N2L
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C36 | C35 | sing | 1.54Å | 1.53Å | |
| C36 | C37 | sing | 1.55Å | 1.53Å | |
| C35 | N7 | sing | 1.47Å | 1.47Å | |
| C37 | C38 | sing | 1.55Å | 1.54Å | |
| C32 | C33 | sing | 1.54Å | 1.54Å | |
| C32 | C29 | sing | 1.53Å | 1.55Å | |
| N7 | C38 | sing | 1.48Å | 1.49Å | |
| N7 | C33 | sing | 1.47Å | 1.47Å | |
| C38 | C39 | sing | 1.51Å | 1.51Å | |
| C33 | C34 | sing | 1.54Å | 1.54Å | |
| C46 | C45 | sing | 1.53Å | 1.49Å | |
| C46 | C47 | sing | 1.53Å | 1.47Å | |
| C45 | C47 | sing | 1.53Å | 1.50Å | |
| C45 | C44 | sing | 1.51Å | 1.49Å | |
| C28 | C29 | sing | 1.53Å | 1.52Å | |
| C28 | C27 | sing | 1.53Å | 1.50Å | |
| C29 | C34 | sing | 1.53Å | 1.55Å | |
| C29 | C30 | sing | 1.53Å | 1.53Å | |
| C39 | C44 | doub | 1.38Å | 1.40Å | Aromatic |
| C39 | C40 | sing | 1.38Å | 1.41Å | Aromatic |
| C44 | C43 | sing | 1.38Å | 1.39Å | Aromatic |
| C30 | C31 | sing | 1.53Å | 1.50Å | |
| C27 | N6 | sing | 1.47Å | 1.47Å | |
| C40 | C41 | doub | 1.38Å | 1.38Å | Aromatic |
| N6 | C31 | sing | 1.47Å | 1.47Å | |
| N6 | C17 | sing | 1.39Å | 1.38Å | |
| C43 | C42 | doub | 1.38Å | 1.39Å | Aromatic |
| C18 | C17 | doub | 1.39Å | 1.40Å | Aromatic |
| C18 | C19 | sing | 1.38Å | 1.38Å | Aromatic |
| C41 | C42 | sing | 1.38Å | 1.37Å | Aromatic |
| C17 | C16 | sing | 1.39Å | 1.40Å | Aromatic |
| O7 | C19 | sing | 1.36Å | 1.39Å | |
| O7 | C20 | sing | 1.36Å | 1.38Å | |
| C19 | C14 | doub | 1.40Å | 1.39Å | Aromatic |
| C16 | C15 | doub | 1.36Å | 1.38Å | Aromatic |
| C21 | C20 | sing | 1.39Å | 1.43Å | Aromatic |
| C21 | N4 | doub | 1.32Å | 1.34Å | Aromatic |
| C20 | C26 | doub | 1.39Å | 1.38Å | Aromatic |
| C14 | C15 | sing | 1.40Å | 1.40Å | Aromatic |
| C14 | C13 | sing | 1.47Å | 1.49Å | |
| N4 | C22 | sing | 1.33Å | 1.34Å | Aromatic |
| O6 | C13 | doub | 1.22Å | 1.22Å | |
| C13 | N3 | sing | 1.35Å | 1.38Å | |
| C26 | C25 | sing | 1.40Å | 1.40Å | Aromatic |
| C22 | C25 | doub | 1.41Å | 1.41Å | Aromatic |
| C22 | N5 | sing | 1.38Å | 1.37Å | Aromatic |
| C25 | C24 | sing | 1.46Å | 1.42Å | Aromatic |
| N3 | S1 | sing | 1.66Å | 1.64Å | |
| N5 | C23 | sing | 1.37Å | 1.37Å | Aromatic |
| O4 | S1 | doub | 1.42Å | 1.44Å | |
| C24 | C23 | doub | 1.34Å | 1.37Å | Aromatic |
| C4 | C5 | doub | 1.38Å | 1.38Å | Aromatic |
| C4 | C3 | sing | 1.38Å | 1.38Å | Aromatic |
| S1 | C3 | sing | 1.76Å | 1.76Å | |
| S1 | O5 | doub | 1.42Å | 1.42Å | |
| C5 | C6 | sing | 1.39Å | 1.41Å | Aromatic |
| C3 | C2 | doub | 1.38Å | 1.38Å | Aromatic |
| C7 | N2 | sing | 1.46Å | 1.46Å | |
| C7 | C8 | sing | 1.53Å | 1.53Å | |
| C6 | N2 | sing | 1.40Å | 1.37Å | |
| C6 | C1 | doub | 1.39Å | 1.41Å | Aromatic |
| C9 | C8 | sing | 1.53Å | 1.53Å | |
| C9 | C10 | sing | 1.53Å | 1.51Å | |
| C2 | C1 | sing | 1.38Å | 1.39Å | Aromatic |
| C8 | C12 | sing | 1.53Å | 1.53Å | |
| C1 | N1 | sing | 1.48Å | 1.44Å | |
| C10 | O3 | sing | 1.43Å | 1.42Å | |
| N1 | O2 | sing | 1.22Å | 1.23Å | |
| N1 | O1 | doub | 1.22Å | 1.23Å | |
| C12 | C11 | sing | 1.53Å | 1.51Å | |
| O3 | C11 | sing | 1.43Å | 1.43Å | |
| N3 | H1 | sing | 0.97Å | 1.00Å | |
| C4 | H2 | sing | 1.08Å | 1.08Å | |
| C5 | H3 | sing | 1.08Å | 1.08Å | |
| C7 | H4 | sing | 1.09Å | 1.10Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C8 | H6 | sing | 1.09Å | 1.10Å | |
| C10 | H7 | sing | 1.09Å | 1.10Å | |
| C10 | H8 | sing | 1.09Å | 1.10Å | |
| C15 | H9 | sing | 1.08Å | 1.08Å | |
| C21 | H10 | sing | 1.08Å | 1.08Å | |
| C24 | H11 | sing | 1.08Å | 1.08Å | |
| C26 | H12 | sing | 1.08Å | 1.08Å | |
| C28 | H13 | sing | 1.09Å | 1.10Å | |
| C28 | H14 | sing | 1.09Å | 1.10Å | |
| C11 | H15 | sing | 1.09Å | 1.10Å | |
| C11 | H16 | sing | 1.09Å | 1.10Å | |
| C12 | H17 | sing | 1.09Å | 1.10Å | |
| C12 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | H19 | sing | 1.08Å | 1.08Å | |
| C18 | H20 | sing | 1.08Å | 1.08Å | |
| C2 | H21 | sing | 1.08Å | 1.08Å | |
| C23 | H22 | sing | 1.08Å | 1.08Å | |
| C27 | H23 | sing | 1.09Å | 1.10Å | |
| C27 | H24 | sing | 1.09Å | 1.10Å | |
| C30 | H25 | sing | 1.09Å | 1.10Å | |
| C30 | H26 | sing | 1.09Å | 1.10Å | |
| C31 | H27 | sing | 1.09Å | 1.10Å | |
| C31 | H28 | sing | 1.09Å | 1.10Å | |
| C32 | H29 | sing | 1.09Å | 1.10Å | |
