1BV
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C28 | C29 | sing | 1.51Å | 1.54Å | |
| C28 | C27 | sing | 1.50Å | 1.54Å | |
| C29 | C30 | doub | 1.31Å | 1.51Å | |
| C27 | C26 | doub | 1.31Å | 1.50Å | |
| C26 | C25 | sing | 1.51Å | 1.53Å | |
| C30 | C14 | sing | 1.51Å | 1.56Å | |
| C14 | C13 | sing | 1.53Å | 1.40Å | |
| C25 | N31 | sing | 1.46Å | 1.44Å | |
| C25 | C23 | sing | 1.50Å | 1.51Å | |
| C13 | C12 | sing | 1.53Å | 1.46Å | |
| N31 | C32 | sing | 1.35Å | 1.42Å | |
| C23 | O24 | doub | 1.21Å | 1.24Å | |
| C23 | N22 | sing | 1.34Å | 1.46Å | |
| C32 | O33 | doub | 1.22Å | 1.20Å | |
| C32 | C34 | sing | 1.48Å | 1.51Å | |
| C12 | C10 | sing | 1.53Å | 1.50Å | |
| C12 | C11 | sing | 1.53Å | 1.50Å | |
| O17 | C16 | doub | 1.21Å | 1.22Å | |
| C38 | C34 | sing | 1.42Å | 1.40Å | Aromatic |
| C38 | C37 | doub | 1.35Å | 1.39Å | Aromatic |
| O5 | S4 | doub | 1.42Å | 1.45Å | |
| C34 | N35 | doub | 1.32Å | 1.37Å | Aromatic |
| C21 | N22 | sing | 1.47Å | 1.48Å | |
| C21 | C20 | sing | 1.54Å | 1.44Å | |
| N22 | C18 | sing | 1.47Å | 1.47Å | |
| O9 | C8 | doub | 1.21Å | 1.22Å | |
| C37 | N36 | sing | 1.35Å | 1.36Å | Aromatic |
| C10 | C8 | sing | 1.50Å | 1.50Å | |
| C10 | C11 | sing | 1.53Å | 1.50Å | |
| C10 | N15 | sing | 1.48Å | 1.46Å | |
| C16 | N15 | sing | 1.36Å | 1.46Å | |
| C16 | C18 | sing | 1.50Å | 1.47Å | |
| C8 | N7 | sing | 1.35Å | 1.46Å | |
| N35 | N36 | sing | 1.28Å | 1.38Å | Aromatic |
| N36 | C39 | sing | 1.47Å | 1.45Å | |
| C40 | C3 | sing | 1.53Å | 1.48Å | |
| C18 | C19 | sing | 1.53Å | 1.51Å | |
| N7 | S4 | sing | 1.66Å | 1.64Å | |
| S4 | C3 | sing | 1.81Å | 1.82Å | |
| S4 | O6 | doub | 1.42Å | 1.49Å | |
| C20 | C19 | sing | 1.54Å | 1.48Å | |
| C20 | O41 | sing | 1.43Å | 1.40Å | |
| C3 | C1 | sing | 1.53Å | 1.49Å | |
| C3 | C2 | sing | 1.53Å | 1.49Å | |
| O41 | C42 | sing | 1.36Å | 1.43Å | |
| C1 | C2 | sing | 1.53Å | 1.49Å | |
| C42 | C43 | doub | 1.37Å | 1.43Å | Aromatic |
| C42 | C47 | sing | 1.41Å | 1.46Å | Aromatic |
| C48 | C47 | doub | 1.40Å | 1.42Å | Aromatic |
| C48 | C49 | sing | 1.36Å | 1.40Å | Aromatic |
| C43 | C44 | sing | 1.40Å | 1.40Å | Aromatic |
| C47 | C46 | sing | 1.42Å | 1.36Å | Aromatic |
| C49 | C50 | doub | 1.40Å | 1.39Å | Aromatic |
| C46 | N45 | sing | 1.34Å | 1.41Å | Aromatic |
| C46 | C51 | doub | 1.40Å | 1.43Å | Aromatic |
| C44 | N45 | doub | 1.32Å | 1.34Å | Aromatic |
| C44 | O52 | sing | 1.36Å | 1.42Å | |
| C50 | C51 | sing | 1.38Å | 1.38Å | Aromatic |
| C50 | O56 | sing | 1.36Å | 1.41Å | |
| C57 | O56 | sing | 1.43Å | 1.40Å | |
| C51 | C58 | sing | 1.51Å | 1.47Å | |
| O52 | C53 | sing | 1.43Å | 1.40Å | |
| C55 | C53 | sing | 1.53Å | 1.51Å | |
| C53 | C54 | sing | 1.53Å | 1.56Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| C2 | H4 | sing | 1.09Å | 1.10Å | |
| N7 | H5 | sing | 0.97Å | 1.00Å | |
| C11 | H6 | sing | 1.09Å | 1.10Å | |
| C11 | H7 | sing | 1.09Å | 1.10Å | |
| C12 | H8 | sing | 1.09Å | 1.10Å | |
| C13 | H9 | sing | 1.09Å | 1.10Å | |
| C13 | H10 | sing | 1.09Å | 1.10Å | |
| C14 | H11 | sing | 1.09Å | 1.10Å | |
| C14 | H12 | sing | 1.09Å | 1.10Å | |
| N15 | H13 | sing | 0.97Å | 1.00Å | |
| C18 | H14 | sing | 1.09Å | 1.10Å | |
| C19 | H15 | sing | 1.09Å | 1.10Å | |
| C19 | H16 | sing | 1.09Å | 1.10Å | |
| C20 | H17 | sing | 1.09Å | 1.10Å | |
| C21 | H18 | sing | 1.09Å | 1.10Å | |
| C21 | H19 | sing | 1.09Å | 1.10Å | |
| C25 | H20 | sing | 1.09Å | 1.10Å | |
| C26 | H21 | sing | 1.08Å | 1.08Å | |
| C27 | H22 | sing | 1.08Å | 1.08Å | |
| C28 | H23 | sing | 1.09Å | 1.10Å | |
| C28 | H24 | sing | 1.09Å | 1.10Å | |
| C29 | H25 | sing | 1.08Å | 1.08Å | |
| C30 | H26 | sing | 1.08Å | 1.08Å | |
| N31 | H27 | sing | 0.97Å | 1.00Å | |
| C37 | H28 | sing | 1.08Å | 1.08Å | |
