A1B0X
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C3 | C4 | doub | 1.38Å | 1.38Å | Aromatic |
| C3 | C2 | sing | 1.38Å | 1.38Å | Aromatic |
| F1 | C2 | sing | 1.35Å | 1.35Å | |
| C4 | C5 | sing | 1.38Å | 1.39Å | Aromatic |
| C2 | C1 | doub | 1.39Å | 1.39Å | Aromatic |
| C65 | C66 | sing | 1.51Å | 1.52Å | |
| C65 | C7 | sing | 1.53Å | 1.52Å | |
| O13 | C66 | doub | 1.21Å | 1.19Å | |
| C66 | N9 | sing | 1.35Å | 1.46Å | |
| C5 | C7 | sing | 1.51Å | 1.50Å | |
| C5 | C6 | doub | 1.38Å | 1.38Å | Aromatic |
| C1 | C6 | sing | 1.38Å | 1.38Å | Aromatic |
| C1 | CL1 | sing | 1.74Å | 1.78Å | |
| C7 | N1 | sing | 1.46Å | 1.45Å | |
| N1 | C8 | sing | 1.35Å | 1.44Å | |
| O1 | C8 | doub | 1.22Å | 1.19Å | |
| C8 | C9 | sing | 1.47Å | 1.52Å | |
| C9 | C18 | doub | 1.38Å | 1.38Å | Aromatic |
| C9 | C10 | sing | 1.47Å | 1.40Å | Aromatic |
| C18 | N2 | sing | 1.34Å | 1.39Å | Aromatic |
| F2 | C12 | sing | 1.35Å | 1.37Å | |
| C12 | C13 | doub | 1.38Å | 1.40Å | Aromatic |
| C12 | C11 | sing | 1.40Å | 1.38Å | Aromatic |
| C13 | C14 | sing | 1.38Å | 1.39Å | Aromatic |
| C10 | C11 | sing | 1.48Å | 1.44Å | |
| C10 | C17 | doub | 1.39Å | 1.36Å | Aromatic |
| C11 | C16 | doub | 1.40Å | 1.40Å | Aromatic |
| C14 | CL2 | sing | 1.74Å | 1.79Å | |
| C14 | C15 | doub | 1.39Å | 1.39Å | Aromatic |
| N2 | C17 | sing | 1.38Å | 1.40Å | Aromatic |
| C16 | C15 | sing | 1.38Å | 1.39Å | Aromatic |
| C17 | C19 | sing | 1.41Å | 1.45Å | |
| C19 | C20 | doub | 1.36Å | 1.35Å | |
| C20 | C21 | sing | 1.41Å | 1.47Å | |
| C21 | O2 | doub | 1.22Å | 1.25Å | |
| C21 | N3 | sing | 1.35Å | 1.34Å | |
| N3 | C22 | sing | 1.46Å | 1.46Å | |
| C22 | C23 | sing | 1.53Å | 1.52Å | |
| C23 | O3 | sing | 1.43Å | 1.41Å | |
| C24 | O3 | sing | 1.43Å | 1.42Å | |
| C24 | C25 | sing | 1.53Å | 1.53Å | |
| C25 | O4 | sing | 1.43Å | 1.42Å | |
| O4 | C26 | sing | 1.43Å | 1.42Å | |
| C26 | C27 | sing | 1.53Å | 1.53Å | |
| C27 | O5 | sing | 1.43Å | 1.42Å | |
| O5 | C28 | sing | 1.43Å | 1.42Å | |
| C29 | C28 | sing | 1.53Å | 1.54Å | |
| C29 | O6 | sing | 1.43Å | 1.41Å | |
| O6 | C30 | sing | 1.43Å | 1.43Å | |
| C30 | C31 | sing | 1.53Å | 1.52Å | |
| O10 | C38 | doub | 1.22Å | 1.23Å | |
| C37 | N4 | sing | 1.46Å | 1.46Å | |
| C37 | C36 | sing | 1.53Å | 1.53Å | |
| C31 | O7 | sing | 1.43Å | 1.43Å | |
| C38 | N4 | sing | 1.35Å | 1.34Å | |
| C38 | C39 | sing | 1.48Å | 1.52Å | |
| O7 | C32 | sing | 1.43Å | 1.42Å | |
| C32 | C33 | sing | 1.53Å | 1.54Å | |
| C36 | O9 | sing | 1.43Å | 1.42Å | |
| O9 | C35 | sing | 1.43Å | 1.42Å | |
| C44 | C39 | doub | 1.40Å | 1.38Å | Aromatic |
| C44 | C43 | sing | 1.38Å | 1.39Å | Aromatic |
| C39 | C40 | sing | 1.40Å | 1.41Å | Aromatic |
| C43 | C42 | doub | 1.38Å | 1.41Å | Aromatic |
| C35 | C34 | sing | 1.53Å | 1.52Å | |
| C34 | O8 | sing | 1.43Å | 1.42Å | |
| C33 | O8 | sing | 1.43Å | 1.41Å | |
| C40 | C41 | doub | 1.39Å | 1.39Å | Aromatic |
| C42 | C41 | sing | 1.40Å | 1.38Å | Aromatic |
| C42 | F3 | sing | 1.35Å | 1.34Å | |
| C41 | C45 | sing | 1.48Å | 1.45Å | |
| C45 | C46 | doub | 1.39Å | 1.40Å | Aromatic |
| C45 | C64 | sing | 1.39Å | 1.42Å | Aromatic |
| C46 | C47 | sing | 1.39Å | 1.39Å | Aromatic |
| F6 | C54 | sing | 1.40Å | 1.36Å | |
| O11 | C48 | doub | 1.22Å | 1.18Å | |
| N6 | C53 | doub | 1.30Å | 1.45Å | |
| N6 | C52 | sing | 1.34Å | 1.49Å | |
| C53 | C49 | sing | 1.46Å | 1.51Å | |
| O12 | C52 | doub | 1.21Å | 1.18Å | |
| C52 | C51 | sing | 1.51Å | 1.51Å | |
| C48 | C49 | sing | 1.48Å | 1.50Å | |
| C48 | N5 | sing | 1.35Å | 1.41Å | |
| C49 | C50 | doub | 1.36Å | 1.47Å | |
| C64 | C63 | doub | 1.38Å | 1.40Å | Aromatic |
| C51 | C50 | sing | 1.52Å | 1.48Å | |
| C50 | C54 | sing | 1.51Å | 1.51Å | |
| C47 | N5 | sing | 1.40Å | 1.45Å | |
| C47 | C55 | doub | 1.40Å | 1.39Å | Aromatic |
| C54 | F4 | sing | 1.40Å | 1.34Å | |
| C54 | F5 | sing | 1.40Å | 1.36Å | |
| C63 | C55 | sing | 1.39Å | 1.39Å | Aromatic |
| C55 | N7 | sing | 1.40Å | 1.49Å | |
| N7 | C59 | sing | 1.47Å | 1.47Å | |
| N7 | C56 | sing | 1.47Å | 1.44Å | |
| C59 | C58 | sing | 1.53Å | 1.55Å | |
| C56 | C57 | sing | 1.53Å | 1.58Å | |
| C60 | C58 | sing | 1.53Å | 1.59Å | |
| C58 | N8 | sing | 1.47Å | 1.42Å | |
| C57 | N8 | sing | 1.47Å | 1.39Å | |
| C57 | C62 | sing | 1.53Å | 1.57Å | |
| N8 | C61 | sing | 1.47Å | 1.32Å | |
| C13 | H1 | sing | 1.08Å | 1.08Å | |
| C15 | H2 | sing | 1.08Å | 1.08Å | |
| C16 | H3 | sing | 1.08Å | 1.08Å | |
| C18 | H4 | sing | 1.08Å | 1.08Å | |
| C19 | H5 | sing | 1.08Å | 1.08Å | |
| C20 | H6 | sing | 1.08Å | 1.08Å | |
| C22 | H7 | sing | 1.09Å | 1.10Å | |
| C22 | H8 | sing | 1.09Å | 1.10Å | |
| C23 | H9 | sing | 1.09Å | 1.10Å | |
| C23 | H10 | sing | 1.09Å | 1.10Å | |
| C24 | H11 | sing | 1.09Å | 1.10Å | |
| C24 | H12 | sing | 1.09Å | 1.10Å | |
| C25 | H13 | sing | 1.09Å | 1.10Å | |
| C25 | H14 | sing | 1.09Å | 1.10Å | |
| C26 | H15 | sing | 1.09Å | 1.10Å | |
| C26 | H16 | sing | 1.09Å | 1.10Å | |
| C27 | H17 | sing | 1.09Å | 1.10Å | |
| C27 | H18 | sing | 1.09Å | 1.10Å | |
| C28 | H19 | sing | 1.09Å | 1.10Å | |
| C28 | H20 | sing | 1.09Å | 1.10Å | |
| C29 | H21 | sing | 1.09Å | 1.10Å | |
| C29 | H22 | sing | 1.09Å | 1.10Å | |
| C3 | H23 | sing | 1.08Å | 1.08Å | |
| C30 | H24 | sing | 1.09Å | 1.10Å | |
| C30 | H25 | sing | 1.09Å | 1.10Å | |
| C31 | H26 | sing | 1.09Å | 1.10Å | |
| C31 | H27 | sing | 1.09Å | 1.10Å | |
| C32 | H28 | sing | 1.09Å | 1.10Å | |
| C32 | H29 | sing | 1.09Å | 1.10Å | |