| C32 | H30 | sing | 1.09Å | 1.10Å | |
| C33 | H31 | sing | 1.09Å | 1.10Å | |
| C34 | H32 | sing | 1.09Å | 1.10Å | |
| C34 | H33 | sing | 1.09Å | 1.10Å | |
| C35 | H34 | sing | 1.09Å | 1.10Å | |
| C35 | H35 | sing | 1.09Å | 1.10Å | |
| C36 | H36 | sing | 1.09Å | 1.10Å | |
| C36 | H37 | sing | 1.09Å | 1.10Å | |
| C37 | H38 | sing | 1.09Å | 1.10Å | |
| C37 | H39 | sing | 1.09Å | 1.10Å | |
| C38 | H40 | sing | 1.09Å | 1.10Å | |
| C40 | H41 | sing | 1.08Å | 1.08Å | |
| C41 | H42 | sing | 1.08Å | 1.08Å | |
| C42 | H43 | sing | 1.08Å | 1.08Å | |
| C43 | H44 | sing | 1.08Å | 1.08Å | |
| C45 | H45 | sing | 1.09Å | 1.10Å | |
| C46 | H46 | sing | 1.09Å | 1.10Å | |
| C46 | H47 | sing | 1.09Å | 1.10Å | |
| C47 | H48 | sing | 1.09Å | 1.10Å | |
| C47 | H49 | sing | 1.09Å | 1.10Å | |
| C9 | H50 | sing | 1.09Å | 1.10Å | |
| C9 | H51 | sing | 1.09Å | 1.10Å | |
| N2 | H52 | sing | 0.97Å | 1.00Å | |
| N5 | H53 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C35 | C36 | C37 | 105.0° | 103.0° |
| C36 | C35 | N7 | 104.7° | 107.3° |
| C36 | C35 | H34 | 110.7° | 109.9° |
| C36 | C35 | H35 | 110.7° | 110.0° |
| C35 | C36 | H36 | 110.6° | 110.8° |
| C35 | C36 | H37 | 110.6° | 110.7° |
| C36 | C37 | C38 | 104.3° | 101.7° |
| C37 | C36 | H36 | 110.6° | 110.7° |
| C37 | C36 | H37 | 110.6° | 110.7° |
| C36 | C37 | H38 | 110.7° | 111.0° |
| C36 | C37 | H39 | 110.7° | 111.0° |
| C35 | N7 | C38 | 104.0° | 108.5° |
| C35 | N7 | C33 | 112.7° | 111.0° |
| N7 | C35 | H34 | 110.6° | 109.9° |
| N7 | C35 | H35 | 110.7° | 109.9° |
| C37 | C38 | N7 | 100.7° | 104.8° |
| C37 | C38 | C39 | 115.6° | 110.4° |
| C38 | C37 | H38 | 110.8° | 111.0° |
| C38 | C37 | H39 | 110.7° | 111.0° |
| C37 | C38 | H40 | 108.9° | 110.4° |
| C33 | C32 | C29 | 89.2° | 87.0° |
| C32 | C33 | N7 | 115.7° | 113.7° |
| C32 | C33 | C34 | 87.5° | 87.1° |
| C33 | C32 | H29 | 114.3° | 113.6° |
| C33 | C32 | H30 | 114.3° | 113.6° |
| C32 | C33 | H31 | 111.2° | 113.6° |
| C32 | C29 | C28 | 114.7° | 113.6° |
| C32 | C29 | C34 | 87.2° | 87.6° |
| C32 | C29 | C30 | 112.9° | 113.6° |
| C29 | C32 | H29 | 114.3° | 113.7° |
| C29 | C32 | H30 | 114.3° | 113.7° |
| C38 | N7 | C33 | 115.3° | 111.0° |
| N7 | C38 | C39 | 112.6° | 110.4° |
| N7 | C38 | H40 | 109.6° | 110.5° |
| N7 | C33 | C34 | 116.7° | 113.6° |
| N7 | C33 | H31 | 112.3° | 112.9° |
| C38 | C39 | C44 | 120.7° | 120.0° |
| C38 | C39 | C40 | 120.0° | 120.0° |
| C39 | C38 | H40 | 109.2° | 110.3° |
| C33 | C34 | C29 | 89.1° | 87.0° |
| C34 | C33 | H31 | 111.2° | 113.5° |
| C33 | C34 | H32 | 114.3° | 113.6° |
| C33 | C34 | H33 | 114.3° | 113.6° |
| C45 | C46 | C47 | 60.8° | 60.0° |
| C46 | C45 | C47 | 58.7° | 60.0° |
| C46 | C45 | C44 | 122.5° | 117.5° |
| C46 | C45 | H45 | 113.9° | 117.5° |
| C45 | C46 | H46 | 119.8° | 117.5° |
| C45 | C46 | H47 | 119.9° | 117.5° |
| C46 | C47 | C45 | 60.4° | 60.0° |
| C47 | C46 | H46 | 119.8° | 117.5° |
| C47 | C46 | H47 | 119.9° | 117.5° |
| C46 | C47 | H48 | 119.9° | 117.5° |
| C46 | C47 | H49 | 119.9° | 117.5° |
| C47 | C45 | C44 | 123.1° | 117.5° |
| C47 | C45 | H45 | 113.8° | 117.5° |
| C45 | C47 | H48 | 119.9° | 117.5° |
| C45 | C47 | H49 | 119.9° | 117.5° |
| C45 | C44 | C39 | 120.4° | 120.0° |
| C45 | C44 | C43 | 120.0° | 120.0° |
| C44 | C45 | H45 | 113.9° | 115.6° |
| C29 | C28 | C27 | 111.0° | 109.0° |
| C28 | C29 | C34 | 115.5° | 113.6° |
| C28 | C29 | C30 | 108.5° | 112.7° |
| C29 | C28 | H13 | 109.1° | 109.6° |
| C29 | C28 | H14 | 109.1° | 109.5° |
| C28 | C27 | N6 | 114.2° | 109.5° |
| C27 | C28 | H13 | 109.1° | 109.6° |
| C27 | C28 | H14 | 109.1° | 109.5° |
| C28 | C27 | H23 | 108.3° | 109.5° |
| C28 | C27 | H24 | 108.3° | 109.5° |
| C34 | C29 | C30 | 116.9° | 113.5° |
| C29 | C34 | H32 | 114.3° | 113.7° |
| C29 | C34 | H33 | 114.3° | 113.7° |
| C29 | C30 | C31 | 112.6° | 109.0° |
| C29 | C30 | H25 | 108.7° | 109.6° |
| C29 | C30 | H26 | 108.7° | 109.5° |
| C44 | C39 | C40 | 119.2° | 120.0° |
| C39 | C44 | C43 | 119.6° | 120.0° |
| C39 | C40 | C41 | 120.0° | 120.0° |
| C39 | C40 | H41 | 120.0° | 120.0° |
| C44 | C43 | C42 | 120.5° | 120.0° |
| C44 | C43 | H44 | 119.7° | 120.0° |
| C30 | C31 | N6 | 113.3° | 109.4° |
| C31 | C30 | H25 | 108.7° | 109.6° |
