A1H5L
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C45 | C46 | doub | 1.38Å | 1.38Å | Aromatic |
| C45 | C43 | sing | 1.39Å | 1.39Å | Aromatic |
| C46 | C40 | sing | 1.39Å | 1.38Å | Aromatic |
| F1 | C44 | sing | 1.40Å | 1.32Å | |
| O14 | C43 | sing | 1.36Å | 1.41Å | |
| O14 | C44 | sing | 1.43Å | 1.34Å | |
| C43 | C42 | doub | 1.39Å | 1.38Å | Aromatic |
| C40 | N6 | sing | 1.40Å | 1.39Å | |
| C40 | C41 | doub | 1.39Å | 1.39Å | Aromatic |
| N6 | C1 | sing | 1.35Å | 1.37Å | |
| F3 | C44 | sing | 1.40Å | 1.32Å | |
| C44 | F2 | sing | 1.40Å | 1.33Å | |
| N1 | C1 | sing | 1.35Å | 1.35Å | |
| N1 | C2 | sing | 1.47Å | 1.47Å | |
| C42 | C41 | sing | 1.38Å | 1.38Å | Aromatic |
| C1 | O1 | doub | 1.22Å | 1.24Å | |
| C39 | C2 | sing | 1.53Å | 1.53Å | |
| C39 | C38 | sing | 1.53Å | 1.53Å | |
| C2 | C3 | sing | 1.53Å | 1.51Å | |
| C38 | C5 | sing | 1.53Å | 1.52Å | |
| C3 | C4 | sing | 1.53Å | 1.53Å | |
| C5 | O2 | sing | 1.43Å | 1.48Å | |
| C5 | C4 | sing | 1.53Å | 1.51Å | |
| O2 | C6 | sing | 1.36Å | 1.35Å | |
| C6 | C37 | doub | 1.39Å | 1.39Å | Aromatic |
| C6 | C7 | sing | 1.39Å | 1.39Å | Aromatic |
| C37 | C36 | sing | 1.38Å | 1.38Å | Aromatic |
| C7 | C8 | doub | 1.38Å | 1.38Å | Aromatic |
| C36 | C9 | doub | 1.40Å | 1.39Å | Aromatic |
| C8 | C9 | sing | 1.40Å | 1.39Å | Aromatic |
| C9 | C10 | sing | 1.48Å | 1.50Å | |
| C10 | O13 | doub | 1.22Å | 1.23Å | |
| C10 | N2 | sing | 1.35Å | 1.34Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| C4 | H2 | sing | 1.09Å | 1.10Å | |
| C4 | H3 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.09Å | 1.10Å | |
| C7 | H5 | sing | 1.08Å | 1.08Å | |
| C8 | H6 | sing | 1.08Å | 1.08Å | |
| C2 | H7 | sing | 1.09Å | 1.10Å | |
| C3 | H8 | sing | 1.09Å | 1.10Å | |
| C3 | H9 | sing | 1.09Å | 1.10Å | |
| N2 | H10 | sing | 0.97Å | 1.00Å | |
| C36 | H12 | sing | 1.08Å | 1.08Å | |
| C37 | H13 | sing | 1.08Å | 1.08Å | |
| C38 | H14 | sing | 1.09Å | 1.10Å | |
| C38 | H15 | sing | 1.09Å | 1.10Å | |
| C39 | H16 | sing | 1.09Å | 1.10Å | |
| C39 | H17 | sing | 1.09Å | 1.10Å | |
| N6 | H18 | sing | 0.97Å | 1.00Å | |
| C41 | H19 | sing | 1.08Å | 1.08Å | |
| C42 | H20 | sing | 1.08Å | 1.08Å | |
| C45 | H21 | sing | 1.08Å | 1.08Å | |
| C46 | H22 | sing | 1.08Å | 1.08Å | |
| N2 | C11 | sing | 1.47Å | 60.70Å | |
| C11 | C12 | sing | 1.53Å | 0.00Å | |
| C12 | O3 | sing | 1.43Å | 0.00Å | |
| O3 | C13 | sing | 1.43Å | 0.00Å | |
| C13 | C14 | sing | 1.53Å | 0.00Å | |
| C14 | O4 | sing | 1.43Å | 0.00Å | |
| O4 | C15 | sing | 1.43Å | 0.00Å | |
| C15 | C16 | sing | 1.53Å | 0.00Å | |
| C16 | O5 | sing | 1.43Å | 0.00Å | |
| O5 | C17 | sing | 1.43Å | 0.00Å | |
| C17 | C18 | sing | 1.53Å | 0.00Å | |
| C18 | O6 | sing | 1.43Å | 0.00Å | |
| O6 | C19 | sing | 1.43Å | 0.00Å | |
| C19 | C20 | sing | 1.53Å | 0.00Å | |
| C20 | N3 | sing | 1.47Å | 0.00Å | |
| N3 | C21 | sing | 1.35Å | 0.00Å | |
| C21 | C22 | sing | 1.51Å | 0.00Å | |
| C22 | O7 | sing | 1.43Å | 0.00Å | |
| O7 | C23 | sing | 1.36Å | 0.00Å | |
| C23 | C24 | sing | 1.39Å | 0.00Å | Aromatic |
| C24 | C25 | doub | 1.38Å | 0.00Å | Aromatic |
| C25 | C26 | sing | 1.39Å | 0.00Å | Aromatic |
| C26 | C27 | doub | 1.38Å | 0.00Å | Aromatic |
| C27 | C28 | sing | 1.41Å | 0.00Å | Aromatic |
| C28 | C23 | doub | 1.39Å | 0.00Å | Aromatic |
| C27 | C29 | sing | 1.48Å | 0.00Å | |
| C28 | C30 | sing | 1.47Å | 0.00Å | |
| C29 | N4 | sing | 1.35Å | 0.00Å | |
| N4 | C30 | sing | 1.35Å | 0.00Å | |
