UQ9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C51 | C49 | sing | 1.51Å | 1.53Å | |
| C51 | H51 | sing | 1.09Å | 1.10Å | |
| C51 | H51A | sing | 1.09Å | 1.10Å | |
| C51 | H51B | sing | 1.09Å | 1.10Å | |
| C49 | C50 | sing | 1.51Å | 1.54Å | |
| C49 | C48 | doub | 1.31Å | 1.40Å | |
| C50 | H50 | sing | 1.09Å | 1.10Å | |
| C50 | H50A | sing | 1.09Å | 1.10Å | |
| C50 | H50B | sing | 1.09Å | 1.10Å | |
| C48 | C47 | sing | 1.51Å | 1.39Å | |
| C48 | H48 | sing | 1.08Å | 1.08Å | |
| C47 | C46 | sing | 1.53Å | 1.53Å | |
| C47 | H47 | sing | 1.09Å | 1.10Å | |
| C47 | H47A | sing | 1.09Å | 1.10Å | |
| C46 | C44 | sing | 1.51Å | 1.54Å | |
| C46 | H46 | sing | 1.09Å | 1.10Å | |
| C46 | H46A | sing | 1.09Å | 1.10Å | |
| C44 | C43 | doub | 1.31Å | 1.40Å | |
| C44 | C45 | sing | 1.51Å | 1.52Å | |
| C45 | H45 | sing | 1.09Å | 1.10Å | |
| C45 | H45A | sing | 1.09Å | 1.10Å | |
| C45 | H45B | sing | 1.09Å | 1.10Å | |
| C42 | C43 | sing | 1.51Å | 1.39Å | |
| C43 | H43 | sing | 1.08Å | 1.08Å | |
| C42 | C41 | sing | 1.53Å | 1.54Å | |
| C42 | H42 | sing | 1.09Å | 1.10Å | |
| C42 | H42A | sing | 1.09Å | 1.10Å | |
| C41 | C39 | sing | 1.51Å | 1.55Å | |
| C41 | H41 | sing | 1.09Å | 1.10Å | |
| C41 | H41A | sing | 1.09Å | 1.10Å | |
| C40 | C39 | sing | 1.51Å | 1.54Å | |
| C39 | C38 | doub | 1.31Å | 1.41Å | |
| C40 | H40 | sing | 1.09Å | 1.10Å | |
| C40 | H40A | sing | 1.09Å | 1.10Å | |
| C40 | H40B | sing | 1.09Å | 1.10Å | |
| C38 | C37 | sing | 1.51Å | 1.42Å | |
| C38 | H38 | sing | 1.08Å | 1.08Å | |
| C37 | C36 | sing | 1.53Å | 1.55Å | |
| C37 | H37 | sing | 1.09Å | 1.10Å | |
| C37 | H37A | sing | 1.09Å | 1.10Å | |
| C34 | C36 | sing | 1.51Å | 1.54Å | |
| C36 | H36 | sing | 1.09Å | 1.10Å | |
| C36 | H36A | sing | 1.09Å | 1.10Å | |
| C33 | C34 | doub | 1.31Å | 1.39Å | |
| C34 | C35 | sing | 1.51Å | 1.54Å | |
| C35 | H35 | sing | 1.09Å | 1.10Å | |
| C35 | H35A | sing | 1.09Å | 1.10Å | |
| C35 | H35B | sing | 1.09Å | 1.10Å | |
| C32 | C33 | sing | 1.51Å | 1.39Å | |
| C33 | H33 | sing | 1.08Å | 1.08Å | |
| C32 | C31 | sing | 1.53Å | 1.53Å | |
| C32 | H32 | sing | 1.09Å | 1.10Å | |
| C32 | H32A | sing | 1.09Å | 1.10Å | |
| C29 | C31 | sing | 1.51Å | 1.55Å | |
| C31 | H31 | sing | 1.09Å | 1.10Å | |
| C31 | H31A | sing | 1.09Å | 1.10Å | |
| C30 | C29 | sing | 1.51Å | 1.54Å | |
| C29 | C28 | doub | 1.31Å | 1.40Å | |
| C30 | H30 | sing | 1.09Å | 1.10Å | |
| C30 | H30A | sing | 1.09Å | 1.10Å | |
| C30 | H30B | sing | 1.09Å | 1.10Å | |
| C27 | C28 | sing | 1.51Å | 1.40Å | |
| C28 | H28 | sing | 1.08Å | 1.08Å | |
| C27 | C26 | sing | 1.53Å | 1.54Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C27 | H27A | sing | 1.09Å | 1.10Å | |
| C24 | C26 | sing | 1.51Å | 1.54Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C26 | H26A | sing | 1.09Å | 1.10Å | |
| C23 | C24 | doub | 1.31Å | 1.38Å | |
| C24 | C25 | sing | 1.51Å | 1.55Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C25 | H25A | sing | 1.09Å | 1.10Å | |
| C25 | H25B | sing | 1.09Å | 1.10Å | |
| C22 | C23 | sing | 1.51Å | 1.39Å | |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| C21 | C22 | sing | 1.53Å | 1.54Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H22A | sing | 1.09Å | 1.10Å | |
| C19 | C21 | sing | 1.51Å | 1.54Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H21A | sing | 1.09Å | 1.10Å | |
| C20 | C19 | sing | 1.51Å | 1.54Å | |
| C19 | C18 | doub | 1.31Å | 1.41Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C20 | H20A | sing | 1.09Å | 1.10Å | |
| C20 | H20B | sing | 1.09Å | 1.10Å | |
| C17 | C18 | sing | 1.51Å | 1.41Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C17 | C16 | sing | 1.53Å | 1.56Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C17 | H17A | sing | 1.09Å | 1.10Å | |
| C14 | C16 | sing | 1.51Å | 1.56Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H16A | sing | 1.09Å | 1.10Å | |
| C13 | C14 | doub | 1.31Å | 1.40Å | |
| C14 | C15 | sing | 1.51Å | 1.54Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H15A | sing | 1.09Å | 1.10Å | |
| C15 | H15B | sing | 1.09Å | 1.10Å | |
| C12 | C13 | sing | 1.51Å | 1.40Å | |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C11 | C12 | sing | 1.53Å | 1.54Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C11 | C9 | sing | 1.51Å | 1.53Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H11A | sing | 1.09Å | 1.10Å | |
| C10 | C9 | sing | 1.51Å | 1.52Å | |
