A1I9F
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F59 | C4 | sing | 1.35Å | 1.34Å | |
| C34 | C32 | sing | 1.56Å | 1.55Å | |
| C34 | C26 | sing | 1.54Å | 1.57Å | |
| C39 | C38 | sing | 1.54Å | 1.55Å | |
| C39 | C40 | sing | 1.57Å | 1.55Å | |
| F33 | C32 | sing | 1.40Å | 1.38Å | |
| C38 | C37 | sing | 1.55Å | 1.55Å | |
| C27 | C26 | sing | 1.54Å | 1.54Å | |
| C27 | C28 | sing | 1.55Å | 1.56Å | |
| C32 | C31 | sing | 1.55Å | 1.53Å | |
| C1 | C2 | trip | 1.17Å | 1.19Å | |
| C26 | C25 | sing | 1.53Å | 1.54Å | |
| C26 | N30 | sing | 1.48Å | 1.50Å | |
| C4 | C5 | doub | 1.39Å | 1.38Å | Aromatic |
| C4 | C3 | sing | 1.39Å | 1.38Å | Aromatic |
| C50 | C49 | sing | 1.53Å | 1.55Å | |
| C25 | O24 | sing | 1.43Å | 1.40Å | |
| C40 | N42 | sing | 1.48Å | 1.45Å | |
| C40 | C41 | sing | 1.54Å | 1.55Å | |
| C2 | C3 | sing | 1.43Å | 1.43Å | |
| C5 | C6 | sing | 1.36Å | 1.39Å | Aromatic |
| N42 | C43 | sing | 1.35Å | 1.36Å | |
| N42 | C37 | sing | 1.48Å | 1.47Å | |
| O44 | C43 | doub | 1.21Å | 1.26Å | |
| C43 | C45 | sing | 1.51Å | 1.51Å | |
| C37 | C36 | sing | 1.54Å | 1.52Å | |
| O24 | C19 | sing | 1.35Å | 1.35Å | |
| C45 | C49 | sing | 1.53Å | 1.56Å | |
| C28 | C29 | sing | 1.55Å | 1.54Å | |
| C3 | C53 | doub | 1.41Å | 1.42Å | Aromatic |
| C54 | C55 | sing | 1.53Å | 1.56Å | |
| C54 | C52 | sing | 1.53Å | 1.56Å | |
| C31 | N30 | sing | 1.48Å | 1.47Å | |
| C51 | C49 | sing | 1.53Å | 1.56Å | |
| C51 | C52 | sing | 1.53Å | 1.57Å | |
| C49 | C47 | sing | 1.51Å | 1.45Å | |
| C19 | N20 | doub | 1.32Å | 1.32Å | Aromatic |
| C19 | N18 | sing | 1.33Å | 1.35Å | Aromatic |
| N30 | C29 | sing | 1.48Å | 1.49Å | |
| N20 | C21 | sing | 1.34Å | 1.34Å | Aromatic |
| N18 | C17 | doub | 1.33Å | 1.34Å | Aromatic |
| C41 | N35 | sing | 1.47Å | 1.48Å | |
| C55 | O56 | sing | 1.43Å | 1.43Å | |
| C52 | C58 | sing | 1.53Å | 1.55Å | |
| F23 | C22 | sing | 1.35Å | 1.36Å | |
| C17 | N35 | sing | 1.38Å | 1.36Å | |
| C17 | C16 | sing | 1.42Å | 1.41Å | Aromatic |
| C6 | C7 | doub | 1.41Å | 1.41Å | Aromatic |
| N35 | C36 | sing | 1.47Å | 1.47Å | |
| C21 | C16 | doub | 1.42Å | 1.40Å | Aromatic |
| C21 | C22 | sing | 1.40Å | 1.38Å | Aromatic |
| C16 | C15 | sing | 1.40Å | 1.38Å | Aromatic |
| C22 | C13 | doub | 1.39Å | 1.37Å | Aromatic |
| C53 | C7 | sing | 1.41Å | 1.40Å | Aromatic |
| C53 | C12 | sing | 1.41Å | 1.42Å | Aromatic |
| C47 | O48 | doub | 1.21Å | 1.22Å | |
| C47 | O46 | sing | 1.34Å | 1.33Å | |
| C7 | C8 | sing | 1.41Å | 1.42Å | Aromatic |
| C13 | C12 | sing | 1.48Å | 1.47Å | |
| C13 | N14 | sing | 1.34Å | 1.36Å | Aromatic |
| C15 | N14 | doub | 1.31Å | 1.34Å | Aromatic |
| O56 | C57 | sing | 1.43Å | 1.43Å | |
| C58 | C57 | sing | 1.53Å | 1.55Å | |
| C12 | C11 | doub | 1.38Å | 1.40Å | Aromatic |
| C8 | C9 | doub | 1.38Å | 1.39Å | Aromatic |
| C11 | C9 | sing | 1.39Å | 1.38Å | Aromatic |
| C9 | O10 | sing | 1.36Å | 1.42Å | |
| C1 | H1 | sing | 1.05Å | 1.06Å | |
| C41 | H2 | sing | 1.09Å | 1.10Å | |
| C41 | H3 | sing | 1.09Å | 1.10Å | |
| C45 | H4 | sing | 1.09Å | 1.10Å | |
| C45 | H5 | sing | 1.09Å | 1.10Å | |
| C50 | H6 | sing | 1.09Å | 1.10Å | |
| C50 | H7 | sing | 1.09Å | 1.10Å | |
| C50 | H8 | sing | 1.09Å | 1.10Å | |
| C51 | H9 | sing | 1.09Å | 1.10Å | |
| C51 | H10 | sing | 1.09Å | 1.10Å | |
| C52 | H11 | sing | 1.09Å | 1.10Å | |
| C55 | H12 | sing | 1.09Å | 1.10Å | |
| C55 | H13 | sing | 1.09Å | 1.10Å | |
| C57 | H14 | sing | 1.09Å | 1.10Å | |
| C57 | H15 | sing | 1.09Å | 1.10Å | |
| C58 | H16 | sing | 1.09Å | 1.10Å | |
| C58 | H17 | sing | 1.09Å | 1.10Å | |
| C11 | H18 | sing | 1.08Å | 1.08Å | |
| C15 | H19 | sing | 1.08Å | 1.08Å | |
| C25 | H20 | sing | 1.09Å | 1.10Å | |
| C25 | H21 | sing | 1.09Å | 1.10Å | |
| C27 | H22 | sing | 1.09Å | 1.10Å | |
| C27 | H23 | sing | 1.09Å | 1.10Å | |
| C28 | H24 | sing | 1.09Å | 1.10Å | |
| C28 | H25 | sing | 1.09Å | 1.10Å | |
| C29 | H26 | sing | 1.09Å | 1.10Å | |
| C29 | H27 | sing | 1.09Å | 1.10Å | |
| C5 | H28 | sing | 1.08Å | 1.08Å | |
| C6 | H29 | sing | 1.08Å | 1.08Å | |
| C8 | H30 | sing | 1.08Å | 1.08Å | |