| C31 | C30 | H26 | 108.7° | 109.5° |
| C30 | C31 | H27 | 108.5° | 109.4° |
| C30 | C31 | H28 | 108.5° | 109.5° |
| C27 | N6 | C31 | 115.0° | 111.5° |
| C27 | N6 | C17 | 121.6° | 111.0° |
| N6 | C27 | H23 | 108.2° | 109.5° |
| N6 | C27 | H24 | 108.3° | 109.5° |
| C40 | C41 | C42 | 120.4° | 120.1° |
| C41 | C40 | H41 | 120.0° | 120.0° |
| C40 | C41 | H42 | 119.8° | 120.0° |
| C31 | N6 | C17 | 121.6° | 111.0° |
| N6 | C31 | H27 | 108.5° | 109.5° |
| N6 | C31 | H28 | 108.5° | 109.5° |
| N6 | C17 | C18 | 119.9° | 119.9° |
| N6 | C17 | C16 | 121.0° | 119.9° |
| C43 | C42 | C41 | 120.3° | 119.9° |
| C43 | C42 | H43 | 119.8° | 120.1° |
| C42 | C43 | H44 | 119.8° | 119.9° |
| C17 | C18 | C19 | 119.9° | 119.9° |
| C18 | C17 | C16 | 118.9° | 120.2° |
| C17 | C18 | H20 | 120.1° | 120.0° |
| C18 | C19 | O7 | 117.5° | 120.2° |
| C18 | C19 | C14 | 121.7° | 119.6° |
| C19 | C18 | H20 | 120.0° | 120.0° |
| C42 | C41 | H42 | 119.8° | 120.0° |
| C41 | C42 | H43 | 119.9° | 120.0° |
| C17 | C16 | C15 | 120.4° | 120.4° |
| C17 | C16 | H19 | 119.8° | 119.8° |
| C19 | O7 | C20 | 118.8° | 118.0° |
| O7 | C19 | C14 | 120.8° | 120.2° |
| O7 | C20 | C21 | 114.2° | 120.3° |
| O7 | C20 | C26 | 124.5° | 120.3° |
| C19 | C14 | C15 | 118.5° | 119.8° |
| C19 | C14 | C13 | 121.7° | 120.1° |
| C16 | C15 | C14 | 120.5° | 120.1° |
| C16 | C15 | H9 | 119.8° | 120.0° |
| C15 | C16 | H19 | 119.8° | 119.8° |
| C20 | C21 | N4 | 121.6° | 121.5° |
| C21 | C20 | C26 | 121.4° | 119.3° |
| C20 | C21 | H10 | 119.2° | 119.3° |
| C21 | N4 | C22 | 116.3° | 121.7° |
| N4 | C21 | H10 | 119.2° | 119.2° |
| C20 | C26 | C25 | 117.2° | 118.0° |
| C20 | C26 | H12 | 121.4° | 121.0° |
| C15 | C14 | C13 | 119.9° | 120.1° |
| C14 | C15 | H9 | 119.7° | 120.0° |
| C14 | C13 | O6 | 122.5° | 120.0° |
| C14 | C13 | N3 | 115.7° | 120.0° |
| N4 | C22 | C25 | 126.3° | 120.0° |
| N4 | C22 | N5 | 125.6° | 133.1° |
| O6 | C13 | N3 | 121.8° | 120.0° |
| C13 | N3 | S1 | 120.5° | 120.0° |
| C13 | N3 | H1 | 119.8° | 120.0° |
| C26 | C25 | C22 | 117.1° | 119.5° |
| C26 | C25 | C24 | 136.3° | 134.2° |
| C25 | C26 | H12 | 121.4° | 121.0° |
| C25 | C22 | N5 | 108.1° | 107.0° |
| C22 | C25 | C24 | 106.5° | 106.2° |
| C22 | N5 | C23 | 108.7° | 110.0° |
| C22 | N5 | H53 | 125.7° | 125.0° |
| C25 | C24 | C23 | 107.0° | 106.9° |
| C25 | C24 | H11 | 126.5° | 126.6° |
| N3 | S1 | O4 | 112.1° | 106.4° |
| N3 | S1 | C3 | 106.4° | 107.3° |
| N3 | S1 | O5 | 106.1° | 106.4° |
| S1 | N3 | H1 | 119.7° | 120.0° |
| N5 | C23 | C24 | 109.6° | 109.9° |
| N5 | C23 | H22 | 125.2° | 125.0° |
| C23 | N5 | H53 | 125.6° | 125.0° |
| O4 | S1 | C3 | 107.4° | 106.4° |
| O4 | S1 | O5 | 117.8° | 123.1° |
| C23 | C24 | H11 | 126.5° | 126.5° |
| C24 | C23 | H22 | 125.2° | 125.1° |
| C5 | C4 | C3 | 119.4° | 120.1° |
| C4 | C5 | C6 | 121.8° | 119.9° |
| C5 | C4 | H2 | 120.3° | 119.9° |
| C4 | C5 | H3 | 119.1° | 120.0° |
| C4 | C3 | S1 | 121.0° | 119.9° |
| C4 | C3 | C2 | 120.9° | 120.1° |
| C3 | C4 | H2 | 120.3° | 120.0° |
| C3 | S1 | O5 | 106.4° | 106.4° |
| S1 | C3 | C2 | 118.1° | 119.9° |
| C5 | C6 | N2 | 121.2° | 120.1° |
| C5 | C6 | C1 | 117.3° | 119.8° |
| C6 | C5 | H3 | 119.1° | 120.0° |
| C3 | C2 | C1 | 119.7° | 120.1° |
| C3 | C2 | H21 | 120.1° | 119.9° |
| N2 | C7 | C8 | 111.2° | 109.5° |
| C7 | N2 | C6 | 124.6° | 120.0° |
| N2 | C7 | H4 | 109.0° | 109.5° |
| N2 | C7 | H5 | 109.1° | 109.5° |
| C7 | N2 | H52 | 105.6° | 120.0° |
| C7 | C8 | C9 | 111.7° | 109.6° |
| C7 | C8 | C12 | 111.8° | 109.5° |
| C8 | C7 | H4 | 109.1° | 109.5° |
| C8 | C7 | H5 | 109.0° | 109.5° |
| C7 | C8 | H6 | 108.1° | 109.6° |
| N2 | C6 | C1 | 121.5° | 120.1° |
| C6 | N2 | H52 | 105.6° | 120.0° |
| C6 | C1 | C2 | 120.9° | 119.9° |
| C6 | C1 | N1 | 123.7° | 120.1° |
| C8 | C9 | C10 | 110.3° | 109.2° |
| C9 | C8 | C12 | 108.9° | 109.0° |
| C9 | C8 | H6 | 108.1° | 109.6° |
| C8 | C9 | H50 | 109.3° | 109.6° |
| C8 | C9 | H51 | 109.3° | 109.5° |
| C9 | C10 | O3 | 112.0° | 109.4° |
| C9 | C10 | H7 | 108.8° | 109.5° |
| C9 | C10 | H8 | 108.9° | 109.4° |
| C10 | C9 | H50 | 109.3° | 109.5° |
| C10 | C9 | H51 | 109.3° | 109.5° |
| C2 | C1 | N1 | 115.4° | 120.0° |
| C1 | C2 | H21 | 120.2° | 120.0° |
| C8 | C12 | C11 | 110.8° | 109.2° |