| C9 | C8 | doub | 1.31Å | 1.40Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H10A | sing | 1.09Å | 1.10Å | |
| C10 | H10B | sing | 1.09Å | 1.10Å | |
| C8 | C7 | sing | 1.51Å | 1.39Å | |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C7 | C6 | sing | 1.51Å | 1.53Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C7 | H7A | sing | 1.09Å | 1.10Å | |
| C5 | C6 | sing | 1.48Å | 1.38Å | |
| C6 | C1 | doub | 1.34Å | 1.41Å | |
| C1 | C2 | sing | 1.48Å | 1.41Å | |
| C1 | C1M | sing | 1.51Å | 1.52Å | |
| C1M | H1M | sing | 1.09Å | 1.10Å | |
| C1M | H1MA | sing | 1.09Å | 1.10Å | |
| C1M | H1MB | sing | 1.09Å | 1.10Å | |
| C3 | C2 | sing | 1.48Å | 1.40Å | |
| C2 | O2 | doub | 1.22Å | 1.24Å | |
| C4 | C3 | doub | 1.35Å | 1.40Å | |
| C3 | O3 | sing | 1.36Å | 1.38Å | |
| O3 | C3M | sing | 1.43Å | 1.42Å | |
| C3M | H3M | sing | 1.09Å | 1.10Å | |
| C3M | H3MA | sing | 1.09Å | 1.10Å | |
| C3M | H3MB | sing | 1.09Å | 1.10Å | |
| O4 | C4 | sing | 1.36Å | 1.37Å | |
| C5 | C4 | sing | 1.48Å | 1.38Å | |
| O4 | C4M | sing | 1.43Å | 1.44Å | |
| C4M | H4M | sing | 1.09Å | 1.10Å | |
| C4M | H4MA | sing | 1.09Å | 1.10Å | |
| C4M | H4MB | sing | 1.09Å | 1.10Å | |
| O5 | C5 | doub | 1.21Å | 1.23Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C49 | C51 | H51 | 109.5° | 109.5° |
| C49 | C51 | H51A | 109.5° | 109.5° |
| C49 | C51 | H51B | 109.4° | 109.5° |
| C51 | C49 | C50 | 118.3° | 120.0° |
| C51 | C49 | C48 | 120.0° | 120.0° |
| H51 | C51 | H51A | 109.5° | 109.5° |
| H51 | C51 | H51B | 109.5° | 109.4° |
| H51A | C51 | H51B | 109.5° | 109.4° |
| C50 | C49 | C48 | 121.6° | 120.0° |
| C49 | C50 | H50 | 109.5° | 109.5° |
| C49 | C50 | H50A | 109.5° | 109.4° |
| C49 | C50 | H50B | 109.4° | 109.5° |
| C49 | C48 | C47 | 127.8° | 120.0° |
| C49 | C48 | H48 | 116.1° | 120.0° |
| H50 | C50 | H50A | 109.5° | 109.5° |
| H50 | C50 | H50B | 109.4° | 109.5° |
| H50A | C50 | H50B | 109.5° | 109.5° |
| C47 | C48 | H48 | 116.1° | 120.0° |
| C48 | C47 | C46 | 112.8° | 109.5° |
| C48 | C47 | H47 | 108.4° | 109.5° |
| C48 | C47 | H47A | 107.6° | 109.5° |
| C46 | C47 | H47 | 108.4° | 109.5° |
| C46 | C47 | H47A | 107.6° | 109.5° |
| C47 | C46 | C44 | 110.4° | 109.5° |
| C47 | C46 | H46 | 109.2° | 109.5° |
| C47 | C46 | H46A | 109.0° | 109.5° |
| H47 | C47 | H47A | 112.2° | 109.5° |
| C44 | C46 | H46 | 109.2° | 109.5° |
| C44 | C46 | H46A | 108.9° | 109.4° |
| C46 | C44 | C43 | 124.5° | 120.0° |
| C46 | C44 | C45 | 117.9° | 120.0° |
| H46 | C46 | H46A | 110.2° | 109.5° |
| C43 | C44 | C45 | 117.6° | 120.1° |
| C44 | C43 | C42 | 130.3° | 120.1° |
| C44 | C43 | H43 | 114.9° | 120.0° |
| C44 | C45 | H45 | 109.5° | 109.4° |
| C44 | C45 | H45A | 109.5° | 109.4° |
| C44 | C45 | H45B | 109.5° | 109.5° |
| H45 | C45 | H45A | 109.5° | 109.5° |
| H45 | C45 | H45B | 109.5° | 109.5° |
| H45A | C45 | H45B | 109.5° | 109.5° |
| C42 | C43 | H43 | 114.8° | 120.0° |
| C43 | C42 | C41 | 111.4° | 109.5° |
| C43 | C42 | H42 | 108.8° | 109.4° |
| C43 | C42 | H42A | 108.3° | 109.5° |
| C41 | C42 | H42 | 108.8° | 109.5° |
| C41 | C42 | H42A | 108.4° | 109.5° |
| C42 | C41 | C39 | 114.9° | 109.5° |
| C42 | C41 | H41 | 107.7° | 109.5° |
| C42 | C41 | H41A | 106.5° | 109.5° |
| H42 | C42 | H42A | 111.1° | 109.4° |
| C39 | C41 | H41 | 107.7° | 109.5° |
| C39 | C41 | H41A | 106.4° | 109.4° |
| C41 | C39 | C40 | 117.2° | 120.0° |
| C41 | C39 | C38 | 121.2° | 120.0° |
| H41 | C41 | H41A | 113.8° | 109.5° |
| C40 | C39 | C38 | 121.6° | 120.0° |
| C39 | C40 | H40 | 109.5° | 109.5° |
| C39 | C40 | H40A | 109.4° | 109.5° |
| C39 | C40 | H40B | 109.5° | 109.4° |
| C39 | C38 | C37 | 131.0° | 120.0° |
| C39 | C38 | H38 | 114.5° | 120.0° |
| H40 | C40 | H40A | 109.5° | 109.4° |
| H40 | C40 | H40B | 109.4° | 109.5° |
| H40A | C40 | H40B | 109.5° | 109.5° |
| C37 | C38 | H38 | 114.5° | 120.1° |
| C38 | C37 | C36 | 115.1° | 109.5° |
| C38 | C37 | H37 | 107.6° | 109.5° |
| C38 | C37 | H37A | 106.3° | 109.5° |
| C36 | C37 | H37 | 107.6° | 109.4° |
| C36 | C37 | H37A | 106.3° | 109.4° |
| C37 | C36 | C34 | 113.6° | 109.5° |
| C37 | C36 | H36 | 108.1° | 109.5° |
| C37 | C36 | H36A | 107.2° | 109.5° |
| H37 | C37 | H37A | 114.0° | 109.5° |
| C34 | C36 | H36 | 108.1° | 109.5° |
| C34 | C36 | H36A | 107.2° | 109.4° |
| C36 | C34 | C33 | 118.8° | 120.0° |
| C36 | C34 | C35 | 120.9° | 120.0° |
| H36 | C36 | H36A | 112.7° | 109.4° |
| C33 | C34 | C35 | 120.4° | 120.0° |
| C34 | C33 | C32 | 126.2° | 120.0° |
