2AJ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C22 | C23 | doub | 1.38Å | 1.40Å | Aromatic |
| C22 | C21 | sing | 1.38Å | 1.41Å | Aromatic |
| C23 | C24 | sing | 1.38Å | 1.41Å | Aromatic |
| N1 | C25 | sing | 1.47Å | 1.44Å | |
| C21 | C20 | doub | 1.38Å | 1.43Å | Aromatic |
| C24 | C25 | sing | 1.51Å | 1.49Å | |
| C24 | C26 | doub | 1.38Å | 1.37Å | Aromatic |
| C20 | C26 | sing | 1.38Å | 1.37Å | Aromatic |
| C20 | C17 | sing | 1.51Å | 1.49Å | |
| C17 | C18 | sing | 1.53Å | 1.55Å | |
| C17 | C16 | sing | 1.53Å | 1.52Å | |
| C18 | C19 | sing | 1.53Å | 1.54Å | |
| C16 | C15 | sing | 1.53Å | 1.53Å | |
| C19 | N | sing | 1.47Å | 1.46Å | |
| C15 | N | sing | 1.47Å | 1.50Å | |
| N | C14 | sing | 1.35Å | 1.33Å | |
| C14 | O2 | doub | 1.22Å | 1.24Å | |
| C14 | C11 | sing | 1.48Å | 1.51Å | |
| C2 | SI1 | sing | 1.86Å | 1.90Å | |
| C11 | C12 | doub | 1.39Å | 1.42Å | Aromatic |
| C11 | C10 | sing | 1.40Å | 1.40Å | Aromatic |
| C1 | SI1 | sing | 1.86Å | 1.86Å | |
| C12 | C13 | sing | 1.39Å | 1.41Å | Aromatic |
| C10 | C9 | doub | 1.36Å | 1.38Å | Aromatic |
| SI1 | O | sing | 1.63Å | 1.56Å | |
| SI1 | C27 | sing | 1.87Å | 1.90Å | |
| O | SI3 | sing | 1.63Å | 1.60Å | |
| C13 | C8 | doub | 1.41Å | 1.43Å | Aromatic |
| C13 | C6 | sing | 1.47Å | 1.41Å | Aromatic |
| C9 | C8 | sing | 1.39Å | 1.37Å | Aromatic |
| C5 | SI3 | sing | 1.86Å | 1.83Å | |
| C8 | O1 | sing | 1.35Å | 1.31Å | Aromatic |
| C27 | C28 | doub | 1.34Å | 1.39Å | Aromatic |
| C27 | C34 | sing | 1.47Å | 1.39Å | Aromatic |
| SI3 | C6 | sing | 1.87Å | 1.88Å | |
| SI3 | C4 | sing | 1.86Å | 1.86Å | |
| C6 | C7 | doub | 1.34Å | 1.38Å | Aromatic |
| C28 | O3 | sing | 1.34Å | 1.35Å | Aromatic |
| C34 | C33 | doub | 1.39Å | 1.40Å | Aromatic |
| C34 | C29 | sing | 1.41Å | 1.39Å | Aromatic |
| C33 | C32 | sing | 1.39Å | 1.40Å | Aromatic |
| O1 | C7 | sing | 1.34Å | 1.40Å | Aromatic |
| O4 | C35 | doub | 1.22Å | 1.21Å | |
| O3 | C29 | sing | 1.35Å | 1.33Å | Aromatic |
| C29 | C30 | doub | 1.39Å | 1.38Å | Aromatic |
| C32 | C35 | sing | 1.48Å | 1.52Å | |
| C32 | C31 | doub | 1.40Å | 1.40Å | Aromatic |
| C35 | N2 | sing | 1.35Å | 1.33Å | |
| C36 | N2 | sing | 1.47Å | 1.46Å | |
| C36 | C37 | sing | 1.54Å | 1.52Å | |
| N2 | C40 | sing | 1.47Å | 1.48Å | |
| C30 | C31 | sing | 1.36Å | 1.41Å | Aromatic |
| C40 | C39 | sing | 1.53Å | 1.52Å | |
| C37 | C38 | sing | 1.53Å | 1.54Å | |
| C39 | C38 | sing | 1.53Å | 1.55Å | |
| C38 | C41 | sing | 1.51Å | 1.50Å | |
| C41 | C47 | doub | 1.38Å | 1.39Å | Aromatic |
| C41 | C42 | sing | 1.38Å | 1.39Å | Aromatic |
| C47 | C45 | sing | 1.38Å | 1.40Å | Aromatic |
| C42 | C43 | doub | 1.38Å | 1.39Å | Aromatic |
| N3 | C46 | sing | 1.47Å | 1.42Å | |
| C45 | C46 | sing | 1.51Å | 1.51Å | |
| C45 | C44 | doub | 1.38Å | 1.39Å | Aromatic |
| C43 | C44 | sing | 1.38Å | 1.38Å | Aromatic |
| C40 | H1 | sing | 1.09Å | 1.10Å | |
| C40 | H2 | sing | 1.09Å | 1.10Å | |
| C39 | H3 | sing | 1.09Å | 1.10Å | |
| C39 | H4 | sing | 1.09Å | 1.10Å | |
| C38 | H5 | sing | 1.09Å | 1.10Å | |
| C47 | H6 | sing | 1.08Å | 1.08Å | |
| C46 | H7 | sing | 1.09Å | 1.10Å | |
| C46 | H8 | sing | 1.09Å | 1.10Å | |
| N3 | H9 | sing | 1.01Å | 1.00Å | |
| N3 | H10 | sing | 1.01Å | 1.00Å | |
| C44 | H12 | sing | 1.08Å | 1.08Å | |
| C43 | H13 | sing | 1.08Å | 1.08Å | |
| C42 | H14 | sing | 1.08Å | 1.08Å | |
| C37 | H15 | sing | 1.09Å | 1.10Å | |
| C37 | H16 | sing | 1.09Å | 1.10Å | |
| C36 | H17 | sing | 1.09Å | 1.10Å | |
| C36 | H18 | sing | 1.09Å | 1.10Å | |
| C31 | H19 | sing | 1.08Å | 1.08Å | |
| C30 | H20 | sing | 1.08Å | 1.08Å | |
| C33 | H21 | sing | 1.08Å | 1.08Å | |
| C28 | H22 | sing | 1.08Å | 1.08Å | |
| C1 | H23 | sing | 1.09Å | 1.10Å | |
| C1 | H24 | sing | 1.09Å | 1.10Å | |
| C1 | H25 | sing | 1.09Å | 1.10Å | |
| C2 | H26 | sing | 1.09Å | 1.10Å | |
| C2 | H27 | sing | 1.09Å | 1.10Å | |
| C2 | H28 | sing | 1.09Å | 1.10Å | |