| O10 | H31 | sing | 0.97Å | 0.95Å | |
| C31 | H33 | sing | 1.09Å | 1.10Å | |
| C31 | H34 | sing | 1.09Å | 1.10Å | |
| C32 | H35 | sing | 1.09Å | 1.10Å | |
| C34 | H36 | sing | 1.09Å | 1.10Å | |
| C34 | H37 | sing | 1.09Å | 1.10Å | |
| C36 | H38 | sing | 1.09Å | 1.10Å | |
| C36 | H39 | sing | 1.09Å | 1.10Å | |
| C37 | H40 | sing | 1.09Å | 1.10Å | |
| C38 | H41 | sing | 1.09Å | 1.10Å | |
| C38 | H42 | sing | 1.09Å | 1.10Å | |
| C39 | H43 | sing | 1.09Å | 1.10Å | |
| C39 | H44 | sing | 1.09Å | 1.10Å | |
| C40 | H45 | sing | 1.09Å | 1.10Å | |
| O46 | H46 | sing | 0.97Å | 0.95Å | |
| C54 | H47 | sing | 1.09Å | 1.10Å | |
| C54 | H48 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F59 | C4 | C5 | 119.6° | 119.7° |
| F59 | C4 | C3 | 117.3° | 119.7° |
| C32 | C34 | C26 | 101.4° | 102.8° |
| C34 | C32 | F33 | 108.8° | 111.7° |
| C34 | C32 | C31 | 102.5° | 101.3° |
| C34 | C32 | H35 | 110.1° | 110.6° |
| C32 | C34 | H36 | 111.4° | 110.7° |
| C32 | C34 | H37 | 111.5° | 110.7° |
| C34 | C26 | C27 | 115.7° | 109.8° |
| C34 | C26 | C25 | 112.6° | 110.8° |
| C34 | C26 | N30 | 106.9° | 107.3° |
| C26 | C34 | H36 | 111.4° | 111.7° |
| C26 | C34 | H37 | 111.5° | 110.0° |
| C38 | C39 | C40 | 106.7° | 104.4° |
| C39 | C38 | C37 | 105.4° | 104.6° |
| C39 | C38 | H41 | 110.5° | 110.4° |
| C39 | C38 | H42 | 110.5° | 110.5° |
| C38 | C39 | H43 | 110.2° | 110.4° |
| C38 | C39 | H44 | 110.2° | 110.4° |
| C39 | C40 | N42 | 98.5° | 103.8° |
| C39 | C40 | C41 | 107.6° | 107.4° |
| C40 | C39 | H43 | 110.1° | 110.2° |
| C40 | C39 | H44 | 110.1° | 110.8° |
| C39 | C40 | H45 | 113.3° | 112.4° |
| F33 | C32 | C31 | 111.9° | 111.0° |
| F33 | C32 | H35 | 112.7° | 110.9° |
| C38 | C37 | N42 | 98.5° | 104.6° |
| C38 | C37 | C36 | 110.2° | 107.7° |
| C38 | C37 | H40 | 113.3° | 112.4° |
| C37 | C38 | H41 | 110.5° | 110.4° |
| C37 | C38 | H42 | 110.5° | 110.4° |
| C26 | C27 | C28 | 105.4° | 103.0° |
| C27 | C26 | C25 | 106.6° | 110.8° |
| C27 | C26 | N30 | 105.6° | 107.2° |
| C26 | C27 | H22 | 110.5° | 110.7° |
| C26 | C27 | H23 | 110.4° | 110.7° |
| C27 | C28 | C29 | 100.6° | 101.6° |
| C28 | C27 | H22 | 110.5° | 110.7° |
| C28 | C27 | H23 | 110.5° | 110.7° |
| C27 | C28 | H24 | 111.6° | 111.1° |
| C27 | C28 | H25 | 111.6° | 111.0° |
| C32 | C31 | N30 | 103.1° | 104.7° |
| C32 | C31 | H33 | 111.0° | 110.4° |
| C32 | C31 | H34 | 111.0° | 110.5° |
| C31 | C32 | H35 | 110.3° | 111.0° |
| C1 | C2 | C3 | 173.5° | 179.9° |
| C2 | C1 | H1 | 180.0° | 179.9° |
| C25 | C26 | N30 | 109.0° | 110.8° |
| C26 | C25 | O24 | 106.1° | 109.5° |
| C26 | C25 | H20 | 110.3° | 109.5° |
| C26 | C25 | H21 | 110.3° | 109.4° |
| C26 | N30 | C31 | 107.3° | 108.3° |
| C26 | N30 | C29 | 108.1° | 108.4° |
| C5 | C4 | C3 | 121.9° | 120.6° |
| C4 | C5 | C6 | 119.4° | 121.0° |
| C4 | C5 | H28 | 120.3° | 119.5° |
| C4 | C3 | C2 | 116.6° | 120.3° |
| C4 | C3 | C53 | 119.0° | 119.3° |
| C50 | C49 | C45 | 115.8° | 109.4° |
| C50 | C49 | C51 | 110.1° | 109.5° |
| C50 | C49 | C47 | 111.7° | 109.5° |
| C49 | C50 | H6 | 109.5° | 109.5° |
| C49 | C50 | H7 | 109.5° | 109.5° |
| C49 | C50 | H8 | 109.5° | 109.5° |
| C25 | O24 | C19 | 119.3° | 117.0° |
| O24 | C25 | H20 | 110.3° | 109.5° |
| O24 | C25 | H21 | 110.3° | 109.5° |
| N42 | C40 | C41 | 108.3° | 107.0° |
| C40 | N42 | C43 | 122.0° | 128.4° |
| C40 | N42 | C37 | 111.1° | 103.1° |
| N42 | C40 | H45 | 114.8° | 112.9° |
| C40 | C41 | N35 | 110.8° | 109.0° |
| C40 | C41 | H2 | 109.1° | 109.6° |
| C40 | C41 | H3 | 109.1° | 109.7° |
| C41 | C40 | H45 | 113.2° | 112.8° |
| C2 | C3 | C53 | 124.2° | 120.4° |
| C5 | C6 | C7 | 119.4° | 120.2° |
| C6 | C5 | H28 | 120.3° | 119.5° |
| C5 | C6 | H29 | 120.3° | 119.9° |
| C43 | N42 | C37 | 126.2° | 128.5° |
| N42 | C43 | O44 | 119.5° | 120.0° |
| N42 | C43 | C45 | 116.6° | 120.0° |
| N42 | C37 | C36 | 105.0° | 107.0° |
| N42 | C37 | H40 | 114.8° | 112.4° |
| O44 | C43 | C45 | 123.7° | 119.9° |
| C43 | C45 | C49 | 117.4° | 109.5° |
| C43 | C45 | H4 | 107.5° | 109.4° |
| C43 | C45 | H5 | 107.4° | 109.5° |