| C12 | C8 | H6 | 108.1° | 109.5° |
| C8 | C12 | H17 | 109.1° | 109.5° |
| C8 | C12 | H18 | 109.2° | 109.5° |
| C1 | N1 | O2 | 118.0° | 120.0° |
| C1 | N1 | O1 | 119.5° | 120.0° |
| C10 | O3 | C11 | 111.2° | 114.1° |
| O3 | C10 | H7 | 108.9° | 109.5° |
| O3 | C10 | H8 | 108.8° | 109.5° |
| O2 | N1 | O1 | 122.5° | 120.0° |
| C12 | C11 | O3 | 111.6° | 109.4° |
| C12 | C11 | H15 | 108.9° | 109.5° |
| C12 | C11 | H16 | 108.9° | 109.5° |
| C11 | C12 | H17 | 109.2° | 109.5° |
| C11 | C12 | H18 | 109.1° | 109.5° |
| O3 | C11 | H15 | 108.9° | 109.5° |
| O3 | C11 | H16 | 109.0° | 109.5° |
| H4 | C7 | H5 | 109.4° | 109.4° |
| H7 | C10 | H8 | 109.5° | 109.5° |
| H13 | C28 | H14 | 109.5° | 109.6° |
| H15 | C11 | H16 | 109.5° | 109.5° |
| H17 | C12 | H18 | 109.4° | 109.6° |
| H23 | C27 | H24 | 109.5° | 109.4° |
| H25 | C30 | H26 | 109.5° | 109.6° |
| H27 | C31 | H28 | 109.5° | 109.5° |
| H29 | C32 | H30 | 109.5° | 112.9° |
| H32 | C34 | H33 | 109.5° | 112.9° |
| H34 | C35 | H35 | 109.5° | 109.8° |
| H36 | C36 | H37 | 109.5° | 110.8° |
| H38 | C37 | H39 | 109.5° | 110.9° |
| H46 | C46 | H47 | 109.5° | 115.5° |
| H48 | C47 | H49 | 109.5° | 115.6° |
| H50 | C9 | H51 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C35 | C36 | C37 | H36 | 119.3° | 118.4° |
| C35 | C36 | C37 | H37 | 119.3° | 118.4° |
| C36 | C35 | N7 | H34 | 119.2° | 119.5° |
| C36 | C35 | N7 | H35 | 119.2° | 119.6° |
| C35 | C36 | C37 | C38 | 13.9° | 35.7° |
| C36 | C35 | N7 | C38 | 38.6° | 1.0° |
| C36 | C35 | N7 | C33 | 164.1° | 123.2° |
| C36 | C35 | H34 | H35 | 122.2° | 121.1° |
| C35 | C36 | H36 | H37 | 122.1° | 123.3° |
| C35 | C36 | C37 | H38 | 133.1° | 153.7° |
| C35 | C36 | C37 | H39 | 105.3° | 82.5° |
| C37 | C36 | C35 | N7 | 14.5° | 22.3° |
| C36 | C37 | C38 | H38 | 119.2° | 118.1° |
| C36 | C37 | C38 | H39 | 119.2° | 118.2° |
| C36 | C37 | C38 | N7 | 36.6° | 37.1° |
| C36 | C37 | C38 | C39 | 158.2° | 155.9° |
| C37 | C36 | C35 | H34 | 133.7° | 97.2° |
| C37 | C36 | C35 | H35 | 104.8° | 141.8° |
| C37 | C36 | H36 | H37 | 122.1° | 123.2° |
| C36 | C37 | H38 | H39 | 122.4° | 123.9° |
| C36 | C37 | C38 | H40 | 78.5° | 81.9° |
| C35 | N7 | C38 | C37 | 46.7° | 24.1° |
| C35 | N7 | C33 | C32 | 54.9° | 59.9° |
| C35 | N7 | C38 | C33 | 123.8° | 122.3° |
| C35 | N7 | C38 | C39 | 170.3° | 142.9° |
| C35 | N7 | C33 | C34 | 155.8° | 157.5° |
| C35 | N7 | C33 | H31 | 74.1° | 71.3° |
| N7 | C35 | H34 | H35 | 122.2° | 121.0° |
| N7 | C35 | C36 | H36 | 133.7° | 96.1° |
| N7 | C35 | C36 | H37 | 104.8° | 140.6° |
| C35 | N7 | C38 | H40 | 67.9° | 94.8° |
| C37 | C38 | N7 | C39 | 123.6° | 118.8° |
| C37 | C38 | N7 | H40 | 114.6° | 118.9° |
| C37 | C38 | N7 | C33 | 170.5° | 146.3° |
| C37 | C38 | C39 | H40 | 123.2° | 122.3° |
| C37 | C38 | C39 | C44 | 132.2° | 81.5° |
| C37 | C38 | C39 | C40 | 50.3° | 98.8° |
| C38 | C37 | C36 | H36 | 105.4° | 82.7° |
| C38 | C37 | C36 | H37 | 133.2° | 154.0° |
| C38 | C37 | H38 | H39 | 122.4° | 123.8° |
| C33 | C32 | C29 | H29 | 116.4° | 114.5° |
| C33 | C32 | C29 | H30 | 116.4° | 114.5° |
| C32 | C33 | N7 | C38 | 174.1° | 179.3° |
| C32 | C33 | N7 | C34 | 100.8° | 97.6° |
| C32 | C33 | N7 | H31 | 129.1° | 131.2° |
| C32 | C33 | C34 | H31 | 111.8° | 114.5° |
| C33 | C32 | C29 | C28 | 97.1° | 89.6° |
| C33 | C32 | C29 | C34 | 19.8° | 25.2° |
| C33 | C32 | C29 | C30 | 138.0° | 139.9° |
| C33 | C32 | H29 | H30 | 129.7° | 131.2° |
| C32 | C33 | C34 | H32 | 136.2° | 89.4° |
| C32 | C33 | C34 | H33 | 96.5° | 139.6° |
| C29 | C32 | C33 | N7 | 138.5° | 139.7° |
| C32 | C29 | C28 | C34 | 99.2° | 98.1° |
| C32 | C29 | C28 | C30 | 127.3° | 131.0° |
| C32 | C29 | C28 | C27 | 176.0° | 175.1° |
| C32 | C29 | C34 | C30 | 114.3° | 114.7° |
| C32 | C29 | C30 | C31 | 175.4° | 175.1° |
| C32 | C29 | C28 | H13 | 63.8° | 55.3° |
| C32 | C29 | C28 | H14 | 55.8° | 65.0° |
| C32 | C29 | C30 | H25 | 54.9° | 55.2° |
| C32 | C29 | C30 | H26 | 64.1° | 65.1° |
| C29 | C32 | H29 | H30 | 129.6° | 131.4° |
| C29 | C32 | C33 | H31 | 91.9° | 89.4° |
| C32 | C29 | C34 | H32 | 136.2° | 89.3° |
| C32 | C29 | C34 | H33 | 96.5° | 139.7° |
| N7 | C38 | C39 | H40 | 121.9° | 122.3° |
| C38 | N7 | C33 | C34 | 85.1° | 81.7° |
| N7 | C38 | C39 | C44 | 112.9° | 163.1° |