| C34 | C33 | H33 | 116.9° | 120.0° |
| C34 | C35 | H35 | 109.5° | 109.5° |
| C34 | C35 | H35A | 109.5° | 109.5° |
| C34 | C35 | H35B | 109.5° | 109.5° |
| H35 | C35 | H35A | 109.5° | 109.5° |
| H35 | C35 | H35B | 109.5° | 109.5° |
| H35A | C35 | H35B | 109.5° | 109.4° |
| C32 | C33 | H33 | 116.9° | 120.0° |
| C33 | C32 | C31 | 113.0° | 109.4° |
| C33 | C32 | H32 | 108.3° | 109.4° |
| C33 | C32 | H32A | 107.5° | 109.5° |
| C31 | C32 | H32 | 108.3° | 109.5° |
| C31 | C32 | H32A | 107.5° | 109.5° |
| C32 | C31 | C29 | 117.8° | 109.5° |
| C32 | C31 | H31 | 106.8° | 109.5° |
| C32 | C31 | H31A | 104.9° | 109.5° |
| H32 | C32 | H32A | 112.3° | 109.5° |
| C29 | C31 | H31 | 106.8° | 109.5° |
| C29 | C31 | H31A | 104.9° | 109.5° |
| C31 | C29 | C30 | 122.4° | 120.0° |
| C31 | C29 | C28 | 115.5° | 120.0° |
| H31 | C31 | H31A | 116.3° | 109.5° |
| C30 | C29 | C28 | 122.1° | 120.0° |
| C29 | C30 | H30 | 109.5° | 109.4° |
| C29 | C30 | H30A | 109.5° | 109.4° |
| C29 | C30 | H30B | 109.4° | 109.5° |
| C29 | C28 | C27 | 133.0° | 120.0° |
| C29 | C28 | H28 | 113.5° | 120.0° |
| H30 | C30 | H30A | 109.5° | 109.5° |
| H30 | C30 | H30B | 109.5° | 109.5° |
| H30A | C30 | H30B | 109.5° | 109.5° |
| C27 | C28 | H28 | 113.5° | 120.0° |
| C28 | C27 | C26 | 109.6° | 109.5° |
| C28 | C27 | H27 | 109.4° | 109.4° |
| C28 | C27 | H27A | 109.4° | 109.5° |
| C26 | C27 | H27 | 109.4° | 109.5° |
| C26 | C27 | H27A | 109.4° | 109.5° |
| C27 | C26 | C24 | 112.3° | 109.5° |
| C27 | C26 | H26 | 108.5° | 109.4° |
| C27 | C26 | H26A | 107.9° | 109.4° |
| H27 | C27 | H27A | 109.6° | 109.5° |
| C24 | C26 | H26 | 108.5° | 109.5° |
| C24 | C26 | H26A | 107.9° | 109.5° |
| C26 | C24 | C23 | 116.9° | 120.0° |
| C26 | C24 | C25 | 123.2° | 120.0° |
| H26 | C26 | H26A | 111.7° | 109.4° |
| C23 | C24 | C25 | 119.9° | 120.0° |
| C24 | C23 | C22 | 126.2° | 120.0° |
| C24 | C23 | H23 | 116.9° | 120.0° |
| C24 | C25 | H25 | 109.5° | 109.5° |
| C24 | C25 | H25A | 109.5° | 109.5° |
| C24 | C25 | H25B | 109.5° | 109.5° |
| H25 | C25 | H25A | 109.5° | 109.5° |
| H25 | C25 | H25B | 109.4° | 109.5° |
| H25A | C25 | H25B | 109.5° | 109.4° |
| C22 | C23 | H23 | 116.9° | 120.0° |
| C23 | C22 | C21 | 110.6° | 109.5° |
| C23 | C22 | H22 | 109.1° | 109.5° |
| C23 | C22 | H22A | 108.8° | 109.5° |
| C21 | C22 | H22 | 109.1° | 109.4° |
| C21 | C22 | H22A | 108.8° | 109.5° |
| C22 | C21 | C19 | 113.4° | 109.5° |
| C22 | C21 | H21 | 108.2° | 109.4° |
| C22 | C21 | H21A | 107.3° | 109.5° |
| H22 | C22 | H22A | 110.4° | 109.4° |
| C19 | C21 | H21 | 108.1° | 109.4° |
| C19 | C21 | H21A | 107.3° | 109.5° |
| C21 | C19 | C20 | 116.6° | 120.0° |
| C21 | C19 | C18 | 120.4° | 120.0° |
| H21 | C21 | H21A | 112.6° | 109.5° |
| C20 | C19 | C18 | 123.0° | 120.0° |
| C19 | C20 | H20 | 109.5° | 109.5° |
| C19 | C20 | H20A | 109.5° | 109.5° |
| C19 | C20 | H20B | 109.5° | 109.5° |
| C19 | C18 | C17 | 131.6° | 120.0° |
| C19 | C18 | H18 | 114.2° | 120.1° |
| H20 | C20 | H20A | 109.5° | 109.4° |
| H20 | C20 | H20B | 109.4° | 109.5° |
| H20A | C20 | H20B | 109.5° | 109.4° |
| C17 | C18 | H18 | 114.2° | 120.0° |
| C18 | C17 | C16 | 112.7° | 109.5° |
| C18 | C17 | H17 | 108.4° | 109.5° |
| C18 | C17 | H17A | 107.7° | 109.5° |
| C16 | C17 | H17 | 108.4° | 109.5° |
| C16 | C17 | H17A | 107.7° | 109.4° |
| C17 | C16 | C14 | 118.8° | 109.5° |
| C17 | C16 | H16 | 106.4° | 109.5° |
| C17 | C16 | H16A | 104.3° | 109.5° |
| H17 | C17 | H17A | 112.0° | 109.5° |
| C14 | C16 | H16 | 106.5° | 109.5° |
| C14 | C16 | H16A | 104.3° | 109.5° |
| C16 | C14 | C13 | 122.9° | 120.0° |
| C16 | C14 | C15 | 120.4° | 120.0° |
| H16 | C16 | H16A | 117.2° | 109.5° |
| C13 | C14 | C15 | 116.7° | 120.0° |
| C14 | C13 | C12 | 124.6° | 120.0° |
| C14 | C13 | H13 | 117.7° | 120.0° |
| C14 | C15 | H15 | 109.5° | 109.5° |
| C14 | C15 | H15A | 109.4° | 109.5° |
| C14 | C15 | H15B | 109.5° | 109.5° |
| H15 | C15 | H15A | 109.5° | 109.4° |
| H15 | C15 | H15B | 109.5° | 109.5° |
| H15A | C15 | H15B | 109.5° | 109.5° |
| C12 | C13 | H13 | 117.7° | 120.0° |
| C13 | C12 | C11 | 114.5° | 109.4° |
| C13 | C12 | H12 | 107.8° | 109.5° |
| C13 | C12 | H12A | 106.7° | 109.4° |
| C11 | C12 | H12 | 107.8° | 109.5° |
| C11 | C12 | H12A | 106.6° | 109.5° |
| C12 | C11 | C9 | 106.6° | 109.4° |
| C12 | C11 | H11 | 110.4° | 109.4° |
| C12 | C11 | H11A | 111.0° | 109.5° |
| H12 | C12 | H12A | 113.5° | 109.5° |
| C9 | C11 | H11 | 110.4° | 109.5° |