| C33 | 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 | |
| C4 | H40 | sing | 1.08Å | 1.08Å | |
| C40 | H41 | sing | 1.08Å | 1.08Å | |
| C43 | H42 | sing | 1.08Å | 1.08Å | |
| C44 | H43 | sing | 1.08Å | 1.08Å | |
| C46 | H44 | sing | 1.08Å | 1.08Å | |
| C51 | H45 | sing | 1.09Å | 1.10Å | |
| C51 | H46 | sing | 1.09Å | 1.10Å | |
| C53 | H47 | sing | 1.08Å | 1.08Å | |
| C56 | H48 | sing | 1.09Å | 1.10Å | |
| C56 | H49 | sing | 1.09Å | 1.10Å | |
| C57 | H50 | sing | 1.09Å | 1.10Å | |
| C58 | H51 | sing | 1.09Å | 1.10Å | |
| C59 | H52 | sing | 1.09Å | 1.10Å | |
| C59 | H53 | sing | 1.09Å | 1.10Å | |
| C6 | H54 | sing | 1.08Å | 1.08Å | |
| C60 | H55 | sing | 1.09Å | 1.10Å | |
| C60 | H56 | sing | 1.09Å | 1.10Å | |
| C60 | H57 | sing | 1.09Å | 1.10Å | |
| C61 | H58 | sing | 1.09Å | 1.10Å | |
| C61 | H59 | sing | 1.09Å | 1.10Å | |
| C61 | H60 | sing | 1.09Å | 1.10Å | |
| C62 | H61 | sing | 1.09Å | 1.10Å | |
| C62 | H62 | sing | 1.09Å | 1.10Å | |
| C62 | H63 | sing | 1.09Å | 1.10Å | |
| C63 | H64 | sing | 1.08Å | 1.08Å | |
| C64 | H65 | sing | 1.08Å | 1.08Å | |
| C65 | H66 | sing | 1.09Å | 1.10Å | |
| C65 | H67 | sing | 1.09Å | 1.10Å | |
| C7 | H68 | sing | 1.09Å | 1.10Å | |
| N1 | H69 | sing | 0.97Å | 1.00Å | |
| N2 | H70 | sing | 0.97Å | 1.00Å | |
| N3 | H71 | sing | 0.97Å | 1.00Å | |
| N4 | H72 | sing | 0.97Å | 1.00Å | |
| N5 | H73 | sing | 0.97Å | 1.00Å | |
| N9 | H75 | sing | 0.97Å | 1.00Å | |
| N9 | H76 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C4 | C3 | C2 | 119.0° | 120.0° |
| C3 | C4 | C5 | 119.3° | 120.0° |
| C4 | C3 | H23 | 120.5° | 120.0° |
| C3 | C4 | H40 | 120.4° | 119.9° |
| C3 | C2 | F1 | 119.4° | 120.0° |
| C3 | C2 | C1 | 121.8° | 120.0° |
| C2 | C3 | H23 | 120.5° | 120.0° |
| F1 | C2 | C1 | 118.8° | 120.0° |
| C4 | C5 | C7 | 119.2° | 119.9° |
| C4 | C5 | C6 | 121.7° | 120.1° |
| C5 | C4 | H40 | 120.4° | 120.0° |
| C2 | C1 | C6 | 118.9° | 119.9° |
| C2 | C1 | CL1 | 118.8° | 120.0° |
| C66 | C65 | C7 | 112.3° | 109.5° |
| C65 | C66 | O13 | 117.9° | 120.0° |
| C65 | C66 | N9 | 118.8° | 120.0° |
| C66 | C65 | H66 | 108.7° | 109.5° |
| C66 | C65 | H67 | 108.8° | 109.4° |
| C65 | C7 | C5 | 109.8° | 109.4° |
| C65 | C7 | N1 | 107.8° | 109.5° |
| C7 | C65 | H66 | 108.7° | 109.5° |
| C7 | C65 | H67 | 108.7° | 109.5° |
| C65 | C7 | H68 | 109.8° | 109.5° |
| O13 | C66 | N9 | 123.3° | 120.0° |
| C66 | N9 | H75 | 120.0° | 120.0° |
| C66 | N9 | H76 | 120.0° | 120.0° |
| C7 | C5 | C6 | 119.0° | 120.0° |
| C5 | C7 | N1 | 108.6° | 109.5° |
| C5 | C7 | H68 | 110.0° | 109.5° |
| C5 | C6 | C1 | 119.3° | 120.0° |
| C5 | C6 | H54 | 120.3° | 120.0° |
| C6 | C1 | CL1 | 122.2° | 120.1° |
| C1 | C6 | H54 | 120.4° | 120.0° |
| C7 | N1 | C8 | 117.4° | 120.0° |
| N1 | C7 | H68 | 110.7° | 109.5° |
| C7 | N1 | H69 | 121.3° | 120.0° |
| N1 | C8 | O1 | 120.7° | 120.0° |
| N1 | C8 | C9 | 116.7° | 120.0° |
| C8 | N1 | H69 | 121.3° | 120.0° |
| O1 | C8 | C9 | 122.5° | 120.0° |
| C8 | C9 | C18 | 125.3° | 126.8° |
| C8 | C9 | C10 | 127.6° | 126.8° |
| C18 | C9 | C10 | 107.0° | 106.4° |
| C9 | C18 | N2 | 106.7° | 109.2° |
| C9 | C18 | H4 | 126.6° | 125.4° |
| C9 | C10 | C11 | 124.2° | 127.1° |
| C9 | C10 | C17 | 110.7° | 105.8° |
| C18 | N2 | C17 | 110.1° | 110.5° |
| N2 | C18 | H4 | 126.7° | 125.4° |
| C18 | N2 | H70 | 124.9° | 124.7° |
| F2 | C12 | C13 | 119.0° | 120.0° |
| F2 | C12 | C11 | 122.1° | 120.1° |
| C13 | C12 | C11 | 118.9° | 119.8° |
| C12 | C13 | C14 | 119.7° | 120.1° |
| C12 | C13 | H1 | 120.2° | 120.0° |
| C12 | C11 | C10 | 123.5° | 120.1° |
| C12 | C11 | C16 | 121.2° | 119.7° |
| C13 | C14 | CL2 | 119.4° | 119.8° |
| C13 | C14 | C15 | 121.8° | 120.3° |
| C14 | C13 | H1 | 120.1° | 119.9° |
| C11 | C10 | C17 | 125.0° | 127.1° |
| C10 | C11 | C16 | 115.3° | 120.1° |
| C10 | C17 | N2 | 105.1° | 108.1° |
| C10 | C17 | C19 | 126.6° | 126.0° |
| C11 | C16 | C15 | 120.0° | 119.9° |
| C11 | C16 | H3 | 120.0° | 120.1° |
| CL2 | C14 | C15 | 118.9° | 119.8° |
| C14 | C15 | C16 | 118.4° | 120.2° |
| C14 | C15 | H2 | 120.8° | 119.9° |
| N2 | C17 | C19 | 128.3° | 126.0° |
| C17 | N2 | H70 | 125.0° | 124.8° |
| C16 | C15 | H2 | 120.8° | 119.9° |
| C15 | C16 | H3 | 120.0° | 120.0° |
| C17 | C19 | C20 | 134.0° | 120.0° |
| C17 | C19 | H5 | 113.0° | 120.0° |
| C19 | C20 | C21 | 121.2° | 120.1° |
| C20 | C19 | H5 | 113.0° | 120.0° |
| C19 | C20 | H6 | 119.4° | 119.9° |
| C20 | C21 | O2 | 128.6° | 119.9° |
| C20 | C21 | N3 | 109.5° | 120.0° |
| C21 | C20 | H6 | 119.4° | 120.0° |
| O2 | C21 | N3 | 121.4° | 120.0° |
| C21 | N3 | C22 | 124.0° | 120.0° |
| C21 | N3 | H71 | 118.0° | 120.0° |
| N3 | C22 | C23 | 110.4° | 109.5° |
| N3 | C22 | H7 | 109.2° | 109.5° |
| N3 | C22 | H8 | 109.2° | 109.5° |
| C22 | N3 | H71 | 118.0° | 120.0° |
| C22 | C23 | O3 | 108.1° | 109.5° |
| C23 | C22 | H7 | 109.3° | 109.5° |
| C23 | C22 | H8 | 109.3° | 109.4° |
| C22 | C23 | H9 | 109.8° | 109.4° |
| C22 | C23 | H10 | 109.8° | 109.5° |
| C23 | O3 | C24 | 113.8° | 114.0° |
| O3 | C23 | H9 | 109.8° | 109.5° |
| O3 | C23 | H10 | 109.8° | 109.5° |
| O3 | C24 | C25 | 106.5° | 109.5° |
| O3 | C24 | H11 | 110.2° | 109.4° |
| O3 | C24 | H12 | 110.2° | 109.5° |
| C24 | C25 | O4 | 106.7° | 109.4° |
| C25 | C24 | H11 | 110.2° | 109.4° |
| C25 | C24 | H12 | 110.2° | 109.5° |
| C24 | C25 | H13 | 110.2° | 109.5° |
| C24 | C25 | H14 | 110.2° | 109.5° |
| C25 | O4 | C26 | 114.7° | 114.0° |