| N7 | C38 | C39 | C40 | 64.6° | 16.6° |
| C38 | N7 | C33 | H31 | 45.0° | 49.5° |
| C38 | N7 | C35 | H34 | 157.8° | 120.4° |
| C38 | N7 | C35 | H35 | 80.7° | 118.6° |
| N7 | C38 | C37 | H38 | 155.8° | 155.2° |
| N7 | C38 | C37 | H39 | 82.5° | 81.1° |
| C33 | N7 | C38 | C39 | 65.8° | 94.8° |
| N7 | C33 | C34 | H31 | 130.6° | 130.9° |
| N7 | C33 | C34 | C29 | 137.5° | 139.7° |
| N7 | C33 | C32 | H29 | 22.1° | 105.8° |
| N7 | C33 | C32 | H30 | 105.1° | 25.1° |
| N7 | C33 | C34 | H32 | 106.1° | 25.2° |
| N7 | C33 | C34 | H33 | 21.1° | 105.7° |
| C33 | N7 | C35 | H34 | 76.7° | 117.3° |
| C33 | N7 | C35 | H35 | 44.8° | 3.7° |
| C33 | N7 | C38 | H40 | 55.9° | 27.4° |
| C38 | C39 | C44 | C45 | 2.7° | 0.0° |
| C38 | C39 | C44 | C40 | 177.6° | 179.7° |
| C38 | C39 | C44 | C43 | 177.1° | 179.8° |
| C38 | C39 | C40 | C41 | 177.5° | 180.0° |
| C39 | C38 | C37 | H38 | 82.6° | 86.0° |
| C39 | C38 | C37 | H39 | 39.0° | 37.8° |
| C38 | C39 | C40 | H41 | 2.5° | 0.0° |
| C33 | C34 | C29 | C28 | 96.3° | 89.6° |
| C33 | C34 | C29 | H32 | 116.4° | 114.5° |
| C33 | C34 | C29 | H33 | 116.4° | 114.5° |
| C33 | C34 | C29 | C30 | 134.2° | 139.9° |
| C34 | C33 | C32 | H29 | 96.5° | 139.6° |
| C34 | C33 | C32 | H30 | 136.3° | 89.4° |
| C33 | C34 | H32 | H33 | 129.7° | 131.3° |
| C45 | C46 | C47 | H46 | 109.7° | 107.5° |
| C45 | C46 | C47 | H47 | 109.7° | 107.5° |
| C46 | C45 | C47 | C44 | 110.8° | 107.5° |
| C46 | C45 | C47 | H45 | 104.5° | 107.5° |
| C46 | C45 | C44 | H45 | 143.9° | 145.7° |
| C46 | C45 | C44 | C39 | 106.0° | 171.4° |
| C46 | C45 | C44 | C43 | 73.8° | 8.9° |
| C45 | C46 | H46 | H47 | 144.3° | 145.7° |
| C45 | C46 | C47 | H48 | 109.6° | 107.5° |
| C45 | C46 | C47 | H49 | 109.6° | 107.5° |
| C47 | C46 | H46 | H47 | 144.3° | 145.6° |
| C46 | C47 | H48 | H49 | 144.5° | 145.7° |
| C47 | C45 | C44 | H45 | 144.7° | 145.7° |
| C47 | C45 | C44 | C39 | 177.4° | 120.0° |
| C47 | C45 | C44 | C43 | 2.4° | 59.8° |
| C45 | C47 | H48 | H49 | 144.5° | 145.7° |
| C45 | C44 | C39 | C43 | 179.8° | 179.7° |
| C45 | C44 | C39 | C40 | 179.7° | 179.7° |
| C45 | C44 | C43 | C42 | 179.4° | 179.7° |
| C45 | C44 | C43 | H44 | 0.6° | 0.0° |
| C44 | C45 | C46 | H46 | 2.1° | 0.0° |
| C44 | C45 | C46 | H47 | 138.5° | 145.0° |
| C44 | C45 | C47 | H48 | 1.2° | 145.0° |
| C44 | C45 | C47 | H49 | 139.6° | 0.0° |
| C29 | C28 | C27 | H13 | 120.3° | 119.9° |
| C29 | C28 | C27 | H14 | 120.2° | 119.8° |
| C28 | C29 | C34 | C30 | 129.5° | 130.5° |
| C28 | C29 | C30 | C31 | 56.3° | 53.8° |
| C29 | C28 | C27 | N6 | 53.2° | 56.9° |
| C29 | C28 | H13 | H14 | 119.3° | 120.2° |
| C29 | C28 | C27 | H23 | 173.8° | 176.9° |
| C29 | C28 | C27 | H24 | 67.6° | 63.1° |
| C28 | C29 | C30 | H25 | 176.8° | 173.7° |
| C28 | C29 | C30 | H26 | 64.2° | 66.0° |
| C28 | C29 | C32 | H29 | 146.5° | 25.0° |
| C28 | C29 | C32 | H30 | 19.3° | 156.0° |
| C28 | C29 | C34 | H32 | 20.1° | 155.9° |
| C28 | C29 | C34 | H33 | 147.3° | 24.9° |
| C27 | C28 | C29 | C34 | 76.8° | 77.1° |
| C27 | C28 | C29 | C30 | 56.8° | 53.8° |
| C28 | C27 | N6 | H23 | 120.7° | 120.0° |
| C28 | C27 | N6 | H24 | 120.7° | 120.0° |
| C28 | C27 | N6 | C31 | 47.0° | 63.5° |
| C28 | C27 | N6 | C17 | 148.1° | 172.2° |
| C27 | C28 | H13 | H14 | 119.3° | 120.2° |
| C28 | C27 | H23 | H24 | 117.8° | 120.0° |
| C34 | C29 | C30 | C31 | 76.5° | 77.1° |
| C34 | C29 | C28 | H13 | 163.0° | 42.8° |
| C34 | C29 | C28 | H14 | 43.4° | 163.1° |
| C34 | C29 | C30 | H25 | 44.0° | 42.8° |
| C34 | C29 | C30 | H26 | 163.0° | 163.1° |
| C34 | C29 | C32 | H29 | 96.6° | 139.7° |
| C34 | C29 | C32 | H30 | 136.2° | 89.3° |
| C29 | C34 | C33 | H31 | 91.9° | 89.4° |
| C29 | C34 | H32 | H33 | 129.7° | 131.4° |
| C29 | C30 | C31 | H25 | 120.5° | 119.9° |
| C29 | C30 | C31 | H26 | 120.5° | 119.8° |
| C29 | C30 | C31 | N6 | 50.8° | 56.9° |
| C30 | C29 | C28 | H13 | 63.5° | 173.7° |
| C30 | C29 | C28 | H14 | 177.0° | 66.0° |
| C29 | C30 | H25 | H26 | 118.6° | 120.2° |
| C29 | C30 | C31 | H27 | 69.8° | 63.1° |
| C29 | C30 | C31 | H28 | 171.3° | 176.9° |
| C30 | C29 | C32 | H29 | 21.6° | 105.6° |
| C30 | C29 | C32 | H30 | 105.6° | 25.4° |
| C30 | C29 | C34 | H32 | 109.4° | 25.4° |
| C30 | C29 | C34 | H33 | 17.8° | 105.6° |