| C38 | H29 | sing | 1.08Å | 1.08Å | |
| C39 | H30 | sing | 1.09Å | 1.10Å | |
| C39 | H31 | sing | 1.09Å | 1.10Å | |
| C39 | H32 | sing | 1.09Å | 1.10Å | |
| C40 | H33 | sing | 1.09Å | 1.10Å | |
| C40 | H34 | sing | 1.09Å | 1.10Å | |
| C40 | H35 | sing | 1.09Å | 1.10Å | |
| C43 | H36 | sing | 1.08Å | 1.08Å | |
| C48 | H37 | sing | 1.08Å | 1.08Å | |
| C49 | H38 | sing | 1.08Å | 1.08Å | |
| C53 | H39 | sing | 1.09Å | 1.10Å | |
| C54 | H40 | sing | 1.09Å | 1.10Å | |
| C54 | H41 | sing | 1.09Å | 1.10Å | |
| C54 | H42 | sing | 1.09Å | 1.10Å | |
| C55 | H43 | sing | 1.09Å | 1.10Å | |
| C55 | H44 | sing | 1.09Å | 1.10Å | |
| C55 | H45 | sing | 1.09Å | 1.10Å | |
| C57 | H46 | sing | 1.09Å | 1.10Å | |
| C57 | H47 | sing | 1.09Å | 1.10Å | |
| C57 | H48 | sing | 1.09Å | 1.10Å | |
| C58 | H49 | sing | 1.09Å | 1.10Å | |
| C58 | H50 | sing | 1.09Å | 1.10Å | |
| C58 | H51 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C29 | C28 | C27 | 117.2° | 109.4° |
| C28 | C29 | C30 | 121.0° | 120.1° |
| C29 | C28 | H23 | 107.5° | 109.5° |
| C29 | C28 | H24 | 107.5° | 109.5° |
| C28 | C29 | H25 | 119.5° | 119.9° |
| C28 | C27 | C26 | 118.4° | 121.1° |
| C28 | C27 | H22 | 120.8° | 119.7° |
| C27 | C28 | H23 | 107.5° | 109.5° |
| C27 | C28 | H24 | 107.5° | 109.5° |
| C29 | C30 | C14 | 117.8° | 120.1° |
| C30 | C29 | H25 | 119.5° | 120.0° |
| C29 | C30 | H26 | 121.1° | 119.9° |
| C27 | C26 | C25 | 116.3° | 119.1° |
| C27 | C26 | H21 | 121.8° | 120.8° |
| C26 | C27 | H22 | 120.8° | 119.2° |
| C26 | C25 | N31 | 115.5° | 109.8° |
| C26 | C25 | C23 | 110.9° | 107.9° |
| C26 | C25 | H20 | 108.9° | 109.8° |
| C25 | C26 | H21 | 121.9° | 120.0° |
| C30 | C14 | C13 | 121.7° | 109.9° |
| C30 | C14 | H11 | 106.3° | 109.4° |
| C30 | C14 | H12 | 106.3° | 109.3° |
| C14 | C30 | H26 | 121.1° | 120.0° |
| C14 | C13 | C12 | 118.3° | 109.5° |
| C14 | C13 | H9 | 107.2° | 109.4° |
| C14 | C13 | H10 | 107.2° | 109.5° |
| C13 | C14 | H11 | 106.3° | 109.4° |
| C13 | C14 | H12 | 106.3° | 109.5° |
| N31 | C25 | C23 | 102.0° | 109.8° |
| C25 | N31 | C32 | 119.4° | 120.1° |
| N31 | C25 | H20 | 110.2° | 109.8° |
| C25 | N31 | H27 | 120.3° | 120.0° |
| C25 | C23 | O24 | 120.5° | 118.5° |
| C25 | C23 | N22 | 122.4° | 123.0° |
| C23 | C25 | H20 | 109.1° | 109.8° |
| C13 | C12 | C10 | 115.0° | 117.9° |
| C13 | C12 | C11 | 113.6° | 118.2° |
| C13 | C12 | H8 | 118.8° | 115.3° |
| C12 | C13 | H9 | 107.2° | 109.5° |
| C12 | C13 | H10 | 107.2° | 109.5° |
| N31 | C32 | O33 | 118.9° | 120.0° |
| N31 | C32 | C34 | 121.4° | 120.1° |
| C32 | N31 | H27 | 120.3° | 120.0° |
| O24 | C23 | N22 | 117.1° | 118.5° |
| C23 | N22 | C21 | 127.7° | 127.3° |
| C23 | N22 | C18 | 123.4° | 124.0° |
| O33 | C32 | C34 | 119.7° | 119.9° |
| C32 | C34 | C38 | 126.6° | 126.5° |
| C32 | C34 | N35 | 125.9° | 126.5° |
| C10 | C12 | C11 | 59.8° | 59.9° |
| C12 | C10 | C8 | 121.1° | 118.0° |
| C12 | C10 | C11 | 59.9° | 60.0° |
| C12 | C10 | N15 | 112.8° | 115.7° |
| C10 | C12 | H8 | 117.9° | 117.1° |
| C12 | C11 | C10 | 60.3° | 60.1° |
| C12 | C11 | H6 | 119.9° | 117.5° |
| C12 | C11 | H7 | 120.0° | 117.5° |
| C11 | C12 | H8 | 118.1° | 117.3° |
| O17 | C16 | N15 | 117.0° | 120.3° |
| O17 | C16 | C18 | 123.5° | 120.3° |
| C34 | C38 | C37 | 107.8° | 105.5° |
| C38 | C34 | N35 | 107.5° | 107.0° |
| C34 | C38 | H29 | 126.1° | 127.2° |
| C38 | C37 | N36 | 107.5° | 107.2° |
| C38 | C37 | H28 | 126.2° | 126.4° |
| C37 | C38 | H29 | 126.1° | 127.3° |
| O5 | S4 | N7 | 105.9° | 104.3° |
| O5 | S4 | C3 | 109.1° | 110.5° |
| O5 | S4 | O6 | 107.7° | 121.1° |
| C34 | N35 | N36 | 108.0° | 110.0° |
| N22 | C21 | C20 | 101.0° | 107.5° |
| C21 | N22 | C18 | 108.9° | 108.6° |
| N22 | C21 | H18 | 111.6° | 109.8° |