| C4 | H29 | sing | 1.09Å | 1.10Å | |
| C4 | H30 | sing | 1.09Å | 1.10Å | |
| C4 | H31 | sing | 1.09Å | 1.10Å | |
| C5 | H32 | sing | 1.09Å | 1.10Å | |
| C5 | H33 | sing | 1.09Å | 1.10Å | |
| C5 | H34 | sing | 1.09Å | 1.10Å | |
| C7 | H35 | sing | 1.08Å | 1.08Å | |
| C12 | H36 | sing | 1.08Å | 1.08Å | |
| C10 | H37 | sing | 1.08Å | 1.08Å | |
| C9 | H38 | sing | 1.08Å | 1.08Å | |
| C19 | H39 | sing | 1.09Å | 1.10Å | |
| C19 | H40 | sing | 1.09Å | 1.10Å | |
| C18 | H41 | sing | 1.09Å | 1.10Å | |
| C18 | H42 | sing | 1.09Å | 1.10Å | |
| C17 | H43 | sing | 1.09Å | 1.10Å | |
| C16 | H44 | sing | 1.09Å | 1.10Å | |
| C16 | H45 | sing | 1.09Å | 1.10Å | |
| C15 | H46 | sing | 1.09Å | 1.10Å | |
| C15 | H47 | sing | 1.09Å | 1.10Å | |
| C26 | H48 | sing | 1.08Å | 1.08Å | |
| C25 | H49 | sing | 1.09Å | 1.10Å | |
| C25 | H50 | sing | 1.09Å | 1.10Å | |
| N1 | H51 | sing | 1.01Å | 1.00Å | |
| N1 | H52 | sing | 1.01Å | 1.00Å | |
| C23 | H54 | sing | 1.08Å | 1.08Å | |
| C22 | H55 | sing | 1.08Å | 1.08Å | |
| C21 | H56 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C23 | C22 | C21 | 118.6° | 120.0° |
| C22 | C23 | C24 | 119.4° | 120.0° |
| C22 | C23 | H54 | 120.3° | 119.9° |
| C23 | C22 | H55 | 120.7° | 120.0° |
| C22 | C21 | C20 | 120.1° | 120.0° |
| C21 | C22 | H55 | 120.7° | 120.0° |
| C22 | C21 | H56 | 119.9° | 120.0° |
| C23 | C24 | C25 | 118.0° | 120.0° |
| C23 | C24 | C26 | 122.1° | 120.0° |
| C24 | C23 | H54 | 120.3° | 120.0° |
| N1 | C25 | C24 | 112.0° | 109.5° |
| N1 | C25 | H49 | 108.8° | 109.5° |
| N1 | C25 | H50 | 108.8° | 109.5° |
| C25 | N1 | H51 | 109.5° | 111.0° |
| C25 | N1 | H52 | 109.5° | 111.0° |
| C21 | C20 | C26 | 119.8° | 120.0° |
| C21 | C20 | C17 | 118.0° | 120.0° |
| C20 | C21 | H56 | 119.9° | 120.0° |
| C25 | C24 | C26 | 119.9° | 120.0° |
| C24 | C25 | H49 | 108.9° | 109.4° |
| C24 | C25 | H50 | 108.8° | 109.4° |
| C24 | C26 | C20 | 119.9° | 120.0° |
| C24 | C26 | H48 | 120.1° | 120.0° |
| C26 | C20 | C17 | 122.1° | 120.0° |
| C20 | C26 | H48 | 120.0° | 120.0° |
| C20 | C17 | C18 | 114.0° | 109.5° |
| C20 | C17 | C16 | 111.6° | 109.5° |
| C20 | C17 | H43 | 106.9° | 109.4° |
| C18 | C17 | C16 | 111.2° | 109.6° |
| C17 | C18 | C19 | 105.8° | 109.3° |
| C17 | C18 | H41 | 110.4° | 109.6° |
| C17 | C18 | H42 | 110.4° | 109.5° |
| C18 | C17 | H43 | 106.2° | 109.4° |
| C17 | C16 | C15 | 115.4° | 109.4° |
| C16 | C17 | H43 | 106.5° | 109.5° |
| C17 | C16 | H44 | 107.9° | 109.5° |
| C17 | C16 | H45 | 107.9° | 109.5° |
| C18 | C19 | N | 110.7° | 108.8° |
| C18 | C19 | H39 | 109.2° | 109.6° |
| C18 | C19 | H40 | 109.2° | 109.7° |
| C19 | C18 | H41 | 110.4° | 109.5° |
| C19 | C18 | H42 | 110.4° | 109.5° |
| C16 | C15 | N | 100.1° | 109.0° |
| C15 | C16 | H44 | 108.0° | 109.6° |
| C15 | C16 | H45 | 108.0° | 109.4° |
| C16 | C15 | H46 | 111.7° | 109.6° |
| C16 | C15 | H47 | 111.7° | 109.6° |
| C19 | N | C15 | 112.3° | 118.7° |
| C19 | N | C14 | 124.4° | 120.7° |
| N | C19 | H39 | 109.2° | 109.6° |
| N | C19 | H40 | 109.2° | 109.6° |
| C15 | N | C14 | 123.2° | 120.6° |
| N | C15 | H46 | 111.8° | 109.7° |
| N | C15 | H47 | 111.8° | 109.2° |
| N | C14 | O2 | 121.1° | 120.0° |
| N | C14 | C11 | 122.0° | 120.0° |
| O2 | C14 | C11 | 116.9° | 120.0° |
| C14 | C11 | C12 | 124.4° | 120.1° |
| C14 | C11 | C10 | 114.6° | 120.0° |
| C2 | SI1 | C1 | 102.0° | 109.5° |
| C2 | SI1 | O | 115.3° | 109.5° |
| C2 | SI1 | C27 | 108.0° | 109.5° |
| SI1 | C2 | H26 | 109.5° | 109.4° |
| SI1 | C2 | H27 | 109.5° | 109.5° |
| SI1 | C2 | H28 | 109.5° | 109.5° |
| C12 | C11 | C10 | 121.0° | 119.9° |
| C11 | C12 | C13 | 116.5° | 119.4° |
| C11 | C12 | H36 | 121.8° | 120.3° |
| C11 | C10 | C9 | 122.7° | 120.7° |
| C11 | C10 | H37 | 118.6° | 119.6° |
| C1 | SI1 | O | 109.8° | 109.5° |
| C1 | SI1 | C27 | 109.2° | 109.5° |
| SI1 | C1 | H23 | 109.5° | 109.5° |
| SI1 | C1 | H24 | 109.5° | 109.5° |