| C44 | C39 | C40 | C41 | 0.1° | 0.3° |
| C39 | C44 | C43 | C42 | 0.8° | 0.5° |
| C44 | C39 | C38 | H40 | 9.0° | 40.8° |
| C44 | C39 | C40 | H41 | 179.9° | 179.7° |
| C39 | C44 | C43 | H44 | 179.2° | 179.7° |
| C39 | C44 | C45 | H45 | 37.9° | 25.7° |
| C40 | C39 | C44 | C43 | 0.5° | 0.5° |
| C39 | C40 | C41 | H41 | 180.0° | 180.0° |
| C39 | C40 | C41 | C42 | 0.0° | 0.0° |
| C40 | C39 | C38 | H40 | 173.5° | 138.9° |
| C39 | C40 | C41 | H42 | 180.0° | 180.0° |
| C44 | C43 | C42 | H44 | 180.0° | 179.7° |
| C44 | C43 | C42 | C41 | 0.8° | 0.3° |
| C44 | C43 | C42 | H43 | 179.2° | 179.8° |
| C43 | C44 | C45 | H45 | 142.3° | 154.6° |
| C30 | C31 | N6 | C27 | 45.2° | 63.5° |
| C30 | C31 | N6 | H27 | 120.6° | 119.9° |
| C30 | C31 | N6 | H28 | 120.6° | 120.0° |
| C30 | C31 | N6 | C17 | 150.0° | 172.2° |
| C31 | C30 | H25 | H26 | 118.6° | 120.2° |
| C30 | C31 | H27 | H28 | 118.3° | 120.0° |
| C27 | N6 | C31 | C17 | 164.9° | 124.3° |
| C27 | N6 | C17 | C18 | 3.8° | 180.0° |
| C27 | N6 | C17 | C16 | 172.2° | 0.0° |
| N6 | C27 | C28 | H13 | 67.1° | 176.8° |
| N6 | C27 | C28 | H14 | 173.4° | 62.9° |
| N6 | C27 | H23 | H24 | 117.8° | 120.0° |
| C27 | N6 | C31 | H27 | 75.4° | 56.4° |
| C27 | N6 | C31 | H28 | 165.7° | 176.5° |
| C40 | C41 | C42 | C43 | 0.3° | 0.0° |
| C40 | C41 | C42 | H42 | 180.0° | 180.0° |
| C40 | C41 | C42 | H43 | 179.7° | 180.0° |
| C31 | N6 | C17 | C18 | 167.7° | 55.5° |
| C31 | N6 | C17 | C16 | 8.3° | 124.5° |
| C31 | N6 | C27 | H23 | 167.7° | 176.5° |
| C31 | N6 | C27 | H24 | 73.7° | 56.5° |
| N6 | C31 | C30 | H25 | 171.2° | 176.8° |
| N6 | C31 | C30 | H26 | 69.7° | 63.0° |
| N6 | C31 | H27 | H28 | 118.3° | 120.1° |
| N6 | C17 | C18 | C16 | 176.1° | 180.0° |
| N6 | C17 | C18 | C19 | 178.6° | 179.7° |
| N6 | C17 | C16 | C15 | 178.5° | 180.0° |
| N6 | C17 | C16 | H19 | 1.6° | 0.0° |
| N6 | C17 | C18 | H20 | 1.5° | 0.0° |
| C17 | N6 | C27 | H23 | 27.4° | 52.2° |
| C17 | N6 | C27 | H24 | 91.1° | 67.7° |
| C17 | N6 | C31 | H27 | 89.5° | 67.8° |
| C17 | N6 | C31 | H28 | 29.4° | 52.3° |
| C43 | C42 | C41 | H43 | 180.0° | 179.9° |
| C43 | C42 | C41 | H42 | 179.7° | 180.0° |
| C17 | C18 | C19 | H20 | 180.0° | 179.7° |
| C17 | C18 | C19 | O7 | 178.7° | 180.0° |
| C17 | C18 | C19 | C14 | 0.3° | 0.2° |
| C18 | C17 | C16 | C15 | 2.4° | 0.0° |
| C18 | C17 | C16 | H19 | 177.6° | 180.0° |
| C19 | C18 | C17 | C16 | 2.5° | 0.3° |
| C18 | C19 | O7 | C14 | 179.0° | 179.7° |
| C18 | C19 | O7 | C20 | 104.6° | 3.9° |
| C18 | C19 | C14 | C15 | 1.9° | 0.1° |
| C18 | C19 | C14 | C13 | 179.7° | 180.0° |
| C42 | C41 | C40 | H41 | 180.0° | 179.9° |
| C41 | C42 | C43 | H44 | 179.2° | 180.0° |
| C17 | C16 | C15 | H19 | 180.0° | 180.0° |
| C17 | C16 | C15 | C14 | 0.2° | 0.3° |
| C17 | C16 | C15 | H9 | 179.8° | 180.0° |
| C16 | C17 | C18 | H20 | 177.6° | 179.9° |
| C19 | O7 | C20 | C21 | 174.5° | 85.8° |
| C19 | O7 | C20 | C26 | 5.2° | 94.4° |
| O7 | C19 | C14 | C15 | 179.2° | 179.7° |
| O7 | C19 | C14 | C13 | 0.7° | 0.2° |
| O7 | C19 | C18 | H20 | 1.3° | 0.3° |
| C20 | O7 | C19 | C14 | 76.4° | 175.8° |
| O7 | C20 | C21 | C26 | 179.7° | 179.8° |
| O7 | C20 | C21 | N4 | 178.7° | 179.7° |
| O7 | C20 | C26 | C25 | 178.7° | 179.7° |
| O7 | C20 | C21 | H10 | 1.3° | 0.2° |
| O7 | C20 | C26 | H12 | 1.3° | 0.2° |
| C19 | C14 | C15 | C16 | 1.9° | 0.4° |
| C19 | C14 | C15 | C13 | 178.5° | 179.9° |
| C19 | C14 | C13 | O6 | 28.6° | 0.0° |
| C19 | C14 | C13 | N3 | 151.9° | 179.9° |
| C19 | C14 | C15 | H9 | 178.1° | 180.0° |
| C14 | C19 | C18 | H20 | 179.7° | 179.9° |
| C16 | C15 | C14 | H9 | 180.0° | 179.7° |
| C16 | C15 | C14 | C13 | 179.6° | 179.7° |
| C20 | C21 | N4 | H10 | 180.0° | 180.0° |
| C20 | C21 | N4 | C22 | 0.9° | 0.0° |
| C21 | C20 | C26 | C25 | 1.0° | 0.0° |
| C21 | C20 | C26 | H12 | 179.0° | 180.0° |
| N4 | C21 | C20 | C26 | 1.0° | 0.0° |
| C21 | N4 | C22 | C25 | 0.9° | 0.0° |
| C21 | N4 | C22 | N5 | 179.6° | 180.0° |
| C20 | C26 | C25 | H12 | 180.0° | 180.0° |
| C20 | C26 | C25 | C22 | 0.9° | 0.0° |
| C20 | C26 | C25 | C24 | 180.0° | 180.0° |
| C26 | C20 | C21 | H10 | 179.0° | 180.0° |
| C15 | C14 | C13 | O6 | 152.9° | 180.0° |
| C15 | C14 | C13 | N3 | 26.5° | 0.0° |
| C14 | C15 | C16 | H19 | 179.8° | 179.7° |