| N22 | C21 | H19 | 111.6° | 109.9° |
| C21 | C20 | C19 | 102.3° | 106.5° |
| C21 | C20 | O41 | 100.3° | 110.1° |
| C21 | C20 | H17 | 113.5° | 110.1° |
| C20 | C21 | H18 | 111.6° | 109.8° |
| C20 | C21 | H19 | 111.6° | 109.8° |
| N22 | C18 | C16 | 108.0° | 108.7° |
| N22 | C18 | C19 | 102.4° | 107.3° |
| N22 | C18 | H14 | 108.6° | 109.5° |
| O9 | C8 | C10 | 120.4° | 120.0° |
| O9 | C8 | N7 | 121.4° | 120.0° |
| C37 | N36 | N35 | 109.3° | 110.3° |
| C37 | N36 | C39 | 125.7° | 124.9° |
| N36 | C37 | H28 | 126.3° | 126.4° |
| C8 | C10 | C11 | 108.0° | 118.4° |
| C8 | C10 | N15 | 123.7° | 115.5° |
| C10 | C8 | N7 | 118.2° | 120.0° |
| C11 | C10 | N15 | 112.1° | 117.9° |
| C10 | C11 | H6 | 119.9° | 117.5° |
| C10 | C11 | H7 | 119.9° | 117.5° |
| C10 | N15 | C16 | 119.6° | 115.7° |
| C10 | N15 | H13 | 120.2° | 122.2° |
| N15 | C16 | C18 | 119.5° | 119.4° |
| C16 | N15 | H13 | 120.2° | 122.1° |
| C16 | C18 | C19 | 120.6° | 111.1° |
| C16 | C18 | H14 | 108.6° | 110.2° |
| C8 | N7 | S4 | 116.4° | 120.0° |
| C8 | N7 | H5 | 121.8° | 120.0° |
| N35 | N36 | C39 | 125.1° | 124.9° |
| N36 | C39 | H30 | 109.5° | 109.5° |
| N36 | C39 | H31 | 109.5° | 109.5° |
| N36 | C39 | H32 | 109.4° | 109.4° |
| C40 | C3 | S4 | 112.4° | 115.5° |
| C40 | C3 | C1 | 123.1° | 117.5° |
| C40 | C3 | C2 | 121.0° | 117.5° |
| C3 | C40 | H33 | 109.5° | 109.5° |
| C3 | C40 | H34 | 109.5° | 109.5° |
| C3 | C40 | H35 | 109.4° | 109.5° |
| C18 | C19 | C20 | 101.6° | 105.0° |
| C19 | C18 | H14 | 108.1° | 110.0° |
| C18 | C19 | H15 | 111.4° | 110.3° |
| C18 | C19 | H16 | 111.4° | 110.3° |
| N7 | S4 | C3 | 108.3° | 104.4° |
| N7 | S4 | O6 | 112.6° | 104.3° |
| S4 | N7 | H5 | 121.8° | 120.0° |
| C3 | S4 | O6 | 113.0° | 110.5° |
| S4 | C3 | C1 | 118.4° | 117.5° |
| S4 | C3 | C2 | 111.7° | 117.5° |
| C19 | C20 | O41 | 112.4° | 110.0° |
| C20 | C19 | H15 | 111.4° | 110.3° |
| C20 | C19 | H16 | 111.4° | 110.4° |
| C19 | C20 | H17 | 112.8° | 110.0° |
| C20 | O41 | C42 | 117.9° | 117.0° |
| O41 | C20 | H17 | 114.3° | 110.0° |
| C1 | C3 | C2 | 60.1° | 60.0° |
| C3 | C1 | C2 | 59.9° | 60.0° |
| C3 | C1 | H1 | 120.0° | 117.5° |
| C3 | C1 | H2 | 120.0° | 117.5° |
| C3 | C2 | C1 | 60.0° | 60.0° |
| C3 | C2 | H3 | 120.0° | 117.5° |
| C3 | C2 | H4 | 120.0° | 117.5° |
| O41 | C42 | C43 | 122.5° | 120.9° |
| O41 | C42 | C47 | 118.9° | 120.9° |
| C2 | C1 | H1 | 120.0° | 117.5° |
| C2 | C1 | H2 | 120.0° | 117.5° |
| C1 | C2 | H3 | 120.0° | 117.5° |
| C1 | C2 | H4 | 120.0° | 117.4° |
| C43 | C42 | C47 | 118.6° | 118.2° |
| C42 | C43 | C44 | 118.9° | 119.8° |
| C42 | C43 | H36 | 120.6° | 120.1° |
| C42 | C47 | C48 | 121.4° | 121.2° |
| C42 | C47 | C46 | 119.3° | 119.0° |
| C47 | C48 | C49 | 119.8° | 119.8° |
| C48 | C47 | C46 | 119.3° | 119.9° |
| C47 | C48 | H37 | 120.1° | 120.1° |
| C48 | C49 | C50 | 120.4° | 120.8° |
| C49 | C48 | H37 | 120.1° | 120.1° |
| C48 | C49 | H38 | 119.8° | 119.6° |
| C43 | C44 | N45 | 120.8° | 121.7° |
| C43 | C44 | O52 | 121.2° | 119.2° |
| C44 | C43 | H36 | 120.6° | 120.0° |
| C47 | C46 | N45 | 120.0° | 119.9° |
| C47 | C46 | C51 | 120.9° | 119.2° |
| C49 | C50 | C51 | 120.0° | 120.8° |
| C49 | C50 | O56 | 121.3° | 119.6° |
| C50 | C49 | H38 | 119.8° | 119.6° |
| N45 | C46 | C51 | 119.1° | 120.9° |
| C46 | N45 | C44 | 122.4° | 121.4° |
| C46 | C51 | C50 | 119.5° | 119.6° |
| C46 | C51 | C58 | 120.6° | 120.2° |
| N45 | C44 | O52 | 118.1° | 119.2° |
| C44 | O52 | C53 | 118.9° | 117.0° |
| C51 | C50 | O56 | 118.6° | 119.6° |
| C50 | C51 | C58 | 119.8° | 120.2° |
| C50 | O56 | C57 | 119.7° | 117.0° |
| O56 | C57 | H46 | 109.5° | 109.5° |
| O56 | C57 | H47 | 109.5° | 109.5° |
| O56 | C57 | H48 | 109.5° | 109.5° |
| C51 | C58 | H49 | 109.5° | 109.4° |
| C51 | C58 | H50 | 109.5° | 109.5° |