| C29 | O9 | doub | 1.21Å | 0.00Å | |
| C30 | O10 | doub | 1.22Å | 0.00Å | |
| N4 | C31 | sing | 1.46Å | 0.00Å | |
| C31 | C32 | sing | 1.53Å | 0.00Å | |
| C32 | C33 | sing | 1.53Å | 0.00Å | |
| C33 | C34 | sing | 1.51Å | 0.00Å | |
| C34 | N5 | sing | 1.34Å | 0.00Å | |
| N5 | C47 | sing | 1.34Å | 0.00Å | |
| C47 | C31 | sing | 1.51Å | 0.00Å | |
| C34 | O11 | doub | 1.21Å | 0.00Å | |
| C47 | O12 | doub | 1.21Å | 0.00Å | |
| C21 | O8 | doub | 1.21Å | 0.00Å | |
| C11 | H11 | sing | 1.09Å | 0.00Å | |
| C11 | H23 | sing | 1.09Å | 0.00Å | |
| C12 | H24 | sing | 1.09Å | 0.00Å | |
| C12 | H25 | sing | 1.09Å | 0.00Å | |
| C13 | H26 | sing | 1.09Å | 0.00Å | |
| C13 | H27 | sing | 1.09Å | 0.00Å | |
| C14 | H28 | sing | 1.09Å | 0.00Å | |
| C14 | H29 | sing | 1.09Å | 0.00Å | |
| C15 | H30 | sing | 1.09Å | 0.00Å | |
| C15 | H31 | sing | 1.09Å | 0.00Å | |
| C16 | H32 | sing | 1.09Å | 0.00Å | |
| C16 | H33 | sing | 1.09Å | 0.00Å | |
| C17 | H34 | sing | 1.09Å | 0.00Å | |
| C17 | H35 | sing | 1.09Å | 0.00Å | |
| C18 | H36 | sing | 1.09Å | 0.00Å | |
| C18 | H37 | sing | 1.09Å | 0.00Å | |
| C19 | H38 | sing | 1.09Å | 0.00Å | |
| C19 | H39 | sing | 1.09Å | 0.00Å | |
| C20 | H40 | sing | 1.09Å | 0.00Å | |
| C20 | H41 | sing | 1.09Å | 0.00Å | |
| N3 | H42 | sing | 0.97Å | 0.00Å | |
| C22 | H43 | sing | 1.09Å | 0.00Å | |
| C22 | H44 | sing | 1.09Å | 0.00Å | |
| C24 | H45 | sing | 1.08Å | 0.00Å | |
| C25 | H46 | sing | 1.08Å | 0.00Å | |
| C26 | H47 | sing | 1.08Å | 0.00Å | |
| C31 | H48 | sing | 1.09Å | 0.00Å | |
| C32 | H49 | sing | 1.09Å | 0.00Å | |
| C32 | H50 | sing | 1.09Å | 0.00Å | |
| C33 | H51 | sing | 1.09Å | 0.00Å | |
| C33 | H52 | sing | 1.09Å | 0.00Å | |
| N5 | H53 | sing | 0.97Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C46 | C45 | C43 | 119.4° | 120.0° |
| C45 | C46 | C40 | 120.8° | 119.9° |
| C46 | C45 | H21 | 120.3° | 120.0° |
| C45 | C46 | H22 | 119.6° | 120.0° |
| C45 | C43 | O14 | 119.2° | 120.0° |
| C45 | C43 | C42 | 120.0° | 120.1° |
| C43 | C45 | H21 | 120.3° | 120.0° |
| C46 | C40 | N6 | 124.4° | 120.0° |
| C46 | C40 | C41 | 119.6° | 120.0° |
| C40 | C46 | H22 | 119.6° | 120.1° |
| F1 | C44 | O14 | 114.0° | 109.5° |
| F1 | C44 | F3 | 106.7° | 109.4° |
| F1 | C44 | F2 | 107.2° | 109.5° |
| C43 | O14 | C44 | 117.1° | 117.0° |
| O14 | C43 | C42 | 120.7° | 120.0° |
| O14 | C44 | F3 | 107.9° | 109.5° |
| O14 | C44 | F2 | 114.0° | 109.5° |
| C43 | C42 | C41 | 120.3° | 120.0° |
| C43 | C42 | H20 | 119.8° | 120.0° |
| N6 | C40 | C41 | 115.9° | 120.0° |
| C40 | N6 | C1 | 128.0° | 120.0° |
| C40 | N6 | H18 | 116.0° | 120.0° |
| C40 | C41 | C42 | 119.8° | 120.0° |
| C40 | C41 | H19 | 120.1° | 120.1° |
| N6 | C1 | N1 | 111.9° | 120.0° |
| N6 | C1 | O1 | 122.9° | 119.9° |
| C1 | N6 | H18 | 116.0° | 119.9° |
| F3 | C44 | F2 | 106.5° | 109.5° |
| C1 | N1 | C2 | 128.7° | 120.0° |
| N1 | C1 | O1 | 125.2° | 120.0° |
| C1 | N1 | H1 | 115.6° | 120.0° |
| N1 | C2 | C39 | 112.9° | 109.5° |
| N1 | C2 | C3 | 115.3° | 109.5° |
| C2 | N1 | H1 | 115.6° | 120.0° |
| N1 | C2 | H7 | 105.6° | 109.5° |
| C42 | C41 | H19 | 120.1° | 120.0° |
| C41 | C42 | H20 | 119.9° | 120.0° |
| C2 | C39 | C38 | 114.7° | 109.5° |
| C39 | C2 | C3 | 111.8° | 109.5° |
| C39 | C2 | H7 | 105.0° | 109.5° |
| C2 | C39 | H16 | 108.2° | 109.5° |
| C2 | C39 | H17 | 108.2° | 109.5° |
| C39 | C38 | C5 | 114.7° | 109.5° |
| C39 | C38 | H14 | 108.2° | 109.4° |
| C39 | C38 | H15 | 108.2° | 109.5° |