| C14 | C13 | O6 | N3 | 179.5° | 180.0° |
| C14 | C13 | N3 | S1 | 174.8° | 180.0° |
| C14 | C13 | N3 | H1 | 5.3° | 0.0° |
| C13 | C14 | C15 | H9 | 0.4° | 0.1° |
| N4 | C22 | C25 | C26 | 0.9° | 0.0° |
| N4 | C22 | C25 | N5 | 178.8° | 180.0° |
| N4 | C22 | C25 | C24 | 179.7° | 180.0° |
| N4 | C22 | N5 | C23 | 179.6° | 179.9° |
| C22 | N4 | C21 | H10 | 179.0° | 180.0° |
| N4 | C22 | N5 | H53 | 0.4° | 0.0° |
| O6 | C13 | N3 | S1 | 5.7° | 0.0° |
| O6 | C13 | N3 | H1 | 174.2° | 180.0° |
| C13 | N3 | S1 | H1 | 180.0° | 180.0° |
| C13 | N3 | S1 | O4 | 52.4° | 178.6° |
| C13 | N3 | S1 | C3 | 64.7° | 65.0° |
| C13 | N3 | S1 | O5 | 177.7° | 48.6° |
| C26 | C25 | C22 | C24 | 179.4° | 180.0° |
| C26 | C25 | C22 | N5 | 179.7° | 180.0° |
| C26 | C25 | C24 | C23 | 179.9° | 180.0° |
| C26 | C25 | C24 | H11 | 0.1° | 0.0° |
| C25 | C22 | N5 | C23 | 0.7° | 0.1° |
| C22 | C25 | C24 | C23 | 0.6° | 0.0° |
| C22 | C25 | C24 | H11 | 179.3° | 180.0° |
| C22 | C25 | C26 | H12 | 179.1° | 180.0° |
| C25 | C22 | N5 | H53 | 179.3° | 180.0° |
| N5 | C22 | C25 | C24 | 0.9° | 0.0° |
| C22 | N5 | C23 | H53 | 180.0° | 179.9° |
| C22 | N5 | C23 | C24 | 0.3° | 0.1° |
| C22 | N5 | C23 | H22 | 179.6° | 179.9° |
| C25 | C24 | C23 | N5 | 0.2° | 0.1° |
| C25 | C24 | C23 | H11 | 180.0° | 179.9° |
| C24 | C25 | C26 | H12 | 0.1° | 0.0° |
| C25 | C24 | C23 | H22 | 179.8° | 180.0° |
| N3 | S1 | O4 | C3 | 116.5° | 114.1° |
| N3 | S1 | O4 | O5 | 123.6° | 122.9° |
| N3 | S1 | C3 | C4 | 96.0° | 90.0° |
| N3 | S1 | C3 | O5 | 112.9° | 113.6° |
| N3 | S1 | C3 | C2 | 84.6° | 90.0° |
| N5 | C23 | C24 | H22 | 180.0° | 180.0° |
| N5 | C23 | C24 | H11 | 179.8° | 180.0° |
| O4 | S1 | C3 | C4 | 24.2° | 23.6° |
| O4 | S1 | C3 | O5 | 126.9° | 132.9° |
| O4 | S1 | C3 | C2 | 155.2° | 156.5° |
| O4 | S1 | N3 | H1 | 127.6° | 1.4° |
| C24 | C23 | N5 | H53 | 179.7° | 180.0° |
| C5 | C4 | C3 | H2 | 180.0° | 179.8° |
| C5 | C4 | C3 | S1 | 179.0° | 180.0° |
| C4 | C5 | C6 | H3 | 180.0° | 180.0° |
| C5 | C4 | C3 | C2 | 0.5° | 0.0° |
| C4 | C5 | C6 | N2 | 179.8° | 180.0° |
| C4 | C5 | C6 | C1 | 0.8° | 0.0° |
| C4 | C3 | S1 | C2 | 179.5° | 180.0° |
| C4 | C3 | S1 | O5 | 151.1° | 156.5° |
| C3 | C4 | C5 | C6 | 0.8° | 0.0° |
| C4 | C3 | C2 | C1 | 0.2° | 0.0° |
| C3 | C4 | C5 | H3 | 179.2° | 180.0° |
| C4 | C3 | C2 | H21 | 179.9° | 180.0° |
| S1 | C3 | C2 | C1 | 179.3° | 180.0° |
| C3 | S1 | N3 | H1 | 115.3° | 115.0° |
| S1 | C3 | C4 | H2 | 1.1° | 0.2° |
| S1 | C3 | C2 | H21 | 0.7° | 0.1° |
| O5 | S1 | C3 | C2 | 28.3° | 23.6° |
| O5 | S1 | N3 | H1 | 2.3° | 131.4° |
| C5 | C6 | N2 | C7 | 6.2° | 6.2° |
| C5 | C6 | N2 | C1 | 179.4° | 180.0° |
| C5 | C6 | C1 | C2 | 0.4° | 0.0° |
| C5 | C6 | C1 | N1 | 179.9° | 180.0° |
| C6 | C5 | C4 | H2 | 179.2° | 179.8° |
| C5 | C6 | N2 | H52 | 128.3° | 173.8° |
| C3 | C2 | C1 | C6 | 0.1° | 0.0° |
| C3 | C2 | C1 | H21 | 180.0° | 179.9° |
| C3 | C2 | C1 | N1 | 179.8° | 180.0° |
| C2 | C3 | C4 | H2 | 179.5° | 179.8° |
| N2 | C7 | C8 | H4 | 120.3° | 120.0° |
| N2 | C7 | C8 | H5 | 120.3° | 120.0° |
| C7 | N2 | C6 | H52 | 122.1° | 180.0° |
| C7 | N2 | C6 | C1 | 173.2° | 173.8° |
| N2 | C7 | C8 | C9 | 175.3° | 65.5° |
| N2 | C7 | C8 | C12 | 53.0° | 175.0° |
| N2 | C7 | H4 | H5 | 119.2° | 120.0° |
| N2 | C7 | C8 | H6 | 65.9° | 54.9° |
| C8 | C7 | N2 | C6 | 171.1° | 180.0° |
| C7 | C8 | C9 | C12 | 124.0° | 119.9° |
| C7 | C8 | C9 | H6 | 118.8° | 120.3° |
| C7 | C8 | C9 | C10 | 176.8° | 176.8° |
| C7 | C8 | C12 | H6 | 118.9° | 120.2° |
| C7 | C8 | C12 | C11 | 176.7° | 176.9° |
| C8 | C7 | H4 | H5 | 119.2° | 120.0° |
| C7 | C8 | C12 | H17 | 63.0° | 63.2° |
| C7 | C8 | C12 | H18 | 56.5° | 57.0° |
| C7 | C8 | C9 | H50 | 56.6° | 56.9° |
| C7 | C8 | C9 | H51 | 63.1° | 63.3° |
| C8 | C7 | N2 | H52 | 66.9° | 0.0° |
| N2 | C6 | C1 | C2 | 179.9° | 180.0° |
| N2 | C6 | C1 | N1 | 0.5° | 0.0° |
| N2 | C6 | C5 | H3 | 0.2° | 0.0° |
| C6 | N2 | C7 | H4 | 68.6° | 60.0° |
| C6 | N2 | C7 | H5 | 50.8° | 60.0° |
| C6 | C1 | C2 | N1 | 179.6° | 180.0° |
| C6 | C1 | N1 | O2 | 179.3° | 144.0° |
| C6 | C1 | N1 | O1 | 0.9° | 36.2° |
| C1 | C6 | C5 | H3 | 179.2° | 180.0° |
| C6 | C1 | C2 | H21 | 179.9° | 180.0° |
| C1 | C6 | N2 | H52 | 51.1° | 6.2° |
| C8 | C9 | C10 | H50 | 120.1° | 120.0° |