| C51 | C58 | H51 | 109.5° | 109.5° |
| O52 | C53 | C55 | 113.0° | 109.5° |
| O52 | C53 | C54 | 112.9° | 109.5° |
| O52 | C53 | H39 | 106.6° | 109.4° |
| C55 | C53 | C54 | 113.3° | 109.5° |
| C55 | C53 | H39 | 105.3° | 109.5° |
| C53 | C55 | H43 | 109.5° | 109.5° |
| C53 | C55 | H44 | 109.5° | 109.5° |
| C53 | C55 | H45 | 109.5° | 109.5° |
| C54 | C53 | H39 | 104.8° | 109.5° |
| C53 | C54 | H40 | 109.5° | 109.5° |
| C53 | C54 | H41 | 109.5° | 109.5° |
| C53 | C54 | H42 | 109.5° | 109.5° |
| H1 | C1 | H2 | 109.5° | 115.5° |
| H3 | C2 | H4 | 109.5° | 115.6° |
| H6 | C11 | H7 | 109.5° | 115.6° |
| H9 | C13 | H10 | 109.5° | 109.5° |
| H11 | C14 | H12 | 109.5° | 109.4° |
| H15 | C19 | H16 | 109.4° | 110.4° |
| H18 | C21 | H19 | 109.4° | 109.9° |
| H23 | C28 | H24 | 109.5° | 109.5° |
| H30 | C39 | H31 | 109.4° | 109.5° |
| H30 | C39 | H32 | 109.4° | 109.5° |
| H31 | C39 | H32 | 109.5° | 109.5° |
| H33 | C40 | H34 | 109.4° | 109.5° |
| H33 | C40 | H35 | 109.5° | 109.4° |
| H34 | C40 | H35 | 109.5° | 109.4° |
| H40 | C54 | H41 | 109.5° | 109.4° |
| H40 | C54 | H42 | 109.5° | 109.5° |
| H41 | C54 | H42 | 109.4° | 109.4° |
| H43 | C55 | H44 | 109.5° | 109.5° |
| H43 | C55 | H45 | 109.4° | 109.5° |
| H44 | C55 | H45 | 109.5° | 109.4° |
| H46 | C57 | H47 | 109.5° | 109.4° |
| H46 | C57 | H48 | 109.5° | 109.4° |
| H47 | C57 | H48 | 109.5° | 109.5° |
| H49 | C58 | H50 | 109.5° | 109.5° |
| H49 | C58 | H51 | 109.4° | 109.4° |
| H50 | C58 | H51 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C29 | C28 | C27 | H23 | 121.1° | 120.0° |
| C29 | C28 | C27 | H24 | 121.1° | 120.0° |
| C28 | C29 | C30 | H25 | 180.0° | 179.9° |
| C29 | C28 | C27 | C26 | 81.6° | 138.5° |
| C28 | C29 | C30 | C14 | 179.9° | 179.9° |
| C29 | C28 | C27 | H22 | 98.4° | 38.9° |
| C29 | C28 | H23 | H24 | 116.5° | 120.1° |
| C28 | C29 | C30 | H26 | 0.1° | 0.3° |
| C27 | C28 | C29 | C30 | 47.4° | 53.3° |
| C28 | C27 | C26 | H22 | 180.0° | 177.4° |
| C28 | C27 | C26 | C25 | 161.9° | 173.7° |
| C28 | C27 | C26 | H21 | 18.1° | 6.6° |
| C27 | C28 | H23 | H24 | 116.5° | 120.0° |
| C27 | C28 | C29 | H25 | 132.6° | 126.6° |
| C29 | C30 | C14 | H26 | 180.0° | 179.8° |
| C29 | C30 | C14 | C13 | 146.3° | 117.6° |
| C29 | C30 | C14 | H11 | 92.0° | 122.2° |
| C29 | C30 | C14 | H12 | 24.7° | 2.5° |
| C30 | C29 | C28 | H23 | 168.5° | 173.3° |
| C30 | C29 | C28 | H24 | 73.7° | 66.7° |
| C27 | C26 | C25 | H21 | 180.0° | 179.7° |
| C27 | C26 | C25 | N31 | 166.6° | 179.3° |
| C27 | C26 | C25 | C23 | 51.1° | 59.6° |
| C27 | C26 | C25 | H20 | 69.0° | 60.0° |
| C26 | C27 | C28 | H23 | 39.5° | 101.5° |
| C26 | C27 | C28 | H24 | 157.3° | 18.5° |
| C26 | C25 | N31 | C23 | 120.4° | 118.5° |
| C26 | C25 | N31 | H20 | 123.8° | 120.8° |
| C26 | C25 | C23 | H20 | 120.0° | 119.6° |
| C26 | C25 | N31 | C32 | 142.5° | 86.6° |
| C26 | C25 | C23 | O24 | 58.1° | 24.0° |
| C26 | C25 | C23 | N22 | 121.7° | 155.8° |
| C25 | C26 | C27 | H22 | 18.1° | 3.7° |
| C26 | C25 | N31 | H27 | 37.5° | 93.4° |
| C30 | C14 | C13 | H11 | 121.7° | 120.1° |
| C30 | C14 | C13 | H12 | 121.7° | 120.1° |
| C30 | C14 | C13 | C12 | 30.3° | 69.5° |
| C30 | C14 | C13 | H9 | 91.0° | 170.5° |
| C30 | C14 | C13 | H10 | 151.5° | 50.5° |
| C30 | C14 | H11 | H12 | 114.5° | 119.7° |
| C14 | C30 | C29 | H25 | 0.1° | 0.0° |
| C14 | C13 | C12 | H9 | 121.3° | 120.0° |
| C14 | C13 | C12 | H10 | 121.2° | 120.0° |
| C14 | C13 | C12 | C10 | 115.1° | 150.9° |
| C14 | C13 | C12 | C11 | 178.6° | 140.2° |
| C14 | C13 | C12 | H8 | 32.8° | 5.8° |
| C14 | C13 | H9 | H10 | 116.0° | 120.0° |
| C13 | C14 | H11 | H12 | 114.5° | 119.9° |
| C13 | C14 | C30 | H26 | 33.6° | 62.6° |
| N31 | C25 | C23 | H20 | 116.5° | 120.8° |
| C25 | N31 | C32 | H27 | 180.0° | 180.0° |