| C38 | C39 | H16 | 108.2° | 109.4° |
| C38 | C39 | H17 | 108.1° | 109.5° |
| C2 | C3 | C4 | 107.7° | 109.5° |
| C3 | C2 | H7 | 105.2° | 109.4° |
| C2 | C3 | H8 | 109.9° | 109.5° |
| C2 | C3 | H9 | 109.9° | 109.5° |
| C38 | C5 | O2 | 108.7° | 109.5° |
| C38 | C5 | C4 | 114.2° | 109.5° |
| C38 | C5 | H4 | 108.4° | 109.5° |
| C5 | C38 | H14 | 108.2° | 109.5° |
| C5 | C38 | H15 | 108.2° | 109.5° |
| C3 | C4 | C5 | 111.8° | 109.5° |
| C3 | C4 | H2 | 108.9° | 109.5° |
| C3 | C4 | H3 | 108.9° | 109.4° |
| C4 | C3 | H8 | 109.9° | 109.4° |
| C4 | C3 | H9 | 109.9° | 109.5° |
| O2 | C5 | C4 | 108.3° | 109.4° |
| C5 | O2 | C6 | 116.3° | 117.0° |
| O2 | C5 | H4 | 108.9° | 109.4° |
| C5 | C4 | H2 | 108.9° | 109.5° |
| C5 | C4 | H3 | 108.9° | 109.5° |
| C4 | C5 | H4 | 108.4° | 109.5° |
| O2 | C6 | C37 | 119.0° | 119.9° |
| O2 | C6 | C7 | 120.3° | 119.9° |
| C37 | C6 | C7 | 120.6° | 120.2° |
| C6 | C37 | C36 | 119.4° | 120.1° |
| C6 | C37 | H13 | 120.3° | 120.0° |
| C6 | C7 | C8 | 119.4° | 120.1° |
| C6 | C7 | H5 | 120.3° | 120.0° |
| C37 | C36 | C9 | 121.0° | 119.9° |
| C37 | C36 | H12 | 119.5° | 120.0° |
| C36 | C37 | H13 | 120.3° | 119.9° |
| C7 | C8 | C9 | 121.0° | 119.9° |
| C8 | C7 | H5 | 120.3° | 119.9° |
| C7 | C8 | H6 | 119.5° | 120.0° |
| C36 | C9 | C8 | 118.6° | 119.8° |
| C36 | C9 | C10 | 120.0° | 120.1° |
| C9 | C36 | H12 | 119.5° | 120.0° |
| C8 | C9 | C10 | 121.4° | 120.1° |
| C9 | C8 | H6 | 119.5° | 120.0° |
| C9 | C10 | O13 | 120.8° | 120.0° |
| C9 | C10 | N2 | 117.2° | 120.0° |
| O13 | C10 | N2 | 122.0° | 120.0° |
| C10 | N2 | H10 | 145.3° | 120.0° |
| C10 | N2 | C11 | 69.4° | 120.0° |
| H2 | C4 | H3 | 109.5° | 109.5° |
| H8 | C3 | H9 | 109.5° | 109.5° |
| H10 | N2 | C11 | 145.3° | 120.0° |
| H14 | C38 | H15 | 109.4° | 109.5° |
| H16 | C39 | H17 | 109.5° | 109.5° |
| N2 | C11 | C12 | 90.0° | 109.4° |
| N2 | C11 | H11 | 90.0° | 109.5° |
| N2 | C11 | H23 | 90.0° | 109.4° |
| C11 | C12 | O3 | 90.0° | 109.5° |
| C12 | C11 | H11 | 90.0° | 109.5° |
| C12 | C11 | H23 | 90.0° | 109.5° |
| C11 | C12 | H24 | 90.0° | 109.4° |
| C11 | C12 | H25 | 90.0° | 109.5° |
| C12 | O3 | C13 | 90.0° | 114.0° |
| O3 | C12 | H24 | 90.0° | 109.5° |
| O3 | C12 | H25 | 90.0° | 109.5° |
| O3 | C13 | C14 | 90.0° | 109.5° |
| O3 | C13 | H26 | 90.0° | 109.5° |
| O3 | C13 | H27 | 90.0° | 109.5° |
| C13 | C14 | O4 | 90.0° | 109.5° |
| C14 | C13 | H26 | 90.0° | 109.4° |
| C14 | C13 | H27 | 90.0° | 109.5° |
| C13 | C14 | H28 | 90.0° | 109.5° |
| C13 | C14 | H29 | 90.0° | 109.4° |
| C14 | O4 | C15 | 90.0° | 114.0° |
| O4 | C14 | H28 | 90.0° | 109.5° |
| O4 | C14 | H29 | 90.0° | 109.5° |
| O4 | C15 | C16 | 90.0° | 109.5° |
| O4 | C15 | H30 | 90.0° | 109.5° |
| O4 | C15 | H31 | 90.0° | 109.5° |
| C15 | C16 | O5 | 90.0° | 109.4° |
| C16 | C15 | H30 | 90.0° | 109.5° |
| C16 | C15 | H31 | 90.0° | 109.4° |
| C15 | C16 | H32 | 90.0° | 109.4° |
| C15 | C16 | H33 | 90.0° | 109.4° |
| C16 | O5 | C17 | 90.0° | 114.0° |
| O5 | C16 | H32 | 90.0° | 109.5° |
| O5 | C16 | H33 | 90.0° | 109.5° |
| O5 | C17 | C18 | 90.0° | 109.5° |
| O5 | C17 | H34 | 90.0° | 109.4° |
| O5 | C17 | H35 | 90.0° | 109.5° |
| C17 | C18 | O6 | 90.0° | 109.4° |
| C18 | C17 | H34 | 90.0° | 109.5° |
| C18 | C17 | H35 | 90.0° | 109.5° |
| C17 | C18 | H36 | 90.0° | 109.4° |
| C17 | C18 | H37 | 90.0° | 109.5° |
| C18 | O6 | C19 | 90.0° | 114.0° |
| O6 | C18 | H36 | 90.0° | 109.5° |