| C8 | C9 | C10 | H51 | 120.1° | 119.9° |
| C9 | C8 | C12 | H6 | 117.2° | 119.9° |
| C8 | C9 | C10 | O3 | 57.1° | 57.7° |
| C9 | C8 | C12 | C11 | 52.9° | 57.0° |
| C9 | C8 | C7 | H4 | 55.0° | 54.6° |
| C9 | C8 | C7 | H5 | 64.4° | 174.5° |
| C8 | C9 | C10 | H7 | 177.5° | 177.6° |
| C8 | C9 | C10 | H8 | 63.3° | 62.4° |
| C9 | C8 | C12 | H17 | 173.1° | 176.9° |
| C9 | C8 | C12 | H18 | 67.3° | 62.9° |
| C8 | C9 | H50 | H51 | 119.6° | 120.2° |
| C10 | C9 | C8 | C12 | 52.8° | 57.0° |
| C9 | C10 | O3 | H7 | 120.4° | 120.0° |
| C9 | C10 | O3 | H8 | 120.4° | 119.9° |
| C9 | C10 | O3 | C11 | 60.2° | 61.2° |
| C10 | C9 | C8 | H6 | 64.4° | 62.9° |
| C9 | C10 | H7 | H8 | 118.9° | 120.0° |
| C10 | C9 | H50 | H51 | 119.6° | 120.1° |
| C2 | C1 | N1 | O2 | 0.3° | 36.0° |
| C2 | C1 | N1 | O1 | 179.5° | 143.8° |
| C8 | C12 | C11 | H17 | 120.2° | 119.9° |
| C8 | C12 | C11 | H18 | 120.2° | 119.9° |
| C8 | C12 | C11 | O3 | 56.8° | 57.6° |
| C12 | C8 | C7 | H4 | 67.3° | 65.0° |
| C12 | C8 | C7 | H5 | 173.3° | 55.0° |
| C8 | C12 | C11 | H15 | 63.5° | 62.4° |
| C8 | C12 | C11 | H16 | 177.1° | 177.6° |
| C8 | C12 | H17 | H18 | 119.4° | 120.2° |
| C12 | C8 | C9 | H50 | 67.4° | 62.9° |
| C12 | C8 | C9 | H51 | 173.0° | 176.9° |
| C1 | N1 | O2 | O1 | 179.8° | 179.8° |
| N1 | C1 | C2 | H21 | 0.2° | 0.0° |
| C10 | O3 | C11 | C12 | 59.7° | 61.2° |
| O3 | C10 | H7 | H8 | 118.8° | 120.1° |
| C10 | O3 | C11 | H15 | 60.6° | 58.8° |
| C10 | O3 | C11 | H16 | 180.0° | 178.9° |
| O3 | C10 | C9 | H50 | 63.0° | 62.3° |
| O3 | C10 | C9 | H51 | 177.2° | 177.5° |
| C12 | C11 | O3 | H15 | 120.3° | 120.0° |
| C12 | C11 | O3 | H16 | 120.3° | 119.9° |
| C11 | C12 | C8 | H6 | 64.3° | 63.0° |
| C12 | C11 | H15 | H16 | 119.0° | 120.0° |
| C11 | C12 | H17 | H18 | 119.4° | 120.1° |
| C11 | O3 | C10 | H7 | 179.5° | 178.8° |
| C11 | O3 | C10 | H8 | 60.2° | 58.8° |
| O3 | C11 | H15 | H16 | 119.1° | 120.0° |
| O3 | C11 | C12 | H17 | 177.0° | 177.5° |
| O3 | C11 | C12 | H18 | 63.4° | 62.3° |
| H2 | C4 | C5 | H3 | 0.9° | 0.3° |
| H4 | C7 | C8 | H6 | 173.8° | 174.9° |
| H4 | C7 | N2 | H52 | 53.4° | 120.0° |
| H5 | C7 | C8 | H6 | 54.4° | 65.1° |
| H5 | C7 | N2 | H52 | 172.9° | 120.0° |
| H6 | C8 | C12 | H17 | 55.9° | 56.9° |
| H6 | C8 | C12 | H18 | 175.5° | 177.1° |
| H6 | C8 | C9 | H50 | 175.4° | 177.2° |
| H6 | C8 | C9 | H51 | 55.7° | 57.0° |
| H7 | C10 | C9 | H50 | 57.3° | 57.6° |
| H7 | C10 | C9 | H51 | 62.4° | 62.5° |
| H8 | C10 | C9 | H50 | 176.6° | 177.7° |
| H8 | C10 | C9 | H51 | 56.9° | 57.5° |
| H9 | C15 | C16 | H19 | 0.2° | 0.0° |
| H11 | C24 | C23 | H22 | 0.2° | 0.0° |
| H13 | C28 | C27 | H23 | 53.6° | 63.2° |
| H13 | C28 | C27 | H24 | 172.2° | 56.7° |
| H14 | C28 | C27 | H23 | 66.0° | 57.1° |
| H14 | C28 | C27 | H24 | 52.6° | 177.1° |
| H15 | C11 | C12 | H17 | 56.7° | 57.5° |
| H15 | C11 | C12 | H18 | 176.3° | 177.7° |
| H16 | C11 | C12 | H17 | 62.7° | 62.5° |
| H16 | C11 | C12 | H18 | 56.9° | 57.7° |
| H22 | C23 | N5 | H53 | 0.4° | 0.0° |
| H25 | C30 | C31 | H27 | 50.6° | 56.8° |
| H25 | C30 | C31 | H28 | 68.2° | 63.2° |
| H26 | C30 | C31 | H27 | 169.7° | 177.1° |
| H26 | C30 | C31 | H28 | 50.8° | 57.1° |
| H29 | C32 | C33 | H31 | 151.7° | 25.2° |
| H30 | C32 | C33 | H31 | 24.5° | 156.1° |
| H31 | C33 | C34 | H32 | 24.5° | 156.0° |
| H31 | C33 | C34 | H33 | 151.7° | 25.1° |
| H34 | C35 | C36 | H36 | 107.0° | 144.4° |
| H34 | C35 | C36 | H37 | 14.4° | 21.2° |
| H35 | C35 | C36 | H36 | 14.5° | 23.4° |
| H35 | C35 | C36 | H37 | 135.9° | 99.8° |
| H36 | C36 | C37 | H38 | 13.8° | 35.3° |
| H36 | C36 | C37 | H39 | 135.4° | 159.1° |
| H37 | C36 | C37 | H38 | 107.6° | 87.9° |
| H37 | C36 | C37 | H39 | 14.0° | 35.9° |
| H38 | C37 | C38 | H40 | 40.7° | 36.2° |
| H39 | C37 | C38 | H40 | 162.3° | 160.0° |
| H41 | C40 | C41 | H42 | 0.0° | 0.1° |
| H42 | C41 | C42 | H43 | 0.3° | 0.0° |
| H43 | C42 | C43 | H44 | 0.7° | 0.1° |
| H45 | C45 | C46 | H46 | 146.0° | 145.1° |
| H45 | C45 | C46 | H47 | 5.4° | 0.1° |
| H45 | C45 | C47 | H48 | 145.9° | 0.0° |
| H45 | C45 | C47 | H49 | 5.1° | 145.0° |
| H46 | C46 | C47 | H48 | 0.1° | 145.0° |
| H46 | C46 | C47 | H49 | 140.7° | 0.0° |
| H47 | C46 | C47 | H48 | 140.8° | 0.0° |
| H47 | C46 | C47 | H49 | 0.1° | 145.0° |