| O4 | C25 | H13 | 110.2° | 109.5° |
| O4 | C25 | H14 | 110.2° | 109.5° |
| O4 | C26 | C27 | 111.1° | 109.4° |
| O4 | C26 | H15 | 109.0° | 109.5° |
| O4 | C26 | H16 | 109.1° | 109.4° |
| C26 | C27 | O5 | 110.7° | 109.5° |
| C27 | C26 | H15 | 109.1° | 109.5° |
| C27 | C26 | H16 | 109.1° | 109.5° |
| C26 | C27 | H17 | 109.1° | 109.5° |
| C26 | C27 | H18 | 109.1° | 109.5° |
| C27 | O5 | C28 | 113.6° | 114.0° |
| O5 | C27 | H17 | 109.2° | 109.4° |
| O5 | C27 | H18 | 109.2° | 109.5° |
| O5 | C28 | C29 | 114.4° | 109.5° |
| O5 | C28 | H19 | 108.2° | 109.4° |
| O5 | C28 | H20 | 108.2° | 109.5° |
| C28 | C29 | O6 | 110.6° | 109.4° |
| C29 | C28 | H19 | 108.2° | 109.4° |
| C29 | C28 | H20 | 108.3° | 109.5° |
| C28 | C29 | H21 | 109.2° | 109.5° |
| C28 | C29 | H22 | 109.2° | 109.5° |
| C29 | O6 | C30 | 111.0° | 114.0° |
| O6 | C29 | H21 | 109.2° | 109.5° |
| O6 | C29 | H22 | 109.2° | 109.5° |
| O6 | C30 | C31 | 108.4° | 109.4° |
| O6 | C30 | H24 | 109.7° | 109.5° |
| O6 | C30 | H25 | 109.7° | 109.5° |
| C30 | C31 | O7 | 108.5° | 109.5° |
| C31 | C30 | H24 | 109.7° | 109.5° |
| C31 | C30 | H25 | 109.7° | 109.4° |
| C30 | C31 | H26 | 109.7° | 109.5° |
| C30 | C31 | H27 | 109.7° | 109.5° |
| O10 | C38 | N4 | 122.3° | 120.0° |
| O10 | C38 | C39 | 123.1° | 120.0° |
| N4 | C37 | C36 | 110.0° | 109.5° |
| C37 | N4 | C38 | 125.7° | 120.0° |
| N4 | C37 | H38 | 109.3° | 109.5° |
| N4 | C37 | H39 | 109.3° | 109.4° |
| C37 | N4 | H72 | 117.2° | 120.0° |
| C37 | C36 | O9 | 107.0° | 109.5° |
| C37 | C36 | H36 | 110.1° | 109.5° |
| C37 | C36 | H37 | 110.1° | 109.5° |
| C36 | C37 | H38 | 109.3° | 109.5° |
| C36 | C37 | H39 | 109.3° | 109.5° |
| C31 | O7 | C32 | 114.2° | 114.0° |
| O7 | C31 | H26 | 109.7° | 109.5° |
| O7 | C31 | H27 | 109.7° | 109.4° |
| N4 | C38 | C39 | 114.5° | 120.0° |
| C38 | N4 | H72 | 117.2° | 120.0° |
| C38 | C39 | C44 | 120.5° | 120.1° |
| C38 | C39 | C40 | 119.3° | 120.1° |
| O7 | C32 | C33 | 111.3° | 109.4° |
| O7 | C32 | H28 | 109.0° | 109.5° |
| O7 | C32 | H29 | 109.0° | 109.5° |
| C32 | C33 | O8 | 113.5° | 109.5° |
| C33 | C32 | H28 | 109.0° | 109.5° |
| C33 | C32 | H29 | 109.0° | 109.4° |
| C32 | C33 | H30 | 108.4° | 109.5° |
| C32 | C33 | H31 | 108.4° | 109.4° |
| C36 | O9 | C35 | 114.9° | 114.0° |
| O9 | C36 | H36 | 110.1° | 109.5° |
| O9 | C36 | H37 | 110.1° | 109.4° |
| O9 | C35 | C34 | 106.4° | 109.5° |
| O9 | C35 | H34 | 110.2° | 109.5° |
| O9 | C35 | H35 | 110.2° | 109.5° |
| C39 | C44 | C43 | 119.3° | 120.2° |
| C44 | C39 | C40 | 120.3° | 119.8° |
| C39 | C44 | H43 | 120.3° | 119.9° |
| C44 | C43 | C42 | 120.3° | 120.2° |
| C44 | C43 | H42 | 119.8° | 119.9° |
| C43 | C44 | H43 | 120.3° | 120.0° |
| C39 | C40 | C41 | 120.3° | 119.8° |
| C39 | C40 | H41 | 119.8° | 120.1° |
| C43 | C42 | C41 | 120.4° | 120.1° |
| C43 | C42 | F3 | 119.2° | 119.9° |
| C42 | C43 | H42 | 119.9° | 119.9° |
| C35 | C34 | O8 | 107.3° | 109.5° |
| C35 | C34 | H32 | 110.0° | 109.5° |
| C35 | C34 | H33 | 110.0° | 109.5° |
| C34 | C35 | H34 | 110.2° | 109.4° |
| C34 | C35 | H35 | 110.2° | 109.5° |
| C34 | O8 | C33 | 112.6° | 114.0° |
| O8 | C34 | H32 | 110.0° | 109.5° |
| O8 | C34 | H33 | 110.0° | 109.4° |
| O8 | C33 | H30 | 108.5° | 109.5° |
| O8 | C33 | H31 | 108.5° | 109.5° |
| C40 | C41 | C42 | 119.3° | 119.9° |
| C40 | C41 | C45 | 115.7° | 120.1° |
| C41 | C40 | H41 | 119.9° | 120.1° |
| C41 | C42 | F3 | 120.3° | 120.0° |
| C42 | C41 | C45 | 124.9° | 120.0° |
| C41 | C45 | C46 | 119.7° | 120.0° |
| C41 | C45 | C64 | 120.5° | 120.0° |
| C46 | C45 | C64 | 119.7° | 119.9° |
| C45 | C46 | C47 | 119.2° | 119.9° |
| C45 | C46 | H44 | 120.4° | 120.0° |
| C45 | C64 | C63 | 120.2° | 120.1° |
| C45 | C64 | H65 | 119.9° | 120.0° |
| C46 | C47 | N5 | 115.6° | 120.0° |
| C46 | C47 | C55 | 121.0° | 119.9° |
| C47 | C46 | H44 | 120.4° | 120.1° |
| F6 | C54 | C50 | 109.6° | 109.4° |
| F6 | C54 | F4 | 110.5° | 109.5° |
| F6 | C54 | F5 | 114.1° | 109.5° |
| O11 | C48 | C49 | 122.6° | 120.0° |
| O11 | C48 | N5 | 123.8° | 120.0° |
| C53 | N6 | C52 | 120.7° | 122.9° |
| N6 | C53 | C49 | 118.7° | 123.2° |
| N6 | C53 | H47 | 120.6° | 118.3° |
| N6 | C52 | O12 | 118.1° | 120.5° |
| N6 | C52 | C51 | 120.6° | 119.1° |
| C53 | C49 | C48 | 114.3° | 119.9° |
| C53 | C49 | C50 | 121.5° | 120.3° |
| C49 | C53 | H47 | 120.7° | 118.4° |
| O12 | C52 | C51 | 121.3° | 120.5° |
| C52 | C51 | C50 | 118.6° | 117.2° |
| C52 | C51 | H45 | 107.1° | 107.9° |
| C52 | C51 | H46 | 107.2° | 107.8° |
| C49 | C48 | N5 | 113.2° | 120.0° |
| C48 | C49 | C50 | 123.8° | 119.9° |
| C48 | N5 | C47 | 121.4° | 120.0° |
| C48 | N5 | H73 | 119.3° | 120.0° |
| C49 | C50 | C51 | 119.8° | 117.3° |
| C49 | C50 | C54 | 119.2° | 121.4° |
| C64 | C63 | C55 | 119.2° | 120.1° |
| C64 | C63 | H64 | 120.4° | 119.9° |
| C63 | C64 | H65 | 119.9° | 119.9° |
| C51 | C50 | C54 | 120.9° | 121.3° |
| C50 | C51 | H45 | 107.1° | 107.9° |
| C50 | C51 | H46 | 107.1° | 107.9° |
| C50 | C54 | F4 | 106.1° | 109.5° |
| C50 | C54 | F5 | 107.1° | 109.5° |
| N5 | C47 | C55 | 123.2° | 120.1° |
| C47 | N5 | H73 | 119.3° | 120.0° |
| C47 | C55 | C63 | 120.8° | 120.1° |
| C47 | C55 | N7 | 115.7° | 119.9° |
| F4 | C54 | F5 | 109.0° | 109.5° |
| C63 | C55 | N7 | 123.6° | 120.0° |
| C55 | C63 | H64 | 120.4° | 120.0° |
| C55 | N7 | C59 | 107.8° | 111.0° |
| C55 | N7 | C56 | 116.1° | 111.0° |
| C59 | N7 | C56 | 104.1° | 110.9° |