| SI1 | C1 | H25 | 109.5° | 109.4° |
| C12 | C13 | C8 | 120.1° | 120.2° |
| C12 | C13 | C6 | 134.5° | 134.3° |
| C13 | C12 | H36 | 121.8° | 120.3° |
| C10 | C9 | C8 | 116.8° | 120.3° |
| C9 | C10 | H37 | 118.7° | 119.7° |
| C10 | C9 | H38 | 121.6° | 119.9° |
| O | SI1 | C27 | 112.0° | 109.4° |
| SI1 | O | SI3 | 144.6° | 114.1° |
| SI1 | C27 | C28 | 120.3° | 126.9° |
| SI1 | C27 | C34 | 134.1° | 126.9° |
| O | SI3 | C5 | 113.7° | 109.4° |
| O | SI3 | C6 | 104.0° | 109.5° |
| O | SI3 | C4 | 102.0° | 109.5° |
| C8 | C13 | C6 | 105.4° | 105.5° |
| C13 | C8 | C9 | 122.9° | 119.5° |
| C13 | C8 | O1 | 112.4° | 107.2° |
| C13 | C6 | SI3 | 133.9° | 127.0° |
| C13 | C6 | C7 | 105.3° | 106.1° |
| C9 | C8 | O1 | 124.7° | 133.3° |
| C8 | C9 | H38 | 121.6° | 119.8° |
| C5 | SI3 | C6 | 105.2° | 109.5° |
| C5 | SI3 | C4 | 116.3° | 109.5° |
| SI3 | C5 | H32 | 109.5° | 109.5° |
| SI3 | C5 | H33 | 109.5° | 109.5° |
| SI3 | C5 | H34 | 109.5° | 109.5° |
| C8 | O1 | C7 | 104.7° | 111.0° |
| C28 | C27 | C34 | 105.0° | 106.2° |
| C27 | C28 | O3 | 110.6° | 110.2° |
| C27 | C28 | H22 | 124.7° | 124.9° |
| C27 | C34 | C33 | 134.1° | 134.3° |
| C27 | C34 | C29 | 107.0° | 105.5° |
| C6 | SI3 | C4 | 115.3° | 109.5° |
| SI3 | C6 | C7 | 120.7° | 126.9° |
| SI3 | C4 | H29 | 109.5° | 109.4° |
| SI3 | C4 | H30 | 109.5° | 109.5° |
| SI3 | C4 | H31 | 109.5° | 109.5° |
| C6 | C7 | O1 | 112.2° | 110.2° |
| C6 | C7 | H35 | 123.9° | 124.8° |
| C28 | O3 | C29 | 107.3° | 111.0° |
| O3 | C28 | H22 | 124.7° | 124.9° |
| C33 | C34 | C29 | 118.8° | 120.2° |
| C34 | C33 | C32 | 119.7° | 119.4° |
| C34 | C33 | H21 | 120.1° | 120.3° |
| C34 | C29 | O3 | 110.0° | 107.2° |
| C34 | C29 | C30 | 122.8° | 119.5° |
| C33 | C32 | C35 | 120.6° | 120.0° |
| C33 | C32 | C31 | 120.5° | 119.9° |
| C32 | C33 | H21 | 120.2° | 120.3° |
| O1 | C7 | H35 | 123.9° | 125.0° |
| O4 | C35 | C32 | 116.7° | 120.0° |
| O4 | C35 | N2 | 120.5° | 120.0° |
| O3 | C29 | C30 | 127.2° | 133.3° |
| C29 | C30 | C31 | 118.3° | 120.3° |
| C29 | C30 | H20 | 120.9° | 119.9° |
| C35 | C32 | C31 | 118.9° | 120.0° |
| C32 | C35 | N2 | 122.6° | 120.0° |
| C32 | C31 | C30 | 119.9° | 120.7° |
| C32 | C31 | H19 | 120.1° | 119.7° |
| C35 | N2 | C36 | 122.3° | 120.6° |
| C35 | N2 | C40 | 122.8° | 120.6° |
| N2 | C36 | C37 | 105.1° | 108.5° |
| C36 | N2 | C40 | 114.8° | 118.8° |
| N2 | C36 | H17 | 110.6° | 109.6° |
| N2 | C36 | H18 | 110.6° | 109.6° |
| C36 | C37 | C38 | 112.7° | 109.3° |
| C36 | C37 | H15 | 108.7° | 109.6° |
| C36 | C37 | H16 | 108.7° | 109.5° |
| C37 | C36 | H17 | 110.6° | 109.7° |
| C37 | C36 | H18 | 110.5° | 109.7° |
| N2 | C40 | C39 | 108.3° | 108.7° |
| N2 | C40 | H1 | 109.7° | 109.6° |
| N2 | C40 | H2 | 109.8° | 109.6° |
| C30 | C31 | H19 | 120.0° | 119.7° |
| C31 | C30 | H20 | 120.9° | 119.8° |
| C40 | C39 | C38 | 108.2° | 109.3° |
| C39 | C40 | H1 | 109.8° | 109.6° |
| C39 | C40 | H2 | 109.8° | 109.6° |
| C40 | C39 | H3 | 109.8° | 109.5° |
| C40 | C39 | H4 | 109.8° | 109.5° |
| C37 | C38 | C39 | 110.4° | 109.5° |
| C37 | C38 | C41 | 112.2° | 109.5° |
| C37 | C38 | H5 | 107.9° | 109.4° |
| C38 | C37 | H15 | 108.7° | 109.5° |
| C38 | C37 | H16 | 108.7° | 109.5° |
| C39 | C38 | C41 | 110.0° | 109.5° |
| C38 | C39 | H3 | 109.8° | 109.5° |
| C38 | C39 | H4 | 109.8° | 109.5° |
| C39 | C38 | H5 | 107.8° | 109.4° |
| C38 | C41 | C47 | 125.4° | 120.0° |
| C38 | C41 | C42 | 117.7° | 120.0° |
| C41 | C38 | H5 | 108.4° | 109.5° |
| C47 | C41 | C42 | 117.0° | 120.0° |
| C41 | C47 | C45 | 123.2° | 119.9° |
| C41 | C47 | H6 | 118.4° | 120.0° |
| C41 | C42 | C43 | 119.1° | 120.0° |
| C41 | C42 | H14 | 120.4° | 120.0° |
| C47 | C45 | C46 | 122.0° | 119.9° |
| C47 | C45 | C44 | 119.7° | 120.1° |
| C45 | C47 | H6 | 118.4° | 120.1° |
| C42 | C43 | C44 | 124.2° | 120.0° |
| C42 | C43 | H13 | 117.9° | 120.0° |
| C43 | C42 | H14 | 120.4° | 120.0° |
| N3 | C46 | C45 | 110.9° | 109.4° |