| C9 | C11 | H11A | 111.1° | 109.4° |
| C11 | C9 | C10 | 118.0° | 120.0° |
| C11 | C9 | C8 | 119.3° | 120.0° |
| H11 | C11 | H11A | 107.3° | 109.5° |
| C10 | C9 | C8 | 122.7° | 120.0° |
| C9 | C10 | H10 | 109.5° | 109.4° |
| C9 | C10 | H10A | 109.5° | 109.4° |
| C9 | C10 | H10B | 109.5° | 109.5° |
| C9 | C8 | C7 | 129.8° | 120.0° |
| C9 | C8 | H8 | 115.1° | 120.0° |
| H10 | C10 | H10A | 109.5° | 109.5° |
| H10 | C10 | H10B | 109.5° | 109.5° |
| H10A | C10 | H10B | 109.5° | 109.5° |
| C7 | C8 | H8 | 115.1° | 120.1° |
| C8 | C7 | C6 | 117.4° | 109.5° |
| C8 | C7 | H7 | 106.9° | 109.5° |
| C8 | C7 | H7A | 105.1° | 109.5° |
| C6 | C7 | H7 | 106.9° | 109.4° |
| C6 | C7 | H7A | 105.0° | 109.4° |
| C7 | C6 | C5 | 115.4° | 119.9° |
| C7 | C6 | C1 | 127.1° | 119.9° |
| H7 | C7 | H7A | 115.9° | 109.5° |
| C5 | C6 | C1 | 117.4° | 120.1° |
| C6 | C5 | C4 | 123.2° | 120.0° |
| C6 | C5 | O5 | 116.3° | 120.0° |
| C6 | C1 | C2 | 120.4° | 120.1° |
| C6 | C1 | C1M | 119.7° | 119.9° |
| C2 | C1 | C1M | 119.9° | 119.9° |
| C1 | C2 | C3 | 120.3° | 120.0° |
| C1 | C2 | O2 | 122.7° | 120.0° |
| C1 | C1M | H1M | 109.5° | 109.5° |
| C1 | C1M | H1MA | 109.5° | 109.4° |
| C1 | C1M | H1MB | 109.5° | 109.5° |
| H1M | C1M | H1MA | 109.5° | 109.5° |
| H1M | C1M | H1MB | 109.4° | 109.5° |
| H1MA | C1M | H1MB | 109.5° | 109.4° |
| C3 | C2 | O2 | 116.9° | 120.0° |
| C2 | C3 | C4 | 118.8° | 119.9° |
| C2 | C3 | O3 | 122.0° | 120.1° |
| C4 | C3 | O3 | 119.3° | 120.0° |
| C3 | C4 | O4 | 121.9° | 120.1° |
| C3 | C4 | C5 | 119.8° | 119.9° |
| C3 | O3 | C3M | 122.0° | 117.0° |
| O3 | C3M | H3M | 109.5° | 109.5° |
| O3 | C3M | H3MA | 109.5° | 109.5° |
| O3 | C3M | H3MB | 109.4° | 109.5° |
| H3M | C3M | H3MA | 109.5° | 109.4° |
| H3M | C3M | H3MB | 109.4° | 109.4° |
| H3MA | C3M | H3MB | 109.5° | 109.5° |
| O4 | C4 | C5 | 118.4° | 120.0° |
| C4 | O4 | C4M | 115.8° | 117.0° |
| C4 | C5 | O5 | 120.5° | 120.0° |
| O4 | C4M | H4M | 109.5° | 109.5° |
| O4 | C4M | H4MA | 109.5° | 109.5° |
| O4 | C4M | H4MB | 109.4° | 109.5° |
| H4M | C4M | H4MA | 109.4° | 109.5° |
| H4M | C4M | H4MB | 109.5° | 109.5° |
| H4MA | C4M | H4MB | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C49 | C51 | H51 | H51A | 120.0° | 120.1° |
| C49 | C51 | H51 | H51B | 119.9° | 120.0° |
| C49 | C51 | H51A | H51B | 120.0° | 120.0° |
| C51 | C49 | C50 | C48 | 179.7° | 180.0° |
| C51 | C49 | C50 | H50 | 5.1° | 90.0° |
| C51 | C49 | C50 | H50A | 125.1° | 150.0° |
| C51 | C49 | C50 | H50B | 114.8° | 30.0° |
| C51 | C49 | C48 | C47 | 179.3° | 0.0° |
| C51 | C49 | C48 | H48 | 0.8° | 180.0° |
| H51 | C51 | H51A | H51B | 120.0° | 119.9° |
| H51 | C51 | C49 | C50 | 165.7° | 0.0° |
| H51 | C51 | C49 | C48 | 14.0° | 180.0° |
| H51A | C51 | C49 | C50 | 74.3° | 120.0° |
| H51A | C51 | C49 | C48 | 106.0° | 60.0° |
| H51B | C51 | C49 | C50 | 45.7° | 120.0° |
| H51B | C51 | C49 | C48 | 134.0° | 60.0° |
| C49 | C50 | H50 | H50A | 120.0° | 120.0° |
| C49 | C50 | H50 | H50B | 120.0° | 120.0° |
| C49 | C50 | H50A | H50B | 120.0° | 120.0° |
| C50 | C49 | C48 | C47 | 1.1° | 180.0° |
| C50 | C49 | C48 | H48 | 178.9° | 0.0° |
| C48 | C49 | C50 | H50 | 175.2° | 90.0° |
| C48 | C49 | C50 | H50A | 55.2° | 30.0° |
| C48 | C49 | C50 | H50B | 64.9° | 150.0° |
| C49 | C48 | C47 | H48 | 180.0° | 180.0° |
| C49 | C48 | C47 | C46 | 107.2° | 125.0° |
| C49 | C48 | C47 | H47 | 12.8° | 115.0° |
| C49 | C48 | C47 | H47A | 134.2° | 5.0° |
| H50 | C50 | H50A | H50B | 120.0° | 120.0° |
| C48 | C47 | C46 | H47 | 120.0° | 120.0° |
| C48 | C47 | C46 | H47A | 118.5° | 120.0° |
| C48 | C47 | H47 | H47A | 118.6° | 120.0° |
| C48 | C47 | C46 | C44 | 175.0° | 180.0° |
| C48 | C47 | C46 | H46 | 55.0° | 60.0° |
| C48 | C47 | C46 | H46A | 65.4° | 60.0° |
| H48 | C48 | C47 | C46 | 72.7° | 55.0° |
| H48 | C48 | C47 | H47 | 167.3° | 65.0° |
| H48 | C48 | C47 | H47A | 45.8° | 175.0° |
| C46 | C47 | H47 | H47A | 118.7° | 120.0° |
| C47 | C46 | C44 | H46 | 120.0° | 120.0° |
| C47 | C46 | C44 | H46A | 119.6° | 120.0° |
| C47 | C46 | H46 | H46A | 119.6° | 120.0° |
| C47 | C46 | C44 | C43 | 88.1° | 95.5° |
| C47 | C46 | C44 | C45 | 90.8° | 84.5° |
| H47 | C47 | C46 | C44 | 65.0° | 60.0° |
| H47 | C47 | C46 | H46 | 175.0° | 180.0° |
| H47 | C47 | C46 | H46A | 54.6° | 60.0° |
| H47A | C47 | C46 | C44 | 56.5° | 60.0° |
| H47A | C47 | C46 | H46 | 63.5° | 60.0° |
| H47A | C47 | C46 | H46A | 176.1° | 180.0° |
| C44 | C46 | H46 | H46A | 119.6° | 120.0° |