| C37 | C36 | N35 | 112.8° | 109.0° |
| C37 | C36 | H38 | 108.6° | 109.6° |
| C37 | C36 | H39 | 108.6° | 109.7° |
| C36 | C37 | H40 | 113.8° | 112.3° |
| O24 | C19 | N20 | 116.8° | 118.6° |
| O24 | C19 | N18 | 118.0° | 118.6° |
| C45 | C49 | C51 | 106.3° | 109.5° |
| C45 | C49 | C47 | 102.9° | 109.5° |
| C49 | C45 | H4 | 107.4° | 109.5° |
| C49 | C45 | H5 | 107.4° | 109.5° |
| C28 | C29 | N30 | 105.7° | 104.9° |
| C29 | C28 | H24 | 111.7° | 110.9° |
| C29 | C28 | H25 | 111.7° | 111.0° |
| C28 | C29 | H26 | 110.4° | 110.4° |
| C28 | C29 | H27 | 110.4° | 110.3° |
| C3 | C53 | C7 | 118.5° | 119.4° |
| C3 | C53 | C12 | 122.3° | 121.0° |
| C55 | C54 | C52 | 111.3° | 109.2° |
| C54 | C55 | O56 | 110.3° | 109.4° |
| C54 | C55 | H12 | 109.3° | 109.5° |
| C54 | C55 | H13 | 109.3° | 109.4° |
| C55 | C54 | H47 | 109.0° | 109.5° |
| C55 | C54 | H48 | 109.0° | 109.5° |
| C54 | C52 | C51 | 104.5° | 109.5° |
| C54 | C52 | C58 | 107.1° | 109.1° |
| C54 | C52 | H11 | 111.4° | 109.6° |
| C52 | C54 | H47 | 109.0° | 109.5° |
| C52 | C54 | H48 | 109.0° | 109.6° |
| C31 | N30 | C29 | 120.1° | 109.7° |
| N30 | C31 | H33 | 111.1° | 110.4° |
| N30 | C31 | H34 | 111.0° | 110.4° |
| C49 | C51 | C52 | 114.6° | 109.5° |
| C51 | C49 | C47 | 109.7° | 109.5° |
| C49 | C51 | H9 | 108.2° | 109.5° |
| C49 | C51 | H10 | 108.2° | 109.5° |
| C51 | C52 | C58 | 110.8° | 109.6° |
| C52 | C51 | H9 | 108.2° | 109.5° |
| C52 | C51 | H10 | 108.2° | 109.4° |
| C51 | C52 | H11 | 111.3° | 109.5° |
| C49 | C47 | O48 | 119.7° | 120.0° |
| C49 | C47 | O46 | 117.6° | 120.0° |
| N20 | C19 | N18 | 124.9° | 122.9° |
| C19 | N20 | C21 | 118.9° | 120.2° |
| C19 | N18 | C17 | 117.9° | 121.5° |
| N30 | C29 | H26 | 110.4° | 110.4° |
| N30 | C29 | H27 | 110.4° | 110.4° |
| N20 | C21 | C16 | 119.8° | 119.0° |
| N20 | C21 | C22 | 121.5° | 122.8° |
| N18 | C17 | N35 | 115.1° | 120.9° |
| N18 | C17 | C16 | 120.1° | 118.2° |
| C41 | N35 | C17 | 120.5° | 110.9° |
| C41 | N35 | C36 | 116.5° | 111.6° |
| N35 | C41 | H2 | 109.2° | 109.6° |
| N35 | C41 | H3 | 109.1° | 109.5° |
| C55 | O56 | C57 | 111.7° | 114.1° |
| O56 | C55 | H12 | 109.3° | 109.5° |
| O56 | C55 | H13 | 109.2° | 109.5° |
| C52 | C58 | C57 | 111.9° | 109.2° |
| C58 | C52 | H11 | 111.5° | 109.5° |
| C52 | C58 | H16 | 108.9° | 109.5° |
| C52 | C58 | H17 | 108.9° | 109.5° |
| F23 | C22 | C21 | 118.4° | 120.8° |
| F23 | C22 | C13 | 120.3° | 120.7° |
| N35 | C17 | C16 | 124.5° | 120.9° |
| C17 | N35 | C36 | 120.6° | 111.0° |
| C17 | C16 | C21 | 118.0° | 118.2° |
| C17 | C16 | C15 | 123.0° | 122.6° |
| C6 | C7 | C53 | 120.7° | 119.6° |
| C6 | C7 | C8 | 118.1° | 120.9° |
| C7 | C6 | H29 | 120.3° | 119.9° |
| N35 | C36 | H38 | 108.6° | 109.6° |
| N35 | C36 | H39 | 108.6° | 109.5° |
| C16 | C21 | C22 | 118.7° | 118.2° |
| C21 | C16 | C15 | 117.9° | 119.2° |
| C21 | C22 | C13 | 121.3° | 118.4° |
| C16 | C15 | N14 | 121.1° | 120.2° |
| C16 | C15 | H19 | 119.5° | 119.9° |
| C22 | C13 | C12 | 120.8° | 119.3° |
| C22 | C13 | N14 | 118.2° | 121.4° |
| C7 | C53 | C12 | 118.8° | 119.6° |
| C53 | C7 | C8 | 121.1° | 119.5° |
| C53 | C12 | C13 | 124.5° | 120.3° |
| C53 | C12 | C11 | 119.7° | 119.5° |
| O48 | C47 | O46 | 122.7° | 120.0° |
| C47 | O46 | H46 | 109.5° | 117.0° |
| C7 | C8 | C9 | 118.4° | 120.0° |
| C7 | C8 | H30 | 120.8° | 120.0° |
| C12 | C13 | N14 | 120.8° | 119.3° |
| C13 | C12 | C11 | 114.9° | 120.2° |
| C13 | N14 | C15 | 121.9° | 122.6° |
| N14 | C15 | H19 | 119.5° | 119.9° |
| O56 | C57 | C58 | 108.7° | 109.5° |
| O56 | C57 | H14 | 109.6° | 109.4° |
| O56 | C57 | H15 | 109.7° | 109.5° |
| C58 | C57 | H14 | 109.7° | 109.5° |
| C58 | C57 | H15 | 109.7° | 109.5° |
| C57 | C58 | H16 | 108.9° | 109.6° |
| C57 | C58 | H17 | 108.8° | 109.5° |
| C12 | C11 | C9 | 120.4° | 120.6° |
| C12 | C11 | H18 | 119.8° | 119.7° |
| C8 | C9 | C11 | 121.4° | 120.9° |
| C8 | C9 | O10 | 118.7° | 119.5° |
| C9 | C8 | H30 | 120.8° | 120.1° |
| C11 | C9 | O10 | 119.8° | 119.6° |
| C9 | C11 | H18 | 119.8° | 119.8° |
| C9 | O10 | H31 | 109.5° | 114.0° |
| H2 | C41 | H3 | 109.4° | 109.6° |