| N3 | C46 | H7 | 109.1° | 109.5° |
| N3 | C46 | H8 | 109.1° | 109.4° |
| C46 | N3 | H9 | 109.5° | 111.0° |
| C46 | N3 | H10 | 109.5° | 111.0° |
| C46 | C45 | C44 | 118.2° | 120.0° |
| C45 | C46 | H7 | 109.1° | 109.5° |
| C45 | C46 | H8 | 109.1° | 109.5° |
| C45 | C44 | C43 | 116.6° | 120.0° |
| C45 | C44 | H12 | 121.7° | 120.0° |
| C43 | C44 | H12 | 121.7° | 120.0° |
| C44 | C43 | H13 | 117.9° | 120.0° |
| H1 | C40 | H2 | 109.5° | 109.7° |
| H3 | C39 | H4 | 109.5° | 109.5° |
| H7 | C46 | H8 | 109.5° | 109.5° |
| H9 | N3 | H10 | 109.4° | 111.0° |
| H15 | C37 | H16 | 109.5° | 109.5° |
| H17 | C36 | H18 | 109.5° | 109.7° |
| H23 | C1 | H24 | 109.5° | 109.5° |
| H23 | C1 | H25 | 109.4° | 109.5° |
| H24 | C1 | H25 | 109.5° | 109.5° |
| H26 | C2 | H27 | 109.5° | 109.5° |
| H26 | C2 | H28 | 109.4° | 109.5° |
| H27 | C2 | H28 | 109.4° | 109.5° |
| H29 | C4 | H30 | 109.5° | 109.5° |
| H29 | C4 | H31 | 109.5° | 109.5° |
| H30 | C4 | H31 | 109.4° | 109.5° |
| H32 | C5 | H33 | 109.5° | 109.4° |
| H32 | C5 | H34 | 109.5° | 109.5° |
| H33 | C5 | H34 | 109.5° | 109.5° |
| H39 | C19 | H40 | 109.5° | 109.6° |
| H41 | C18 | H42 | 109.5° | 109.5° |
| H44 | C16 | H45 | 109.5° | 109.5° |
| H46 | C15 | H47 | 109.5° | 109.7° |
| H49 | C25 | H50 | 109.4° | 109.4° |
| H51 | N1 | H52 | 109.5° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C23 | C22 | C21 | H55 | 180.0° | 179.7° |
| C22 | C23 | C24 | H54 | 180.0° | 180.0° |
| C23 | C22 | C21 | C20 | 1.7° | 0.6° |
| C22 | C23 | C24 | C25 | 179.0° | 180.0° |
| C22 | C23 | C24 | C26 | 0.1° | 0.0° |
| C23 | C22 | C21 | H56 | 178.3° | 180.0° |
| C21 | C22 | C23 | C24 | 0.6° | 0.3° |
| C22 | C21 | C20 | H56 | 180.0° | 179.3° |
| C22 | C21 | C20 | C26 | 2.3° | 0.6° |
| C22 | C21 | C20 | C17 | 179.4° | 179.7° |
| C21 | C22 | C23 | H54 | 179.4° | 179.7° |
| C23 | C24 | C25 | N1 | 115.4° | 89.9° |
| C23 | C24 | C25 | C26 | 178.9° | 179.9° |
| C23 | C24 | C26 | C20 | 0.6° | 0.1° |
| C23 | C24 | C26 | H48 | 179.4° | 180.0° |
| C23 | C24 | C25 | H49 | 5.0° | 30.1° |
| C23 | C24 | C25 | H50 | 124.2° | 150.0° |
| C24 | C23 | C22 | H55 | 179.4° | 180.0° |
| N1 | C25 | C24 | H49 | 120.4° | 120.0° |
| N1 | C25 | C24 | H50 | 120.4° | 120.0° |
| N1 | C25 | C24 | C26 | 65.7° | 90.0° |
| N1 | C25 | H49 | H50 | 118.8° | 120.1° |
| C25 | N1 | H51 | H52 | 120.0° | 123.9° |
| C21 | C20 | C26 | C24 | 1.7° | 0.3° |
| C21 | C20 | C26 | C17 | 177.0° | 179.7° |
| C21 | C20 | C17 | C18 | 141.5° | 59.7° |
| C21 | C20 | C17 | C16 | 91.6° | 60.4° |
| C21 | C20 | C17 | H43 | 24.5° | 179.6° |
| C21 | C20 | C26 | H48 | 178.3° | 179.7° |
| C20 | C21 | C22 | H55 | 178.3° | 179.7° |
| C25 | C24 | C26 | C20 | 179.5° | 180.0° |
| C25 | C24 | C26 | H48 | 0.5° | 0.0° |
| C24 | C25 | H49 | H50 | 118.8° | 119.9° |
| C24 | C25 | N1 | H51 | 180.0° | 56.0° |
| C24 | C25 | N1 | H52 | 60.0° | 180.0° |
| C25 | C24 | C23 | H54 | 1.0° | 0.0° |
| C24 | C26 | C20 | H48 | 180.0° | 180.0° |
| C24 | C26 | C20 | C17 | 178.7° | 180.0° |
| C26 | C24 | C25 | H49 | 173.9° | 150.0° |
| C26 | C24 | C25 | H50 | 54.7° | 30.0° |
| C26 | C24 | C23 | H54 | 179.9° | 180.0° |
| C26 | C20 | C17 | C18 | 41.5° | 120.0° |
| C26 | C20 | C17 | C16 | 85.5° | 119.9° |
| C26 | C20 | C17 | H43 | 158.5° | 0.1° |
| C26 | C20 | C21 | H56 | 177.7° | 180.0° |
| C20 | C17 | C18 | C16 | 127.1° | 120.0° |
| C20 | C17 | C18 | H43 | 117.4° | 119.9° |
| C20 | C17 | C16 | H43 | 116.3° | 120.0° |
| C20 | C17 | C18 | C19 | 177.3° | 178.6° |
| C20 | C17 | C16 | C15 | 174.0° | 178.7° |
| C20 | C17 | C18 | H41 | 57.9° | 58.6° |
| C20 | C17 | C18 | H42 | 63.3° | 61.5° |
| C20 | C17 | C16 | H44 | 53.1° | 58.6° |
| C20 | C17 | C16 | H45 | 65.1° | 61.4° |
| C17 | C20 | C26 | H48 | 1.3° | 0.0° |
| C17 | C20 | C21 | H56 | 0.6° | 0.4° |
| C18 | C17 | C16 | H43 | 115.2° | 120.0° |
| C17 | C18 | C19 | H41 | 119.4° | 120.0° |
| C17 | C18 | C19 | H42 | 119.4° | 119.9° |