| N31 | C25 | C23 | O24 | 65.4° | 143.7° |
| N31 | C25 | C23 | N22 | 114.8° | 36.2° |
| C25 | N31 | C32 | O33 | 1.3° | 0.0° |
| C25 | N31 | C32 | C34 | 178.2° | 180.0° |
| N31 | C25 | C26 | H21 | 13.5° | 1.0° |
| C23 | C25 | N31 | C32 | 97.1° | 154.9° |
| C25 | C23 | O24 | N22 | 179.9° | 179.9° |
| C25 | C23 | N22 | C21 | 0.3° | 8.8° |
| C25 | C23 | N22 | C18 | 179.8° | 171.5° |
| C23 | C25 | C26 | H21 | 128.9° | 120.7° |
| C23 | C25 | N31 | H27 | 82.9° | 25.0° |
| C13 | C12 | C10 | C11 | 103.9° | 108.1° |
| C13 | C12 | C10 | H8 | 148.2° | 144.5° |
| C13 | C12 | C11 | H8 | 146.1° | 145.3° |
| C13 | C12 | C10 | C8 | 10.1° | 0.3° |
| C13 | C12 | C10 | N15 | 152.9° | 143.2° |
| C13 | C12 | C11 | H6 | 3.3° | 144.8° |
| C13 | C12 | C11 | H7 | 144.2° | 0.2° |
| C12 | C13 | H9 | H10 | 116.0° | 120.0° |
| C12 | C13 | C14 | H11 | 152.0° | 50.6° |
| C12 | C13 | C14 | H12 | 91.4° | 170.5° |
| N31 | C32 | O33 | C34 | 179.5° | 180.0° |
| N31 | C32 | C34 | C38 | 2.6° | 179.7° |
| N31 | C32 | C34 | N35 | 179.3° | 0.0° |
| C32 | N31 | C25 | H20 | 18.7° | 34.2° |
| O24 | C23 | N22 | C21 | 179.6° | 171.3° |
| O24 | C23 | N22 | C18 | 0.4° | 8.4° |
| O24 | C23 | C25 | H20 | 178.1° | 95.6° |
| C23 | N22 | C21 | C18 | 180.0° | 179.7° |
| C23 | N22 | C21 | C20 | 154.1° | 162.3° |
| C23 | N22 | C18 | C16 | 48.4° | 35.9° |
| C23 | N22 | C18 | C19 | 176.7° | 156.2° |
| C23 | N22 | C18 | H14 | 69.1° | 84.5° |
| C23 | N22 | C21 | H18 | 35.4° | 42.8° |
| C23 | N22 | C21 | H19 | 87.3° | 78.2° |
| N22 | C23 | C25 | H20 | 1.8° | 84.6° |
| O33 | C32 | C34 | C38 | 176.9° | 0.3° |
| O33 | C32 | C34 | N35 | 1.2° | 179.9° |
| O33 | C32 | N31 | H27 | 178.7° | 180.0° |
| C32 | C34 | C38 | N35 | 178.4° | 179.7° |
| C32 | C34 | C38 | C37 | 178.8° | 179.9° |
| C32 | C34 | N35 | N36 | 179.0° | 180.0° |
| C34 | C32 | N31 | H27 | 1.8° | 0.0° |
| C32 | C34 | C38 | H29 | 1.2° | 0.1° |
| C10 | C12 | C11 | H8 | 107.7° | 107.0° |
| C12 | C10 | C8 | O9 | 26.9° | 32.5° |
| C12 | C10 | C8 | C11 | 65.1° | 69.1° |
| C12 | C10 | C8 | N15 | 161.1° | 143.0° |
| C12 | C10 | C11 | N15 | 104.4° | 105.2° |
| C12 | C10 | N15 | C16 | 89.6° | 115.6° |
| C12 | C10 | C8 | N7 | 154.4° | 147.5° |
| C10 | C12 | C11 | H6 | 109.6° | 107.5° |
| C10 | C12 | C11 | H7 | 109.6° | 107.5° |
| C10 | C12 | C13 | H9 | 6.2° | 89.1° |
| C10 | C12 | C13 | H10 | 123.7° | 30.9° |
| C12 | C10 | N15 | H13 | 90.4° | 64.5° |
| C12 | C11 | H6 | H7 | 144.6° | 145.6° |
| C11 | C12 | C13 | H9 | 60.2° | 20.2° |
| C11 | C12 | C13 | H10 | 57.3° | 99.8° |
| O17 | C16 | C18 | N22 | 57.0° | 52.6° |
| O17 | C16 | N15 | C10 | 2.5° | 19.0° |
| O17 | C16 | N15 | C18 | 177.6° | 179.9° |
| O17 | C16 | C18 | C19 | 59.9° | 65.2° |
| O17 | C16 | N15 | H13 | 177.5° | 160.9° |
| O17 | C16 | C18 | H14 | 174.6° | 172.6° |
| C34 | C38 | C37 | H29 | 180.0° | 179.9° |
| C34 | C38 | C37 | N36 | 0.0° | 0.4° |
| C38 | C34 | N35 | N36 | 0.6° | 0.3° |
| C34 | C38 | C37 | H28 | 180.0° | 179.9° |
| C37 | C38 | C34 | N35 | 0.4° | 0.4° |
| C38 | C37 | N36 | H28 | 180.0° | 179.7° |
| C38 | C37 | N36 | N35 | 0.4° | 0.2° |
| C38 | C37 | N36 | C39 | 179.9° | 179.8° |
| O5 | S4 | N7 | C8 | 55.5° | 51.0° |
| O5 | S4 | C3 | C40 | 64.9° | 145.9° |
| O5 | S4 | N7 | C3 | 116.9° | 116.0° |
| O5 | S4 | N7 | O6 | 117.4° | 127.9° |
| O5 | S4 | C3 | O6 | 119.7° | 136.8° |
| O5 | S4 | C3 | C1 | 88.4° | 68.3° |
| O5 | S4 | C3 | C2 | 155.2° | 0.3° |
| O5 | S4 | N7 | H5 | 124.6° | 128.9° |
| C34 | N35 | N36 | C37 | 0.6° | 0.0° |
| C34 | N35 | N36 | C39 | 179.6° | 180.0° |
| N35 | C34 | C38 | H29 | 179.6° | 179.7° |
| N22 | C21 | C20 | H18 | 118.6° | 119.5° |
| N22 | C21 | C20 | H19 | 118.6° | 119.5° |
| C21 | N22 | C18 | C16 | 131.5° | 143.9° |