| H4 | C45 | H5 | 109.5° | 109.4° |
| H6 | C50 | H7 | 109.5° | 109.5° |
| H6 | C50 | H8 | 109.4° | 109.5° |
| H7 | C50 | H8 | 109.5° | 109.5° |
| H9 | C51 | H10 | 109.5° | 109.5° |
| H12 | C55 | H13 | 109.5° | 109.4° |
| H14 | C57 | H15 | 109.5° | 109.4° |
| H16 | C58 | H17 | 109.5° | 109.6° |
| H20 | C25 | H21 | 109.5° | 109.4° |
| H22 | C27 | H23 | 109.5° | 110.8° |
| H24 | C28 | H25 | 109.4° | 110.9° |
| H26 | C29 | H27 | 109.5° | 110.3° |
| H33 | C31 | H34 | 109.5° | 110.3° |
| H36 | C34 | H37 | 109.5° | 110.7° |
| H38 | C36 | H39 | 109.5° | 109.6° |
| H41 | C38 | H42 | 109.5° | 110.4° |
| H43 | C39 | H44 | 109.5° | 110.4° |
| H47 | C54 | H48 | 109.5° | 109.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F59 | C4 | C5 | C3 | 167.7° | 180.0° |
| F59 | C4 | C3 | C2 | 1.0° | 0.0° |
| F59 | C4 | C5 | C6 | 175.7° | 180.0° |
| F59 | C4 | C3 | C53 | 177.7° | 179.7° |
| F59 | C4 | C5 | H28 | 4.3° | 0.0° |
| C32 | C34 | C26 | H36 | 118.7° | 118.8° |
| C32 | C34 | C26 | H37 | 118.7° | 117.9° |
| C34 | C32 | F33 | C31 | 112.6° | 112.2° |
| C34 | C32 | F33 | H35 | 122.4° | 123.9° |
| C32 | C34 | C26 | C27 | 100.5° | 93.9° |
| C34 | C32 | C31 | H35 | 117.2° | 117.5° |
| C32 | C34 | C26 | C25 | 136.5° | 143.4° |
| C32 | C34 | C26 | N30 | 16.8° | 22.3° |
| C34 | C32 | C31 | N30 | 43.8° | 38.3° |
| C34 | C32 | C31 | H33 | 75.2° | 157.1° |
| C34 | C32 | C31 | H34 | 162.8° | 80.5° |
| C32 | C34 | H36 | H37 | 123.8° | 123.1° |
| C26 | C34 | C32 | F33 | 82.3° | 81.9° |
| C34 | C26 | C27 | C25 | 126.1° | 122.7° |
| C34 | C26 | C27 | N30 | 118.0° | 116.2° |
| C34 | C26 | C27 | C28 | 138.6° | 138.9° |
| C26 | C34 | C32 | C31 | 36.3° | 36.3° |
| C34 | C26 | C25 | N30 | 118.5° | 119.0° |
| C34 | C26 | C25 | O24 | 52.3° | 61.0° |
| C34 | C26 | N30 | C31 | 10.1° | 1.7° |
| C34 | C26 | N30 | C29 | 120.8° | 117.2° |
| C34 | C26 | C25 | H20 | 171.8° | 59.0° |
| C34 | C26 | C25 | H21 | 67.1° | 179.0° |
| C34 | C26 | C27 | H22 | 19.3° | 20.5° |
| C34 | C26 | C27 | H23 | 102.0° | 102.7° |
| C26 | C34 | C32 | H35 | 153.7° | 154.1° |
| C26 | C34 | H36 | H37 | 123.8° | 122.9° |
| C38 | C39 | C40 | H43 | 119.6° | 118.5° |
| C38 | C39 | C40 | H44 | 119.6° | 118.9° |
| C39 | C38 | C37 | H41 | 119.4° | 118.8° |
| C39 | C38 | C37 | H42 | 119.4° | 118.9° |
| C38 | C39 | C40 | N42 | 24.0° | 25.5° |
| C38 | C39 | C40 | C41 | 88.3° | 87.6° |
| C39 | C38 | C37 | N42 | 24.8° | 26.2° |
| C39 | C38 | C37 | C36 | 84.7° | 87.4° |
| C39 | C38 | C37 | H40 | 146.6° | 148.5° |
| C39 | C38 | H41 | H42 | 121.9° | 122.5° |
| C38 | C39 | H43 | H44 | 121.3° | 122.4° |
| C38 | C39 | C40 | H45 | 145.7° | 147.7° |
| C40 | C39 | C38 | C37 | 0.7° | 0.4° |
| C39 | C40 | N42 | C41 | 111.8° | 113.3° |
| C39 | C40 | N42 | H45 | 120.6° | 122.0° |
| C39 | C40 | C41 | H45 | 126.0° | 124.5° |
| C39 | C40 | N42 | C43 | 127.4° | 137.3° |
| C39 | C40 | N42 | C37 | 44.4° | 42.4° |
| C39 | C40 | C41 | N35 | 54.8° | 47.4° |
| C39 | C40 | C41 | H2 | 175.1° | 72.5° |
| C39 | C40 | C41 | H3 | 65.4° | 167.2° |
| C40 | C39 | C38 | H41 | 120.1° | 118.4° |
| C40 | C39 | C38 | H42 | 118.7° | 119.2° |
| C40 | C39 | H43 | H44 | 121.2° | 122.8° |
| F33 | C32 | C31 | H35 | 126.4° | 123.8° |
| F33 | C32 | C31 | N30 | 72.6° | 80.4° |
| F33 | C32 | C31 | H33 | 168.4° | 38.4° |
| F33 | C32 | C31 | H34 | 46.4° | 160.8° |
| F33 | C32 | C34 | H36 | 36.4° | 158.7° |
| F33 | C32 | C34 | H37 | 159.0° | 35.5° |
| C38 | C37 | N42 | C40 | 44.9° | 43.1° |
| C38 | C37 | N42 | C43 | 126.4° | 136.6° |
| C38 | C37 | N42 | C36 | 113.6° | 114.1° |
| C38 | C37 | N42 | H40 | 120.6° | 122.2° |
| C38 | C37 | C36 | H40 | 128.5° | 124.2° |
| C38 | C37 | C36 | N35 | 49.4° | 48.5° |
| C38 | C37 | C36 | H38 | 71.1° | 168.3° |
| C38 | C37 | C36 | H39 | 169.9° | 71.4° |
| C37 | C38 | H41 | H42 | 121.9° | 122.3° |
| C37 | C38 | C39 | H43 | 120.3° | 118.8° |
| C37 | C38 | C39 | H44 | 118.9° | 118.8° |
| C26 | C27 | C28 | H22 | 119.4° | 118.4° |
| C26 | C27 | C28 | H23 | 119.3° | 118.4° |
| C27 | C26 | C25 | N30 | 113.5° | 118.9° |