| C18 | C17 | C16 | C15 | 57.5° | 61.2° |
| C17 | C18 | C19 | N | 56.9° | 54.6° |
| C17 | C18 | C19 | H39 | 177.1° | 65.2° |
| C17 | C18 | C19 | H40 | 63.2° | 174.4° |
| C17 | C18 | H41 | H42 | 121.7° | 120.1° |
| C18 | C17 | C16 | H44 | 178.4° | 178.7° |
| C18 | C17 | C16 | H45 | 63.3° | 58.6° |
| C16 | C17 | C18 | C19 | 50.2° | 61.3° |
| C17 | C16 | C15 | H44 | 120.9° | 120.0° |
| C17 | C16 | C15 | H45 | 120.8° | 119.9° |
| C17 | C16 | C15 | N | 60.2° | 54.4° |
| C16 | C17 | C18 | H41 | 69.2° | 178.7° |
| C16 | C17 | C18 | H42 | 169.6° | 58.6° |
| C17 | C16 | H44 | H45 | 117.2° | 120.1° |
| C17 | C16 | C15 | H46 | 58.3° | 174.4° |
| C17 | C16 | C15 | H47 | 178.6° | 65.1° |
| C18 | C19 | N | H39 | 120.2° | 119.8° |
| C18 | C19 | N | H40 | 120.2° | 119.9° |
| C18 | C19 | N | C15 | 70.5° | 53.3° |
| C18 | C19 | N | C14 | 108.2° | 126.3° |
| C18 | C19 | H39 | H40 | 119.5° | 120.4° |
| C19 | C18 | H41 | H42 | 121.7° | 120.1° |
| C19 | C18 | C17 | H43 | 65.3° | 58.7° |
| C16 | C15 | N | C19 | 66.1° | 53.3° |
| C16 | C15 | N | H46 | 118.5° | 120.0° |
| C16 | C15 | N | H47 | 118.5° | 119.7° |
| C16 | C15 | N | C14 | 112.7° | 126.4° |
| C15 | C16 | C17 | H43 | 57.7° | 58.8° |
| C15 | C16 | H44 | H45 | 117.3° | 120.0° |
| C16 | C15 | H46 | H47 | 124.4° | 120.4° |
| C19 | N | C15 | C14 | 178.8° | 179.7° |
| C19 | N | C14 | O2 | 14.8° | 173.6° |
| C19 | N | C14 | C11 | 167.3° | 6.5° |
| N | C19 | H39 | H40 | 119.4° | 120.3° |
| N | C19 | C18 | H41 | 62.5° | 174.6° |
| N | C19 | C18 | H42 | 176.4° | 65.3° |
| C19 | N | C15 | H46 | 52.4° | 173.3° |
| C19 | N | C15 | H47 | 175.5° | 66.5° |
| C15 | N | C14 | O2 | 163.8° | 6.1° |
| C15 | N | C14 | C11 | 14.1° | 173.9° |
| C15 | N | C19 | H39 | 169.3° | 66.5° |
| C15 | N | C19 | H40 | 49.7° | 173.3° |
| N | C15 | C16 | H44 | 179.0° | 174.4° |
| N | C15 | C16 | H45 | 60.7° | 65.5° |
| N | C15 | H46 | H47 | 124.4° | 120.0° |
| N | C14 | O2 | C11 | 178.0° | 180.0° |
| N | C14 | C11 | C12 | 60.8° | 140.9° |
| N | C14 | C11 | C10 | 118.4° | 39.1° |
| C14 | N | C19 | H39 | 12.0° | 113.9° |
| C14 | N | C19 | H40 | 131.6° | 6.4° |
| C14 | N | C15 | H46 | 128.9° | 6.4° |
| C14 | N | C15 | H47 | 5.8° | 113.9° |
| O2 | C14 | C11 | C12 | 121.2° | 39.1° |
| O2 | C14 | C11 | C10 | 59.6° | 140.9° |
| C14 | C11 | C12 | C10 | 179.2° | 180.0° |
| C14 | C11 | C12 | C13 | 177.6° | 180.0° |
| C14 | C11 | C10 | C9 | 177.7° | 180.0° |
| C14 | C11 | C12 | H36 | 2.4° | 0.1° |
| C14 | C11 | C10 | H37 | 2.3° | 0.0° |
| C2 | SI1 | C1 | O | 122.7° | 120.0° |
| C2 | SI1 | C1 | C27 | 114.2° | 120.0° |
| C2 | SI1 | O | C27 | 124.0° | 120.0° |
| C2 | SI1 | O | SI3 | 170.3° | 73.3° |
| C2 | SI1 | C27 | C28 | 57.9° | 27.6° |
| C2 | SI1 | C27 | C34 | 112.3° | 152.4° |
| C2 | SI1 | C1 | H23 | 180.0° | 175.1° |
| C2 | SI1 | C1 | H24 | 60.0° | 55.1° |
| C2 | SI1 | C1 | H25 | 60.0° | 64.9° |
| SI1 | C2 | H26 | H27 | 120.0° | 120.0° |
| SI1 | C2 | H26 | H28 | 120.0° | 120.0° |
| SI1 | C2 | H27 | H28 | 120.0° | 120.0° |
| C11 | C12 | C13 | H36 | 180.0° | 179.9° |
| C12 | C11 | C10 | C9 | 3.1° | 0.0° |
| C11 | C12 | C13 | C8 | 2.4° | 0.1° |
| C11 | C12 | C13 | C6 | 179.1° | 180.0° |
| C12 | C11 | C10 | H37 | 176.9° | 180.0° |
| C10 | C11 | C12 | C13 | 3.2° | 0.0° |
| C11 | C10 | C9 | H37 | 180.0° | 179.9° |
| C11 | C10 | C9 | C8 | 1.9° | 0.1° |
| C10 | C11 | C12 | H36 | 176.8° | 180.0° |
| C11 | C10 | C9 | H38 | 178.1° | 180.0° |
| C1 | SI1 | O | C27 | 121.5° | 120.0° |
| C1 | SI1 | O | SI3 | 55.9° | 166.7° |
| C1 | SI1 | C27 | C28 | 168.1° | 147.6° |
| C1 | SI1 | C27 | C34 | 2.1° | 32.4° |
| SI1 | C1 | H23 | H24 | 120.0° | 120.0° |
| SI1 | C1 | H23 | H25 | 120.0° | 120.0° |
| SI1 | C1 | H24 | H25 | 120.0° | 120.0° |
| C1 | SI1 | C2 | H26 | 180.0° | 61.4° |
| C1 | SI1 | C2 | H27 | 60.0° | 58.6° |
| C1 | SI1 | C2 | H28 | 60.0° | 178.6° |
| C12 | C13 | C8 | C6 | 177.5° | 179.9° |