| C21 | N22 | C18 | C19 | 3.2° | 23.6° |
| N22 | C21 | C20 | C19 | 45.2° | 4.6° |
| N22 | C21 | C20 | O41 | 70.7° | 123.9° |
| C21 | N22 | C18 | H14 | 110.9° | 95.8° |
| N22 | C21 | C20 | H17 | 167.0° | 114.7° |
| N22 | C21 | H18 | H19 | 124.0° | 121.0° |
| C20 | C21 | N22 | C18 | 26.0° | 17.5° |
| C21 | C20 | C19 | C18 | 48.1° | 9.2° |
| C21 | C20 | C19 | O41 | 106.7° | 119.3° |
| C21 | C20 | C19 | H17 | 122.3° | 119.3° |
| C21 | C20 | O41 | H17 | 121.8° | 121.5° |
| C21 | C20 | O41 | C42 | 163.7° | 87.3° |
| C21 | C20 | C19 | H15 | 70.6° | 109.6° |
| C21 | C20 | C19 | H16 | 166.9° | 128.1° |
| C20 | C21 | H18 | H19 | 123.9° | 121.0° |
| N22 | C18 | C16 | N15 | 120.5° | 127.4° |
| N22 | C18 | C16 | C19 | 117.0° | 117.9° |
| N22 | C18 | C16 | H14 | 117.6° | 119.9° |
| N22 | C18 | C19 | H14 | 114.5° | 119.0° |
| N22 | C18 | C19 | C20 | 30.4° | 19.9° |
| N22 | C18 | C19 | H15 | 88.3° | 98.9° |
| N22 | C18 | C19 | H16 | 149.2° | 138.9° |
| C18 | N22 | C21 | H18 | 144.6° | 137.0° |
| C18 | N22 | C21 | H19 | 92.6° | 102.0° |
| O9 | C8 | C10 | N7 | 178.8° | 180.0° |
| O9 | C8 | C10 | C11 | 38.2° | 101.6° |
| O9 | C8 | C10 | N15 | 172.0° | 110.5° |
| O9 | C8 | N7 | S4 | 2.1° | 5.0° |
| O9 | C8 | N7 | H5 | 177.9° | 175.0° |
| C37 | N36 | N35 | C39 | 179.8° | 180.0° |
| N36 | C37 | C38 | H29 | 180.0° | 179.7° |
| C37 | N36 | C39 | H30 | 179.7° | 90.0° |
| C37 | N36 | C39 | H31 | 59.7° | 30.1° |
| C37 | N36 | C39 | H32 | 60.3° | 150.0° |
| C8 | C10 | C11 | N15 | 139.6° | 147.1° |
| C8 | C10 | N15 | C16 | 72.9° | 28.2° |
| C10 | C8 | N7 | S4 | 179.2° | 174.9° |
| C10 | C8 | N7 | H5 | 0.8° | 5.0° |
| C8 | C10 | C11 | H6 | 6.5° | 144.8° |
| C8 | C10 | C11 | H7 | 134.4° | 0.2° |
| C8 | C10 | C12 | H8 | 158.3° | 144.1° |
| C8 | C10 | N15 | H13 | 107.1° | 151.7° |
| C11 | C10 | N15 | C16 | 155.0° | 176.3° |
| C11 | C10 | C8 | N7 | 140.6° | 78.4° |
| C10 | C11 | H6 | H7 | 144.5° | 145.6° |
| C11 | C10 | N15 | H13 | 25.0° | 3.6° |
| C10 | N15 | C16 | H13 | 180.0° | 179.9° |
| C10 | N15 | C16 | C18 | 175.1° | 161.1° |
| N15 | C10 | C8 | N7 | 6.8° | 69.5° |
| N15 | C10 | C11 | H6 | 146.1° | 2.3° |
| N15 | C10 | C11 | H7 | 5.2° | 147.3° |
| N15 | C10 | C12 | H8 | 4.8° | 1.3° |
| N15 | C16 | C18 | C19 | 122.6° | 114.7° |
| N15 | C16 | C18 | H14 | 2.9° | 7.5° |
| C16 | C18 | C19 | H14 | 125.7° | 122.3° |
| C16 | C18 | C19 | C20 | 150.2° | 138.6° |
| C18 | C16 | N15 | H13 | 4.9° | 19.0° |
| C16 | C18 | C19 | H15 | 31.5° | 19.7° |
| C16 | C18 | C19 | H16 | 91.1° | 102.4° |
| C8 | N7 | S4 | H5 | 180.0° | 180.0° |
| C8 | N7 | S4 | C3 | 172.3° | 65.0° |
| C8 | N7 | S4 | O6 | 61.9° | 178.9° |
| N35 | N36 | C37 | H28 | 179.7° | 180.0° |
| N35 | N36 | C39 | H30 | 0.0° | 90.0° |
| N35 | N36 | C39 | H31 | 120.0° | 149.9° |
| N35 | N36 | C39 | H32 | 120.0° | 30.0° |
| C39 | N36 | C37 | H28 | 0.1° | 0.0° |
| N36 | C39 | H30 | H31 | 120.0° | 120.0° |
| N36 | C39 | H30 | H32 | 120.0° | 120.0° |
| N36 | C39 | H31 | H32 | 120.0° | 120.0° |
| C40 | C3 | S4 | N7 | 49.9° | 34.3° |
| C40 | C3 | S4 | C1 | 153.3° | 145.7° |
| C40 | C3 | S4 | C2 | 139.9° | 145.6° |
| C40 | C3 | S4 | O6 | 175.3° | 77.3° |
| C40 | C3 | C1 | C2 | 109.6° | 107.5° |
| C40 | C3 | C1 | H1 | 0.1° | 145.0° |
| C40 | C3 | C1 | H2 | 140.9° | 0.1° |
| C40 | C3 | C2 | H3 | 137.7° | 0.0° |
| C40 | C3 | C2 | H4 | 3.4° | 145.1° |
| C3 | C40 | H33 | H34 | 120.0° | 120.1° |
| C3 | C40 | H33 | H35 | 120.0° | 120.0° |
| C3 | C40 | H34 | H35 | 120.0° | 120.0° |
| C18 | C19 | C20 | H15 | 118.7° | 118.8° |
| C18 | C19 | C20 | H16 | 118.7° | 118.9° |
| C18 | C19 | C20 | O41 | 58.6° | 110.1° |
| C18 | C19 | H15 | H16 | 123.7° | 122.2° |
| C18 | C19 | C20 | H17 | 170.4° | 128.5° |
| N7 | S4 | C3 | O6 | 125.5° | 111.6° |