| O6 | C18 | H37 | 90.0° | 109.5° |
| O6 | C19 | C20 | 90.0° | 109.5° |
| O6 | C19 | H38 | 90.0° | 109.4° |
| O6 | C19 | H39 | 90.0° | 109.4° |
| C19 | C20 | N3 | 90.0° | 109.4° |
| C20 | C19 | H38 | 90.0° | 109.5° |
| C20 | C19 | H39 | 90.0° | 109.5° |
| C19 | C20 | H40 | 90.0° | 109.5° |
| C19 | C20 | H41 | 90.0° | 109.5° |
| C20 | N3 | C21 | 90.0° | 120.0° |
| N3 | C20 | H40 | 90.0° | 109.5° |
| N3 | C20 | H41 | 90.0° | 109.5° |
| C20 | N3 | H42 | 90.0° | 120.0° |
| N3 | C21 | C22 | 90.0° | 120.0° |
| N3 | C21 | O8 | 90.0° | 120.0° |
| C21 | N3 | H42 | 90.0° | 120.0° |
| C21 | C22 | O7 | 90.0° | 109.5° |
| C22 | C21 | O8 | 90.0° | 120.0° |
| C21 | C22 | H43 | 90.0° | 109.5° |
| C21 | C22 | H44 | 90.0° | 109.5° |
| C22 | O7 | C23 | 90.0° | 117.0° |
| O7 | C22 | H43 | 90.0° | 109.4° |
| O7 | C22 | H44 | 90.0° | 109.5° |
| O7 | C23 | C24 | 90.0° | 120.2° |
| O7 | C23 | C28 | 90.0° | 120.3° |
| C23 | C24 | C25 | 90.0° | 120.4° |
| C24 | C23 | C28 | 90.0° | 119.5° |
| C23 | C24 | H45 | 90.0° | 119.8° |
| C24 | C25 | C26 | 90.0° | 120.6° |
| C25 | C24 | H45 | 90.0° | 119.8° |
| C24 | C25 | H46 | 90.0° | 119.7° |
| C25 | C26 | C27 | 90.0° | 119.9° |
| C26 | C25 | H46 | 90.0° | 119.7° |
| C25 | C26 | H47 | 90.0° | 120.0° |
| C26 | C27 | C28 | 90.0° | 119.8° |
| C26 | C27 | C29 | 90.0° | 134.3° |
| C27 | C26 | H47 | 90.0° | 120.1° |
| C27 | C28 | C23 | 90.0° | 119.8° |
| C28 | C27 | C29 | 90.0° | 105.8° |
| C27 | C28 | C30 | 90.0° | 105.9° |
| C23 | C28 | C30 | 90.0° | 134.3° |
| C27 | C29 | N4 | 90.0° | 108.5° |
| C27 | C29 | O9 | 90.0° | 125.8° |
| C28 | C30 | N4 | 90.0° | 108.7° |
| C28 | C30 | O10 | 90.0° | 125.7° |
| C29 | N4 | C30 | 90.0° | 111.1° |
| N4 | C29 | O9 | 90.0° | 125.7° |
| C29 | N4 | C31 | 90.0° | 124.5° |
| N4 | C30 | O10 | 90.0° | 125.7° |
| C30 | N4 | C31 | 90.0° | 124.4° |
| N4 | C31 | C32 | 90.0° | 109.5° |
| N4 | C31 | C47 | 90.0° | 109.5° |
| N4 | C31 | H48 | 90.0° | 109.5° |
| C31 | C32 | C33 | 90.0° | 108.6° |
| C32 | C31 | C47 | 90.0° | 109.1° |
| C32 | C31 | H48 | 90.0° | 109.5° |
| C31 | C32 | H49 | 90.0° | 109.6° |
| C31 | C32 | H50 | 90.0° | 109.6° |
| C32 | C33 | C34 | 90.0° | 109.2° |
| C33 | C32 | H49 | 90.0° | 109.6° |
| C33 | C32 | H50 | 90.0° | 109.7° |
| C32 | C33 | H51 | 90.0° | 109.5° |
| C32 | C33 | H52 | 90.0° | 109.5° |
| C33 | C34 | N5 | 90.0° | 121.3° |
| C33 | C34 | O11 | 90.0° | 119.4° |
| C34 | C33 | H51 | 90.0° | 109.5° |
| C34 | C33 | H52 | 90.0° | 109.5° |
| C34 | N5 | C47 | 90.0° | 122.6° |
| N5 | C34 | O11 | 90.0° | 119.3° |
| C34 | N5 | H53 | 90.0° | 118.7° |
| N5 | C47 | C31 | 90.0° | 121.3° |
| N5 | C47 | O12 | 90.0° | 119.4° |
| C47 | N5 | H53 | 90.0° | 118.7° |
| C31 | C47 | O12 | 90.0° | 119.4° |
| C47 | C31 | H48 | 90.0° | 109.6° |
| H11 | C11 | H23 | 90.0° | 109.5° |
| H24 | C12 | H25 | 90.0° | 109.4° |
| H26 | C13 | H27 | 90.0° | 109.5° |
| H28 | C14 | H29 | 90.0° | 109.4° |
| H30 | C15 | H31 | 90.0° | 109.5° |
| H32 | C16 | H33 | 90.0° | 109.5° |
| H34 | C17 | H35 | 90.0° | 109.5° |
| H36 | C18 | H37 | 90.0° | 109.5° |
| H38 | C19 | H39 | 90.0° | 109.5° |
| H40 | C20 | H41 | 90.0° | 109.5° |
| H43 | C22 | H44 | 90.0° | 109.5° |
| H49 | C32 | H50 | 90.0° | 109.7° |
| H51 | C33 | H52 | 90.0° | 109.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C46 | C45 | C43 | H21 | 180.0° | 179.4° |
| C45 | C46 | C40 | H22 | 180.0° | 179.5° |
| C46 | C45 | C43 | O14 | 177.6° | 179.8° |