| C12 | C13 | C8 | C9 | 1.5° | 0.0° |
| C12 | C13 | C8 | O1 | 178.5° | 180.0° |
| C12 | C13 | C6 | SI3 | 5.5° | 0.1° |
| C12 | C13 | C6 | C7 | 177.6° | 179.7° |
| C10 | C9 | C8 | C13 | 1.1° | 0.0° |
| C10 | C9 | C8 | H38 | 180.0° | 179.9° |
| C10 | C9 | C8 | O1 | 178.8° | 179.9° |
| SI1 | O | SI3 | C5 | 81.5° | 73.0° |
| O | SI1 | C27 | C28 | 70.1° | 92.3° |
| O | SI1 | C27 | C34 | 119.7° | 87.6° |
| SI1 | O | SI3 | C6 | 164.6° | 167.0° |
| SI1 | O | SI3 | C4 | 44.4° | 46.9° |
| O | SI1 | C1 | H23 | 57.3° | 64.9° |
| O | SI1 | C1 | H24 | 62.7° | 175.1° |
| O | SI1 | C1 | H25 | 177.3° | 55.1° |
| O | SI1 | C2 | H26 | 61.1° | 58.7° |
| O | SI1 | C2 | H27 | 178.9° | 178.7° |
| O | SI1 | C2 | H28 | 58.9° | 61.3° |
| C27 | SI1 | O | SI3 | 65.6° | 46.7° |
| SI1 | C27 | C28 | C34 | 172.7° | 180.0° |
| SI1 | C27 | C28 | O3 | 175.0° | 179.9° |
| SI1 | C27 | C34 | C33 | 9.9° | 0.0° |
| SI1 | C27 | C34 | C29 | 174.1° | 179.9° |
| SI1 | C27 | C28 | H22 | 5.0° | 0.0° |
| C27 | SI1 | C1 | H23 | 65.8° | 55.1° |
| C27 | SI1 | C1 | H24 | 174.2° | 64.9° |
| C27 | SI1 | C1 | H25 | 54.2° | 175.1° |
| C27 | SI1 | C2 | H26 | 65.0° | 178.6° |
| C27 | SI1 | C2 | H27 | 55.0° | 61.3° |
| C27 | SI1 | C2 | H28 | 175.0° | 58.7° |
| O | SI3 | C6 | C13 | 84.0° | 89.7° |
| O | SI3 | C5 | C6 | 113.2° | 120.0° |
| O | SI3 | C5 | C4 | 118.0° | 120.0° |
| O | SI3 | C6 | C4 | 110.8° | 120.0° |
| O | SI3 | C6 | C7 | 99.5° | 90.0° |
| O | SI3 | C4 | H29 | 180.0° | 72.0° |
| O | SI3 | C4 | H30 | 60.0° | 168.1° |
| O | SI3 | C4 | H31 | 60.0° | 48.0° |
| O | SI3 | C5 | H32 | 180.0° | 63.4° |
| O | SI3 | C5 | H33 | 60.0° | 176.7° |
| O | SI3 | C5 | H34 | 60.0° | 56.6° |
| C13 | C8 | C9 | O1 | 180.0° | 180.0° |
| C8 | C13 | C6 | SI3 | 177.5° | 180.0° |
| C8 | C13 | C6 | C7 | 0.6° | 0.2° |
| C13 | C8 | O1 | C7 | 0.8° | 0.3° |
| C8 | C13 | C12 | H36 | 177.6° | 180.0° |
| C13 | C8 | C9 | H38 | 178.9° | 179.9° |
| C6 | C13 | C8 | C9 | 179.0° | 180.0° |
| C13 | C6 | SI3 | C5 | 35.8° | 30.3° |
| C6 | C13 | C8 | O1 | 0.9° | 0.1° |
| C13 | C6 | SI3 | C7 | 176.5° | 179.7° |
| C13 | C6 | SI3 | C4 | 165.2° | 150.3° |
| C13 | C6 | C7 | O1 | 0.1° | 0.4° |
| C13 | C6 | C7 | H35 | 179.9° | 179.8° |
| C6 | C13 | C12 | H36 | 0.9° | 0.1° |
| C9 | C8 | O1 | C7 | 179.1° | 179.7° |
| C8 | C9 | C10 | H37 | 178.1° | 180.0° |
| C5 | SI3 | C6 | C4 | 129.4° | 120.0° |
| C5 | SI3 | C6 | C7 | 140.8° | 150.0° |
| C5 | SI3 | C4 | H29 | 55.8° | 48.0° |
| C5 | SI3 | C4 | H30 | 64.2° | 72.0° |
| C5 | SI3 | C4 | H31 | 175.8° | 168.0° |
| SI3 | C5 | H32 | H33 | 120.0° | 119.9° |
| SI3 | C5 | H32 | H34 | 120.0° | 120.0° |
| SI3 | C5 | H33 | H34 | 120.0° | 120.0° |
| C8 | O1 | C7 | C6 | 0.4° | 0.5° |
| C8 | O1 | C7 | H35 | 179.6° | 179.7° |
| O1 | C8 | C9 | H38 | 1.2° | 0.0° |
| C27 | C28 | O3 | H22 | 180.0° | 180.0° |
| C28 | C27 | C34 | C33 | 178.9° | 180.0° |
| C28 | C27 | C34 | C29 | 2.8° | 0.0° |
| C27 | C28 | O3 | C29 | 0.7° | 0.0° |
| C34 | C27 | C28 | O3 | 2.3° | 0.0° |
| C27 | C34 | C33 | C29 | 175.7° | 179.9° |
| C27 | C34 | C33 | C32 | 176.9° | 180.0° |
| C27 | C34 | C29 | O3 | 2.6° | 0.0° |
| C27 | C34 | C29 | C30 | 179.3° | 179.8° |
| C27 | C34 | C33 | H21 | 3.1° | 0.0° |
| C34 | C27 | C28 | H22 | 177.8° | 180.0° |
| SI3 | C6 | C7 | O1 | 177.5° | 179.8° |
| C6 | SI3 | C4 | H29 | 68.0° | 168.0° |
| C6 | SI3 | C4 | H30 | 172.0° | 48.0° |
| C6 | SI3 | C4 | H31 | 52.0° | 72.0° |
| C6 | SI3 | C5 | H32 | 66.9° | 56.6° |
| C6 | SI3 | C5 | H33 | 53.1° | 63.3° |
| C6 | SI3 | C5 | H34 | 173.2° | 176.6° |
| SI3 | C6 | C7 | H35 | 2.5° | 0.0° |
| C4 | SI3 | C6 | C7 | 11.3° | 30.0° |
| SI3 | C4 | H29 | H30 | 120.0° | 120.0° |
| SI3 | C4 | H29 | H31 | 120.0° | 120.0° |
| SI3 | C4 | H30 | H31 | 120.0° | 120.0° |
| C4 | SI3 | C5 | H32 | 62.0° | 176.6° |
| C4 | SI3 | C5 | H33 | 178.0° | 56.7° |
| C4 | SI3 | C5 | H34 | 58.0° | 63.4° |