| N7 | S4 | C3 | C1 | 156.8° | 180.0° |
| N7 | S4 | C3 | C2 | 90.0° | 111.3° |
| S4 | C3 | C1 | C2 | 100.1° | 107.5° |
| S4 | C3 | C1 | H1 | 150.4° | 0.0° |
| S4 | C3 | C1 | H2 | 9.4° | 145.0° |
| S4 | C3 | C2 | H3 | 1.7° | 145.0° |
| S4 | C3 | C2 | H4 | 139.4° | 0.1° |
| C3 | S4 | N7 | H5 | 7.7° | 115.0° |
| S4 | C3 | C40 | H33 | 180.0° | 154.3° |
| S4 | C3 | C40 | H34 | 60.0° | 34.3° |
| S4 | C3 | C40 | H35 | 60.0° | 85.7° |
| O6 | S4 | C3 | C1 | 31.3° | 68.4° |
| O6 | S4 | C3 | C2 | 35.4° | 137.0° |
| O6 | S4 | N7 | H5 | 118.0° | 1.0° |
| C19 | C20 | O41 | H17 | 130.2° | 121.4° |
| C19 | C20 | O41 | C42 | 88.3° | 155.7° |
| C20 | C19 | C18 | H14 | 84.1° | 99.1° |
| C20 | C19 | H15 | H16 | 123.7° | 122.3° |
| C19 | C20 | C21 | H18 | 163.8° | 124.1° |
| C19 | C20 | C21 | H19 | 73.5° | 114.9° |
| C20 | O41 | C42 | C43 | 0.5° | 5.5° |
| C20 | O41 | C42 | C47 | 179.6° | 174.2° |
| O41 | C20 | C19 | H15 | 177.3° | 131.1° |
| O41 | C20 | C19 | H16 | 60.1° | 8.8° |
| O41 | C20 | C21 | H18 | 47.9° | 116.7° |
| O41 | C20 | C21 | H19 | 170.7° | 4.3° |
| C3 | C1 | C2 | H1 | 109.4° | 107.5° |
| C3 | C1 | C2 | H2 | 109.4° | 107.5° |
| C3 | C1 | H1 | H2 | 144.7° | 145.6° |
| C1 | C3 | C2 | H3 | 109.4° | 107.5° |
| C1 | C3 | C2 | H4 | 109.4° | 107.4° |
| C1 | C3 | C40 | H33 | 28.1° | 59.9° |
| C1 | C3 | C40 | H34 | 148.1° | 180.0° |
| C1 | C3 | C40 | H35 | 91.9° | 60.0° |
| C3 | C2 | H3 | H4 | 144.8° | 145.8° |
| C2 | C3 | C40 | H33 | 44.3° | 8.7° |
| C2 | C3 | C40 | H34 | 75.7° | 111.3° |
| C2 | C3 | C40 | H35 | 164.3° | 128.7° |
| O41 | C42 | C43 | C47 | 179.9° | 179.7° |
| O41 | C42 | C47 | C48 | 0.2° | 0.0° |
| O41 | C42 | C43 | C44 | 179.8° | 180.0° |
| O41 | C42 | C47 | C46 | 179.5° | 179.7° |
| C42 | O41 | C20 | H17 | 42.0° | 34.3° |
| O41 | C42 | C43 | H36 | 0.1° | 0.0° |
| C2 | C1 | H1 | H2 | 144.8° | 145.7° |
| C1 | C2 | H3 | H4 | 144.7° | 145.6° |
| C43 | C42 | C47 | C48 | 180.0° | 179.8° |
| C42 | C43 | C44 | H36 | 180.0° | 180.0° |
| C43 | C42 | C47 | C46 | 0.6° | 0.6° |
| C42 | C43 | C44 | N45 | 0.1° | 0.0° |
| C42 | C43 | C44 | O52 | 180.0° | 180.0° |
| C42 | C47 | C48 | C46 | 179.4° | 179.7° |
| C42 | C47 | C48 | C49 | 179.8° | 180.0° |
| C47 | C42 | C43 | C44 | 0.3° | 0.3° |
| C42 | C47 | C46 | N45 | 0.5° | 0.6° |
| C42 | C47 | C46 | C51 | 179.9° | 179.7° |
| C47 | C42 | C43 | H36 | 179.8° | 179.7° |
| C42 | C47 | C48 | H37 | 0.2° | 0.1° |
| C47 | C48 | C49 | H37 | 180.0° | 179.9° |
| C47 | C48 | C49 | C50 | 0.5° | 0.0° |
| C48 | C47 | C46 | N45 | 179.9° | 179.7° |
| C48 | C47 | C46 | C51 | 0.7° | 0.0° |
| C47 | C48 | C49 | H38 | 179.5° | 180.0° |
| C49 | C48 | C47 | C46 | 0.8° | 0.3° |
| C48 | C49 | C50 | H38 | 180.0° | 179.9° |
| C48 | C49 | C50 | C51 | 0.2° | 0.7° |
| C48 | C49 | C50 | O56 | 179.3° | 180.0° |
| C43 | C44 | N45 | C46 | 0.3° | 0.0° |
| C43 | C44 | N45 | O52 | 179.9° | 180.0° |
| C43 | C44 | O52 | C53 | 170.1° | 180.0° |
| C47 | C46 | N45 | C51 | 179.4° | 179.7° |
| C47 | C46 | N45 | C44 | 0.1° | 0.3° |
| C47 | C46 | C51 | C50 | 0.3° | 0.6° |
| C47 | C46 | C51 | C58 | 179.7° | 179.8° |
| C46 | C47 | C48 | H37 | 179.2° | 179.7° |
| C49 | C50 | C51 | C46 | 0.1° | 0.9° |
| C49 | C50 | C51 | O56 | 179.5° | 179.4° |
| C49 | C50 | O56 | C57 | 28.1° | 0.0° |
| C49 | C50 | C51 | C58 | 179.9° | 179.9° |
| C50 | C49 | C48 | H37 | 179.5° | 179.9° |
| C46 | N45 | C44 | O52 | 179.9° | 180.0° |
| N45 | C46 | C51 | C50 | 179.8° | 179.1° |
| N45 | C46 | C51 | C58 | 0.2° | 0.1° |
| C51 | C46 | N45 | C44 | 179.5° | 180.0° |
| C46 | C51 | C50 | C58 | 180.0° | 179.2° |
| C46 | C51 | C50 | O56 | 179.4° | 179.7° |
| C46 | C51 | C58 | H49 | 90.0° | 90.0° |
| C46 | C51 | C58 | H50 | 150.0° | 150.0° |