| C27 | C26 | C25 | O24 | 179.7° | 61.1° |
| C26 | C27 | C28 | C29 | 35.1° | 35.9° |
| C27 | C26 | N30 | C31 | 133.9° | 119.6° |
| C27 | C26 | N30 | C29 | 3.0° | 0.6° |
| C27 | C26 | C25 | H20 | 60.2° | 178.9° |
| C27 | C26 | C25 | H21 | 60.8° | 58.9° |
| C26 | C27 | H22 | H23 | 121.8° | 123.2° |
| C26 | C27 | C28 | H24 | 153.7° | 153.9° |
| C26 | C27 | C28 | H25 | 83.5° | 82.2° |
| C27 | C26 | C34 | H36 | 18.2° | 147.3° |
| C27 | C26 | C34 | H37 | 140.8° | 24.0° |
| C28 | C27 | C26 | C25 | 95.3° | 98.5° |
| C28 | C27 | C26 | N30 | 20.6° | 22.6° |
| C27 | C28 | C29 | H24 | 118.6° | 118.1° |
| C27 | C28 | C29 | H25 | 118.5° | 118.1° |
| C27 | C28 | C29 | N30 | 37.1° | 37.1° |
| C28 | C27 | H22 | H23 | 121.9° | 123.2° |
| C27 | C28 | H24 | H25 | 124.1° | 123.9° |
| C27 | C28 | C29 | H26 | 82.3° | 81.8° |
| C27 | C28 | C29 | H27 | 156.5° | 156.0° |
| C32 | C31 | N30 | C26 | 33.4° | 25.4° |
| C32 | C31 | N30 | H33 | 119.0° | 118.9° |
| C32 | C31 | N30 | H34 | 119.0° | 118.9° |
| C32 | C31 | N30 | C29 | 90.5° | 92.7° |
| C32 | C31 | H33 | H34 | 123.0° | 122.4° |
| C31 | C32 | C34 | H36 | 155.0° | 83.1° |
| C31 | C32 | C34 | H37 | 82.4° | 153.7° |
| C1 | C2 | C3 | C4 | 59.6° | 149.2° |
| C1 | C2 | C3 | C53 | 116.9° | 31.1° |
| C26 | C25 | O24 | H20 | 119.5° | 120.0° |
| C26 | C25 | O24 | H21 | 119.4° | 120.0° |
| C26 | C25 | O24 | C19 | 169.9° | 180.0° |
| C25 | C26 | N30 | C31 | 111.9° | 119.4° |
| C25 | C26 | N30 | C29 | 117.2° | 121.7° |
| C26 | C25 | H20 | H21 | 121.5° | 120.0° |
| C25 | C26 | C27 | H22 | 145.4° | 143.1° |
| C25 | C26 | C27 | H23 | 24.1° | 19.9° |
| C25 | C26 | C34 | H36 | 104.8° | 24.6° |
| C25 | C26 | C34 | H37 | 17.8° | 98.7° |
| N30 | C26 | C25 | O24 | 66.2° | 180.0° |
| C26 | N30 | C29 | C28 | 25.8° | 23.9° |
| C26 | N30 | C31 | C29 | 123.9° | 118.1° |
| N30 | C26 | C25 | H20 | 53.3° | 60.0° |
| N30 | C26 | C25 | H21 | 174.4° | 60.0° |
| N30 | C26 | C27 | H22 | 98.8° | 95.8° |
| N30 | C26 | C27 | H23 | 140.0° | 141.0° |
| C26 | N30 | C29 | H26 | 93.6° | 95.0° |
| C26 | N30 | C29 | H27 | 145.2° | 142.7° |
| C26 | N30 | C31 | H33 | 85.6° | 144.3° |
| C26 | N30 | C31 | H34 | 152.4° | 93.5° |
| N30 | C26 | C34 | H36 | 135.4° | 96.5° |
| N30 | C26 | C34 | H37 | 102.0° | 140.2° |
| C5 | C4 | C3 | C2 | 167.0° | 180.0° |
| C4 | C5 | C6 | H28 | 180.0° | 180.0° |
| C5 | C4 | C3 | C53 | 9.7° | 0.3° |
| C4 | C5 | C6 | C7 | 6.3° | 0.2° |
| C4 | C5 | C6 | H29 | 173.7° | 179.9° |
| C4 | C3 | C2 | C53 | 176.5° | 179.7° |
| C3 | C4 | C5 | C6 | 8.0° | 0.1° |
| C4 | C3 | C53 | C7 | 9.7° | 0.3° |
| C4 | C3 | C53 | C12 | 178.0° | 179.8° |
| C3 | C4 | C5 | H28 | 172.0° | 180.0° |
| C50 | C49 | C45 | C43 | 52.6° | 60.0° |
| C50 | C49 | C45 | C51 | 122.6° | 120.0° |
| C50 | C49 | C45 | C47 | 122.1° | 120.0° |
| C50 | C49 | C51 | C47 | 123.3° | 120.0° |
| C50 | C49 | C51 | C52 | 60.1° | 65.0° |
| C50 | C49 | C47 | O48 | 8.4° | 4.9° |
| C50 | C49 | C47 | O46 | 172.6° | 175.0° |
| C50 | C49 | C45 | H4 | 173.7° | 180.0° |
| C50 | C49 | C45 | H5 | 68.5° | 60.0° |
| C49 | C50 | H6 | H7 | 120.0° | 120.0° |
| C49 | C50 | H6 | H8 | 120.0° | 120.0° |
| C49 | C50 | H7 | H8 | 120.0° | 120.0° |
| C50 | C49 | C51 | H9 | 179.1° | 175.1° |
| C50 | C49 | C51 | H10 | 60.6° | 55.0° |
| C25 | O24 | C19 | N20 | 170.4° | 0.0° |
| C25 | O24 | C19 | N18 | 4.4° | 179.7° |
| O24 | C25 | H20 | H21 | 121.6° | 120.0° |
| N42 | C40 | C41 | H45 | 128.5° | 124.7° |
| C40 | N42 | C43 | C37 | 170.4° | 179.6° |
| C40 | N42 | C43 | O44 | 11.3° | 0.1° |
| C40 | N42 | C43 | C45 | 173.6° | 180.0° |
| C40 | N42 | C37 | C36 | 68.7° | 71.0° |
| N42 | C40 | C41 | N35 | 50.7° | 63.5° |
| N42 | C40 | C41 | H2 | 69.5° | 176.7° |
| N42 | C40 | C41 | H3 | 170.9° | 56.4° |
| C40 | N42 | C37 | H40 | 165.5° | 165.3° |
| N42 | C40 | C39 | H43 | 95.6° | 93.1° |
| N42 | C40 | C39 | H44 | 143.6° | 144.4° |
| C41 | C40 | N42 | C43 | 120.8° | 109.4° |
| C41 | C40 | N42 | C37 | 67.5° | 70.9° |
| C40 | C41 | N35 | H2 | 120.2° | 119.9° |
| C40 | C41 | N35 | H3 | 120.2° | 119.9° |