| C46 | C44 | C43 | C45 | 178.9° | 180.0° |
| C46 | C44 | C45 | H45 | 170.7° | 90.0° |
| C46 | C44 | C45 | H45A | 50.7° | 150.0° |
| C46 | C44 | C45 | H45B | 69.3° | 30.0° |
| C46 | C44 | C43 | C42 | 2.0° | 6.9° |
| C46 | C44 | C43 | H43 | 178.0° | 173.2° |
| H46 | C46 | C44 | C43 | 151.9° | 144.5° |
| H46 | C46 | C44 | C45 | 29.2° | 35.5° |
| H46A | C46 | C44 | C43 | 31.6° | 24.5° |
| H46A | C46 | C44 | C45 | 149.6° | 155.5° |
| C43 | C44 | C45 | H45 | 8.2° | 90.0° |
| C43 | C44 | C45 | H45A | 128.2° | 30.0° |
| C43 | C44 | C45 | H45B | 111.8° | 150.0° |
| C44 | C43 | C42 | H43 | 180.0° | 179.9° |
| C44 | C43 | C42 | C41 | 172.2° | 126.1° |
| C44 | C43 | C42 | H42 | 52.3° | 113.9° |
| C44 | C43 | C42 | H42A | 68.6° | 6.0° |
| C44 | C45 | H45 | H45A | 120.0° | 119.9° |
| C44 | C45 | H45 | H45B | 120.0° | 120.0° |
| C44 | C45 | H45A | H45B | 120.0° | 120.0° |
| C45 | C44 | C43 | C42 | 179.2° | 173.1° |
| C45 | C44 | C43 | H43 | 0.8° | 6.8° |
| H45 | C45 | H45A | H45B | 120.0° | 120.1° |
| C43 | C42 | C41 | H42 | 120.0° | 120.0° |
| C43 | C42 | C41 | H42A | 119.1° | 120.0° |
| C43 | C42 | H42 | H42A | 119.2° | 119.9° |
| C43 | C42 | C41 | C39 | 115.5° | 180.0° |
| C43 | C42 | C41 | H41 | 124.5° | 60.0° |
| C43 | C42 | C41 | H41A | 2.1° | 60.0° |
| H43 | C43 | C42 | C41 | 7.8° | 53.8° |
| H43 | C43 | C42 | H42 | 127.7° | 66.2° |
| H43 | C43 | C42 | H42A | 111.4° | 173.9° |
| C41 | C42 | H42 | H42A | 119.2° | 120.0° |
| C42 | C41 | C39 | H41 | 120.0° | 120.0° |
| C42 | C41 | C39 | H41A | 117.6° | 120.0° |
| C42 | C41 | H41 | H41A | 117.8° | 120.0° |
| C42 | C41 | C39 | C40 | 123.4° | 85.0° |
| C42 | C41 | C39 | C38 | 57.7° | 95.0° |
| H42 | C42 | C41 | C39 | 4.5° | 60.0° |
| H42 | C42 | C41 | H41 | 115.5° | 180.0° |
| H42 | C42 | C41 | H41A | 122.0° | 60.0° |
| H42A | C42 | C41 | C39 | 125.4° | 60.0° |
| H42A | C42 | C41 | H41 | 5.4° | 60.0° |
| H42A | C42 | C41 | H41A | 117.1° | 180.0° |
| C39 | C41 | H41 | H41A | 117.7° | 120.0° |
| C41 | C39 | C40 | C38 | 178.9° | 180.0° |
| C41 | C39 | C40 | H40 | 83.8° | 4.7° |
| C41 | C39 | C40 | H40A | 36.2° | 124.6° |
| C41 | C39 | C40 | H40B | 156.3° | 115.4° |
| C41 | C39 | C38 | C37 | 179.4° | 174.4° |
| C41 | C39 | C38 | H38 | 0.6° | 5.6° |
| H41 | C41 | C39 | C40 | 3.4° | 155.0° |
| H41 | C41 | C39 | C38 | 177.7° | 25.0° |
| H41A | C41 | C39 | C40 | 119.0° | 35.0° |
| H41A | C41 | C39 | C38 | 59.9° | 145.0° |
| C39 | C40 | H40 | H40A | 120.0° | 120.0° |
| C39 | C40 | H40 | H40B | 120.0° | 120.0° |
| C39 | C40 | H40A | H40B | 120.0° | 119.9° |
| C40 | C39 | C38 | C37 | 1.7° | 5.6° |
| C40 | C39 | C38 | H38 | 178.3° | 174.4° |
| C38 | C39 | C40 | H40 | 97.3° | 175.3° |
| C38 | C39 | C40 | H40A | 142.7° | 55.4° |
| C38 | C39 | C40 | H40B | 22.7° | 64.6° |
| C39 | C38 | C37 | H38 | 180.0° | 180.0° |
| C39 | C38 | C37 | C36 | 73.8° | 124.2° |
| C39 | C38 | C37 | H37 | 166.2° | 115.9° |
| C39 | C38 | C37 | H37A | 43.7° | 4.2° |
| H40 | C40 | H40A | H40B | 120.0° | 120.0° |
| C38 | C37 | C36 | H37 | 120.0° | 120.0° |
| C38 | C37 | C36 | H37A | 117.5° | 120.0° |
| C38 | C37 | H37 | H37A | 117.7° | 120.1° |
| C38 | C37 | C36 | C34 | 144.9° | 180.0° |
| C38 | C37 | C36 | H36 | 24.9° | 60.0° |
| C38 | C37 | C36 | H36A | 96.9° | 60.0° |
| H38 | C38 | C37 | C36 | 106.2° | 55.8° |
| H38 | C38 | C37 | H37 | 13.8° | 64.1° |
| H38 | C38 | C37 | H37A | 136.3° | 175.8° |
| C36 | C37 | H37 | H37A | 117.7° | 119.9° |
| C37 | C36 | C34 | H36 | 120.0° | 120.0° |
| C37 | C36 | C34 | H36A | 118.2° | 120.0° |
| C37 | C36 | H36 | H36A | 118.3° | 120.0° |
| C37 | C36 | C34 | C33 | 64.3° | 95.0° |
| C37 | C36 | C34 | C35 | 116.2° | 85.0° |
| H37 | C37 | C36 | C34 | 95.1° | 60.0° |
| H37 | C37 | C36 | H36 | 144.9° | 180.0° |
| H37 | C37 | C36 | H36A | 23.1° | 60.0° |
| H37A | C37 | C36 | C34 | 27.5° | 60.0° |
| H37A | C37 | C36 | H36 | 92.5° | 60.0° |
| H37A | C37 | C36 | H36A | 145.7° | 180.0° |
| C34 | C36 | H36 | H36A | 118.3° | 119.9° |
| C36 | C34 | C33 | C35 | 179.6° | 180.0° |
| C36 | C34 | C35 | H35 | 101.3° | 3.2° |
| C36 | C34 | C35 | H35A | 18.6° | 123.2° |
| C36 | C34 | C35 | H35B | 138.7° | 116.8° |
| C36 | C34 | C33 | C32 | 178.7° | 174.9° |
| C36 | C34 | C33 | H33 | 1.3° | 5.1° |
| H36 | C36 | C34 | C33 | 175.7° | 25.0° |
| H36 | C36 | C34 | C35 | 3.8° | 155.0° |
| H36A | C36 | C34 | C33 | 53.9° | 145.0° |
| H36A | C36 | C34 | C35 | 125.6° | 35.0° |
| C33 | C34 | C35 | H35 | 79.1° | 176.8° |