| C46 | C51 | C58 | H51 | 30.0° | 29.9° |
| N45 | C44 | O52 | C53 | 10.0° | 0.0° |
| N45 | C44 | C43 | H36 | 179.8° | 180.0° |
| C44 | O52 | C53 | C55 | 73.8° | 150.0° |
| C44 | O52 | C53 | C54 | 156.0° | 90.0° |
| O52 | C44 | C43 | H36 | 0.1° | 0.0° |
| C44 | O52 | C53 | H39 | 41.4° | 30.0° |
| C51 | C50 | O56 | C57 | 152.5° | 179.4° |
| C51 | C50 | C49 | H38 | 179.8° | 179.4° |
| C50 | C51 | C58 | H49 | 90.0° | 89.2° |
| C50 | C51 | C58 | H50 | 30.0° | 30.9° |
| C50 | C51 | C58 | H51 | 150.0° | 150.9° |
| O56 | C50 | C51 | C58 | 0.6° | 0.5° |
| O56 | C50 | C49 | H38 | 0.7° | 0.0° |
| C50 | O56 | C57 | H46 | 180.0° | 60.0° |
| C50 | O56 | C57 | H47 | 60.0° | 60.0° |
| C50 | O56 | C57 | H48 | 60.0° | 180.0° |
| O56 | C57 | H46 | H47 | 120.0° | 120.0° |
| O56 | C57 | H46 | H48 | 120.0° | 120.0° |
| O56 | C57 | H47 | H48 | 120.0° | 120.0° |
| C51 | C58 | H49 | H50 | 120.0° | 120.0° |
| C51 | C58 | H49 | H51 | 120.0° | 119.9° |
| C51 | C58 | H50 | H51 | 120.0° | 120.0° |
| O52 | C53 | C55 | C54 | 130.0° | 120.0° |
| O52 | C53 | C55 | H39 | 115.9° | 120.0° |
| O52 | C53 | C54 | H39 | 115.6° | 120.0° |
| O52 | C53 | C54 | H40 | 180.0° | 179.9° |
| O52 | C53 | C54 | H41 | 60.0° | 60.0° |
| O52 | C53 | C54 | H42 | 60.0° | 60.0° |
| O52 | C53 | C55 | H43 | 180.0° | 60.0° |
| O52 | C53 | C55 | H44 | 60.0° | 180.0° |
| O52 | C53 | C55 | H45 | 60.0° | 60.1° |
| C55 | C53 | C54 | H39 | 114.3° | 120.0° |
| C55 | C53 | C54 | H40 | 49.9° | 60.0° |
| C55 | C53 | C54 | H41 | 70.1° | 180.0° |
| C55 | C53 | C54 | H42 | 170.0° | 60.0° |
| C53 | C55 | H43 | H44 | 120.0° | 120.0° |
| C53 | C55 | H43 | H45 | 120.0° | 120.1° |
| C53 | C55 | H44 | H45 | 120.0° | 120.0° |
| C53 | C54 | H40 | H41 | 120.0° | 120.0° |
| C53 | C54 | H40 | H42 | 120.0° | 120.1° |
| C53 | C54 | H41 | H42 | 120.0° | 120.0° |
| C54 | C53 | C55 | H43 | 50.0° | 180.0° |
| C54 | C53 | C55 | H44 | 170.0° | 60.0° |
| C54 | C53 | C55 | H45 | 70.0° | 59.9° |
| H1 | C1 | C2 | H3 | 141.1° | 145.0° |
| H1 | C1 | C2 | H4 | 0.1° | 0.0° |
| H2 | C1 | C2 | H3 | 0.0° | 0.0° |
| H2 | C1 | C2 | H4 | 141.1° | 145.0° |
| H6 | C11 | C12 | H8 | 142.7° | 0.5° |
| H7 | C11 | C12 | H8 | 1.9° | 145.5° |
| H8 | C12 | C13 | H9 | 154.0° | 125.8° |
| H8 | C12 | C13 | H10 | 88.5° | 114.2° |
| H9 | C13 | C14 | H11 | 30.7° | 69.4° |
| H9 | C13 | C14 | H12 | 147.3° | 50.4° |
| H10 | C13 | C14 | H11 | 86.8° | 170.6° |
| H10 | C13 | C14 | H12 | 29.8° | 69.5° |
| H11 | C14 | C30 | H26 | 88.1° | 57.5° |
| H12 | C14 | C30 | H26 | 155.3° | 177.3° |
| H14 | C18 | C19 | H15 | 157.2° | 142.0° |
| H14 | C18 | C19 | H16 | 34.6° | 19.8° |
| H15 | C19 | C20 | H17 | 51.7° | 9.7° |
| H16 | C19 | C20 | H17 | 70.8° | 112.6° |
| H17 | C20 | C21 | H18 | 74.4° | 4.8° |
| H17 | C20 | C21 | H19 | 48.4° | 125.8° |
| H20 | C25 | C26 | H21 | 111.0° | 119.7° |
| H20 | C25 | N31 | H27 | 161.3° | 145.8° |
| H21 | C26 | C27 | H22 | 161.9° | 176.0° |
| H22 | C27 | C28 | H23 | 140.5° | 81.1° |
| H22 | C27 | C28 | H24 | 22.7° | 158.9° |
| H23 | C28 | C29 | H25 | 11.5° | 6.6° |
| H24 | C28 | C29 | H25 | 106.3° | 113.4° |
| H25 | C29 | C30 | H26 | 179.9° | 179.8° |
| H28 | C37 | C38 | H29 | 0.1° | 0.0° |
| H30 | C39 | H31 | H32 | 120.0° | 120.0° |
| H33 | C40 | H34 | H35 | 120.0° | 119.9° |
| H37 | C48 | C49 | H38 | 0.5° | 0.0° |
| H39 | C53 | C54 | H40 | 64.4° | 60.0° |
| H39 | C53 | C54 | H41 | 175.6° | 60.0° |
| H39 | C53 | C54 | H42 | 55.6° | 180.0° |
| H39 | C53 | C55 | H43 | 64.1° | 60.0° |
| H39 | C53 | C55 | H44 | 56.0° | 60.0° |
| H39 | C53 | C55 | H45 | 176.0° | 180.0° |
| H40 | C54 | H41 | H42 | 120.0° | 119.9° |
| H43 | C55 | H44 | H45 | 120.0° | 120.0° |
| H46 | C57 | H47 | H48 | 120.0° | 120.0° |
| H49 | C58 | H50 | H51 | 120.0° | 120.0° |
