | C21 | C22 | 110.1° | 109.5° |
| C21 | C20 | H10 | 109.2° | 109.5° |
| C21 | C20 | H11 | 109.2° | 109.4° |
| C20 | C21 | H12 | 109.3° | 109.5° |
| C20 | C21 | H13 | 109.3° | 109.4° |
| C21 | C22 | C23 | 119.5° | 120.0° |
| C21 | C22 | C24 | 121.3° | 120.0° |
| C22 | C21 | H12 | 109.3° | 109.5° |
| C22 | C21 | H13 | 109.3° | 109.5° |
| C23 | C22 | C24 | 119.1° | 120.0° |
| C22 | C23 | H15 | 109.5° | 109.4° |
| C22 | C23 | H16 | 109.4° | 109.5° |
| C22 | C23 | H17 | 109.5° | 109.4° |
| C22 | C24 | C25 | 112.9° | 120.0° |
| C22 | C24 | H18 | 123.5° | 120.0° |
| O60 | C59 | C57 | 109.5° | 110.5° |
| O60 | C59 | C61 | 110.0° | 110.5° |
| O60 | C59 | H74 | 110.4° | 110.6° |
| C59 | O60 | H80 | 109.5° | 113.9° |
| C24 | C25 | C26 | 109.2° | 109.5° |
| C25 | C24 | H18 | 123.5° | 120.0° |
| C24 | C25 | H20 | 109.5° | 109.5° |
| C24 | C25 | H21 | 109.5° | 109.5° |
| C25 | C26 | C27 | 109.4° | 109.5° |
| C26 | C25 | H20 | 109.6° | 109.5° |
| C26 | C25 | H21 | 109.5° | 109.4° |
| C25 | C26 | H22 | 109.5° | 109.5° |
| C25 | C26 | H23 | 109.5° | 109.5° |
| C28 | C27 | C26 | 119.9° | 120.0° |
| C28 | C27 | C29 | 121.0° | 120.0° |
| C27 | C28 | H25 | 109.5° | 109.5° |
| C27 | C28 | H26 | 109.4° | 109.5° |
| C27 | C28 | H27 | 109.5° | 109.5° |
| C38 | C37 | C36 | 119.5° | 120.0° |
| C38 | C37 | C39 | 121.3° | 120.0° |
| C37 | C38 | H45 | 109.5° | 109.5° |
| C37 | C38 | H46 | 109.5° | 109.5° |
| C37 | C38 | H47 | 109.4° | 109.5° |
| C48 | C47 | C49 | 119.2° | 120.0° |
| C48 | C47 | C46 | 120.0° | 120.0° |
| C47 | C48 | H65 | 109.5° | 109.5° |
| C47 | C48 | H66 | 109.5° | 109.4° |
| C47 | C48 | H67 | 109.5° | 109.5° |
| C43 | C42 | C41 | 119.1° | 119.9° |
| C43 | C42 | C44 | 121.5° | 120.0° |
| C42 | C43 | H55 | 109.5° | 109.5° |
| C42 | C43 | H56 | 109.5° | 109.5° |
| C42 | C43 | H57 | 109.5° | 109.5° |
| C57 | C59 | C61 | 107.8° | 104.2° |
| C59 | C57 | O58 | 109.9° | 110.9° |
| C59 | C57 | C55 | 108.2° | 102.1° |
| C59 | C57 | H73 | 107.6° | 111.0° |
| C57 | C59 | H74 | 107.7° | 110.5° |
| C59 | C61 | O56 | 105.5° | 107.4° |
| C59 | C61 | C62 | 110.5° | 109.8° |
| C61 | C59 | H74 | 111.3° | 110.5° |
| C59 | C61 | H75 | 112.0° | 109.9° |
| C26 | C27 | C29 | 119.1° | 120.0° |
| C27 | C26 | H22 | 109.5° | 109.5° |
| C27 | C26 | H23 | 109.5° | 109.5° |
| C27 | C29 | C30 | 112.5° | 120.0° |
| C27 | C29 | H28 | 123.7° | 120.0° |
| O58 | C57 | C55 | 109.3° | 110.9° |
| O58 | C57 | H73 | 109.9° | 110.8° |
| C57 | O58 | H79 | 109.5° | 114.0° |
| C57 | C55 | O56 | 106.9° | 103.6° |
| C57 | C55 | O54 | 110.5° | 110.6° |
| C57 | C55 | H72 | 111.2° | 110.6° |
| C55 | C57 | H73 | 111.8° | 110.9° |
| O56 | C61 | C62 | 109.4° | 109.9° |
| C61 | O56 | C55 | 104.6° | 106.9° |
| O56 | C61 | H75 | 109.6° | 109.8° |
| C61 | C62 | O63 | 108.1° | 109.4° |
| C62 | C61 | H75 | 109.7° | 110.0° |
| C61 | C62 | H76 | 109.8° | 109.5° |
| C61 | C62 | H77 | 109.8° | 109.5° |
| C39 | C40 | C41 | 108.9° | 109.5° |
| C40 | C39 | C37 | 112.7° | 120.0° |
| C40 | C39 | H48 | 123.6° | 120.0° |
| C39 | C40 | H50 | 109.6° | 109.5° |
| C39 | C40 | H51 | 109.6° | 109.5° |
| C40 | C41 | C42 | 108.7° | 109.5° |
| C41 | C40 | H50 | 109.6° | 109.5° |
| C41 | C40 | H51 | 109.6° | 109.4° |
| C40 | C41 | H52 | 109.7° | 109.5° |
| C40 | C41 | H53 | 109.7° | 109.5° |
| C36 | C37 | C39 | 119.2° | 120.0° |
| C37 | C36 | C35 | 109.0° | 109.5° |
| C37 | C36 | H42 | 109.6° | 109.5° |
| C37 | C36 | H43 | 109.6° | 109.5° |
| C37 | C39 | H48 | 123.6° | 119.9° |
| C29 | C30 | C31 | 109.5° | 109.5° |
| C30 | C29 | H28 | 123.7° | 120.0° |
| C29 | C30 | H30 | 109.5° | 109.5° |
| C29 | C30 | H31 | 109.4° | 109.5° |
| C30 | C31 | C32 | 110.0° | 109.5° |
| C31 | C30 | H30 | 109.4° | 109.4° |
| C31 | C30 | H31 | 109.4° | 109.5° |
| C30 | C31 | H32 | 109.3° | 109.5° |
| C30 | C31 | H33 | 109.4° | 109.5° |
| C49 | C47 | C46 | 120.8° | 120.1° |
| C47 | C49 | C50 | 113.2° | 120.0° |
| C47 | C49 | H68 | 123.4° | 120.0° |
| C47 | C46 | C45 | 109.5° | 109.5° |
| C47 | C46 | H62 | 109.5° | 109.4° |
| C47 | C46 | H63 | 109.4° | 109.5° |
| O56 | C55 | O54 | 110.3° | 110.6° |