| C40 | C41 | N35 | C17 | 120.3° | 69.2° |
| C40 | C41 | N35 | C36 | 42.2° | 55.2° |
| C40 | C41 | H2 | H3 | 119.4° | 120.4° |
| C41 | C40 | C39 | H43 | 152.1° | 153.9° |
| C41 | C40 | C39 | H44 | 31.2° | 31.4° |
| C2 | C3 | C53 | C7 | 166.7° | 180.0° |
| C2 | C3 | C53 | C12 | 5.5° | 0.1° |
| C3 | C2 | C1 | H1 | 87.4° | 136.5° |
| C5 | C6 | C7 | H29 | 180.0° | 179.8° |
| C5 | C6 | C7 | C53 | 6.8° | 0.2° |
| C5 | C6 | C7 | C8 | 175.2° | 179.8° |
| N42 | C43 | O44 | C45 | 174.7° | 179.9° |
| C43 | N42 | C37 | C36 | 120.0° | 109.4° |
| N42 | C43 | C45 | C49 | 166.4° | 180.0° |
| N42 | C43 | C45 | H4 | 45.2° | 60.0° |
| N42 | C43 | C45 | H5 | 72.5° | 59.9° |
| C43 | N42 | C37 | H40 | 5.8° | 14.4° |
| C43 | N42 | C40 | H45 | 6.8° | 15.3° |
| C37 | N42 | C43 | O44 | 178.3° | 179.5° |
| C37 | N42 | C43 | C45 | 3.2° | 0.4° |
| N42 | C37 | C36 | H40 | 126.4° | 123.8° |
| N42 | C37 | C36 | N35 | 55.7° | 63.5° |
| N42 | C37 | C36 | H38 | 176.2° | 56.3° |
| N42 | C37 | C36 | H39 | 64.8° | 176.6° |
| N42 | C37 | C38 | H41 | 144.2° | 92.6° |
| N42 | C37 | C38 | H42 | 94.5° | 145.1° |
| C37 | N42 | C40 | H45 | 164.9° | 164.4° |
| O44 | C43 | C45 | C49 | 8.5° | 0.0° |
| O44 | C43 | C45 | H4 | 129.6° | 120.1° |
| O44 | C43 | C45 | H5 | 112.7° | 120.0° |
| C43 | C45 | C49 | H4 | 121.2° | 120.0° |
| C43 | C45 | C49 | H5 | 121.1° | 120.0° |
| C43 | C45 | C49 | C51 | 175.2° | 180.0° |
| C43 | C45 | C49 | C47 | 69.5° | 60.0° |
| C43 | C45 | H4 | H5 | 116.4° | 120.0° |
| C37 | C36 | N35 | C41 | 46.1° | 55.2° |
| C37 | C36 | N35 | C17 | 116.4° | 69.2° |
| C37 | C36 | N35 | H38 | 120.5° | 119.9° |
| C37 | C36 | N35 | H39 | 120.5° | 119.9° |
| C37 | C36 | H38 | H39 | 118.5° | 120.4° |
| C36 | C37 | C38 | H41 | 34.7° | 153.8° |
| C36 | C37 | C38 | H42 | 156.0° | 31.5° |
| O24 | C19 | N20 | N18 | 174.4° | 179.8° |
| O24 | C19 | N20 | C21 | 178.2° | 180.0° |
| O24 | C19 | N18 | C17 | 178.4° | 180.0° |
| C19 | O24 | C25 | H20 | 50.4° | 60.0° |
| C19 | O24 | C25 | H21 | 70.7° | 60.0° |
| C45 | C49 | C51 | C47 | 110.6° | 120.0° |
| C45 | C49 | C51 | C52 | 173.7° | 175.1° |
| C45 | C49 | C47 | O48 | 133.2° | 124.9° |
| C45 | C49 | C47 | O46 | 47.8° | 55.0° |
| C49 | C45 | H4 | H5 | 116.4° | 120.0° |
| C45 | C49 | C50 | H6 | 180.0° | 65.0° |
| C45 | C49 | C50 | H7 | 60.0° | 175.0° |
| C45 | C49 | C50 | H8 | 60.0° | 55.0° |
| C45 | C49 | C51 | H9 | 53.0° | 55.1° |
| C45 | C49 | C51 | H10 | 65.5° | 65.0° |
| C28 | C29 | N30 | C31 | 149.3° | 141.9° |
| C28 | C29 | N30 | H26 | 119.4° | 118.9° |
| C28 | C29 | N30 | H27 | 119.4° | 118.9° |
| C29 | C28 | C27 | H22 | 84.3° | 82.5° |
| C29 | C28 | C27 | H23 | 154.4° | 154.2° |
| C29 | C28 | H24 | H25 | 124.2° | 123.8° |
| C28 | C29 | H26 | H27 | 121.7° | 122.2° |
| C3 | C53 | C7 | C6 | 8.4° | 0.1° |
| C3 | C53 | C7 | C12 | 172.5° | 179.9° |
| C3 | C53 | C7 | C8 | 173.6° | 180.0° |
| C3 | C53 | C12 | C13 | 19.1° | 0.1° |
| C3 | C53 | C12 | C11 | 173.1° | 179.9° |
| C55 | C54 | C52 | H47 | 120.3° | 119.9° |
| C55 | C54 | C52 | H48 | 120.3° | 119.9° |
| C55 | C54 | C52 | C51 | 169.0° | 176.8° |
| C54 | C55 | O56 | H12 | 120.1° | 120.0° |
| C54 | C55 | O56 | H13 | 120.1° | 119.9° |
| C55 | C54 | C52 | C58 | 51.4° | 56.9° |
| C54 | C55 | O56 | C57 | 63.5° | 61.1° |
| C55 | C54 | C52 | H11 | 70.8° | 63.0° |
| C54 | C55 | H12 | H13 | 119.6° | 120.0° |
| C55 | C54 | H47 | H48 | 119.2° | 120.1° |
| C54 | C52 | C51 | C49 | 153.4° | 179.7° |
| C54 | C52 | C51 | C58 | 115.0° | 119.6° |
| C54 | C52 | C51 | H11 | 120.3° | 120.2° |
| C52 | C54 | C55 | O56 | 57.1° | 57.6° |
| C54 | C52 | C58 | H11 | 122.1° | 119.9° |
| C54 | C52 | C58 | C57 | 53.1° | 56.9° |
| C54 | C52 | C51 | H9 | 85.8° | 59.7° |
| C54 | C52 | C51 | H10 | 32.7° | 60.3° |
| C52 | C54 | C55 | H12 | 177.2° | 177.6° |
| C52 | C54 | C55 | H13 | 63.0° | 62.4° |
| C54 | C52 | C58 | H16 | 173.5° | 176.9° |
| C54 | C52 | C58 | H17 | 67.2° | 62.9° |
| C52 | C54 | H47 | H48 | 119.2° | 120.2° |
| C31 | N30 | C29 | H26 | 29.9° | 23.0° |
| C31 | N30 | C29 | H27 | 91.3° | 99.2° |