| N7 | C59 | C58 | 113.7° | 109.4° |
| N7 | C59 | H52 | 108.4° | 109.5° |
| N7 | C59 | H53 | 108.4° | 109.5° |
| N7 | C56 | C57 | 108.3° | 109.3° |
| N7 | C56 | H48 | 109.7° | 109.5° |
| N7 | C56 | H49 | 109.7° | 109.5° |
| C59 | C58 | C60 | 107.6° | 109.5° |
| C59 | C58 | N8 | 111.9° | 109.4° |
| C59 | C58 | H51 | 107.3° | 109.5° |
| C58 | C59 | H52 | 108.4° | 109.5° |
| C58 | C59 | H53 | 108.4° | 109.5° |
| C56 | C57 | N8 | 112.3° | 109.4° |
| C56 | C57 | C62 | 103.9° | 109.5° |
| C57 | C56 | H48 | 109.8° | 109.5° |
| C57 | C56 | H49 | 109.7° | 109.5° |
| C56 | C57 | H50 | 108.2° | 109.5° |
| C60 | C58 | N8 | 114.0° | 109.5° |
| C60 | C58 | H51 | 106.8° | 109.5° |
| C58 | C60 | H55 | 109.5° | 109.5° |
| C58 | C60 | H56 | 109.5° | 109.5° |
| C58 | C60 | H57 | 109.5° | 109.5° |
| C58 | N8 | C57 | 110.9° | 110.9° |
| C58 | N8 | C61 | 111.6° | 111.0° |
| N8 | C58 | H51 | 108.9° | 109.5° |
| N8 | C57 | C62 | 112.9° | 109.5° |
| C57 | N8 | C61 | 109.4° | 111.0° |
| N8 | C57 | H50 | 110.8° | 109.5° |
| C62 | C57 | H50 | 108.3° | 109.5° |
| C57 | C62 | H61 | 109.5° | 109.5° |
| C57 | C62 | H62 | 109.5° | 109.5° |
| C57 | C62 | H63 | 109.5° | 109.4° |
| N8 | C61 | H58 | 109.5° | 109.5° |
| N8 | C61 | H59 | 109.5° | 109.5° |
| N8 | C61 | H60 | 109.4° | 109.5° |
| H7 | C22 | H8 | 109.4° | 109.4° |
| H9 | C23 | H10 | 109.5° | 109.5° |
| H11 | C24 | H12 | 109.5° | 109.5° |
| H13 | C25 | H14 | 109.5° | 109.5° |
| H15 | C26 | H16 | 109.5° | 109.5° |
| H17 | C27 | H18 | 109.5° | 109.5° |
| H19 | C28 | H20 | 109.5° | 109.5° |
| H21 | C29 | H22 | 109.5° | 109.5° |
| H24 | C30 | H25 | 109.5° | 109.5° |
| H26 | C31 | H27 | 109.5° | 109.4° |
| H28 | C32 | H29 | 109.4° | 109.5° |
| H30 | C33 | H31 | 109.5° | 109.4° |
| H32 | C34 | H33 | 109.4° | 109.5° |
| H34 | C35 | H35 | 109.5° | 109.5° |
| H36 | C36 | H37 | 109.5° | 109.5° |
| H38 | C37 | H39 | 109.5° | 109.5° |
| H45 | C51 | H46 | 109.4° | 107.7° |
| H48 | C56 | H49 | 109.5° | 109.5° |
| H52 | C59 | H53 | 109.5° | 109.4° |
| H55 | C60 | H56 | 109.5° | 109.5° |
| H55 | C60 | H57 | 109.5° | 109.4° |
| H56 | C60 | H57 | 109.5° | 109.5° |
| H58 | C61 | H59 | 109.4° | 109.5° |
| H58 | C61 | H60 | 109.5° | 109.5° |
| H59 | C61 | H60 | 109.5° | 109.4° |
| H61 | C62 | H62 | 109.5° | 109.5° |
| H61 | C62 | H63 | 109.5° | 109.5° |
| H62 | C62 | H63 | 109.5° | 109.5° |
| H66 | C65 | H67 | 109.5° | 109.5° |
| H75 | N9 | H76 | 120.0° | 120.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C4 | C3 | C2 | H23 | 180.0° | 179.9° |
| C4 | C3 | C2 | F1 | 179.7° | 180.0° |
| C3 | C4 | C5 | H40 | 180.0° | 180.0° |
| C4 | C3 | C2 | C1 | 1.8° | 0.1° |
| C3 | C4 | C5 | C7 | 178.3° | 180.0° |
| C3 | C4 | C5 | C6 | 0.6° | 0.0° |
| C3 | C2 | F1 | C1 | 177.9° | 179.9° |
| C2 | C3 | C4 | C5 | 0.5° | 0.0° |
| C3 | C2 | C1 | C6 | 2.0° | 0.1° |
| C3 | C2 | C1 | CL1 | 179.3° | 179.7° |
| C2 | C3 | C4 | H40 | 179.5° | 179.9° |
| F1 | C2 | C1 | C6 | 179.9° | 180.0° |
| F1 | C2 | C1 | CL1 | 1.4° | 0.2° |
| F1 | C2 | C3 | H23 | 0.3° | 0.1° |
| C4 | C5 | C7 | C65 | 80.2° | 100.0° |
| C4 | C5 | C7 | C6 | 178.9° | 180.0° |
| C4 | C5 | C6 | C1 | 0.3° | 0.0° |
| C4 | C5 | C7 | N1 | 162.1° | 140.0° |
| C5 | C4 | C3 | H23 | 179.5° | 179.9° |
| C4 | C5 | C6 | H54 | 179.7° | 179.7° |
| C4 | C5 | C7 | H68 | 40.8° | 20.0° |
| C2 | C1 | C6 | C5 | 0.9° | 0.0° |
| C2 | C1 | C6 | CL1 | 178.6° | 179.8° |
| C1 | C2 | C3 | H23 | 178.2° | 180.0° |
| C2 | C1 | C6 | H54 | 179.1° | 179.7° |
| C66 | C65 | C7 | H66 | 120.4° | 120.0° |
| C66 | C65 | C7 | H67 | 120.5° | 119.9° |
| C65 | C66 | O13 | N9 | 177.7° | 179.9° |
| C66 | C65 | C7 | C5 | 175.7° | 175.2° |
| C66 | C65 | C7 | N1 | 66.1° | 64.8° |
| C66 | C65 | H66 | H67 | 118.7° | 119.9° |
| C66 | C65 | C7 | H68 | 54.6° | 55.2° |
| C65 | C66 | N9 | H75 | 177.6° | 0.0° |
| C65 | C66 | N9 | H76 | 2.3° | 180.0° |
| C7 | C65 | C66 | O13 | 62.1° | 4.6° |
| C7 | C65 | C66 | N9 | 120.1° | 175.4° |
| C65 | C7 | C5 | N1 | 117.7° | 120.0° |
| C65 | C7 | C5 | H68 | 121.0° | 120.0° |
| C65 | C7 | C5 | C6 | 98.7° | 80.0° |
| C65 | C7 | N1 | H68 | 120.1° | 120.0° |
| C65 | C7 | N1 | C8 | 138.4° | 158.8° |
| C7 | C65 | H66 | H67 | 118.7° | 120.0° |
| C65 | C7 | N1 | H69 | 41.6° | 21.3° |
| O13 | C66 | C65 | H66 | 58.3° | 124.6° |
| O13 | C66 | C65 | H67 | 177.4° | 115.4° |
| O13 | C66 | N9 | H75 | 0.0° | 180.0° |
| O13 | C66 | N9 | H76 | 180.0° | 0.0° |
| N9 | C66 | C65 | H66 | 119.5° | 55.3° |
| N9 | C66 | C65 | H67 | 0.3° | 64.7° |
| C66 | N9 | H75 | H76 | 180.0° | 180.0° |
| C7 | C5 | C6 | C1 | 178.5° | 180.0° |
| C5 | C7 | N1 | H68 | 120.9° | 120.1° |
| C5 | C7 | N1 | C8 | 102.7° | 81.3° |
| C7 | C5 | C4 | H40 | 1.7° | 0.0° |
| C7 | C5 | C6 | H54 | 1.4° | 0.3° |
| C5 | C7 | C65 | H66 | 55.3° | 55.2° |
| C5 | C7 | C65 | H67 | 63.8° | 64.9° |
| C5 | C7 | N1 | H69 | 77.4° | 98.7° |
| C5 | C6 | C1 | H54 | 180.0° | 179.7° |
| C5 | C6 | C1 | CL1 | 179.5° | 179.7° |
| C6 | C5 | C7 | N1 | 19.0° | 40.0° |
| C6 | C5 | C4 | H40 | 179.5° | 180.0° |
| C6 | C5 | C7 | H68 | 140.3° | 160.0° |
| CL1 | C1 | C6 | H54 | 0.4° | 0.0° |
| C7 | N1 | C8 | H69 | 180.0° | 180.0° |
| C7 | N1 | C8 | O1 | 1.7° | 5.0° |
| C7 | N1 | C8 | C9 | 177.4° | 175.0° |
| N1 | C7 | C65 | H66 | 173.5° | 175.2° |
| N1 | C7 | C65 | H67 | 54.4° | 55.1° |
| N1 | C8 | O1 | C9 | 175.4° | 179.9° |
| N1 | C8 | C9 | C18 | 1.0° | 0.0° |
| N1 | C8 | C9 | C10 | 178.6° | 180.0° |