| O56 | C55 | H72 | 107.5° | 110.6° |
| C55 | O54 | P52 | 118.4° | 123.0° |
| O54 | C55 | H72 | 110.3° | 110.6° |
| C41 | C42 | C44 | 119.3° | 120.0° |
| C42 | C41 | H52 | 109.7° | 109.4° |
| C42 | C41 | H53 | 109.7° | 109.5° |
| C42 | C44 | C45 | 112.8° | 120.0° |
| C42 | C44 | H58 | 123.6° | 120.0° |
| C44 | C45 | C46 | 108.9° | 109.5° |
| C45 | C44 | H58 | 123.6° | 120.0° |
| C44 | C45 | H60 | 109.6° | 109.5° |
| C44 | C45 | H61 | 109.6° | 109.5° |
| C46 | C45 | H60 | 109.6° | 109.4° |
| C46 | C45 | H61 | 109.6° | 109.5° |
| C45 | C46 | H62 | 109.5° | 109.4° |
| C45 | C46 | H63 | 109.4° | 109.5° |
| C49 | C50 | O51 | 109.0° | 109.5° |
| C50 | C49 | H68 | 123.4° | 120.0° |
| C49 | C50 | H70 | 109.6° | 109.5° |
| C49 | C50 | H71 | 109.6° | 109.5° |
| C36 | C35 | C34 | 109.0° | 109.5° |
| C36 | C35 | H40 | 109.6° | 109.5° |
| C36 | C35 | H41 | 109.6° | 109.4° |
| C35 | C36 | H42 | 109.6° | 109.5° |
| C35 | C36 | H43 | 109.6° | 109.5° |
| O63 | C62 | H76 | 109.8° | 109.5° |
| O63 | C62 | H77 | 109.8° | 109.5° |
| C62 | O63 | H81 | 109.5° | 114.0° |
| C31 | C32 | C34 | 121.0° | 120.0° |
| C31 | C32 | C33 | 119.6° | 120.0° |
| C32 | C31 | H32 | 109.4° | 109.4° |
| C32 | C31 | H33 | 109.3° | 109.5° |
| C35 | C34 | C32 | 112.3° | 120.0° |
| C35 | C34 | H38 | 123.8° | 120.0° |
| C34 | C35 | H40 | 109.6° | 109.5° |
| C34 | C35 | H41 | 109.6° | 109.5° |
| O54 | P52 | O51 | 109.8° | 109.4° |
| O54 | P52 | O64 | 109.5° | 109.4° |
| O54 | P52 | O53 | 109.6° | 109.4° |
| C50 | O51 | P52 | 118.0° | 123.0° |
| O51 | C50 | H70 | 109.6° | 109.4° |
| O51 | C50 | H71 | 109.6° | 109.5° |
| C34 | C32 | C33 | 119.4° | 120.0° |
| C32 | C34 | H38 | 123.9° | 119.9° |
| C32 | C33 | H35 | 109.5° | 109.5° |
| C32 | C33 | H36 | 109.5° | 109.5° |
| C32 | C33 | H37 | 109.5° | 109.5° |
| O51 | P52 | O64 | 108.9° | 109.5° |
| O51 | P52 | O53 | 109.6° | 109.5° |
| O64 | P52 | O53 | 109.4° | 109.5° |
| P52 | O53 | H78 | 109.5° | 114.0° |
| H1 | C16 | H2 | 109.4° | 109.5° |
| H1 | C16 | C15 | 125.1° | 109.4° |
| H2 | C16 | C15 | 125.1° | 109.5° |
| H5 | C18 | H6 | 109.4° | 109.5° |
| H5 | C18 | H7 | 109.5° | 109.5° |
| H6 | C18 | H7 | 109.4° | 109.5° |
| H10 | C20 | H11 | 109.5° | 109.5° |
| H12 | C21 | H13 | 109.5° | 109.5° |
| H15 | C23 | H16 | 109.5° | 109.5° |
| H15 | C23 | H17 | 109.5° | 109.5° |
| H16 | C23 | H17 | 109.5° | 109.5° |
| H20 | C25 | H21 | 109.5° | 109.5° |
| H22 | C26 | H23 | 109.5° | 109.4° |
| H25 | C28 | H26 | 109.5° | 109.4° |
| H25 | C28 | H27 | 109.5° | 109.5° |
| H26 | C28 | H27 | 109.5° | 109.4° |
| H30 | C30 | H31 | 109.5° | 109.4° |
| H32 | C31 | H33 | 109.5° | 109.5° |
| H35 | C33 | H36 | 109.5° | 109.5° |
| H35 | C33 | H37 | 109.4° | 109.5° |
| H36 | C33 | H37 | 109.5° | 109.5° |
| H40 | C35 | H41 | 109.4° | 109.4° |
| H42 | C36 | H43 | 109.5° | 109.4° |
| H45 | C38 | H46 | 109.5° | 109.5° |
| H45 | C38 | H47 | 109.5° | 109.5° |
| H46 | C38 | H47 | 109.5° | 109.4° |
| H50 | C40 | H51 | 109.5° | 109.5° |
| H52 | C41 | H53 | 109.4° | 109.5° |
| H55 | C43 | H56 | 109.5° | 109.4° |
| H55 | C43 | H57 | 109.5° | 109.5° |
| H56 | C43 | H57 | 109.4° | 109.4° |
| H60 | C45 | H61 | 109.5° | 109.4° |
| H62 | C46 | H63 | 109.5° | 109.5° |
| H65 | C48 | H66 | 109.5° | 109.4° |
| H65 | C48 | H67 | 109.4° | 109.5° |
| H66 | C48 | H67 | 109.5° | 109.5° |
| H70 | C50 | H71 | 109.5° | 109.5° |
| H76 | C62 | H77 | 109.5° | 109.5° |
| C16 | C15 | C14 | 90.0° | 109.5° |
| C16 | C15 | H3 | 90.0° | 109.5° |
| C16 | C15 | H4 | 90.0° | 109.5° |
| C15 | C14 | C12 | 90.0° | 120.0° |
| C14 | C15 | H3 | 90.0° | 109.5° |
| C14 | C15 | H4 | 90.0° | 109.4° |
| C15 | C14 | H9 | 90.0° | 120.0° |
| C14 | C12 | C11 | 90.0° | 120.0° |
| C14 | C12 | C13 | 90.0° | 120.0° |
| C12 | C14 | H9 | 90.0° | 120.0° |
| C12 | C11 | C10 | 90.0° | 109.4° |
| C11 | C12 | C13 | 90.0° | 120.0° |
| C12 | C11 | H14 | 90.0° | 109.4° |
| C12 | C11 | H19 | 90.0° | 109.4° |
| C11 | C10 | C9 | 90.0° | 109.4° |
| C10 | C11 | H14 | 90.0° | 109.5° |
| C10 | C11 | H19 | 90.0° | 109.5° |
| C11 | C10 | H24 | 90.0° | 109.5° |
| C11 | C10 | H29 | 90.0° | 109.5° |