| C46 | C45 | C43 | C42 | 0.0° | 0.3° |
| C45 | C46 | C40 | N6 | 178.1° | 179.7° |
| C45 | C46 | C40 | C41 | 0.5° | 0.5° |
| C43 | C45 | C46 | C40 | 0.5° | 0.6° |
| C45 | C43 | O14 | C42 | 177.6° | 179.9° |
| C45 | C43 | O14 | C44 | 90.0° | 0.1° |
| C45 | C43 | C42 | C41 | 0.6° | 0.0° |
| C45 | C43 | C42 | H20 | 179.4° | 179.9° |
| C43 | C45 | C46 | H22 | 179.5° | 179.9° |
| C46 | C40 | N6 | C41 | 178.7° | 179.7° |
| C46 | C40 | N6 | C1 | 134.7° | 35.5° |
| C46 | C40 | C41 | C42 | 0.1° | 0.2° |
| C46 | C40 | N6 | H18 | 45.3° | 144.5° |
| C46 | C40 | C41 | H19 | 179.9° | 179.8° |
| C40 | C46 | C45 | H21 | 179.5° | 179.9° |
| F1 | C44 | O14 | C43 | 64.5° | 60.0° |
| F1 | C44 | O14 | F3 | 118.3° | 120.0° |
| F1 | C44 | O14 | F2 | 123.6° | 120.1° |
| F1 | C44 | F3 | F2 | 114.3° | 120.0° |
| C43 | O14 | C44 | F3 | 177.2° | 180.0° |
| C43 | O14 | C44 | F2 | 59.1° | 60.1° |
| O14 | C43 | C42 | C41 | 178.2° | 179.9° |
| O14 | C43 | C42 | H20 | 1.8° | 0.0° |
| O14 | C43 | C45 | H21 | 2.4° | 0.4° |
| C44 | O14 | C43 | C42 | 92.4° | 180.0° |
| O14 | C44 | F3 | F2 | 122.8° | 120.0° |
| C43 | C42 | C41 | C40 | 0.6° | 0.0° |
| C43 | C42 | C41 | H20 | 180.0° | 179.9° |
| C43 | C42 | C41 | H19 | 179.4° | 179.9° |
| C42 | C43 | C45 | H21 | 180.0° | 179.7° |
| C40 | N6 | C1 | H18 | 180.0° | 179.9° |
| C40 | N6 | C1 | N1 | 179.4° | 175.5° |
| N6 | C40 | C41 | C42 | 178.9° | 180.0° |
| C40 | N6 | C1 | O1 | 1.1° | 4.6° |
| N6 | C40 | C41 | H19 | 1.2° | 0.1° |
| N6 | C40 | C46 | H22 | 1.8° | 0.2° |
| C41 | C40 | N6 | C1 | 44.0° | 144.7° |
| C40 | C41 | C42 | H19 | 180.0° | 180.0° |
| C41 | C40 | N6 | H18 | 136.0° | 35.2° |
| C40 | C41 | C42 | H20 | 179.3° | 180.0° |
| C41 | C40 | C46 | H22 | 179.6° | 180.0° |
| N6 | C1 | N1 | O1 | 179.5° | 179.9° |
| N6 | C1 | N1 | C2 | 151.9° | 180.0° |
| N6 | C1 | N1 | H1 | 28.1° | 0.2° |
| C1 | N1 | C2 | H1 | 180.0° | 179.8° |
| C1 | N1 | C2 | C39 | 151.3° | 85.0° |
| C1 | N1 | C2 | C3 | 21.2° | 155.0° |
| C1 | N1 | C2 | H7 | 94.5° | 35.1° |
| N1 | C1 | N6 | H18 | 0.6° | 4.5° |
| C2 | N1 | C1 | O1 | 28.6° | 0.1° |
| N1 | C2 | C39 | C3 | 131.9° | 120.0° |
| N1 | C2 | C39 | H7 | 114.6° | 120.0° |
| N1 | C2 | C39 | C38 | 138.7° | 180.0° |
| N1 | C2 | C3 | H7 | 115.9° | 120.0° |
| N1 | C2 | C3 | C4 | 171.1° | 180.0° |
| N1 | C2 | C3 | H8 | 51.4° | 60.1° |
| N1 | C2 | C3 | H9 | 69.2° | 60.0° |
| N1 | C2 | C39 | H16 | 17.9° | 60.0° |
| N1 | C2 | C39 | H17 | 100.6° | 60.0° |
| O1 | C1 | N1 | H1 | 151.4° | 179.8° |
| O1 | C1 | N6 | H18 | 178.9° | 175.5° |
| C2 | C39 | C38 | H16 | 120.8° | 120.0° |
| C2 | C39 | C38 | H17 | 120.8° | 120.0° |
| C39 | C2 | C3 | H7 | 113.4° | 120.0° |
| C2 | C39 | C38 | C5 | 41.0° | 60.0° |
| C39 | C2 | C3 | C4 | 58.2° | 60.0° |
| C39 | C2 | N1 | H1 | 28.7° | 95.2° |
| C39 | C2 | C3 | H8 | 177.9° | 59.9° |
| C39 | C2 | C3 | H9 | 61.5° | 180.0° |
| C2 | C39 | C38 | H14 | 79.8° | 60.0° |
| C2 | C39 | C38 | H15 | 161.7° | 180.0° |
| C2 | C39 | H16 | H17 | 117.6° | 120.1° |
| C38 | C39 | C2 | C3 | 6.8° | 60.0° |
| C39 | C38 | C5 | H14 | 120.8° | 120.0° |
| C39 | C38 | C5 | H15 | 120.8° | 120.0° |
| C39 | C38 | C5 | O2 | 85.5° | 180.0° |
| C39 | C38 | C5 | C4 | 35.4° | 60.0° |
| C39 | C38 | C5 | H4 | 156.3° | 60.1° |
| C38 | C39 | C2 | H7 | 106.8° | 60.0° |
| C39 | C38 | H14 | H15 | 117.6° | 120.0° |
| C38 | C39 | H16 | H17 | 117.6° | 119.9° |
| C2 | C3 | C4 | H8 | 119.7° | 120.0° |
| C2 | C3 | C4 | H9 | 119.7° | 120.0° |