| C8 | N1 | C7 | H68 | 18.3° | 38.8° |
| O1 | C8 | C9 | C18 | 174.6° | 180.0° |
| O1 | C8 | C9 | C10 | 5.8° | 0.1° |
| O1 | C8 | N1 | H69 | 178.3° | 175.0° |
| C8 | C9 | C18 | C10 | 179.7° | 180.0° |
| C8 | C9 | C18 | N2 | 178.3° | 179.8° |
| C8 | C9 | C10 | C11 | 3.8° | 0.0° |
| C8 | C9 | C10 | C17 | 177.8° | 179.7° |
| C8 | C9 | C18 | H4 | 1.7° | 0.2° |
| C9 | C8 | N1 | H69 | 2.6° | 5.0° |
| C9 | C18 | N2 | H4 | 180.0° | 180.0° |
| C18 | C9 | C10 | C11 | 176.5° | 180.0° |
| C18 | C9 | C10 | C17 | 1.9° | 0.3° |
| C9 | C18 | N2 | C17 | 5.1° | 0.0° |
| C9 | C18 | N2 | H70 | 174.9° | 180.0° |
| C10 | C9 | C18 | N2 | 2.0° | 0.2° |
| C9 | C10 | C11 | C12 | 70.6° | 89.9° |
| C9 | C10 | C11 | C17 | 178.1° | 179.6° |
| C9 | C10 | C11 | C16 | 110.6° | 90.3° |
| C9 | C10 | C17 | N2 | 4.9° | 0.3° |
| C9 | C10 | C17 | C19 | 176.9° | 179.8° |
| C10 | C9 | C18 | H4 | 178.0° | 179.8° |
| C18 | N2 | C17 | C10 | 6.2° | 0.2° |
| C18 | N2 | C17 | H70 | 180.0° | 180.0° |
| C18 | N2 | C17 | C19 | 175.7° | 179.9° |
| F2 | C12 | C13 | C11 | 179.2° | 180.0° |
| F2 | C12 | C13 | C14 | 179.8° | 180.0° |
| F2 | C12 | C11 | C10 | 1.1° | 0.0° |
| F2 | C12 | C11 | C16 | 179.9° | 179.8° |
| F2 | C12 | C13 | H1 | 0.2° | 0.1° |
| C12 | C13 | C14 | H1 | 180.0° | 179.9° |
| C13 | C12 | C11 | C10 | 179.7° | 180.0° |
| C13 | C12 | C11 | C16 | 0.9° | 0.2° |
| C12 | C13 | C14 | CL2 | 179.8° | 179.9° |
| C12 | C13 | C14 | C15 | 0.9° | 0.0° |
| C11 | C12 | C13 | C14 | 0.9° | 0.1° |
| C12 | C11 | C10 | C16 | 178.9° | 179.8° |
| C12 | C11 | C10 | C17 | 111.3° | 89.7° |
| C12 | C11 | C16 | C15 | 0.9° | 0.5° |
| C11 | C12 | C13 | H1 | 179.1° | 180.0° |
| C12 | C11 | C16 | H3 | 179.1° | 179.8° |
| C13 | C14 | CL2 | C15 | 178.9° | 179.9° |
| C13 | C14 | C15 | C16 | 0.9° | 0.3° |
| C13 | C14 | C15 | H2 | 179.2° | 180.0° |
| C11 | C10 | C17 | N2 | 173.5° | 180.0° |
| C10 | C11 | C16 | C15 | 179.8° | 179.7° |
| C11 | C10 | C17 | C19 | 4.8° | 0.1° |
| C10 | C11 | C16 | H3 | 0.2° | 0.1° |
| C17 | C10 | C11 | C16 | 67.5° | 90.1° |
| C10 | C17 | N2 | C19 | 178.2° | 180.0° |
| C10 | C17 | C19 | C20 | 156.3° | 180.0° |
| C10 | C17 | C19 | H5 | 23.7° | 0.1° |
| C10 | C17 | N2 | H70 | 173.8° | 179.8° |
| C11 | C16 | C15 | C14 | 0.8° | 0.6° |
| C11 | C16 | C15 | H3 | 180.0° | 179.8° |
| C11 | C16 | C15 | H2 | 179.2° | 179.8° |
| CL2 | C14 | C15 | C16 | 179.7° | 179.7° |
| CL2 | C14 | C13 | H1 | 0.2° | 0.0° |
| CL2 | C14 | C15 | H2 | 0.3° | 0.1° |
| C14 | C15 | C16 | H2 | 180.0° | 179.6° |
| C15 | C14 | C13 | H1 | 179.1° | 179.9° |
| C14 | C15 | C16 | H3 | 179.2° | 179.7° |
| N2 | C17 | C19 | C20 | 21.5° | 0.0° |
| C17 | N2 | C18 | H4 | 174.9° | 180.0° |
| N2 | C17 | C19 | H5 | 158.4° | 180.0° |
| C17 | C19 | C20 | H5 | 180.0° | 180.0° |
| C17 | C19 | C20 | C21 | 176.7° | 180.0° |
| C17 | C19 | C20 | H6 | 3.3° | 0.0° |
| C19 | C17 | N2 | H70 | 4.4° | 0.2° |
| C19 | C20 | C21 | H6 | 180.0° | 180.0° |
| C19 | C20 | C21 | O2 | 5.7° | 0.0° |
| C19 | C20 | C21 | N3 | 166.4° | 180.0° |
| C20 | C21 | O2 | N3 | 171.2° | 180.0° |
| C20 | C21 | N3 | C22 | 171.7° | 180.0° |
| C21 | C20 | C19 | H5 | 3.3° | 0.0° |
| C20 | C21 | N3 | H71 | 8.3° | 0.0° |
| O2 | C21 | N3 | C22 | 1.0° | 0.0° |
| O2 | C21 | C20 | H6 | 174.3° | 180.0° |
| O2 | C21 | N3 | H71 | 179.0° | 180.0° |
| C21 | N3 | C22 | H71 | 180.0° | 180.0° |
| C21 | N3 | C22 | C23 | 95.1° | 180.0° |
| N3 | C21 | C20 | H6 | 13.6° | 0.0° |
| C21 | N3 | C22 | H7 | 144.8° | 60.0° |
| C21 | N3 | C22 | H8 | 25.1° | 60.0° |
| N3 | C22 | C23 | H7 | 120.1° | 120.1° |
| N3 | C22 | C23 | H8 | 120.1° | 120.0° |
| N3 | C22 | C23 | O3 | 161.1° | 65.0° |
| N3 | C22 | H7 | H8 | 119.5° | 120.0° |
| N3 | C22 | C23 | H9 | 41.3° | 175.0° |
| N3 | C22 | C23 | H10 | 79.1° | 55.0° |
| C22 | C23 | O3 | H9 | 119.8° | 120.0° |
| C22 | C23 | O3 | H10 | 119.8° | 120.0° |
| C22 | C23 | O3 | C24 | 97.9° | 180.0° |
| C23 | C22 | H7 | H8 | 119.6° | 120.0° |
| C22 | C23 | H9 | H10 | 120.6° | 119.9° |
| C23 | C22 | N3 | H71 | 85.0° | 0.0° |
| C23 | O3 | C24 | C25 | 179.2° | 180.0° |
| O3 | C23 | C22 | H7 | 78.7° | 175.0° |
| O3 | C23 | C22 | H8 | 41.0° | 55.0° |
| O3 | C23 | H9 | H10 | 120.6° | 120.0° |
| C23 | O3 | C24 | H11 | 61.2° | 60.0° |
| C23 | O3 | C24 | H12 | 59.7° | 60.0° |
| O3 | C24 | C25 | H11 | 119.5° | 120.0° |
| O3 | C24 | C25 | H12 | 119.5° | 120.1° |
| O3 | C24 | C25 | O4 | 58.8° | 65.1° |
| C24 | O3 | C23 | H9 | 21.9° | 60.0° |
| C24 | O3 | C23 | H10 | 142.3° | 60.0° |
| O3 | C24 | H11 | H12 | 121.4° | 120.0° |
| O3 | C24 | C25 | H13 | 60.8° | 175.0° |
| O3 | C24 | C25 | H14 | 178.3° | 54.9° |
| C24 | C25 | O4 | H13 | 119.6° | 120.0° |
| C24 | C25 | O4 | H14 | 119.6° | 120.0° |
| C24 | C25 | O4 | C26 | 170.1° | 180.0° |
| C25 | C24 | H11 | H12 | 121.4° | 120.0° |
| C24 | C25 | H13 | H14 | 121.3° | 120.0° |
| C25 | O4 | C26 | C27 | 67.9° | 180.0° |
| O4 | C25 | C24 | H11 | 178.3° | 175.0° |
| O4 | C25 | C24 | H12 | 60.8° | 55.0° |
| O4 | C25 | H13 | H14 | 121.3° | 120.0° |
| C25 | O4 | C26 | H15 | 52.4° | 60.0° |
| C25 | O4 | C26 | H16 | 171.8° | 60.0° |
| O4 | C26 | C27 | H15 | 120.2° | 120.0° |
| O4 | C26 | C27 | H16 | 120.2° | 120.0° |
| O4 | C26 | C27 | O5 | 176.7° | 65.0° |
| C26 | O4 | C25 | H13 | 70.4° | 60.1° |
| C26 | O4 | C25 | H14 | 50.5° | 60.0° |
| O4 | C26 | H15 | H16 | 119.2° | 120.0° |
| O4 | C26 | C27 | H17 | 63.1° | 175.0° |
| O4 | C26 | C27 | H18 | 56.6° | 55.0° |