| C10 | C9 | C7 | 90.0° | 120.0° |
| C9 | C10 | H24 | 90.0° | 109.5° |
| C9 | C10 | H29 | 90.0° | 109.5° |
| C10 | C9 | H34 | 90.0° | 120.0° |
| C9 | C7 | C6 | 90.0° | 120.0° |
| C9 | C7 | C8 | 90.0° | 120.0° |
| C7 | C9 | H34 | 90.0° | 120.0° |
| C7 | C6 | C5 | 90.0° | 109.5° |
| C6 | C7 | C8 | 90.0° | 120.0° |
| C7 | C6 | H39 | 90.0° | 109.5° |
| C7 | C6 | H44 | 90.0° | 109.5° |
| C6 | C5 | C4 | 90.0° | 109.5° |
| C5 | C6 | H39 | 90.0° | 109.5° |
| C5 | C6 | H44 | 90.0° | 109.5° |
| C6 | C5 | H49 | 90.0° | 109.5° |
| C6 | C5 | H54 | 90.0° | 109.5° |
| C5 | C4 | C3 | 90.0° | 120.0° |
| C4 | C5 | H49 | 90.0° | 109.5° |
| C4 | C5 | H54 | 90.0° | 109.5° |
| C5 | C4 | H59 | 90.0° | 120.0° |
| C4 | C3 | C2 | 90.0° | 120.0° |
| C4 | C3 | C1 | 90.0° | 120.0° |
| C3 | C4 | H59 | 90.0° | 120.0° |
| C2 | C3 | C1 | 90.0° | 120.0° |
| C3 | C2 | H64 | 90.0° | 109.5° |
| C3 | C2 | H69 | 90.0° | 109.4° |
| C3 | C2 | H82 | 90.0° | 109.5° |
| C12 | C13 | H83 | 90.0° | 109.5° |
| C12 | C13 | H84 | 90.0° | 109.4° |
| C12 | C13 | H85 | 90.0° | 109.5° |
| C7 | C8 | H86 | 90.0° | 109.5° |
| C7 | C8 | H87 | 90.0° | 109.5° |
| C7 | C8 | H88 | 90.0° | 109.5° |
| C3 | C1 | H89 | 90.0° | 109.5° |
| C3 | C1 | H90 | 90.0° | 109.5° |
| C3 | C1 | H91 | 90.0° | 109.5° |
| H3 | C15 | H4 | 90.0° | 109.5° |
| H14 | C11 | H19 | 90.0° | 109.5° |
| H24 | C10 | H29 | 90.0° | 109.4° |
| H39 | C6 | H44 | 90.0° | 109.4° |
| H49 | C5 | H54 | 90.0° | 109.4° |
| H64 | C2 | H69 | 90.0° | 109.5° |
| H64 | C2 | H82 | 90.0° | 109.5° |
| H69 | C2 | H82 | 90.0° | 109.5° |
| H83 | C13 | H84 | 90.0° | 109.5° |
| H83 | C13 | H85 | 90.0° | 109.5° |
| H84 | C13 | H85 | 90.0° | 109.4° |
| H86 | C8 | H87 | 90.0° | 109.4° |
| H86 | C8 | H88 | 90.0° | 109.4° |
| H87 | C8 | H88 | 90.0° | 109.5° |
| H89 | C1 | H90 | 90.0° | 109.4° |
| H89 | C1 | H91 | 90.0° | 109.5° |
| H90 | C1 | H91 | 90.0° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C18 | C17 | C19 | C16 | 179.9° | 179.9° |
| C18 | C17 | C19 | C20 | 180.0° | 173.4° |
| C18 | C17 | C16 | H1 | 136.4° | 33.1° |
| C18 | C17 | C16 | H2 | 35.3° | 153.1° |
| C17 | C18 | H5 | H6 | 120.0° | 120.0° |
| C17 | C18 | H5 | H7 | 120.0° | 120.0° |
| C17 | C18 | H6 | H7 | 120.0° | 120.0° |
| C18 | C17 | C19 | H8 | 0.0° | 6.5° |
| C18 | C17 | C16 | C15 | 129.5° | 86.9° |
| C17 | C19 | C20 | H8 | 180.0° | 179.9° |
| C17 | C19 | C20 | C21 | 175.6° | 119.0° |
| C19 | C17 | C16 | H1 | 43.7° | 146.9° |
| C19 | C17 | C16 | H2 | 144.6° | 26.8° |
| C19 | C17 | C18 | H5 | 180.0° | 89.9° |
| C19 | C17 | C18 | H6 | 60.0° | 150.1° |
| C19 | C17 | C18 | H7 | 60.0° | 30.1° |
| C17 | C19 | C20 | H10 | 55.4° | 121.0° |
| C17 | C19 | C20 | H11 | 64.3° | 1.0° |
| C19 | C17 | C16 | C15 | 50.4° | 93.2° |
| C16 | C17 | C19 | C20 | 0.1° | 6.7° |
| C17 | C16 | H1 | H2 | 172.8° | 120.0° |
| C17 | C16 | H1 | C15 | 14.5° | 120.0° |
| C17 | C16 | H2 | C15 | 14.5° | 120.0° |
| C16 | C17 | C18 | H5 | 0.1° | 90.0° |
| C16 | C17 | C18 | H6 | 120.1° | 30.0° |
| C16 | C17 | C18 | H7 | 119.9° | 150.0° |
| C16 | C17 | C19 | H8 | 179.9° | 173.4° |
| C17 | C16 | C15 | C14 | 90.0° | 175.1° |
| C17 | C16 | C15 | H3 | 90.0° | 64.9° |
| C17 | C16 | C15 | H4 | 90.0° | 55.2° |
| C19 | C20 | C21 | H10 | 120.2° | 120.0° |
| C19 | C20 | C21 | H11 | 120.2° | 120.0° |
| C19 | C20 | C21 | C22 | 91.1° | 175.2° |
| C19 | C20 | H10 | H11 | 119.6° | 120.0° |
| C19 | C20 | C21 | H12 | 148.8° | 55.2° |
| C19 | C20 | C21 | H13 | 28.9° | 64.8° |
| C20 | C21 | C22 | H12 | 120.1° | 120.0° |
| C20 | C21 | C22 | H13 | 120.1° | 120.0° |
| C20 | C21 | C22 | C23 | 82.4° | 87.2° |
| C20 | C21 | C22 | C24 | 97.3° | 92.8° |
| C21 | C20 | C19 | H8 | 4.4° | 61.1° |
| C21 | C20 | H10 | H11 | 119.5° | 119.9° |
| C20 | C21 | H12 | H13 | 119.7° | 120.0° |
| C21 | C22 | C23 | C24 | 179.7° | 179.9° |
| C21 | C22 | C24 | C25 | 0.2° | 2.2° |
| C22 | C21 | C20 | H10 | 29.0° | 64.8° |
| C22 | C21 | C20 | H11 | 148.7° | 55.2° |
| C22 | C21 | H12 | H13 | 119.7° | 120.0° |
| C21 | C22 | C23 | H15 | 180.0° | 90.0° |
| C21 | C22 | C23 | H16 | 60.0° | 150.0° |
| C21 | C22 | C23 | H17 | 60.0° | 29.9° |