| C33 | C34 | C35 | H35A | 160.9° | 56.8° |
| C33 | C34 | C35 | H35B | 40.9° | 63.2° |
| C34 | C33 | C32 | H33 | 180.0° | 180.0° |
| C34 | C33 | C32 | C31 | 137.2° | 124.3° |
| C34 | C33 | C32 | H32 | 102.7° | 115.7° |
| C34 | C33 | C32 | H32A | 18.8° | 4.3° |
| C34 | C35 | H35 | H35A | 120.0° | 120.0° |
| C34 | C35 | H35 | H35B | 120.0° | 120.1° |
| C34 | C35 | H35A | H35B | 120.0° | 120.0° |
| C35 | C34 | C33 | C32 | 1.7° | 5.1° |
| C35 | C34 | C33 | H33 | 178.3° | 174.9° |
| H35 | C35 | H35A | H35B | 120.0° | 120.0° |
| C33 | C32 | C31 | H32 | 120.0° | 119.9° |
| C33 | C32 | C31 | H32A | 118.4° | 120.0° |
| C33 | C32 | H32 | H32A | 118.5° | 120.0° |
| C33 | C32 | C31 | C29 | 101.4° | 180.0° |
| C33 | C32 | C31 | H31 | 138.6° | 60.0° |
| C33 | C32 | C31 | H31A | 14.7° | 60.0° |
| H33 | C33 | C32 | C31 | 42.8° | 55.7° |
| H33 | C33 | C32 | H32 | 77.3° | 64.2° |
| H33 | C33 | C32 | H32A | 161.2° | 175.8° |
| C31 | C32 | H32 | H32A | 118.6° | 120.1° |
| C32 | C31 | C29 | H31 | 120.0° | 120.0° |
| C32 | C31 | C29 | H31A | 116.1° | 120.0° |
| C32 | C31 | H31 | H31A | 116.6° | 120.0° |
| C32 | C31 | C29 | C30 | 57.4° | 85.1° |
| C32 | C31 | C29 | C28 | 124.4° | 95.0° |
| H32 | C32 | C31 | C29 | 18.6° | 60.1° |
| H32 | C32 | C31 | H31 | 101.4° | 180.0° |
| H32 | C32 | C31 | H31A | 134.7° | 60.0° |
| H32A | C32 | C31 | C29 | 140.2° | 60.0° |
| H32A | C32 | C31 | H31 | 20.2° | 60.0° |
| H32A | C32 | C31 | H31A | 103.8° | 180.0° |
| C29 | C31 | H31 | H31A | 116.6° | 120.1° |
| C31 | C29 | C30 | C28 | 178.1° | 180.0° |
| C31 | C29 | C30 | H30 | 88.6° | 3.5° |
| C31 | C29 | C30 | H30A | 31.4° | 123.5° |
| C31 | C29 | C30 | H30B | 151.4° | 116.5° |
| C31 | C29 | C28 | C27 | 178.7° | 175.0° |
| C31 | C29 | C28 | H28 | 1.4° | 5.0° |
| H31 | C31 | C29 | C30 | 62.6° | 155.0° |
| H31 | C31 | C29 | C28 | 115.6° | 25.0° |
| H31A | C31 | C29 | C30 | 173.5° | 35.0° |
| H31A | C31 | C29 | C28 | 8.3° | 145.0° |
| C29 | C30 | H30 | H30A | 120.0° | 119.9° |
| C29 | C30 | H30 | H30B | 120.0° | 120.0° |
| C29 | C30 | H30A | H30B | 120.0° | 120.0° |
| C30 | C29 | C28 | C27 | 0.5° | 5.1° |
| C30 | C29 | C28 | H28 | 179.5° | 174.9° |
| C28 | C29 | C30 | H30 | 93.3° | 176.5° |
| C28 | C29 | C30 | H30A | 146.7° | 56.5° |
| C28 | C29 | C30 | H30B | 26.7° | 63.5° |
| C29 | C28 | C27 | H28 | 180.0° | 180.0° |
| C29 | C28 | C27 | C26 | 140.5° | 122.2° |
| C29 | C28 | C27 | H27 | 99.5° | 117.8° |
| C29 | C28 | C27 | H27A | 20.6° | 2.2° |
| H30 | C30 | H30A | H30B | 120.0° | 120.1° |
| C28 | C27 | C26 | H27 | 120.0° | 120.0° |
| C28 | C27 | C26 | H27A | 119.9° | 120.0° |
| C28 | C27 | H27 | H27A | 119.9° | 120.0° |
| C28 | C27 | C26 | C24 | 143.8° | 180.0° |
| C28 | C27 | C26 | H26 | 23.9° | 60.0° |
| C28 | C27 | C26 | H26A | 97.4° | 60.0° |
| H28 | C28 | C27 | C26 | 39.5° | 57.8° |
| H28 | C28 | C27 | H27 | 80.5° | 62.2° |
| H28 | C28 | C27 | H27A | 159.5° | 177.8° |
| C26 | C27 | H27 | H27A | 120.0° | 120.0° |
| C27 | C26 | C24 | H26 | 120.0° | 120.0° |
| C27 | C26 | C24 | H26A | 118.8° | 120.0° |
| C27 | C26 | H26 | H26A | 118.9° | 119.9° |
| C27 | C26 | C24 | C23 | 87.7° | 92.5° |
| C27 | C26 | C24 | C25 | 91.8° | 87.5° |
| H27 | C27 | C26 | C24 | 96.2° | 60.0° |
| H27 | C27 | C26 | H26 | 143.9° | 179.9° |
| H27 | C27 | C26 | H26A | 22.6° | 60.0° |
| H27A | C27 | C26 | C24 | 23.9° | 60.0° |
| H27A | C27 | C26 | H26 | 96.1° | 60.0° |
| H27A | C27 | C26 | H26A | 142.7° | 180.0° |
| C24 | C26 | H26 | H26A | 118.8° | 120.1° |
| C26 | C24 | C23 | C25 | 179.5° | 179.9° |
| C26 | C24 | C25 | H25 | 125.7° | 89.9° |
| C26 | C24 | C25 | H25A | 5.6° | 150.0° |
| C26 | C24 | C25 | H25B | 114.4° | 30.1° |
| C26 | C24 | C23 | C22 | 0.1° | 6.3° |
| C26 | C24 | C23 | H23 | 180.0° | 173.7° |
| H26 | C26 | C24 | C23 | 152.3° | 147.5° |
| H26 | C26 | C24 | C25 | 28.1° | 32.4° |
| H26A | C26 | C24 | C23 | 31.1° | 27.5° |
| H26A | C26 | C24 | C25 | 149.4° | 152.5° |
| C23 | C24 | C25 | H25 | 53.8° | 90.0° |
| C23 | C24 | C25 | H25A | 173.9° | 30.1° |
| C23 | C24 | C25 | H25B | 66.1° | 150.0° |
| C24 | C23 | C22 | H23 | 180.0° | 180.0° |
| C24 | C23 | C22 | C21 | 172.6° | 127.2° |
| C24 | C23 | C22 | H22 | 67.4° | 112.8° |
| C24 | C23 | C22 | H22A | 53.1° | 7.2° |
| C24 | C25 | H25 | H25A | 120.0° | 120.0° |
| C24 | C25 | H25 | H25B | 120.0° | 120.0° |
| C24 | C25 | H25A | H25B | 120.0° | 120.0° |
| C25 | C24 | C23 | C22 | 179.5° | 173.8° |