| C26 | C27 | O5 | H17 | 120.2° | 120.0° |
| C26 | C27 | O5 | H18 | 120.2° | 120.0° |
| C26 | C27 | O5 | C28 | 148.0° | 180.0° |
| C27 | C26 | H15 | H16 | 119.3° | 120.1° |
| C26 | C27 | H17 | H18 | 119.4° | 120.0° |
| C27 | O5 | C28 | C29 | 57.9° | 180.0° |
| O5 | C27 | C26 | H15 | 56.5° | 175.0° |
| O5 | C27 | C26 | H16 | 63.0° | 55.0° |
| O5 | C27 | H17 | H18 | 119.5° | 120.0° |
| C27 | O5 | C28 | H19 | 62.8° | 60.0° |
| C27 | O5 | C28 | H20 | 178.6° | 60.0° |
| O5 | C28 | C29 | H19 | 120.7° | 119.9° |
| O5 | C28 | C29 | H20 | 120.7° | 120.0° |
| O5 | C28 | C29 | O6 | 73.4° | 65.0° |
| C28 | O5 | C27 | H17 | 91.8° | 60.0° |
| C28 | O5 | C27 | H18 | 27.9° | 60.0° |
| O5 | C28 | H19 | H20 | 117.7° | 120.0° |
| O5 | C28 | C29 | H21 | 46.8° | 175.0° |
| O5 | C28 | C29 | H22 | 166.4° | 55.0° |
| C28 | C29 | O6 | H21 | 120.2° | 120.0° |
| C28 | C29 | O6 | H22 | 120.1° | 120.0° |
| C28 | C29 | O6 | C30 | 86.0° | 180.0° |
| C29 | C28 | H19 | H20 | 117.8° | 120.0° |
| C28 | C29 | H21 | H22 | 119.5° | 120.1° |
| C29 | O6 | C30 | C31 | 153.6° | 180.0° |
| O6 | C29 | C28 | H19 | 165.9° | 175.0° |
| O6 | C29 | C28 | H20 | 47.3° | 55.0° |
| O6 | C29 | H21 | H22 | 119.5° | 120.0° |
| C29 | O6 | C30 | H24 | 86.6° | 60.0° |
| C29 | O6 | C30 | H25 | 33.7° | 60.0° |
| O6 | C30 | C31 | H24 | 119.8° | 120.1° |
| O6 | C30 | C31 | H25 | 119.8° | 119.9° |
| O6 | C30 | C31 | O7 | 65.2° | 65.0° |
| C30 | O6 | C29 | H21 | 153.8° | 60.0° |
| C30 | O6 | C29 | H22 | 34.1° | 60.0° |
| O6 | C30 | H24 | H25 | 120.5° | 120.0° |
| O6 | C30 | C31 | H26 | 54.7° | 175.0° |
| O6 | C30 | C31 | H27 | 175.0° | 55.0° |
| C30 | C31 | O7 | H26 | 119.9° | 120.0° |
| C30 | C31 | O7 | H27 | 119.9° | 120.0° |
| C30 | C31 | O7 | C32 | 126.1° | 180.0° |
| C31 | C30 | H24 | H25 | 120.5° | 120.0° |
| C30 | C31 | H26 | H27 | 120.5° | 120.0° |
| O10 | C38 | N4 | C37 | 4.9° | 0.0° |
| O10 | C38 | N4 | C39 | 177.0° | 180.0° |
| O10 | C38 | C39 | C44 | 38.4° | 179.7° |
| O10 | C38 | C39 | C40 | 142.8° | 0.0° |
| O10 | C38 | N4 | H72 | 175.1° | 180.0° |
| N4 | C37 | C36 | H38 | 120.1° | 120.0° |
| N4 | C37 | C36 | H39 | 120.1° | 120.0° |
| C37 | N4 | C38 | H72 | 180.0° | 180.0° |
| C37 | N4 | C38 | C39 | 178.1° | 180.0° |
| N4 | C37 | C36 | O9 | 64.5° | 65.0° |
| N4 | C37 | C36 | H36 | 175.9° | 175.0° |
| N4 | C37 | C36 | H37 | 55.2° | 55.0° |
| N4 | C37 | H38 | H39 | 119.8° | 119.9° |
| C36 | C37 | N4 | C38 | 125.3° | 180.0° |
| C37 | C36 | O9 | H36 | 119.6° | 120.0° |
| C37 | C36 | O9 | H37 | 119.6° | 120.0° |
| C37 | C36 | O9 | C35 | 145.9° | 180.0° |
| C37 | C36 | H36 | H37 | 121.1° | 120.0° |
| C36 | C37 | H38 | H39 | 119.7° | 120.0° |
| C36 | C37 | N4 | H72 | 54.7° | 0.0° |
| C31 | O7 | C32 | C33 | 76.7° | 180.0° |
| O7 | C31 | C30 | H24 | 175.0° | 175.0° |
| O7 | C31 | C30 | H25 | 54.7° | 55.0° |
| O7 | C31 | H26 | H27 | 120.4° | 119.9° |
| C31 | O7 | C32 | H28 | 163.0° | 60.0° |
| C31 | O7 | C32 | H29 | 43.6° | 60.1° |
| N4 | C38 | C39 | C44 | 138.5° | 0.2° |
| N4 | C38 | C39 | C40 | 40.2° | 180.0° |
| C38 | N4 | C37 | H38 | 5.3° | 59.9° |
| C38 | N4 | C37 | H39 | 114.6° | 60.0° |
| C38 | C39 | C44 | C40 | 178.7° | 179.8° |
| C38 | C39 | C44 | C43 | 178.7° | 179.7° |
| C38 | C39 | C40 | C41 | 179.8° | 180.0° |
| C38 | C39 | C40 | H41 | 0.2° | 0.0° |
| C38 | C39 | C44 | H43 | 1.3° | 0.1° |
| C39 | C38 | N4 | H72 | 1.9° | 0.0° |
| O7 | C32 | C33 | H28 | 120.3° | 120.0° |
| O7 | C32 | C33 | H29 | 120.3° | 119.9° |
| O7 | C32 | C33 | O8 | 118.6° | 65.0° |
| C32 | O7 | C31 | H26 | 6.2° | 60.0° |
| C32 | O7 | C31 | H27 | 114.1° | 60.0° |
| O7 | C32 | H28 | H29 | 119.2° | 120.0° |
| O7 | C32 | C33 | H30 | 2.0° | 175.0° |
| O7 | C32 | C33 | H31 | 120.8° | 55.1° |
| C32 | C33 | O8 | C34 | 86.7° | 180.0° |
| C32 | C33 | O8 | H30 | 120.6° | 120.0° |
| C32 | C33 | O8 | H31 | 120.6° | 120.0° |
| C33 | C32 | H28 | H29 | 119.1° | 120.0° |
| C32 | C33 | H30 | H31 | 118.1° | 119.9° |
| C36 | O9 | C35 | C34 | 164.8° | 180.0° |
| C36 | O9 | C35 | H34 | 75.7° | 60.0° |
| C36 | O9 | C35 | H35 | 45.3° | 60.0° |
| O9 | C36 | H36 | H37 | 121.1° | 120.0° |
| O9 | C36 | C37 | H38 | 55.6° | 175.0° |
| O9 | C36 | C37 | H39 | 175.4° | 55.0° |
| O9 | C35 | C34 | H34 | 119.5° | 120.0° |
| O9 | C35 | C34 | H35 | 119.5° | 120.0° |
| O9 | C35 | C34 | O8 | 65.1° | 65.0° |
| O9 | C35 | C34 | H32 | 54.6° | 175.1° |
| O9 | C35 | C34 | H33 | 175.2° | 55.0° |
| O9 | C35 | H34 | H35 | 121.4° | 120.0° |
| C35 | O9 | C36 | H36 | 94.5° | 60.0° |
| C35 | O9 | C36 | H37 | 26.3° | 60.0° |
| C39 | C44 | C43 | H43 | 180.0° | 179.8° |
| C39 | C44 | C43 | C42 | 0.9° | 0.5° |
| C44 | C39 | C40 | C41 | 1.0° | 0.3° |
| C44 | C39 | C40 | H41 | 179.0° | 179.8° |
| C39 | C44 | C43 | H42 | 179.1° | 179.7° |
| C43 | C44 | C39 | C40 | 0.0° | 0.5° |
| C44 | C43 | C42 | H42 | 180.0° | 179.8° |
| C44 | C43 | C42 | C41 | 2.8° | 0.3° |
| C44 | C43 | C42 | F3 | 178.9° | 179.7° |
| C39 | C40 | C41 | H41 | 180.0° | 180.0° |
| C39 | C40 | C41 | C42 | 2.9° | 0.0° |
| C39 | C40 | C41 | C45 | 178.8° | 180.0° |
| C40 | C39 | C44 | H43 | 180.0° | 179.7° |
| C43 | C42 | C41 | C40 | 3.8° | 0.0° |
| C43 | C42 | C41 | F3 | 178.3° | 180.0° |
| C43 | C42 | C41 | C45 | 179.3° | 180.0° |
| C42 | C43 | C44 | H43 | 179.1° | 179.7° |
| C35 | C34 | O8 | H32 | 119.7° | 120.0° |
| C35 | C34 | O8 | H33 | 119.7° | 120.0° |
| C35 | C34 | O8 | C33 | 173.7° | 180.0° |