| C21 | C22 | C24 | H18 | 179.8° | 177.8° |
| C23 | C22 | C24 | C25 | 180.0° | 177.8° |
| C23 | C22 | C21 | H12 | 157.5° | 152.8° |
| C23 | C22 | C21 | H13 | 37.6° | 32.7° |
| C22 | C23 | H15 | H16 | 120.0° | 120.0° |
| C22 | C23 | H15 | H17 | 120.0° | 119.9° |
| C22 | C23 | H16 | H17 | 120.0° | 120.0° |
| C23 | C22 | C24 | H18 | 0.0° | 2.2° |
| C22 | C24 | C25 | H18 | 180.0° | 180.0° |
| C22 | C24 | C25 | C26 | 176.4° | 116.9° |
| C24 | C22 | C21 | H12 | 22.8° | 27.2° |
| C24 | C22 | C21 | H13 | 142.6° | 147.2° |
| C24 | C22 | C23 | H15 | 0.3° | 90.0° |
| C24 | C22 | C23 | H16 | 120.2° | 30.0° |
| C24 | C22 | C23 | H17 | 119.7° | 150.0° |
| C22 | C24 | C25 | H20 | 63.6° | 123.1° |
| C22 | C24 | C25 | H21 | 56.4° | 3.0° |
| O60 | C59 | C57 | C61 | 119.7° | 118.6° |
| O60 | C59 | C57 | H74 | 120.1° | 122.7° |
| O60 | C59 | C61 | H74 | 122.8° | 122.7° |
| O60 | C59 | C57 | O58 | 130.6° | 144.1° |
| O60 | C59 | C57 | C55 | 110.0° | 97.8° |
| O60 | C59 | C61 | O56 | 96.8° | 120.6° |
| O60 | C59 | C61 | C62 | 145.0° | 119.9° |
| O60 | C59 | C57 | H73 | 10.9° | 20.4° |
| O60 | C59 | C61 | H75 | 22.4° | 1.2° |
| C24 | C25 | C26 | H20 | 120.0° | 120.0° |
| C24 | C25 | C26 | H21 | 120.0° | 120.0° |
| C24 | C25 | C26 | C27 | 179.7° | 175.2° |
| C24 | C25 | H20 | H21 | 120.1° | 120.0° |
| C24 | C25 | C26 | H22 | 59.7° | 55.1° |
| C24 | C25 | C26 | H23 | 60.2° | 64.8° |
| C25 | C26 | C27 | C28 | 18.8° | 84.6° |
| C25 | C26 | C27 | H22 | 120.0° | 120.0° |
| C25 | C26 | C27 | H23 | 120.0° | 120.0° |
| C25 | C26 | C27 | C29 | 160.8° | 95.3° |
| C26 | C25 | C24 | H18 | 3.6° | 63.1° |
| C26 | C25 | H20 | H21 | 120.1° | 120.0° |
| C25 | C26 | H22 | H23 | 120.0° | 120.0° |
| C28 | C27 | C26 | C29 | 179.6° | 180.0° |
| C28 | C27 | C29 | C30 | 0.4° | 5.7° |
| C28 | C27 | C26 | H22 | 138.8° | 155.3° |
| C28 | C27 | C26 | H23 | 101.2° | 35.4° |
| C27 | C28 | H25 | H26 | 120.0° | 120.0° |
| C27 | C28 | H25 | H27 | 120.0° | 120.1° |
| C27 | C28 | H26 | H27 | 120.0° | 120.0° |
| C28 | C27 | C29 | H28 | 179.6° | 174.3° |
| C38 | C37 | C39 | C40 | 0.1° | 5.5° |
| C38 | C37 | C36 | C39 | 179.8° | 180.0° |
| C38 | C37 | C36 | C35 | 138.3° | 84.7° |
| C38 | C37 | C36 | H42 | 18.3° | 155.3° |
| C38 | C37 | C36 | H43 | 101.8° | 35.3° |
| C37 | C38 | H45 | H46 | 120.0° | 120.0° |
| C37 | C38 | H45 | H47 | 120.0° | 120.0° |
| C37 | C38 | H46 | H47 | 120.0° | 120.0° |
| C38 | C37 | C39 | H48 | 179.9° | 174.5° |
| C48 | C47 | C49 | C46 | 179.7° | 180.0° |
| C48 | C47 | C46 | C45 | 5.0° | 87.1° |
| C48 | C47 | C49 | C50 | 179.9° | 176.3° |
| C48 | C47 | C46 | H62 | 125.1° | 153.0° |
| C48 | C47 | C46 | H63 | 115.0° | 33.0° |
| C47 | C48 | H65 | H66 | 120.0° | 119.9° |
| C47 | C48 | H65 | H67 | 120.0° | 120.1° |
| C47 | C48 | H66 | H67 | 120.0° | 120.0° |
| C48 | C47 | C49 | H68 | 0.1° | 3.7° |
| C43 | C42 | C41 | C40 | 27.6° | 84.7° |
| C43 | C42 | C41 | C44 | 179.5° | 180.0° |
| C43 | C42 | C44 | C45 | 0.4° | 3.5° |
| C43 | C42 | C41 | H52 | 147.5° | 155.3° |
| C43 | C42 | C41 | H53 | 92.3° | 35.3° |
| C42 | C43 | H55 | H56 | 120.0° | 120.0° |
| C42 | C43 | H55 | H57 | 120.0° | 120.1° |
| C42 | C43 | H56 | H57 | 120.0° | 120.0° |
| C43 | C42 | C44 | H58 | 179.6° | 176.5° |
| C57 | C59 | C61 | H74 | 117.9° | 118.6° |
| C59 | C57 | O58 | C55 | 118.7° | 112.7° |
| C59 | C57 | O58 | H73 | 118.2° | 123.7° |
| C59 | C57 | C55 | H73 | 118.3° | 118.2° |
| C57 | C59 | C61 | O56 | 22.5° | 1.9° |
| C57 | C59 | C61 | C62 | 95.7° | 121.4° |
| C59 | C57 | C55 | O56 | 7.7° | 36.9° |
| C59 | C57 | C55 | O54 | 112.4° | 155.5° |
| C59 | C57 | C55 | H72 | 124.8° | 81.6° |
| C57 | C59 | C61 | H75 | 141.7° | 117.4° |
| C59 | C57 | O58 | H79 | 180.0° | 174.2° |
| C57 | C59 | O60 | H80 | 180.0° | 61.4° |
| C61 | C59 | C57 | O58 | 109.7° | 97.3° |
| C61 | C59 | C57 | C55 | 9.7° | 20.9° |
| C59 | C61 | O56 | C62 | 118.9° | 119.5° |
| C59 | C61 | O56 | H75 | 120.8° | 119.4° |
| C59 | C61 | C62 | H75 | 124.0° | 121.0° |
| C59 | C61 | O56 | C55 | 26.8° | 26.3° |
| C59 | C61 | C62 | O63 | 174.1° | 175.0° |
| C61 | C59 | C57 | H73 | 130.6° | 139.1° |