| C2 | C3 | C4 | C5 | 64.2° | 60.0° |
| C3 | C2 | N1 | H1 | 158.8° | 24.8° |
| C2 | C3 | C4 | H2 | 56.2° | 180.0° |
| C2 | C3 | C4 | H3 | 175.5° | 60.0° |
| C2 | C3 | H8 | H9 | 120.8° | 120.0° |
| C3 | C2 | C39 | H16 | 114.0° | 60.0° |
| C3 | C2 | C39 | H17 | 127.5° | 180.0° |
| C38 | C5 | C4 | C3 | 16.5° | 60.0° |
| C38 | C5 | O2 | C4 | 124.5° | 120.0° |
| C38 | C5 | O2 | H4 | 117.8° | 120.0° |
| C38 | C5 | C4 | H4 | 120.9° | 120.1° |
| C38 | C5 | O2 | C6 | 160.5° | 92.6° |
| C38 | C5 | C4 | H2 | 103.9° | 180.0° |
| C38 | C5 | C4 | H3 | 136.8° | 59.9° |
| C5 | C38 | H14 | H15 | 117.6° | 120.1° |
| C5 | C38 | C39 | H16 | 161.7° | 60.0° |
| C5 | C38 | C39 | H17 | 79.8° | 180.0° |
| C3 | C4 | C5 | O2 | 137.6° | 180.0° |
| C3 | C4 | C5 | H2 | 120.4° | 120.0° |
| C3 | C4 | C5 | H3 | 120.3° | 119.9° |
| C3 | C4 | H2 | H3 | 118.9° | 120.0° |
| C3 | C4 | C5 | H4 | 104.4° | 60.1° |
| C4 | C3 | C2 | H7 | 55.3° | 60.0° |
| C4 | C3 | H8 | H9 | 120.8° | 120.0° |
| O2 | C5 | C4 | H4 | 118.0° | 119.9° |
| C5 | O2 | C6 | C37 | 116.1° | 174.6° |
| C5 | O2 | C6 | C7 | 61.3° | 5.1° |
| O2 | C5 | C4 | H2 | 17.3° | 60.0° |
| O2 | C5 | C4 | H3 | 102.0° | 60.1° |
| O2 | C5 | C38 | H14 | 153.7° | 60.0° |
| O2 | C5 | C38 | H15 | 35.2° | 60.0° |
| C4 | C5 | O2 | C6 | 75.0° | 147.4° |
| C5 | C4 | H2 | H3 | 119.0° | 120.0° |
| C5 | C4 | C3 | H8 | 176.1° | 60.0° |
| C5 | C4 | C3 | H9 | 55.5° | 180.0° |
| C4 | C5 | C38 | H14 | 85.4° | 59.9° |
| C4 | C5 | C38 | H15 | 156.2° | 180.0° |
| O2 | C6 | C37 | C7 | 177.3° | 179.7° |
| O2 | C6 | C37 | C36 | 178.3° | 179.7° |
| O2 | C6 | C7 | C8 | 178.4° | 179.7° |
| C6 | O2 | C5 | H4 | 42.7° | 27.4° |
| O2 | C6 | C7 | H5 | 1.6° | 0.3° |
| O2 | C6 | C37 | H13 | 1.7° | 0.3° |
| C6 | C37 | C36 | H13 | 180.0° | 180.0° |
| C37 | C6 | C7 | C8 | 1.1° | 0.0° |
| C6 | C37 | C36 | C9 | 0.6° | 0.0° |
| C37 | C6 | C7 | H5 | 178.9° | 180.0° |
| C6 | C37 | C36 | H12 | 179.5° | 180.0° |
| C7 | C6 | C37 | C36 | 0.9° | 0.0° |
| C6 | C7 | C8 | H5 | 180.0° | 180.0° |
| C6 | C7 | C8 | C9 | 0.9° | 0.1° |
| C6 | C7 | C8 | H6 | 179.1° | 180.0° |
| C7 | C6 | C37 | H13 | 179.1° | 180.0° |
| C37 | C36 | C9 | H12 | 180.0° | 180.0° |
| C37 | C36 | C9 | C8 | 0.3° | 0.1° |
| C37 | C36 | C9 | C10 | 179.3° | 180.0° |
| C7 | C8 | C9 | C36 | 0.5° | 0.1° |
| C7 | C8 | C9 | H6 | 180.0° | 179.9° |
| C7 | C8 | C9 | C10 | 179.1° | 179.9° |
| C36 | C9 | C8 | C10 | 179.6° | 180.0° |
| C36 | C9 | C10 | O13 | 9.1° | 180.0° |
| C36 | C9 | C10 | N2 | 169.2° | 0.0° |
| C36 | C9 | C8 | H6 | 179.5° | 180.0° |
| C9 | C36 | C37 | H13 | 179.5° | 180.0° |
| C8 | C9 | C10 | O13 | 171.3° | 0.0° |
| C8 | C9 | C10 | N2 | 10.5° | 180.0° |
| C9 | C8 | C7 | H5 | 179.1° | 180.0° |
| C8 | C9 | C36 | H12 | 179.7° | 179.9° |
| C9 | C10 | O13 | N2 | 178.2° | 180.0° |
| C10 | C9 | C8 | H6 | 0.9° | 0.0° |
| C9 | C10 | N2 | H10 | 147.6° | 0.0° |
| C10 | C9 | C36 | H12 | 0.7° | 0.1° |
| C9 | C10 | N2 | C11 | 32.4° | 180.0° |
| O13 | C10 | N2 | H10 | 30.6° | 179.9° |
| O13 | C10 | N2 | C11 | 149.4° | 0.0° |
| C10 | N2 | H10 | C11 | 180.0° | 179.9° |
| C10 | N2 | C11 | C12 | 90.0° | 180.0° |
| C10 | N2 | C11 | H11 | 90.0° | 60.0° |
| C10 | N2 | C11 | H23 | 90.0° | 60.0° |
| H1 | N1 | C2 | H7 | 85.5° | 144.7° |
| H2 | C4 | C5 | H4 | 135.2° | 59.9° |
| H2 | C4 | C3 | H8 | 63.6° | 60.0° |
| H2 | C4 | C3 | H9 | 175.9° | 60.0° |
| H3 | C4 | C5 | H4 | 15.9° | 180.0° |
| H3 | C4 | C3 | H8 | 55.7° | 180.0° |