| C25 | C24 | C23 | H23 | 0.5° | 6.2° |
| H25 | C25 | H25A | H25B | 119.9° | 120.0° |
| C23 | C22 | C21 | H22 | 120.0° | 120.0° |
| C23 | C22 | C21 | H22A | 119.5° | 120.0° |
| C23 | C22 | H22 | H22A | 119.5° | 120.0° |
| C23 | C22 | C21 | C19 | 176.7° | 180.0° |
| C23 | C22 | C21 | H21 | 63.3° | 60.0° |
| C23 | C22 | C21 | H21A | 58.4° | 60.0° |
| H23 | C23 | C22 | C21 | 7.4° | 52.8° |
| H23 | C23 | C22 | H22 | 112.6° | 67.2° |
| H23 | C23 | C22 | H22A | 126.9° | 172.8° |
| C21 | C22 | H22 | H22A | 119.5° | 119.9° |
| C22 | C21 | C19 | H21 | 120.0° | 119.9° |
| C22 | C21 | C19 | H21A | 118.3° | 120.0° |
| C22 | C21 | H21 | H21A | 118.4° | 120.0° |
| C22 | C21 | C19 | C20 | 167.6° | 85.0° |
| C22 | C21 | C19 | C18 | 12.6° | 95.0° |
| H22 | C22 | C21 | C19 | 56.7° | 60.0° |
| H22 | C22 | C21 | H21 | 176.7° | 179.9° |
| H22 | C22 | C21 | H21A | 61.6° | 60.0° |
| H22A | C22 | C21 | C19 | 63.8° | 59.9° |
| H22A | C22 | C21 | H21 | 56.2° | 60.0° |
| H22A | C22 | C21 | H21A | 177.9° | 180.0° |
| C19 | C21 | H21 | H21A | 118.4° | 120.0° |
| C21 | C19 | C20 | C18 | 179.7° | 180.0° |
| C21 | C19 | C20 | H20 | 101.2° | 4.6° |
| C21 | C19 | C20 | H20A | 138.8° | 124.6° |
| C21 | C19 | C20 | H20B | 18.8° | 115.4° |
| C21 | C19 | C18 | C17 | 179.5° | 174.4° |
| C21 | C19 | C18 | H18 | 0.5° | 5.7° |
| H21 | C21 | C19 | C20 | 47.6° | 155.0° |
| H21 | C21 | C19 | C18 | 132.7° | 24.9° |
| H21A | C21 | C19 | C20 | 74.1° | 35.0° |
| H21A | C21 | C19 | C18 | 105.7° | 145.0° |
| C19 | C20 | H20 | H20A | 120.0° | 120.0° |
| C19 | C20 | H20 | H20B | 120.0° | 120.1° |
| C19 | C20 | H20A | H20B | 120.0° | 120.1° |
| C20 | C19 | C18 | C17 | 0.2° | 5.6° |
| C20 | C19 | C18 | H18 | 179.8° | 174.4° |
| C18 | C19 | C20 | H20 | 78.5° | 175.4° |
| C18 | C19 | C20 | H20A | 41.5° | 55.4° |
| C18 | C19 | C20 | H20B | 161.5° | 64.6° |
| C19 | C18 | C17 | H18 | 180.0° | 180.0° |
| C19 | C18 | C17 | C16 | 134.2° | 124.2° |
| C19 | C18 | C17 | H17 | 105.8° | 115.9° |
| C19 | C18 | C17 | H17A | 15.5° | 4.2° |
| H20 | C20 | H20A | H20B | 119.9° | 119.9° |
| C18 | C17 | C16 | H17 | 120.0° | 120.0° |
| C18 | C17 | C16 | H17A | 118.6° | 120.0° |
| C18 | C17 | H17 | H17A | 118.7° | 120.0° |
| C18 | C17 | C16 | C14 | 169.0° | NaN° |
| C18 | C17 | C16 | H16 | 71.0° | 60.0° |
| C18 | C17 | C16 | H16A | 53.5° | 60.0° |
| H18 | C18 | C17 | C16 | 45.8° | 55.8° |
| H18 | C18 | C17 | H17 | 74.2° | 64.1° |
| H18 | C18 | C17 | H17A | 164.4° | 175.8° |
| C16 | C17 | H17 | H17A | 118.7° | 120.0° |
| C17 | C16 | C14 | H16 | 120.0° | 120.0° |
| C17 | C16 | C14 | H16A | 115.5° | 120.0° |
| C17 | C16 | H16 | H16A | 116.1° | 120.0° |
| C17 | C16 | C14 | C13 | 33.1° | 95.0° |
| C17 | C16 | C14 | C15 | 148.6° | 85.0° |
| H17 | C17 | C16 | C14 | 49.0° | 60.0° |
| H17 | C17 | C16 | H16 | 169.0° | 180.0° |
| H17 | C17 | C16 | H16A | 66.5° | 60.0° |
| H17A | C17 | C16 | C14 | 72.4° | 60.0° |
| H17A | C17 | C16 | H16 | 47.6° | 60.0° |
| H17A | C17 | C16 | H16A | 172.1° | 180.0° |
| C14 | C16 | H16 | H16A | 116.2° | 120.0° |
| C16 | C14 | C13 | C15 | 178.3° | 179.9° |
| C16 | C14 | C15 | H15 | 20.6° | 4.9° |
| C16 | C14 | C15 | H15A | 99.3° | 115.0° |
| C16 | C14 | C15 | H15B | 140.6° | 124.9° |
| C16 | C14 | C13 | C12 | 178.9° | 174.4° |
| C16 | C14 | C13 | H13 | 1.1° | 5.7° |
| H16 | C16 | C14 | C13 | 86.8° | 25.0° |
| H16 | C16 | C14 | C15 | 91.4° | 154.9° |
| H16A | C16 | C14 | C13 | 148.6° | 145.0° |
| H16A | C16 | C14 | C15 | 33.1° | 35.0° |
| C13 | C14 | C15 | H15 | 157.7° | 175.1° |
| C13 | C14 | C15 | H15A | 82.3° | 65.0° |
| C13 | C14 | C15 | H15B | 37.8° | 55.0° |
| C14 | C13 | C12 | H13 | 180.0° | 179.9° |
| C14 | C13 | C12 | C11 | 164.7° | 122.6° |
| C14 | C13 | C12 | H12 | 44.7° | 117.4° |
| C14 | C13 | C12 | H12A | 77.6° | 2.6° |
| C14 | C15 | H15 | H15A | 120.0° | 120.0° |
| C14 | C15 | H15 | H15B | 120.0° | 120.1° |
| C14 | C15 | H15A | H15B | 120.0° | 120.0° |
| C15 | C14 | C13 | C12 | 0.6° | 5.7° |
| C15 | C14 | C13 | H13 | 179.4° | 174.3° |
| H15 | C15 | H15A | H15B | 120.0° | 120.0° |
| C13 | C12 | C11 | H12 | 120.0° | 120.0° |
| C13 | C12 | C11 | H12A | 117.7° | 120.0° |
| C13 | C12 | H12 | H12A | 117.9° | 120.0° |
| C13 | C12 | C11 | C9 | 176.9° | 180.0° |
| C13 | C12 | C11 | H11 | 63.1° | 60.1° |
| C13 | C12 | C11 | H11A | 55.8° | 60.0° |
| H13 | C13 | C12 | C11 | 15.3° | 57.4° |
| H13 | C13 | C12 | H12 | 135.3° | 62.6° |
| H13 | C13 | C12 | H12A | 102.4° | 177.5° |