| C59 | C61 | C62 | H76 | 54.3° | 55.0° |
| C59 | C61 | C62 | H77 | 66.1° | 65.0° |
| C61 | C59 | O60 | H80 | 61.7° | 176.1° |
| C26 | C27 | C29 | C30 | 180.0° | 174.2° |
| C27 | C26 | C25 | H20 | 60.3° | 64.8° |
| C27 | C26 | C25 | H21 | 59.8° | 55.2° |
| C27 | C26 | H22 | H23 | 120.0° | 120.0° |
| C26 | C27 | C28 | H25 | 180.0° | 92.3° |
| C26 | C27 | C28 | H26 | 60.0° | 147.7° |
| C26 | C27 | C28 | H27 | 60.0° | 27.7° |
| C26 | C27 | C29 | H28 | 0.0° | 5.7° |
| C27 | C29 | C30 | H28 | 180.0° | 179.9° |
| C27 | C29 | C30 | C31 | 171.2° | 123.3° |
| C29 | C27 | C26 | H22 | 40.8° | 24.7° |
| C29 | C27 | C26 | H23 | 79.2° | 144.7° |
| C29 | C27 | C28 | H25 | 0.4° | 87.6° |
| C29 | C27 | C28 | H26 | 120.4° | 32.3° |
| C29 | C27 | C28 | H27 | 119.6° | 152.3° |
| C27 | C29 | C30 | H30 | 68.8° | 116.7° |
| C27 | C29 | C30 | H31 | 51.2° | 3.2° |
| O58 | C57 | C55 | H73 | 122.0° | 123.6° |
| O58 | C57 | C55 | O56 | 127.4° | 81.2° |
| O58 | C57 | C55 | O54 | 7.4° | 37.4° |
| O58 | C57 | C55 | H72 | 115.5° | 160.2° |
| O58 | C57 | C59 | H74 | 10.5° | 21.3° |
| C57 | C55 | O56 | C61 | 21.0° | 39.9° |
| C57 | C55 | O56 | O54 | 120.1° | 118.5° |
| C57 | C55 | O56 | H72 | 119.5° | 118.6° |
| C57 | C55 | O54 | H72 | 123.4° | 122.9° |
| C57 | C55 | O54 | P52 | 178.7° | 152.2° |
| C55 | C57 | C59 | H74 | 129.9° | 139.5° |
| C55 | C57 | O58 | H79 | 61.3° | 61.5° |
| O56 | C61 | C62 | H75 | 120.3° | 121.0° |
| C61 | O56 | C55 | O54 | 99.2° | 158.4° |
| O56 | C61 | C62 | O63 | 70.1° | 67.1° |
| C61 | O56 | C55 | H72 | 140.5° | 78.7° |
| O56 | C61 | C59 | H74 | 140.4° | 116.7° |
| O56 | C61 | C62 | H76 | 170.1° | 172.9° |
| O56 | C61 | C62 | H77 | 49.7° | 53.0° |
| C62 | C61 | O56 | C55 | 92.1° | 145.8° |
| C61 | C62 | O63 | H76 | 119.8° | 120.0° |
| C61 | C62 | O63 | H77 | 119.8° | 120.0° |
| C62 | C61 | C59 | H74 | 22.2° | 2.8° |
| C61 | C62 | H76 | H77 | 120.6° | 120.0° |
| C61 | C62 | O63 | H81 | 180.0° | 180.0° |
| C39 | C40 | C41 | H50 | 119.9° | 120.0° |
| C39 | C40 | C41 | H51 | 119.9° | 120.0° |
| C40 | C39 | C37 | C36 | 180.0° | 174.5° |
| C40 | C39 | C37 | H48 | 180.0° | 180.0° |
| C39 | C40 | C41 | C42 | 113.0° | 175.1° |
| C39 | C40 | H50 | H51 | 120.3° | 120.1° |
| C39 | C40 | C41 | H52 | 6.9° | 55.2° |
| C39 | C40 | C41 | H53 | 127.1° | 64.8° |
| C41 | C40 | C39 | C37 | 174.4° | 126.6° |
| C40 | C41 | C42 | H52 | 119.9° | 120.0° |
| C40 | C41 | C42 | H53 | 119.9° | 120.0° |
| C40 | C41 | C42 | C44 | 151.9° | 95.3° |
| C41 | C40 | C39 | H48 | 5.6° | 53.4° |
| C41 | C40 | H50 | H51 | 120.3° | 119.9° |
| C40 | C41 | H52 | H53 | 120.3° | 120.0° |
| C37 | C36 | C35 | H42 | 119.9° | 120.1° |
| C37 | C36 | C35 | H43 | 120.0° | 120.0° |
| C37 | C36 | C35 | C34 | 153.3° | 175.1° |
| C37 | C36 | C35 | H40 | 33.3° | 64.8° |
| C37 | C36 | C35 | H41 | 86.8° | 55.1° |
| C37 | C36 | H42 | H43 | 120.3° | 120.0° |
| C36 | C37 | C38 | H45 | 180.0° | 93.9° |
| C36 | C37 | C38 | H46 | 60.0° | 146.1° |
| C36 | C37 | C38 | H47 | 60.0° | 26.1° |
| C36 | C37 | C39 | H48 | 0.1° | 5.5° |
| C39 | C37 | C36 | C35 | 41.6° | 95.3° |
| C39 | C37 | C36 | H42 | 161.5° | 24.7° |
| C39 | C37 | C36 | H43 | 78.4° | 144.7° |
| C39 | C37 | C38 | H45 | 0.2° | 86.1° |
| C39 | C37 | C38 | H46 | 120.2° | 33.9° |
| C39 | C37 | C38 | H47 | 119.8° | 153.9° |
| C37 | C39 | C40 | H50 | 54.5° | 113.4° |
| C37 | C39 | C40 | H51 | 65.6° | 6.6° |
| C29 | C30 | C31 | H30 | 120.0° | 120.0° |
| C29 | C30 | C31 | H31 | 120.0° | 120.1° |
| C29 | C30 | C31 | C32 | 92.3° | 175.2° |
| C29 | C30 | H30 | H31 | 120.0° | 120.0° |
| C29 | C30 | C31 | H32 | 147.6° | 64.9° |
| C29 | C30 | C31 | H33 | 27.8° | 55.1° |
| C30 | C31 | C32 | H32 | 120.1° | 120.0° |
| C30 | C31 | C32 | H33 | 120.1° | 120.0° |
| C30 | C31 | C32 | C34 | 98.6° | 93.1° |
| C30 | C31 | C32 | C33 | 81.1° | 86.9° |
| C31 | C30 | C29 | H28 | 8.8° | 56.6° |
| C31 | C30 | H30 | H31 | 119.9° | 120.0° |
| C30 | C31 | H32 | H33 | 119.8° | 120.0° |
| C49 | C47 | C46 | C45 | 175.3° | 93.0° |
| C47 | C49 | C50 | H68 | 180.0° | 180.0° |
| C47 | C49 | C50 | O51 | 164.5° | 134.8° |
| C49 | C47 | C46 | H62 | 55.3° | 27.0° |