| H3 | C4 | C3 | H9 | 64.8° | 60.0° |
| H4 | C5 | C38 | H14 | 35.5° | 180.0° |
| H4 | C5 | C38 | H15 | 82.9° | 59.9° |
| H5 | C7 | C8 | H6 | 0.9° | 0.1° |
| H7 | C2 | C3 | H8 | 64.5° | 180.0° |
| H7 | C2 | C3 | H9 | 175.0° | 60.0° |
| H7 | C2 | C39 | H16 | 132.5° | 179.9° |
| H7 | C2 | C39 | H17 | 14.0° | 60.0° |
| H10 | N2 | C11 | C12 | 90.0° | 0.1° |
| H10 | N2 | C11 | H11 | 90.0° | 119.9° |
| H10 | N2 | C11 | H23 | 90.0° | 120.0° |
| H12 | C36 | C37 | H13 | 0.5° | 0.0° |
| H14 | C38 | C39 | H16 | 41.0° | 180.0° |
| H14 | C38 | C39 | H17 | 159.4° | 60.0° |
| H15 | C38 | C39 | H16 | 77.5° | 60.0° |
| H15 | C38 | C39 | H17 | 41.0° | 60.0° |
| H19 | C41 | C42 | H20 | 0.7° | 0.0° |
| H21 | C45 | C46 | H22 | 0.5° | 0.6° |
| N2 | C11 | C12 | H11 | 90.0° | 120.0° |
| N2 | C11 | C12 | H23 | 90.0° | 119.9° |
| N2 | C11 | C12 | O3 | 90.0° | 65.1° |
| N2 | C11 | H11 | H23 | 90.0° | 120.0° |
| N2 | C11 | C12 | H24 | 90.0° | 175.0° |
| N2 | C11 | C12 | H25 | 90.0° | 55.0° |
| C11 | C12 | O3 | H24 | 90.0° | 119.9° |
| C11 | C12 | O3 | H25 | 90.0° | 120.1° |
| C11 | C12 | O3 | C13 | 90.0° | 180.0° |
| C12 | C11 | H11 | H23 | 90.0° | 120.1° |
| C11 | C12 | H24 | H25 | 90.0° | 120.0° |
| C12 | O3 | C13 | C14 | 90.0° | 180.0° |
| O3 | C12 | C11 | H11 | 90.0° | 54.9° |
| O3 | C12 | C11 | H23 | 90.0° | 175.0° |
| O3 | C12 | H24 | H25 | 90.0° | 120.0° |
| C12 | O3 | C13 | H26 | 90.0° | 60.0° |
| C12 | O3 | C13 | H27 | 90.0° | 60.0° |
| O3 | C13 | C14 | H26 | 90.0° | 120.0° |
| O3 | C13 | C14 | H27 | 90.0° | 120.0° |
| O3 | C13 | C14 | O4 | 90.0° | 65.0° |
| C13 | O3 | C12 | H24 | 90.0° | 60.0° |
| C13 | O3 | C12 | H25 | 90.0° | 59.9° |
| O3 | C13 | H26 | H27 | 90.0° | 120.0° |
| O3 | C13 | C14 | H28 | 90.0° | 175.0° |
| O3 | C13 | C14 | H29 | 90.0° | 55.0° |
| C13 | C14 | O4 | H28 | 90.0° | 120.0° |
| C13 | C14 | O4 | H29 | 90.0° | 120.0° |
| C13 | C14 | O4 | C15 | 90.0° | 180.0° |
| C14 | C13 | H26 | H27 | 90.0° | 120.0° |
| C13 | C14 | H28 | H29 | 90.0° | 119.9° |
| C14 | O4 | C15 | C16 | 90.0° | 180.0° |
| O4 | C14 | C13 | H26 | 90.0° | 55.0° |
| O4 | C14 | C13 | H27 | 90.0° | 175.0° |
| O4 | C14 | H28 | H29 | 90.0° | 120.0° |
| C14 | O4 | C15 | H30 | 90.0° | 60.0° |
| C14 | O4 | C15 | H31 | 90.0° | 60.0° |
| O4 | C15 | C16 | H30 | 90.0° | 120.1° |
| O4 | C15 | C16 | H31 | 90.0° | 120.0° |
| O4 | C15 | C16 | O5 | 90.0° | 65.0° |
| C15 | O4 | C14 | H28 | 90.0° | 60.0° |
| C15 | O4 | C14 | H29 | 90.0° | 60.0° |
| O4 | C15 | H30 | H31 | 90.0° | 120.0° |
| O4 | C15 | C16 | H32 | 90.0° | 175.0° |
| O4 | C15 | C16 | H33 | 90.0° | 55.0° |
| C15 | C16 | O5 | H32 | 90.0° | 120.0° |
| C15 | C16 | O5 | H33 | 90.0° | 120.0° |
| C15 | C16 | O5 | C17 | 90.0° | 180.0° |
| C16 | C15 | H30 | H31 | 90.0° | 119.9° |
| C15 | C16 | H32 | H33 | 90.0° | 120.0° |
| C16 | O5 | C17 | C18 | 90.0° | 180.0° |
| O5 | C16 | C15 | H30 | 90.0° | 55.0° |
| O5 | C16 | C15 | H31 | 90.0° | 175.0° |
| O5 | C16 | H32 | H33 | 90.0° | 120.1° |
| C16 | O5 | C17 | H34 | 90.0° | 60.0° |
| C16 | O5 | C17 | H35 | 90.0° | 60.0° |
| O5 | C17 | C18 | H34 | 90.0° | 120.0° |
| O5 | C17 | C18 | H35 | 90.0° | 120.0° |
| O5 | C17 | C18 | O6 | 90.0° | 65.0° |
| C17 | O5 | C16 | H32 | 90.0° | 60.0° |
| C17 | O5 | C16 | H33 | 90.0° | 60.0° |
| O5 | C17 | H34 | H35 | 90.0° | 120.0° |
| O5 | C17 | C18 | H36 | 90.0° | 175.0° |
| O5 | C17 | C18 | H37 | 90.0° | 55.0° |
| C17 | C18 | O6 | H36 | 90.0° | 119.9° |