| C11 | C12 | H12 | H12A | 117.9° | 120.1° |
| C12 | C11 | C9 | H11 | 120.0° | 119.9° |
| C12 | C11 | C9 | H11A | 121.1° | 120.0° |
| C12 | C11 | H11 | H11A | 121.1° | 120.1° |
| C12 | C11 | C9 | C10 | 97.3° | 85.0° |
| C12 | C11 | C9 | C8 | 81.0° | 95.0° |
| H12 | C12 | C11 | C9 | 56.9° | 60.0° |
| H12 | C12 | C11 | H11 | 176.9° | 179.9° |
| H12 | C12 | C11 | H11A | 64.2° | 59.9° |
| H12A | C12 | C11 | C9 | 65.4° | 60.0° |
| H12A | C12 | C11 | H11 | 54.6° | 59.9° |
| H12A | C12 | C11 | H11A | 173.5° | 180.0° |
| C9 | C11 | H11 | H11A | 121.2° | 120.0° |
| C11 | C9 | C10 | C8 | 178.2° | 180.0° |
| C11 | C9 | C10 | H10 | 142.7° | 4.4° |
| C11 | C9 | C10 | H10A | 22.7° | 124.4° |
| C11 | C9 | C10 | H10B | 97.4° | 115.6° |
| C11 | C9 | C8 | C7 | 177.8° | 176.0° |
| C11 | C9 | C8 | H8 | 2.2° | 4.1° |
| H11 | C11 | C9 | C10 | 22.7° | 155.0° |
| H11 | C11 | C9 | C8 | 159.0° | 24.9° |
| H11A | C11 | C9 | C10 | 141.6° | 35.0° |
| H11A | C11 | C9 | C8 | 40.1° | 145.0° |
| C9 | C10 | H10 | H10A | 120.0° | 120.0° |
| C9 | C10 | H10 | H10B | 120.0° | 120.0° |
| C9 | C10 | H10A | H10B | 120.0° | 120.0° |
| C10 | C9 | C8 | C7 | 0.5° | 4.0° |
| C10 | C9 | C8 | H8 | 179.5° | 176.0° |
| C8 | C9 | C10 | H10 | 35.6° | 175.6° |
| C8 | C9 | C10 | H10A | 155.6° | 55.6° |
| C8 | C9 | C10 | H10B | 84.4° | 64.4° |
| C9 | C8 | C7 | H8 | 180.0° | 180.0° |
| C9 | C8 | C7 | C6 | 144.7° | 125.6° |
| C9 | C8 | C7 | H7 | 95.3° | 114.5° |
| C9 | C8 | C7 | H7A | 28.4° | 5.6° |
| H10 | C10 | H10A | H10B | 120.0° | 120.1° |
| C8 | C7 | C6 | H7 | 120.0° | 120.0° |
| C8 | C7 | C6 | H7A | 116.3° | 120.0° |
| C8 | C7 | H7 | H7A | 116.7° | 120.1° |
| C8 | C7 | C6 | C5 | 93.7° | 85.2° |
| C8 | C7 | C6 | C1 | 89.0° | 94.9° |
| H8 | C8 | C7 | C6 | 35.4° | 54.4° |
| H8 | C8 | C7 | H7 | 84.7° | 65.6° |
| H8 | C8 | C7 | H7A | 151.6° | 174.4° |
| C6 | C7 | H7 | H7A | 116.7° | 119.9° |
| C7 | C6 | C5 | C1 | 177.6° | 179.8° |
| C7 | C6 | C1 | C2 | 178.4° | 180.0° |
| C7 | C6 | C1 | C1M | 1.1° | 0.1° |
| C7 | C6 | C5 | C4 | 178.8° | 179.7° |
| C7 | C6 | C5 | O5 | 1.9° | 0.1° |
| H7 | C7 | C6 | C5 | 146.2° | 154.8° |
| H7 | C7 | C6 | C1 | 31.0° | 25.1° |
| H7A | C7 | C6 | C5 | 22.5° | 34.8° |
| H7A | C7 | C6 | C1 | 154.7° | 145.0° |
| C5 | C6 | C1 | C2 | 1.2° | 0.2° |
| C5 | C6 | C1 | C1M | 178.3° | 179.8° |
| C6 | C5 | C4 | C3 | 0.6° | 0.6° |
| C6 | C5 | C4 | O4 | 179.9° | 179.8° |
| C6 | C5 | C4 | O5 | 179.2° | 179.7° |
| C6 | C1 | C2 | C1M | 179.5° | 179.9° |
| C6 | C1 | C1M | H1M | 1.8° | 90.0° |
| C6 | C1 | C1M | H1MA | 121.9° | 150.0° |
| C6 | C1 | C1M | H1MB | 118.1° | 30.1° |
| C6 | C1 | C2 | C3 | 0.5° | 0.1° |
| C6 | C1 | C2 | O2 | 179.4° | 179.9° |
| C1 | C6 | C5 | C4 | 1.3° | 0.5° |
| C1 | C6 | C5 | O5 | 179.5° | 179.8° |
| C2 | C1 | C1M | H1M | 177.7° | 89.9° |
| C2 | C1 | C1M | H1MA | 57.7° | 30.1° |
| C2 | C1 | C1M | H1MB | 62.4° | 150.0° |
| C1 | C2 | C3 | O2 | 180.0° | 180.0° |
| C1 | C2 | C3 | C4 | 0.1° | 0.0° |
| C1 | C2 | C3 | O3 | 178.1° | 180.0° |
| C1 | C1M | H1M | H1MA | 120.0° | 119.9° |
| C1 | C1M | H1M | H1MB | 120.0° | 120.1° |
| C1 | C1M | H1MA | H1MB | 120.0° | 120.0° |
| C1M | C1 | C2 | C3 | 179.0° | 180.0° |
| C1M | C1 | C2 | O2 | 1.1° | 0.0° |
| H1M | C1M | H1MA | H1MB | 120.0° | 120.0° |
| C2 | C3 | C4 | O3 | 178.3° | 180.0° |
| C2 | C3 | O3 | C3M | 34.8° | 66.9° |
| C2 | C3 | C4 | O4 | 179.3° | 179.9° |
| C2 | C3 | C4 | C5 | 0.1° | 0.3° |
| O2 | C2 | C3 | C4 | 179.9° | 180.0° |
| O2 | C2 | C3 | O3 | 1.8° | 0.0° |
| C4 | C3 | O3 | C3M | 146.9° | 113.1° |
| C3 | C4 | O4 | C5 | 179.4° | 179.6° |
| C3 | C4 | O4 | C4M | 41.3° | 113.2° |
| C3 | C4 | C5 | O5 | 179.8° | 179.7° |
| C3 | O3 | C3M | H3M | 3.3° | 64.6° |
| C3 | O3 | C3M | H3MA | 116.7° | 175.4° |
| C3 | O3 | C3M | H3MB | 123.3° | 55.4° |
| O3 | C3 | C4 | O4 | 2.4° | 0.1° |
| O3 | C3 | C4 | C5 | 178.2° | 179.7° |
| O3 | C3M | H3M | H3MA | 120.0° | 120.0° |
| O3 | C3M | H3M | H3MB | 120.0° | 120.0° |
| O3 | C3M | H3MA | H3MB | 120.0° | 120.0° |
| H3M | C3M | H3MA | H3MB | 120.0° | 120.0° |
| C4 | O4 | C4M | H4M | 17.7° | 65.4° |
| C4 | O4 | C4M | H4MA | 102.2° | 54.6° |
| C4 | O4 | C4M | H4MB | 137.8° | 174.5° |
| O4 | C4 | C5 | O5 | 0.7° | 0.1° |
| C5 | C4 | O4 | C4M | 138.2° | 67.2° |
| O4 | C4M | H4M | H4MA | 120.0° | 120.0° |
| O4 | C4M | H4M | H4MB | 120.0° | 120.1° |
| O4 | C4M | H4MA | H4MB | 120.0° | 120.0° |
| H4M | C4M | H4MA | H4MB | 120.0° | 120.0° |