| C49 | C47 | C46 | H63 | 64.7° | 147.0° |
| C49 | C47 | C48 | H65 | 180.0° | 94.9° |
| C49 | C47 | C48 | H66 | 60.0° | 145.2° |
| C49 | C47 | C48 | H67 | 60.0° | 25.2° |
| C47 | C49 | C50 | H70 | 75.6° | 105.2° |
| C47 | C49 | C50 | H71 | 44.5° | 14.8° |
| C47 | C46 | C45 | C44 | 134.5° | 175.2° |
| C47 | C46 | C45 | H62 | 120.0° | 119.9° |
| C47 | C46 | C45 | H63 | 120.0° | 120.1° |
| C46 | C47 | C49 | C50 | 0.2° | 3.6° |
| C47 | C46 | C45 | H60 | 105.5° | 55.2° |
| C47 | C46 | C45 | H61 | 14.6° | 64.7° |
| C47 | C46 | H62 | H63 | 120.0° | 120.0° |
| C46 | C47 | C48 | H65 | 0.3° | 85.1° |
| C46 | C47 | C48 | H66 | 119.7° | 34.9° |
| C46 | C47 | C48 | H67 | 120.3° | 154.9° |
| C46 | C47 | C49 | H68 | 179.8° | 176.3° |
| O56 | C55 | O54 | H72 | 118.7° | 122.9° |
| O56 | C55 | O54 | P52 | 63.4° | 93.6° |
| O56 | C55 | C57 | H73 | 110.6° | 155.2° |
| C55 | O56 | C61 | H75 | 147.6° | 93.1° |
| C55 | O54 | P52 | O51 | 49.9° | 175.0° |
| C55 | O54 | P52 | O64 | 69.6° | 55.0° |
| C55 | O54 | P52 | O53 | 170.4° | 65.0° |
| O54 | C55 | C57 | H73 | 129.3° | 86.2° |
| C41 | C42 | C44 | C45 | 179.9° | 176.5° |
| C42 | C41 | C40 | H50 | 127.1° | 64.8° |
| C42 | C41 | C40 | H51 | 6.9° | 55.1° |
| C42 | C41 | H52 | H53 | 120.3° | 120.0° |
| C41 | C42 | C43 | H55 | 180.0° | 90.0° |
| C41 | C42 | C43 | H56 | 60.0° | 150.0° |
| C41 | C42 | C43 | H57 | 60.0° | 30.1° |
| C41 | C42 | C44 | H58 | 0.1° | 3.6° |
| C42 | C44 | C45 | H58 | 180.0° | 179.9° |
| C42 | C44 | C45 | C46 | 123.2° | 126.3° |
| C44 | C42 | C41 | H52 | 32.0° | 24.7° |
| C44 | C42 | C41 | H53 | 88.2° | 144.7° |
| C44 | C42 | C43 | H55 | 0.5° | 90.0° |
| C44 | C42 | C43 | H56 | 120.6° | 30.0° |
| C44 | C42 | C43 | H57 | 119.5° | 150.0° |
| C42 | C44 | C45 | H60 | 117.0° | 113.7° |
| C42 | C44 | C45 | H61 | 3.2° | 6.3° |
| C44 | C45 | C46 | H60 | 119.9° | 120.0° |
| C44 | C45 | C46 | H61 | 119.9° | 120.1° |
| C44 | C45 | H60 | H61 | 120.3° | 120.1° |
| C44 | C45 | C46 | H62 | 105.4° | 64.8° |
| C44 | C45 | C46 | H63 | 14.5° | 55.2° |
| C46 | C45 | C44 | H58 | 56.8° | 53.7° |
| C46 | C45 | H60 | H61 | 120.3° | 119.9° |
| C45 | C46 | H62 | H63 | 120.0° | 120.0° |
| C49 | C50 | O51 | H70 | 119.9° | 120.0° |
| C49 | C50 | O51 | H71 | 119.9° | 120.0° |
| C49 | C50 | O51 | P52 | 100.6° | 180.0° |
| C49 | C50 | H70 | H71 | 120.2° | 120.0° |
| C36 | C35 | C34 | H40 | 119.9° | 120.0° |
| C36 | C35 | C34 | H41 | 119.9° | 120.0° |
| C36 | C35 | C34 | C32 | 109.7° | 122.4° |
| C36 | C35 | C34 | H38 | 70.3° | 57.6° |
| C36 | C35 | H40 | H41 | 120.2° | 119.9° |
| C35 | C36 | H42 | H43 | 120.2° | 120.0° |
| O63 | C62 | C61 | H75 | 50.1° | 53.9° |
| O63 | C62 | H76 | H77 | 120.6° | 120.0° |
| C31 | C32 | C34 | C35 | 0.2° | 7.3° |
| C31 | C32 | C34 | C33 | 179.7° | 180.0° |
| C32 | C31 | C30 | H30 | 27.7° | 55.1° |
| C32 | C31 | C30 | H31 | 147.7° | 64.8° |
| C32 | C31 | H32 | H33 | 119.8° | 120.0° |
| C31 | C32 | C33 | H35 | 180.0° | 90.0° |
| C31 | C32 | C33 | H36 | 60.0° | 150.0° |
| C31 | C32 | C33 | H37 | 60.0° | 30.0° |
| C31 | C32 | C34 | H38 | 179.8° | 172.6° |
| C35 | C34 | C32 | H38 | 180.0° | 180.0° |
| C35 | C34 | C32 | C33 | 179.9° | 172.7° |
| C34 | C35 | H40 | H41 | 120.2° | 120.0° |
| C34 | C35 | C36 | H42 | 86.8° | 55.1° |
| C34 | C35 | C36 | H43 | 33.3° | 64.9° |
| O54 | P52 | O51 | C50 | 109.3° | 175.0° |
| O54 | P52 | O51 | O64 | 119.9° | 120.0° |
| O54 | P52 | O51 | O53 | 120.4° | 120.0° |
| O54 | P52 | O64 | O53 | 120.2° | 120.0° |
| P52 | O54 | C55 | H72 | 55.3° | 29.3° |
| O54 | P52 | O53 | H78 | 120.1° | 60.1° |
| C50 | O51 | P52 | O64 | 10.6° | 55.0° |
| C50 | O51 | P52 | O53 | 130.3° | 65.1° |
| O51 | C50 | C49 | H68 | 15.5° | 45.2° |
| O51 | C50 | H70 | H71 | 120.2° | 120.0° |
| C34 | C32 | C31 | H32 | 21.4° | 146.9° |
| C34 | C32 | C31 | H33 | 141.3° | 26.9° |
| C34 | C32 | C33 | H35 | 0.3° | 90.0° |
| C34 | C32 | C33 | H36 | 120.3° | 30.0° |
| C34 | C32 | C33 | H37 | 119.7° | 150.0° |
| C32 | C34 | C35 | H40 | 130.3° | 117.5° |
| C32 | C34 | C35 | H41 | 10.2° | 2.4° |
| C33 | C32 | C31 | H32 | 158.9° | 33.1° |
| C33 | C32 | C31 | H33 | 39.0° | 153.1° |