| C6 | C7 | O1 | H35 | 180.0° | 179.8° |
| C28 | O3 | C29 | C34 | 1.2° | 0.0° |
| C28 | O3 | C29 | C30 | 179.2° | 179.8° |
| C34 | C33 | C32 | H21 | 180.0° | 179.9° |
| C33 | C34 | C29 | O3 | 179.3° | 180.0° |
| C33 | C34 | C29 | C30 | 2.5° | 0.2° |
| C34 | C33 | C32 | C35 | 177.5° | 180.0° |
| C34 | C33 | C32 | C31 | 0.7° | 0.3° |
| C29 | C34 | C33 | C32 | 1.2° | 0.1° |
| C34 | C29 | O3 | C30 | 178.1° | 179.8° |
| C34 | C29 | C30 | C31 | 1.8° | 0.2° |
| C34 | C29 | C30 | H20 | 178.2° | 179.8° |
| C29 | C34 | C33 | H21 | 178.8° | 180.0° |
| C33 | C32 | C35 | O4 | 113.6° | 37.3° |
| C33 | C32 | C35 | C31 | 176.9° | 179.7° |
| C33 | C32 | C35 | N2 | 71.0° | 142.4° |
| C33 | C32 | C31 | C30 | 1.4° | 0.3° |
| C33 | C32 | C31 | H19 | 178.7° | 179.7° |
| O4 | C35 | C32 | N2 | 175.4° | 179.7° |
| O4 | C35 | C32 | C31 | 63.2° | 143.0° |
| O4 | C35 | N2 | C36 | 11.9° | 5.9° |
| O4 | C35 | N2 | C40 | 164.2° | 174.5° |
| O3 | C29 | C30 | C31 | 179.6° | 180.0° |
| O3 | C29 | C30 | H20 | 0.4° | 0.0° |
| C29 | O3 | C28 | H22 | 179.3° | 180.0° |
| C29 | C30 | C31 | C32 | 0.2° | 0.1° |
| C29 | C30 | C31 | H20 | 180.0° | 180.0° |
| C29 | C30 | C31 | H19 | 179.9° | 180.0° |
| C32 | C35 | N2 | C36 | 172.8° | 174.4° |
| C32 | C35 | N2 | C40 | 11.0° | 5.3° |
| C35 | C32 | C31 | C30 | 178.2° | 180.0° |
| C35 | C32 | C31 | H19 | 1.8° | 0.0° |
| C35 | C32 | C33 | H21 | 2.5° | 0.1° |
| C31 | C32 | C35 | N2 | 112.2° | 37.3° |
| C32 | C31 | C30 | H19 | 180.0° | 180.0° |
| C32 | C31 | C30 | H20 | 179.8° | 180.0° |
| C31 | C32 | C33 | H21 | 179.3° | 179.7° |
| C35 | N2 | C36 | C40 | 176.4° | 179.7° |
| C35 | N2 | C36 | C37 | 113.0° | 126.4° |
| C35 | N2 | C40 | C39 | 110.1° | 126.4° |
| C35 | N2 | C40 | H1 | 9.7° | 6.7° |
| C35 | N2 | C40 | H2 | 130.1° | 113.8° |
| C35 | N2 | C36 | H17 | 127.7° | 113.8° |
| C35 | N2 | C36 | H18 | 6.3° | 6.6° |
| N2 | C36 | C37 | H17 | 119.3° | 119.7° |
| N2 | C36 | C37 | H18 | 119.3° | 119.8° |
| C36 | N2 | C40 | C39 | 66.3° | 53.9° |
| N2 | C36 | C37 | C38 | 56.7° | 54.8° |
| C36 | N2 | C40 | H1 | 173.9° | 173.6° |
| C36 | N2 | C40 | H2 | 53.5° | 65.9° |
| N2 | C36 | C37 | H15 | 177.2° | 65.2° |
| N2 | C36 | C37 | H16 | 63.8° | 174.8° |
| N2 | C36 | H17 | H18 | 122.1° | 120.3° |
| C37 | C36 | N2 | C40 | 63.5° | 53.9° |
| C36 | C37 | C38 | H15 | 120.5° | 120.0° |
| C36 | C37 | C38 | H16 | 120.5° | 119.9° |
| C36 | C37 | C38 | C39 | 55.4° | 61.4° |
| C36 | C37 | C38 | C41 | 178.5° | 178.5° |
| C36 | C37 | C38 | H5 | 62.1° | 58.5° |
| C36 | C37 | H15 | H16 | 118.5° | 120.1° |
| C37 | C36 | H17 | H18 | 122.0° | 120.6° |
| N2 | C40 | C39 | H1 | 119.8° | 119.8° |
| N2 | C40 | C39 | H2 | 119.8° | 119.8° |
| N2 | C40 | C39 | C38 | 57.3° | 54.6° |
| N2 | C40 | H1 | H2 | 120.6° | 120.4° |
| N2 | C40 | C39 | H3 | 62.5° | 65.3° |
| N2 | C40 | C39 | H4 | 177.1° | 174.6° |
| C40 | N2 | C36 | H17 | 55.8° | 65.9° |
| C40 | N2 | C36 | H18 | 177.3° | 173.7° |
| C40 | C39 | C38 | C37 | 53.9° | 61.3° |
| C40 | C39 | C38 | H3 | 119.8° | 120.0° |
| C40 | C39 | C38 | H4 | 119.8° | 120.0° |
| C40 | C39 | C38 | C41 | 178.3° | 178.6° |
| C39 | C40 | H1 | H2 | 120.6° | 120.3° |
| C40 | C39 | H3 | H4 | 120.6° | 120.1° |
| C40 | C39 | C38 | H5 | 63.8° | 58.6° |
| C37 | C38 | C39 | C41 | 124.4° | 120.1° |
| C37 | C38 | C39 | H5 | 117.7° | 120.0° |
| C37 | C38 | C41 | H5 | 119.1° | 119.9° |
| C37 | C38 | C41 | C47 | 37.0° | 119.9° |
| C37 | C38 | C41 | C42 | 141.3° | 59.9° |
| C37 | C38 | C39 | H3 | 65.9° | 58.6° |
| C37 | C38 | C39 | H4 | 173.7° | 178.7° |
| C38 | C37 | H15 | H16 | 118.6° | 120.1° |
| C38 | C37 | C36 | H17 | 62.6° | 64.9° |
| C38 | C37 | C36 | H18 | 176.0° | 174.6° |
| C39 | C38 | C41 | H5 | 117.6° | 119.9° |
| C39 | C38 | C41 | C47 | 86.3° | 119.9° |
| C39 | C38 | C41 | C42 | 95.3° | 60.3° |
| C38 | C39 | C40 | H1 | 177.1° | 174.4° |
| C38 | C39 | C40 | H2 | 62.5° | 65.2° |