| C35 | C34 | H32 | H33 | 121.0° | 120.1° |
| C34 | C35 | H34 | H35 | 121.4° | 120.0° |
| C34 | O8 | C33 | H30 | 152.7° | 60.0° |
| C34 | O8 | C33 | H31 | 33.9° | 60.0° |
| O8 | C34 | H32 | H33 | 121.0° | 120.0° |
| O8 | C34 | C35 | H34 | 175.4° | 175.0° |
| O8 | C34 | C35 | H35 | 54.4° | 55.0° |
| O8 | C33 | C32 | H28 | 121.1° | 175.0° |
| O8 | C33 | C32 | H29 | 1.7° | 55.0° |
| O8 | C33 | H30 | H31 | 118.2° | 120.0° |
| C33 | O8 | C34 | H32 | 54.0° | 60.0° |
| C33 | O8 | C34 | H33 | 66.6° | 60.0° |
| C40 | C41 | C42 | C45 | 175.5° | 180.0° |
| C40 | C41 | C42 | F3 | 177.9° | 180.0° |
| C40 | C41 | C45 | C46 | 42.8° | 130.0° |
| C40 | C41 | C45 | C64 | 134.8° | 50.3° |
| C42 | C41 | C45 | C46 | 141.6° | 50.0° |
| C42 | C41 | C45 | C64 | 40.8° | 129.7° |
| C42 | C41 | C40 | H41 | 177.1° | 180.0° |
| C41 | C42 | C43 | H42 | 177.2° | 180.0° |
| F3 | C42 | C41 | C45 | 2.4° | 0.0° |
| F3 | C42 | C43 | H42 | 1.1° | 0.0° |
| C41 | C45 | C46 | C64 | 177.6° | 179.7° |
| C41 | C45 | C46 | C47 | 176.6° | 180.0° |
| C41 | C45 | C64 | C63 | 176.9° | 179.7° |
| C45 | C41 | C40 | H41 | 1.2° | 0.0° |
| C41 | C45 | C46 | H44 | 3.4° | 0.0° |
| C41 | C45 | C64 | H65 | 3.2° | 0.0° |
| C45 | C46 | C47 | H44 | 180.0° | 180.0° |
| C46 | C45 | C64 | C63 | 0.7° | 0.5° |
| C45 | C46 | C47 | N5 | 175.3° | 180.0° |
| C45 | C46 | C47 | C55 | 0.4° | 0.0° |
| C46 | C45 | C64 | H65 | 179.3° | 179.7° |
| C64 | C45 | C46 | C47 | 1.0° | 0.3° |
| C45 | C64 | C63 | H65 | 180.0° | 179.8° |
| C45 | C64 | C63 | C55 | 0.1° | 0.5° |
| C64 | C45 | C46 | H44 | 179.0° | 179.7° |
| C45 | C64 | C63 | H64 | 179.9° | 179.7° |
| C46 | C47 | N5 | C48 | 65.3° | 33.6° |
| C46 | C47 | N5 | C55 | 174.7° | 180.0° |
| C46 | C47 | C55 | C63 | 0.4° | 0.0° |
| C46 | C47 | C55 | N7 | 178.5° | 180.0° |
| C46 | C47 | N5 | H73 | 114.8° | 146.4° |
| F6 | C54 | C50 | C49 | 76.7° | 61.8° |
| F6 | C54 | C50 | C51 | 106.2° | 118.2° |
| F6 | C54 | C50 | F4 | 119.4° | 120.0° |
| F6 | C54 | C50 | F5 | 124.3° | 120.0° |
| F6 | C54 | F4 | F5 | 126.2° | 120.0° |
| O11 | C48 | C49 | C53 | 131.2° | 175.1° |
| O11 | C48 | C49 | N5 | 173.0° | 180.0° |
| O11 | C48 | C49 | C50 | 41.2° | 5.2° |
| O11 | C48 | N5 | C47 | 2.7° | 5.0° |
| O11 | C48 | N5 | H73 | 177.2° | 175.0° |
| N6 | C53 | C49 | H47 | 180.0° | 179.7° |
| C53 | N6 | C52 | O12 | 179.8° | 179.7° |
| C53 | N6 | C52 | C51 | 0.5° | 0.3° |
| N6 | C53 | C49 | C48 | 176.1° | 179.7° |
| N6 | C53 | C49 | C50 | 3.6° | 0.6° |
| C52 | N6 | C53 | C49 | 1.9° | 0.6° |
| N6 | C52 | O12 | C51 | 179.3° | 180.0° |
| N6 | C52 | C51 | C50 | 0.7° | 0.0° |
| N6 | C52 | C51 | H45 | 120.6° | 122.0° |
| N6 | C52 | C51 | H46 | 122.0° | 121.9° |
| C52 | N6 | C53 | H47 | 178.2° | 179.8° |
| C53 | C49 | C48 | C50 | 172.3° | 179.7° |
| C53 | C49 | C48 | N5 | 41.8° | 5.0° |
| C53 | C49 | C50 | C51 | 3.8° | 0.2° |
| C53 | C49 | C50 | C54 | 179.0° | 179.7° |
| O12 | C52 | C51 | C50 | 180.0° | 180.0° |
| O12 | C52 | C51 | H45 | 58.6° | 58.0° |
| O12 | C52 | C51 | H46 | 58.7° | 58.1° |
| C52 | C51 | C50 | C49 | 2.4° | 0.0° |
| C52 | C51 | C50 | H45 | 121.3° | 122.0° |
| C52 | C51 | C50 | H46 | 121.3° | 121.9° |
| C52 | C51 | C50 | C54 | 179.5° | 180.0° |
| C52 | C51 | H45 | H46 | 115.9° | 116.2° |
| C48 | C49 | C50 | C51 | 175.6° | 180.0° |
| C48 | C49 | C50 | C54 | 7.2° | 0.0° |
| C49 | C48 | N5 | C47 | 170.2° | 175.0° |
| C48 | C49 | C53 | H47 | 4.0° | 0.0° |
| C49 | C48 | N5 | H73 | 9.9° | 5.0° |
| N5 | C48 | C49 | C50 | 145.9° | 174.8° |
| C48 | N5 | C47 | H73 | 180.0° | 180.0° |
| C48 | N5 | C47 | C55 | 120.1° | 146.4° |
| C49 | C50 | C51 | C54 | 177.1° | 180.0° |
| C49 | C50 | C54 | F4 | 164.0° | 58.2° |
| C49 | C50 | C54 | F5 | 47.6° | 178.2° |
| C49 | C50 | C51 | H45 | 119.0° | 122.0° |
| C49 | C50 | C51 | H46 | 123.7° | 121.9° |
| C50 | C49 | C53 | H47 | 176.5° | 179.8° |
| C64 | C63 | C55 | C47 | 0.6° | 0.3° |
| C64 | C63 | C55 | H64 | 180.0° | 179.8° |
| C64 | C63 | C55 | N7 | 178.1° | 179.8° |
| C51 | C50 | C54 | F4 | 13.2° | 121.8° |
| C51 | C50 | C54 | F5 | 129.5° | 1.8° |
| C50 | C51 | H45 | H46 | 115.8° | 116.3° |
| C50 | C54 | F4 | F5 | 115.0° | 120.0° |
| C54 | C50 | C51 | H45 | 58.2° | 58.0° |
| C54 | C50 | C51 | H46 | 59.2° | 58.1° |
| N5 | C47 | C55 | C63 | 174.0° | 180.0° |
| N5 | C47 | C55 | N7 | 7.1° | 0.0° |
| N5 | C47 | C46 | H44 | 4.8° | 0.0° |
| C47 | C55 | C63 | N7 | 178.7° | 179.9° |
| C47 | C55 | N7 | C59 | 72.9° | 120.0° |
| C47 | C55 | N7 | C56 | 170.9° | 116.2° |
| C55 | C47 | C46 | H44 | 179.6° | 180.0° |
| C47 | C55 | C63 | H64 | 179.3° | 180.0° |
| C55 | C47 | N5 | H73 | 59.9° | 33.6° |
| C63 | C55 | N7 | C59 | 106.0° | 60.1° |
| C63 | C55 | N7 | C56 | 10.3° | 63.8° |
| C55 | C63 | C64 | H65 | 179.9° | 179.7° |
| C55 | N7 | C59 | C56 | 123.8° | 123.9° |
| C55 | N7 | C59 | C58 | 176.4° | 176.8° |
| C55 | N7 | C56 | C57 | 179.4° | 176.8° |
| C55 | N7 | C56 | H48 | 60.8° | 56.8° |
| C55 | N7 | C56 | H49 | 59.6° | 63.2° |
| C55 | N7 | C59 | H52 | 55.8° | 63.2° |
| C55 | N7 | C59 | H53 | 63.0° | 56.8° |
| N7 | C55 | C63 | H64 | 1.9° | 0.0° |
| N7 | C59 | C58 | H52 | 120.6° | 120.0° |
| N7 | C59 | C58 | H53 | 120.6° | 120.0° |
| C59 | N7 | C56 | C57 | 62.3° | 59.3° |
| N7 | C59 | C58 | C60 | 179.7° | 178.4° |
| N7 | C59 | C58 | N8 | 53.8° | 58.4° |
| C59 | N7 | C56 | H48 | 57.5° | 179.3° |
| C59 | N7 | C56 | H49 | 177.9° | 60.7° |
| N7 | C59 | C58 | H51 | 65.6° | 61.6° |