| C32 | C33 | H35 | H36 | 120.0° | 120.0° |
| C32 | C33 | H35 | H37 | 120.0° | 120.0° |
| C32 | C33 | H36 | H37 | 120.0° | 120.0° |
| C33 | C32 | C34 | H38 | 0.1° | 7.4° |
| O51 | P52 | O64 | O53 | 119.8° | 120.1° |
| P52 | O51 | C50 | H70 | 139.4° | 60.0° |
| P52 | O51 | C50 | H71 | 19.3° | 60.0° |
| O51 | P52 | O53 | H78 | 119.4° | 59.9° |
| O64 | P52 | O53 | H78 | 0.0° | 180.0° |
| H1 | C16 | H2 | C15 | 172.7° | 120.0° |
| H1 | C16 | C15 | C14 | 90.0° | 55.2° |
| H1 | C16 | C15 | H3 | 90.0° | 175.2° |
| H1 | C16 | C15 | H4 | 90.0° | 64.8° |
| H2 | C16 | C15 | C14 | 90.0° | 64.9° |
| H2 | C16 | C15 | H3 | 90.0° | 55.1° |
| H2 | C16 | C15 | H4 | 90.0° | 175.2° |
| H5 | C18 | H6 | H7 | 120.0° | 120.0° |
| H8 | C19 | C20 | H10 | 124.6° | 58.9° |
| H8 | C19 | C20 | H11 | 115.7° | 178.9° |
| H10 | C20 | C21 | H12 | 91.1° | 175.3° |
| H10 | C20 | C21 | H13 | 149.1° | 55.2° |
| H11 | C20 | C21 | H12 | 28.6° | 64.8° |
| H11 | C20 | C21 | H13 | 91.2° | 175.2° |
| H15 | C23 | H16 | H17 | 120.0° | 120.0° |
| H18 | C24 | C25 | H20 | 116.3° | 56.9° |
| H18 | C24 | C25 | H21 | 123.6° | 177.0° |
| H20 | C25 | C26 | H22 | 179.7° | 175.1° |
| H20 | C25 | C26 | H23 | 59.7° | 55.2° |
| H21 | C25 | C26 | H22 | 60.2° | 64.9° |
| H21 | C25 | C26 | H23 | 179.8° | 175.2° |
| H25 | C28 | H26 | H27 | 120.0° | 120.0° |
| H28 | C29 | C30 | H30 | 111.2° | 63.4° |
| H28 | C29 | C30 | H31 | 128.8° | 176.7° |
| H30 | C30 | C31 | H32 | 92.3° | 175.1° |
| H30 | C30 | C31 | H33 | 147.8° | 64.9° |
| H31 | C30 | C31 | H32 | 27.6° | 55.2° |
| H31 | C30 | C31 | H33 | 92.2° | 175.2° |
| H35 | C33 | H36 | H37 | 120.0° | 120.0° |
| H38 | C34 | C35 | H40 | 49.7° | 62.4° |
| H38 | C34 | C35 | H41 | 169.8° | 177.6° |
| H40 | C35 | C36 | H42 | 153.3° | 175.1° |
| H40 | C35 | C36 | H43 | 86.6° | 55.2° |
| H41 | C35 | C36 | H42 | 33.1° | 64.9° |
| H41 | C35 | C36 | H43 | 153.3° | 175.1° |
| H45 | C38 | H46 | H47 | 120.0° | 120.0° |
| H48 | C39 | C40 | H50 | 125.5° | 66.6° |
| H48 | C39 | C40 | H51 | 114.4° | 173.4° |
| H50 | C40 | C41 | H52 | 113.0° | 175.2° |
| H50 | C40 | C41 | H53 | 7.2° | 55.2° |
| H51 | C40 | C41 | H52 | 126.8° | 64.8° |
| H51 | C40 | C41 | H53 | 113.0° | 175.2° |
| H55 | C43 | H56 | H57 | 120.0° | 119.9° |
| H58 | C44 | C45 | H60 | 63.1° | 66.2° |
| H58 | C44 | C45 | H61 | 176.8° | 173.8° |
| H60 | C45 | C46 | H62 | 14.5° | 175.2° |
| H60 | C45 | C46 | H63 | 134.5° | 64.8° |
| H61 | C45 | C46 | H62 | 134.6° | 55.2° |
| H61 | C45 | C46 | H63 | 105.4° | 175.2° |
| H65 | C48 | H66 | H67 | 120.0° | 120.0° |
| H68 | C49 | C50 | H70 | 104.4° | 74.7° |
| H68 | C49 | C50 | H71 | 135.5° | 165.2° |
| H72 | C55 | C57 | H73 | 6.5° | 36.6° |
| H73 | C57 | C59 | H74 | 109.2° | 102.3° |
| H73 | C57 | O58 | H79 | 61.8° | 62.1° |
| H74 | C59 | C61 | H75 | 100.3° | 123.9° |
| H74 | C59 | O60 | H80 | 61.6° | 61.3° |
| H75 | C61 | C62 | H76 | 69.7° | 66.0° |
| H75 | C61 | C62 | H77 | 169.9° | 174.0° |
| H76 | C62 | O63 | H81 | 60.2° | 60.0° |
| H77 | C62 | O63 | H81 | 60.2° | 60.0° |
| C16 | C15 | C14 | H3 | 90.0° | 120.0° |
| C16 | C15 | C14 | H4 | 90.0° | 120.0° |
| C16 | C15 | C14 | C12 | 90.0° | 118.6° |
| C16 | C15 | H3 | H4 | 90.0° | 120.0° |
| C16 | C15 | C14 | H9 | 90.0° | 61.4° |
| C15 | C14 | C12 | H9 | 90.0° | 179.9° |
| C15 | C14 | C12 | C11 | 90.0° | 177.7° |
| C15 | C14 | C12 | C13 | 90.0° | 2.2° |
| C14 | C15 | H3 | H4 | 90.0° | 120.0° |
| C14 | C12 | C11 | C13 | 90.0° | 179.9° |
| C14 | C12 | C11 | C10 | 90.0° | 95.3° |
| C12 | C14 | C15 | H3 | 90.0° | 1.4° |
| C12 | C14 | C15 | H4 | 90.0° | 121.4° |
| C14 | C12 | C11 | H14 | 90.0° | 144.7° |
| C14 | C12 | C11 | H19 | 90.0° | 24.7° |
| C14 | C12 | C13 | H83 | 90.0° | 83.6° |
| C14 | C12 | C13 | H84 | 90.0° | 156.3° |
| C14 | C12 | C13 | H85 | 90.0° | 36.4° |
| C12 | C11 | C10 | H14 | 90.0° | 119.9° |
| C12 | C11 | C10 | H19 | 90.0° | 120.0° |
| C12 | C11 | C10 | C9 | 90.0° | 175.2° |
| C11 | C12 | C14 | H9 | 90.0° | 2.4° |
| C12 | C11 | H14 | H19 | 90.0° | 120.0° |
| C12 | C11 | C10 | H24 | 90.0° | 64.8° |
| C12 | C11 | C10 | H29 | 90.0° | 55.2° |