| N30 | C31 | H33 | H34 | 123.0° | 122.2° |
| N30 | C31 | C32 | H35 | 161.0° | 155.7° |
| C49 | C51 | C52 | H9 | 120.8° | 120.0° |
| C49 | C51 | C52 | H10 | 120.7° | 120.0° |
| C49 | C51 | C52 | C58 | 91.6° | 60.1° |
| C51 | C49 | C47 | O48 | 114.0° | 115.1° |
| C51 | C49 | C47 | O46 | 65.0° | 65.0° |
| C51 | C49 | C45 | H4 | 63.6° | 60.0° |
| C51 | C49 | C45 | H5 | 54.1° | 60.0° |
| C51 | C49 | C50 | H6 | 59.5° | 175.0° |
| C51 | C49 | C50 | H7 | 60.5° | 55.0° |
| C51 | C49 | C50 | H8 | 179.4° | 65.0° |
| C49 | C51 | H9 | H10 | 117.7° | 120.0° |
| C49 | C51 | C52 | H11 | 33.1° | 60.1° |
| C52 | C51 | C49 | C47 | 63.2° | 55.1° |
| C51 | C52 | C58 | H11 | 124.5° | 120.2° |
| C51 | C52 | C58 | C57 | 166.5° | 176.8° |
| C52 | C51 | H9 | H10 | 117.7° | 120.0° |
| C51 | C52 | C58 | H16 | 73.1° | 63.2° |
| C51 | C52 | C58 | H17 | 46.2° | 57.0° |
| C51 | C52 | C54 | H47 | 70.7° | 57.0° |
| C51 | C52 | C54 | H48 | 48.7° | 63.3° |
| C49 | C47 | O48 | O46 | 178.9° | 180.0° |
| C47 | C49 | C45 | H4 | 51.6° | 60.0° |
| C47 | C49 | C45 | H5 | 169.4° | 180.0° |
| C47 | C49 | C50 | H6 | 62.7° | 55.0° |
| C47 | C49 | C50 | H7 | 177.3° | 65.0° |
| C47 | C49 | C50 | H8 | 57.3° | 175.0° |
| C47 | C49 | C51 | H9 | 57.6° | 64.9° |
| C47 | C49 | C51 | H10 | 176.1° | 175.0° |
| C49 | C47 | O46 | H46 | 178.9° | 180.0° |
| N20 | C19 | N18 | C17 | 4.0° | 0.2° |
| C19 | N20 | C21 | C16 | 5.4° | 0.1° |
| C19 | N20 | C21 | C22 | 174.7° | 179.7° |
| N18 | C19 | N20 | C21 | 7.4° | 0.2° |
| C19 | N18 | C17 | N35 | 172.2° | 180.0° |
| C19 | N18 | C17 | C16 | 1.2° | 0.1° |
| N30 | C29 | C28 | H24 | 155.7° | 155.2° |
| N30 | C29 | C28 | H25 | 81.4° | 81.0° |
| N30 | C29 | H26 | H27 | 121.7° | 122.3° |
| C29 | N30 | C31 | H33 | 150.6° | 26.2° |
| C29 | N30 | C31 | H34 | 28.5° | 148.4° |
| N20 | C21 | C22 | F23 | 4.3° | 0.3° |
| N20 | C21 | C16 | C17 | 0.5° | 0.3° |
| N20 | C21 | C16 | C22 | 180.0° | 179.7° |
| N20 | C21 | C16 | C15 | 169.2° | 180.0° |
| N20 | C21 | C22 | C13 | 174.5° | 179.7° |
| N18 | C17 | N35 | C41 | 139.5° | 64.0° |
| N18 | C17 | N35 | C16 | 173.1° | 179.9° |
| N18 | C17 | N35 | C36 | 22.2° | 60.7° |
| N18 | C17 | C16 | C21 | 2.8° | 0.3° |
| N18 | C17 | C16 | C15 | 165.3° | 180.0° |
| C41 | N35 | C17 | C36 | 161.7° | 124.7° |
| C41 | N35 | C17 | C16 | 33.6° | 116.0° |
| N35 | C41 | H2 | H3 | 119.4° | 120.1° |
| C41 | N35 | C36 | H38 | 166.6° | 64.7° |
| C41 | N35 | C36 | H39 | 74.4° | 175.1° |
| N35 | C41 | C40 | H45 | 179.2° | 171.8° |
| C55 | O56 | C57 | C58 | 64.0° | 61.1° |
| O56 | C55 | H12 | H13 | 119.6° | 120.0° |
| C55 | O56 | C57 | H14 | 176.1° | 58.9° |
| C55 | O56 | C57 | H15 | 55.9° | 178.8° |
| O56 | C55 | C54 | H47 | 177.3° | 62.3° |
| O56 | C55 | C54 | H48 | 63.2° | 177.5° |
| C52 | C58 | C57 | O56 | 59.5° | 57.5° |
| C52 | C58 | C57 | H16 | 120.4° | 120.0° |
| C52 | C58 | C57 | H17 | 120.4° | 119.8° |
| C58 | C52 | C51 | H9 | 29.2° | 59.9° |
| C58 | C52 | C51 | H10 | 147.7° | 179.9° |
| C52 | C58 | C57 | H14 | 179.4° | 62.4° |
| C52 | C58 | C57 | H15 | 60.4° | 177.6° |
| C52 | C58 | H16 | H17 | 118.9° | 120.1° |
| C58 | C52 | C54 | H47 | 171.7° | 63.0° |
| C58 | C52 | C54 | H48 | 68.9° | 176.8° |
| F23 | C22 | C21 | C16 | 175.7° | 180.0° |
| F23 | C22 | C21 | C13 | 178.8° | 180.0° |
| F23 | C22 | C13 | C12 | 1.6° | 0.1° |
| F23 | C22 | C13 | N14 | 175.4° | 179.8° |
| N35 | C17 | C16 | C21 | 170.0° | 179.7° |
| N35 | C17 | C16 | C15 | 21.9° | 0.1° |
| C17 | N35 | C41 | H2 | 119.5° | 50.7° |
| C17 | N35 | C41 | H3 | 0.1° | 170.8° |
| C17 | N35 | C36 | H38 | 4.1° | 171.0° |
| C17 | N35 | C36 | H39 | 123.1° | 50.8° |
| C16 | C17 | N35 | C36 | 164.7° | 119.2° |
| C17 | C16 | C21 | C15 | 168.7° | 179.7° |
| C17 | C16 | C21 | C22 | 179.5° | 180.0° |
| C17 | C16 | C15 | N14 | 175.7° | 180.0° |
| C17 | C16 | C15 | H19 | 4.3° | 0.0° |
| C6 | C7 | C53 | C8 | 178.0° | 179.9° |
| C6 | C7 | C53 | C12 | 179.1° | 180.0° |
| C6 | C7 | C8 | C9 | 179.1° | 179.9° |
| C7 | C6 | C5 | H28 | 173.7° | 179.8° |
| C6 | C7 | C8 | H30 | 0.9° | 0.0° |