| N7 | C59 | H52 | H53 | 118.1° | 120.0° |
| C56 | N7 | C59 | C58 | 59.8° | 59.3° |
| N7 | C56 | C57 | H48 | 119.8° | 120.0° |
| N7 | C56 | C57 | H49 | 119.8° | 119.9° |
| N7 | C56 | C57 | N8 | 64.9° | 58.4° |
| N7 | C56 | C57 | C62 | 172.7° | 178.4° |
| N7 | C56 | H48 | H49 | 120.5° | 120.0° |
| N7 | C56 | C57 | H50 | 57.7° | 61.6° |
| C56 | N7 | C59 | H52 | 179.6° | 60.7° |
| C56 | N7 | C59 | H53 | 60.9° | 179.4° |
| C59 | C58 | C60 | N8 | 124.7° | 119.9° |
| C59 | C58 | C60 | H51 | 115.0° | 120.0° |
| C59 | C58 | N8 | H51 | 118.5° | 119.9° |
| C59 | C58 | N8 | C57 | 49.6° | 59.3° |
| C59 | C58 | N8 | C61 | 171.9° | 176.9° |
| C58 | C59 | H52 | H53 | 118.1° | 120.1° |
| C59 | C58 | C60 | H55 | 180.0° | 179.9° |
| C59 | C58 | C60 | H56 | 60.0° | 60.1° |
| C59 | C58 | C60 | H57 | 60.0° | 60.0° |
| C56 | C57 | N8 | C58 | 55.7° | 59.4° |
| C56 | C57 | N8 | C62 | 117.1° | 119.9° |
| C56 | C57 | N8 | H50 | 121.2° | 120.0° |
| C56 | C57 | C62 | H50 | 114.9° | 120.0° |
| C56 | C57 | N8 | C61 | 179.2° | 176.8° |
| C57 | C56 | H48 | H49 | 120.5° | 120.1° |
| C56 | C57 | C62 | H61 | 180.0° | 60.0° |
| C56 | C57 | C62 | H62 | 60.0° | 180.0° |
| C56 | C57 | C62 | H63 | 60.0° | 60.0° |
| C60 | C58 | N8 | H51 | 119.2° | 120.0° |
| C60 | C58 | N8 | C57 | 172.0° | 179.4° |
| C60 | C58 | N8 | C61 | 65.8° | 56.8° |
| C60 | C58 | C59 | H52 | 59.7° | 58.4° |
| C60 | C58 | C59 | H53 | 59.1° | 61.6° |
| C58 | C60 | H55 | H56 | 120.0° | 120.0° |
| C58 | C60 | H55 | H57 | 120.0° | 120.0° |
| C58 | C60 | H56 | H57 | 120.0° | 120.0° |
| C58 | N8 | C57 | C61 | 123.5° | 123.8° |
| C58 | N8 | C57 | C62 | 172.9° | 179.3° |
| C58 | N8 | C57 | H50 | 65.5° | 60.6° |
| N8 | C58 | C59 | H52 | 174.4° | 61.6° |
| N8 | C58 | C59 | H53 | 66.9° | 178.4° |
| N8 | C58 | C60 | H55 | 55.3° | 60.0° |
| N8 | C58 | C60 | H56 | 175.3° | 180.0° |
| N8 | C58 | C60 | H57 | 64.7° | 60.0° |
| C58 | N8 | C61 | H58 | 180.0° | 63.8° |
| C58 | N8 | C61 | H59 | 60.0° | 56.2° |
| C58 | N8 | C61 | H60 | 60.0° | 176.2° |
| N8 | C57 | C62 | H50 | 123.1° | 120.1° |
| N8 | C57 | C56 | H48 | 54.9° | 178.4° |
| N8 | C57 | C56 | H49 | 175.3° | 61.5° |
| C57 | N8 | C58 | H51 | 68.9° | 60.6° |
| C57 | N8 | C61 | H58 | 56.9° | 60.0° |
| C57 | N8 | C61 | H59 | 63.0° | 180.0° |
| C57 | N8 | C61 | H60 | 177.0° | 60.1° |
| N8 | C57 | C62 | H61 | 58.0° | 179.9° |
| N8 | C57 | C62 | H62 | 62.0° | 60.1° |
| N8 | C57 | C62 | H63 | 178.0° | 59.9° |
| C62 | C57 | N8 | C61 | 63.7° | 56.9° |
| C62 | C57 | C56 | H48 | 67.5° | 61.7° |
| C62 | C57 | C56 | H49 | 52.9° | 58.4° |
| C57 | C62 | H61 | H62 | 120.0° | 120.0° |
| C57 | C62 | H61 | H63 | 120.0° | 120.0° |
| C57 | C62 | H62 | H63 | 120.0° | 120.0° |
| C61 | N8 | C57 | H50 | 58.0° | 63.2° |
| C61 | N8 | C58 | H51 | 53.4° | 63.2° |
| N8 | C61 | H58 | H59 | 120.0° | 120.0° |
| N8 | C61 | H58 | H60 | 120.0° | 120.0° |
| N8 | C61 | H59 | H60 | 120.0° | 120.0° |
| H2 | C15 | C16 | H3 | 0.8° | 0.0° |
| H4 | C18 | N2 | H70 | 5.1° | 0.0° |
| H5 | C19 | C20 | H6 | 176.7° | 180.0° |
| H7 | C22 | C23 | H9 | 161.5° | 54.9° |
| H7 | C22 | C23 | H10 | 41.1° | 65.0° |
| H7 | C22 | N3 | H71 | 35.2° | 120.0° |
| H8 | C22 | C23 | H9 | 78.8° | 65.0° |
| H8 | C22 | C23 | H10 | 160.8° | 175.0° |
| H8 | C22 | N3 | H71 | 154.9° | 120.0° |
| H11 | C24 | C25 | H13 | 58.8° | 55.0° |
| H11 | C24 | C25 | H14 | 62.1° | 65.0° |
| H12 | C24 | C25 | H13 | 179.7° | 64.9° |
| H12 | C24 | C25 | H14 | 58.8° | 175.0° |
| H15 | C26 | C27 | H17 | 176.7° | 55.1° |
| H15 | C26 | C27 | H18 | 63.7° | 65.0° |
| H16 | C26 | C27 | H17 | 57.1° | 65.0° |
| H16 | C26 | C27 | H18 | 176.8° | 175.0° |
| H19 | C28 | C29 | H21 | 74.0° | 55.1° |
| H19 | C28 | C29 | H22 | 45.7° | 65.0° |
| H20 | C28 | C29 | H21 | 167.5° | 65.0° |
| H20 | C28 | C29 | H22 | 72.9° | 175.0° |
| H23 | C3 | C4 | H40 | 0.5° | 0.0° |
| H24 | C30 | C31 | H26 | 65.1° | 54.9° |
| H24 | C30 | C31 | H27 | 55.2° | 65.1° |
| H25 | C30 | C31 | H26 | 174.5° | 65.1° |
| H25 | C30 | C31 | H27 | 65.2° | 174.9° |
| H28 | C32 | C33 | H30 | 118.3° | 55.0° |
| H28 | C32 | C33 | H31 | 0.5° | 64.9° |
| H29 | C32 | C33 | H30 | 122.3° | 65.1° |
| H29 | C32 | C33 | H31 | 118.9° | 175.0° |
| H32 | C34 | C35 | H34 | 64.9° | 55.0° |
| H32 | C34 | C35 | H35 | 174.1° | 65.0° |
| H33 | C34 | C35 | H34 | 55.7° | 65.0° |
| H33 | C34 | C35 | H35 | 65.3° | 175.0° |
| H36 | C36 | C37 | H38 | 64.0° | 55.0° |
| H36 | C36 | C37 | H39 | 55.8° | 65.0° |
| H37 | C36 | C37 | H38 | 175.3° | 65.1° |
| H37 | C36 | C37 | H39 | 64.9° | 174.9° |
| H38 | C37 | N4 | H72 | 174.8° | 120.0° |
| H39 | C37 | N4 | H72 | 65.4° | 120.0° |
| H42 | C43 | C44 | H43 | 0.9° | 0.1° |
| H48 | C56 | C57 | H50 | 177.5° | 58.4° |
| H49 | C56 | C57 | H50 | 62.1° | 178.4° |
| H50 | C57 | C62 | H61 | 65.0° | 60.0° |
| H50 | C57 | C62 | H62 | 174.9° | 60.0° |
| H50 | C57 | C62 | H63 | 54.9° | 180.0° |
| H51 | C58 | C59 | H52 | 55.0° | 178.5° |
| H51 | C58 | C59 | H53 | 173.7° | 58.4° |
| H51 | C58 | C60 | H55 | 65.0° | 60.1° |
| H51 | C58 | C60 | H56 | 55.0° | 60.0° |
| H51 | C58 | C60 | H57 | 175.0° | 180.0° |
| H55 | C60 | H56 | H57 | 120.0° | 120.0° |
| H58 | C61 | H59 | H60 | 120.0° | 120.0° |
| H61 | C62 | H62 | H63 | 120.0° | 120.0° |
| H64 | C63 | C64 | H65 | 0.1° | 0.0° |
| H66 | C65 | C7 | H68 | 65.8° | 64.8° |
| H67 | C65 | C7 | H68 | 175.0° | 175.1° |
| H68 | C7 | N1 | H69 | 161.7° | 141.2° |