| C11 | C12 | C13 | H83 | 90.0° | 96.3° |
| C11 | C12 | C13 | H84 | 90.0° | 23.8° |
| C11 | C12 | C13 | H85 | 90.0° | 143.7° |
| C11 | C10 | C9 | H24 | 90.0° | 120.0° |
| C11 | C10 | C9 | H29 | 90.0° | 120.0° |
| C11 | C10 | C9 | C7 | 90.0° | 119.4° |
| C10 | C11 | C12 | C13 | 90.0° | 84.8° |
| C10 | C11 | H14 | H19 | 90.0° | 120.1° |
| C11 | C10 | H24 | H29 | 90.0° | 120.0° |
| C11 | C10 | C9 | H34 | 90.0° | 60.6° |
| C10 | C9 | C7 | H34 | 90.0° | 179.9° |
| C10 | C9 | C7 | C6 | 90.0° | 174.1° |
| C10 | C9 | C7 | C8 | 90.0° | 6.0° |
| C9 | C10 | C11 | H14 | 90.0° | 55.3° |
| C9 | C10 | C11 | H19 | 90.0° | 64.8° |
| C9 | C10 | H24 | H29 | 90.0° | 120.0° |
| C9 | C7 | C6 | C8 | 90.0° | 179.9° |
| C9 | C7 | C6 | C5 | 90.0° | 95.0° |
| C7 | C9 | C10 | H24 | 90.0° | 0.6° |
| C7 | C9 | C10 | H29 | 90.0° | 120.5° |
| C9 | C7 | C6 | H39 | 90.0° | 145.0° |
| C9 | C7 | C6 | H44 | 90.0° | 25.1° |
| C9 | C7 | C8 | H86 | 90.0° | 86.1° |
| C9 | C7 | C8 | H87 | 90.0° | 154.0° |
| C9 | C7 | C8 | H88 | 90.0° | 33.9° |
| C7 | C6 | C5 | H39 | 90.0° | 120.0° |
| C7 | C6 | C5 | H44 | 90.0° | 120.1° |
| C7 | C6 | C5 | C4 | 90.0° | 180.0° |
| C6 | C7 | C9 | H34 | 90.0° | 5.9° |
| C7 | C6 | H39 | H44 | 90.0° | 120.0° |
| C7 | C6 | C5 | H49 | 90.0° | 60.0° |
| C7 | C6 | C5 | H54 | 90.0° | 59.9° |
| C6 | C7 | C8 | H86 | 90.0° | 94.0° |
| C6 | C7 | C8 | H87 | 90.0° | 25.9° |
| C6 | C7 | C8 | H88 | 90.0° | 146.0° |
| C6 | C5 | C4 | H49 | 90.0° | 120.0° |
| C6 | C5 | C4 | H54 | 90.0° | 120.0° |
| C6 | C5 | C4 | C3 | 90.0° | 119.3° |
| C5 | C6 | C7 | C8 | 90.0° | 84.9° |
| C5 | C6 | H39 | H44 | 90.0° | 120.0° |
| C6 | C5 | H49 | H54 | 90.0° | 120.0° |
| C6 | C5 | C4 | H59 | 90.0° | 60.6° |
| C5 | C4 | C3 | H59 | 90.0° | 179.9° |
| C5 | C4 | C3 | C2 | 90.0° | 6.1° |
| C5 | C4 | C3 | C1 | 90.0° | 173.8° |
| C4 | C5 | C6 | H39 | 90.0° | 59.9° |
| C4 | C5 | C6 | H44 | 90.0° | 60.0° |
| C4 | C5 | H49 | H54 | 90.0° | 120.0° |
| C4 | C3 | C2 | C1 | 90.0° | 179.9° |
| C3 | C4 | C5 | H49 | 90.0° | 0.7° |
| C3 | C4 | C5 | H54 | 90.0° | 120.6° |
| C4 | C3 | C2 | H64 | 90.0° | 83.7° |
| C4 | C3 | C2 | H69 | 90.0° | 156.3° |
| C4 | C3 | C2 | H82 | 90.0° | 36.3° |
| C4 | C3 | C1 | H89 | 90.0° | 0.0° |
| C4 | C3 | C1 | H90 | 90.0° | 120.0° |
| C4 | C3 | C1 | H91 | 90.0° | 120.0° |
| C2 | C3 | C4 | H59 | 90.0° | 173.8° |
| C3 | C2 | H64 | H69 | 90.0° | 120.0° |
| C3 | C2 | H64 | H82 | 90.0° | 120.0° |
| C3 | C2 | H69 | H82 | 90.0° | 120.0° |
| C2 | C3 | C1 | H89 | 90.0° | 180.0° |
| C2 | C3 | C1 | H90 | 90.0° | 60.0° |
| C2 | C3 | C1 | H91 | 90.0° | 59.9° |
| C13 | C12 | C14 | H9 | 90.0° | 177.7° |
| C13 | C12 | C11 | H14 | 90.0° | 35.2° |
| C13 | C12 | C11 | H19 | 90.0° | 155.3° |
| C12 | C13 | H83 | H84 | 90.0° | 120.0° |
| C12 | C13 | H83 | H85 | 90.0° | 120.0° |
| C12 | C13 | H84 | H85 | 90.0° | 119.9° |
| C8 | C7 | C9 | H34 | 90.0° | 174.1° |
| C8 | C7 | C6 | H39 | 90.0° | 35.1° |
| C8 | C7 | C6 | H44 | 90.0° | 155.0° |
| C7 | C8 | H86 | H87 | 90.0° | 120.0° |
| C7 | C8 | H86 | H88 | 90.0° | 120.0° |
| C7 | C8 | H87 | H88 | 90.0° | 120.1° |
| C1 | C3 | C4 | H59 | 90.0° | 6.3° |
| C1 | C3 | C2 | H64 | 90.0° | 96.2° |
| C1 | C3 | C2 | H69 | 90.0° | 23.8° |
| C1 | C3 | C2 | H82 | 90.0° | 143.8° |
| C3 | C1 | H89 | H90 | 90.0° | 120.0° |
| C3 | C1 | H89 | H91 | 90.0° | 120.1° |
| C3 | C1 | H90 | H91 | 90.0° | 120.0° |
| H3 | C15 | C14 | H9 | 90.0° | 178.7° |
| H4 | C15 | C14 | H9 | 90.0° | 58.6° |
| H14 | C11 | C10 | H24 | 90.0° | 175.3° |
| H14 | C11 | C10 | H29 | 90.0° | 64.7° |
| H19 | C11 | C10 | H24 | 90.0° | 55.2° |
| H19 | C11 | C10 | H29 | 90.0° | 175.2° |
| H24 | C10 | C9 | H34 | 90.0° | 179.4° |
| H29 | C10 | C9 | H34 | 90.0° | 59.4° |
| H39 | C6 | C5 | H49 | 90.0° | 180.0° |
| H39 | C6 | C5 | H54 | 90.0° | 60.1° |
| H44 | C6 | C5 | H49 | 90.0° | 60.1° |
| H44 | C6 | C5 | H54 | 90.0° | 180.0° |
| H49 | C5 | C4 | H59 | 90.0° | 179.4° |
| H54 | C5 | C4 | H59 | 90.0° | 59.5° |
| H64 | C2 | H69 | H82 | 90.0° | 120.0° |
| H83 | C13 | H84 | H85 | 90.0° | 120.0° |
| H86 | C8 | H87 | H88 | 90.0° | 119.9° |
| H89 | C1 | H90 | H91 | 90.0° | 119.9° |