| C36 | N35 | C41 | H2 | 78.0° | 175.1° |
| C36 | N35 | C41 | H3 | 162.4° | 64.8° |
| N35 | C36 | H38 | H39 | 118.5° | 120.2° |
| N35 | C36 | C37 | H40 | 177.9° | 172.6° |
| C16 | C21 | C22 | C13 | 5.5° | 0.0° |
| C21 | C16 | C15 | N14 | 7.6° | 0.3° |
| C21 | C16 | C15 | H19 | 172.4° | 179.7° |
| C22 | C21 | C16 | C15 | 10.8° | 0.3° |
| C21 | C22 | C13 | C12 | 177.2° | 180.0° |
| C21 | C22 | C13 | N14 | 3.3° | 0.3° |
| C16 | C15 | N14 | C13 | 1.4° | 0.1° |
| C16 | C15 | N14 | H19 | 180.0° | 179.9° |
| C22 | C13 | C12 | C53 | 60.4° | 129.5° |
| C22 | C13 | C12 | N14 | 173.7° | 179.7° |
| C22 | C13 | N14 | C15 | 6.9° | 0.3° |
| C22 | C13 | C12 | C11 | 108.0° | 50.5° |
| C7 | C53 | C12 | C13 | 168.8° | 179.9° |
| C7 | C53 | C12 | C11 | 0.9° | 0.1° |
| C53 | C7 | C8 | C9 | 2.8° | 0.0° |
| C53 | C7 | C6 | H29 | 173.3° | 179.9° |
| C53 | C7 | C8 | H30 | 177.1° | 179.9° |
| C12 | C53 | C7 | C8 | 1.1° | 0.1° |
| C53 | C12 | C13 | C11 | 168.4° | 180.0° |
| C53 | C12 | C13 | N14 | 125.9° | 50.2° |
| C53 | C12 | C11 | C9 | 2.5° | 0.1° |
| C53 | C12 | C11 | H18 | 177.5° | 179.9° |
| O48 | C47 | O46 | H46 | 0.0° | 0.0° |
| C7 | C8 | C9 | H30 | 180.0° | 179.9° |
| C7 | C8 | C9 | C11 | 4.5° | 0.1° |
| C7 | C8 | C9 | O10 | 178.7° | 179.9° |
| C8 | C7 | C6 | H29 | 4.8° | 0.0° |
| C12 | C13 | N14 | C15 | 179.3° | 180.0° |
| C13 | C12 | C11 | C9 | 171.5° | 179.9° |
| C13 | C12 | C11 | H18 | 8.5° | 0.1° |
| N14 | C13 | C12 | C11 | 65.7° | 129.8° |
| C13 | N14 | C15 | H19 | 178.6° | 180.0° |
| O56 | C57 | C58 | H14 | 119.9° | 120.0° |
| O56 | C57 | C58 | H15 | 119.9° | 120.1° |
| C57 | O56 | C55 | H12 | 176.4° | 178.9° |
| C57 | O56 | C55 | H13 | 56.7° | 58.9° |
| O56 | C57 | H14 | H15 | 120.4° | 120.0° |
| O56 | C57 | C58 | H16 | 179.9° | 177.5° |
| O56 | C57 | C58 | H17 | 60.8° | 62.3° |
| C57 | C58 | C52 | H11 | 68.9° | 63.0° |
| C58 | C57 | H14 | H15 | 120.3° | 120.1° |
| C57 | C58 | H16 | H17 | 118.9° | 120.1° |
| C12 | C11 | C9 | C8 | 4.4° | 0.1° |
| C12 | C11 | C9 | H18 | 180.0° | 179.9° |
| C12 | C11 | C9 | O10 | 178.8° | 179.9° |
| C8 | C9 | C11 | O10 | 176.8° | 179.8° |
| C8 | C9 | C11 | H18 | 175.6° | 180.0° |
| C8 | C9 | O10 | H31 | 180.0° | 90.2° |
| C11 | C9 | C8 | H30 | 175.5° | 180.0° |
| C11 | C9 | O10 | H31 | 3.1° | 90.0° |
| O10 | C9 | C11 | H18 | 1.2° | 0.2° |
| O10 | C9 | C8 | H30 | 1.3° | 0.1° |
| H2 | C41 | C40 | H45 | 59.0° | 52.0° |
| H3 | C41 | C40 | H45 | 60.6° | 68.3° |
| H6 | C50 | H7 | H8 | 120.0° | 120.0° |
| H9 | C51 | C52 | H11 | 153.8° | 179.9° |
| H10 | C51 | C52 | H11 | 87.7° | 59.9° |
| H11 | C52 | C58 | H16 | 51.4° | 57.0° |
| H11 | C52 | C58 | H17 | 170.7° | 177.1° |
| H11 | C52 | C54 | H47 | 49.5° | 177.2° |
| H11 | C52 | C54 | H48 | 169.0° | 56.9° |
| H12 | C55 | C54 | H47 | 62.5° | 57.7° |
| H12 | C55 | C54 | H48 | 56.9° | 62.4° |
| H13 | C55 | C54 | H47 | 57.2° | 177.7° |
| H13 | C55 | C54 | H48 | 176.7° | 57.6° |
| H14 | C57 | C58 | H16 | 60.3° | 57.5° |
| H14 | C57 | C58 | H17 | 59.0° | 177.7° |
| H15 | C57 | C58 | H16 | 60.0° | 62.5° |
| H15 | C57 | C58 | H17 | 179.3° | 57.7° |
| H22 | C27 | C28 | H24 | 34.3° | 35.6° |
| H22 | C27 | C28 | H25 | 157.1° | 159.4° |
| H23 | C27 | C28 | H24 | 87.0° | 87.7° |
| H23 | C27 | C28 | H25 | 35.9° | 36.1° |
| H24 | C28 | C29 | H26 | 36.3° | 36.3° |
| H24 | C28 | C29 | H27 | 84.9° | 85.9° |
| H25 | C28 | C29 | H26 | 159.2° | 160.1° |
| H25 | C28 | C29 | H27 | 38.0° | 37.9° |
| H28 | C5 | C6 | H29 | 6.3° | 0.0° |
| H33 | C31 | C32 | H35 | 42.0° | 85.4° |
| H34 | C31 | C32 | H35 | 80.0° | 36.9° |
| H35 | C32 | C34 | H36 | 87.6° | 34.6° |
| H35 | C32 | C34 | H37 | 35.0° | 88.5° |
| H38 | C36 | C37 | H40 | 57.4° | 67.5° |
| H39 | C36 | C37 | H40 | 61.6° | 52.8° |
| H40 | C37 | C38 | H41 | 94.0° | 29.7° |
| H40 | C37 | C38 | H42 | 27.2° | 92.6° |
| H41 | C38 | C39 | H43 | 120.4° | 0.0° |
| H41 | C38 | C39 | H44 | 0.5° | 122.4° |
| H42 | C38 | C39 | H43 | 0.9° | 122.4° |
| H42 | C38 | C39 | H44 | 121.8° | 0.0° |
| H43 | C39 | C40 | H45 | 26.2° | 29.2° |
| H44 | C39 | C40 | H45 | 94.7° | 93.3° |