| C38 | C39 | H3 | H4 | 120.6° | 120.1° |
| C39 | C38 | C37 | H15 | 175.9° | 58.6° |
| C39 | C38 | C37 | H16 | 65.0° | 178.7° |
| C38 | C41 | C47 | C42 | 178.4° | 179.8° |
| C38 | C41 | C47 | C45 | 179.1° | 180.0° |
| C38 | C41 | C42 | C43 | 177.7° | 179.8° |
| C41 | C38 | C39 | H3 | 58.5° | 61.4° |
| C41 | C38 | C39 | H4 | 61.9° | 58.6° |
| C38 | C41 | C47 | H6 | 0.9° | 0.0° |
| C38 | C41 | C42 | H14 | 2.3° | 0.1° |
| C41 | C38 | C37 | H15 | 61.0° | 61.5° |
| C41 | C38 | C37 | H16 | 58.1° | 58.6° |
| C41 | C47 | C45 | H6 | 180.0° | 180.0° |
| C47 | C41 | C42 | C43 | 3.8° | 0.4° |
| C41 | C47 | C45 | C46 | 178.2° | 180.0° |
| C41 | C47 | C45 | C44 | 1.8° | 0.0° |
| C47 | C41 | C38 | H5 | 156.1° | 0.0° |
| C47 | C41 | C42 | H14 | 176.2° | 179.7° |
| C42 | C41 | C47 | C45 | 2.6° | 0.2° |
| C41 | C42 | C43 | H14 | 180.0° | 179.9° |
| C41 | C42 | C43 | C44 | 4.6° | 0.4° |
| C42 | C41 | C38 | H5 | 22.2° | 179.8° |
| C42 | C41 | C47 | H6 | 177.4° | 179.8° |
| C41 | C42 | C43 | H13 | 175.4° | 179.7° |
| C47 | C45 | C46 | N3 | 65.0° | 90.0° |
| C47 | C45 | C46 | C44 | 180.0° | 179.9° |
| C47 | C45 | C44 | C43 | 2.1° | 0.0° |
| C47 | C45 | C46 | H7 | 174.8° | 150.0° |
| C47 | C45 | C46 | H8 | 55.2° | 30.0° |
| C47 | C45 | C44 | H12 | 177.9° | 180.0° |
| C42 | C43 | C44 | C45 | 3.6° | 0.2° |
| C42 | C43 | C44 | H13 | 180.0° | 179.8° |
| C42 | C43 | C44 | H12 | 176.4° | 179.8° |
| N3 | C46 | C45 | H7 | 120.2° | 120.0° |
| N3 | C46 | C45 | H8 | 120.2° | 120.0° |
| N3 | C46 | C45 | C44 | 115.0° | 90.0° |
| N3 | C46 | H7 | H8 | 119.4° | 120.0° |
| C46 | N3 | H9 | H10 | 120.0° | 123.9° |
| C46 | C45 | C44 | C43 | 177.9° | 180.0° |
| C46 | C45 | C47 | H6 | 1.8° | 0.1° |
| C45 | C46 | H7 | H8 | 119.3° | 120.1° |
| C45 | C46 | N3 | H9 | 180.0° | 56.1° |
| C45 | C46 | N3 | H10 | 60.0° | 180.0° |
| C46 | C45 | C44 | H12 | 2.1° | 0.0° |
| C45 | C44 | C43 | H12 | 180.0° | 180.0° |
| C44 | C45 | C47 | H6 | 178.2° | 180.0° |
| C44 | C45 | C46 | H7 | 5.2° | 30.0° |
| C44 | C45 | C46 | H8 | 124.8° | 150.0° |
| C45 | C44 | C43 | H13 | 176.4° | 180.0° |
| C44 | C43 | C42 | H14 | 175.4° | 179.7° |
| H1 | C40 | C39 | H3 | 57.2° | 54.5° |
| H1 | C40 | C39 | H4 | 63.1° | 65.6° |
| H2 | C40 | C39 | H3 | 177.7° | 174.9° |
| H2 | C40 | C39 | H4 | 57.3° | 54.8° |
| H3 | C39 | C38 | H5 | 176.5° | 178.6° |
| H4 | C39 | C38 | H5 | 56.0° | 61.4° |
| H5 | C38 | C37 | H15 | 58.3° | 178.6° |
| H5 | C38 | C37 | H16 | 177.4° | 61.4° |
| H7 | C46 | N3 | H9 | 59.8° | 63.9° |
| H7 | C46 | N3 | H10 | 60.2° | 59.9° |
| H8 | C46 | N3 | H9 | 59.8° | 176.1° |
| H8 | C46 | N3 | H10 | 179.8° | 60.0° |
| H12 | C44 | C43 | H13 | 3.6° | 0.1° |
| H13 | C43 | C42 | H14 | 4.6° | 0.1° |
| H15 | C37 | C36 | H17 | 57.9° | 175.1° |
| H15 | C37 | C36 | H18 | 63.5° | 54.6° |
| H16 | C37 | C36 | H17 | 176.9° | 55.1° |
| H16 | C37 | C36 | H18 | 55.5° | 65.5° |
| H19 | C31 | C30 | H20 | 0.1° | 0.0° |
| H23 | C1 | H24 | H25 | 120.0° | 120.0° |
| H26 | C2 | H27 | H28 | 119.9° | 120.1° |
| H29 | C4 | H30 | H31 | 119.9° | 120.0° |
| H32 | C5 | H33 | H34 | 120.0° | 120.0° |
| H37 | C10 | C9 | H38 | 1.9° | 0.1° |
| H39 | C19 | C18 | H41 | 57.7° | 54.8° |
| H39 | C19 | C18 | H42 | 63.5° | 174.9° |
| H40 | C19 | C18 | H41 | 177.4° | 65.5° |
| H40 | C19 | C18 | H42 | 56.2° | 54.5° |
| H41 | C18 | C17 | H43 | 175.3° | 61.3° |
| H42 | C18 | C17 | H43 | 54.1° | 178.6° |
| H43 | C17 | C16 | H44 | 63.2° | 61.3° |
| H43 | C17 | C16 | H45 | 178.6° | 178.6° |
| H44 | C16 | C15 | H46 | 62.6° | 65.6° |
| H44 | C16 | C15 | H47 | 60.5° | 54.9° |
| H45 | C16 | C15 | H46 | 179.1° | 54.5° |
| H45 | C16 | C15 | H47 | 57.8° | 174.9° |
| H49 | C25 | N1 | H51 | 59.6° | 64.0° |
| H49 | C25 | N1 | H52 | 60.4° | 60.0° |
| H50 | C25 | N1 | H51 | 59.6° | 176.0° |
| H50 | C25 | N1 | H52 | 179.7° | 60.0° |
| H54 | C23 | C22 | H55 | 0.6° | 0.0° |
| H55 | C22 | C21 | H56 | 1.7° | 0.3° |