| C17 | C18 | O6 | H37 | 90.0° | 120.0° |
| C17 | C18 | O6 | C19 | 90.0° | 180.0° |
| C18 | C17 | H34 | H35 | 90.0° | 120.0° |
| C17 | C18 | H36 | H37 | 90.0° | 120.0° |
| C18 | O6 | C19 | C20 | 90.0° | 180.0° |
| O6 | C18 | C17 | H34 | 90.0° | 54.9° |
| O6 | C18 | C17 | H35 | 90.0° | 175.0° |
| O6 | C18 | H36 | H37 | 90.0° | 120.1° |
| C18 | O6 | C19 | H38 | 90.0° | 60.0° |
| C18 | O6 | C19 | H39 | 90.0° | 60.0° |
| O6 | C19 | C20 | H38 | 90.0° | 120.0° |
| O6 | C19 | C20 | H39 | 90.0° | 119.9° |
| O6 | C19 | C20 | N3 | 90.0° | 65.0° |
| C19 | O6 | C18 | H36 | 90.0° | 60.1° |
| C19 | O6 | C18 | H37 | 90.0° | 60.0° |
| O6 | C19 | H38 | H39 | 90.0° | 119.9° |
| O6 | C19 | C20 | H40 | 90.0° | 175.0° |
| O6 | C19 | C20 | H41 | 90.0° | 55.0° |
| C19 | C20 | N3 | H40 | 90.0° | 120.0° |
| C19 | C20 | N3 | H41 | 90.0° | 120.0° |
| C19 | C20 | N3 | C21 | 90.0° | 180.0° |
| C20 | C19 | H38 | H39 | 90.0° | 120.1° |
| C19 | C20 | H40 | H41 | 90.0° | 120.0° |
| C19 | C20 | N3 | H42 | 90.0° | 0.0° |
| C20 | N3 | C21 | H42 | 90.0° | 180.0° |
| C20 | N3 | C21 | C22 | 90.0° | 180.0° |
| C20 | N3 | C21 | O8 | 90.0° | 0.0° |
| N3 | C20 | C19 | H38 | 90.0° | 55.0° |
| N3 | C20 | C19 | H39 | 90.0° | 175.0° |
| N3 | C20 | H40 | H41 | 90.0° | 120.0° |
| N3 | C21 | C22 | O8 | 90.0° | 180.0° |
| N3 | C21 | C22 | O7 | 90.0° | 180.0° |
| C21 | N3 | C20 | H40 | 90.0° | 60.1° |
| C21 | N3 | C20 | H41 | 90.0° | 60.0° |
| N3 | C21 | C22 | H43 | 90.0° | 60.1° |
| N3 | C21 | C22 | H44 | 90.0° | 60.0° |
| C21 | C22 | O7 | H43 | 90.0° | 120.0° |
| C21 | C22 | O7 | H44 | 90.0° | 120.0° |
| C21 | C22 | O7 | C23 | 90.0° | 180.0° |
| C22 | C21 | N3 | H42 | 90.0° | 0.1° |
| C21 | C22 | H43 | H44 | 90.0° | 120.0° |
| C22 | O7 | C23 | C24 | 90.0° | 0.0° |
| C22 | O7 | C23 | C28 | 90.0° | 179.7° |
| O7 | C22 | C21 | O8 | 90.0° | 0.0° |
| O7 | C22 | H43 | H44 | 90.0° | 120.0° |
| O7 | C23 | C24 | C28 | 90.0° | 179.7° |
| O7 | C23 | C24 | C25 | 90.0° | 180.0° |
| O7 | C23 | C28 | C27 | 90.0° | 179.7° |
| O7 | C23 | C28 | C30 | 90.0° | 0.5° |
| C23 | O7 | C22 | H43 | 90.0° | 60.0° |
| C23 | O7 | C22 | H44 | 90.0° | 60.0° |
| O7 | C23 | C24 | H45 | 90.0° | 0.0° |
| C23 | C24 | C25 | H45 | 90.0° | 180.0° |
| C23 | C24 | C25 | C26 | 90.0° | 0.1° |
| C24 | C23 | C28 | C27 | 90.0° | 0.6° |
| C24 | C23 | C28 | C30 | 90.0° | 179.8° |
| C23 | C24 | C25 | H46 | 90.0° | 180.0° |
| C24 | C25 | C26 | H46 | 90.0° | 179.9° |
| C24 | C25 | C26 | C27 | 90.0° | 0.1° |
| C25 | C24 | C23 | C28 | 90.0° | 0.2° |
| C24 | C25 | C26 | H47 | 90.0° | 180.0° |
| C25 | C26 | C27 | H47 | 90.0° | 180.0° |
| C25 | C26 | C27 | C28 | 90.0° | 0.2° |
| C25 | C26 | C27 | C29 | 90.0° | 180.0° |
| C26 | C25 | C24 | H45 | 90.0° | 179.9° |
| C26 | C27 | C28 | C29 | 90.0° | 179.8° |
| C26 | C27 | C28 | C23 | 90.0° | 0.5° |
| C26 | C27 | C28 | C30 | 90.0° | 180.0° |
| C26 | C27 | C29 | N4 | 90.0° | 180.0° |
| C26 | C27 | C29 | O9 | 90.0° | 0.0° |
| C27 | C26 | C25 | H46 | 90.0° | 180.0° |
| C27 | C28 | C23 | C30 | 90.0° | 179.3° |
| C28 | C27 | C29 | N4 | 90.0° | 0.2° |
| C27 | C28 | C30 | N4 | 90.0° | 0.1° |
| C28 | C27 | C29 | O9 | 90.0° | 179.8° |
| C27 | C28 | C30 | O10 | 90.0° | 180.0° |
| C28 | C27 | C26 | H47 | 90.0° | 179.7° |
| C23 | C28 | C27 | C29 | 90.0° | 179.6° |
| C23 | C28 | C30 | N4 | 90.0° | 179.5° |
| C23 | C28 | C30 | O10 | 90.0° | 0.7° |
| C28 | C23 | C24 | H45 | 90.0° | 179.7° |
| C29 | C27 | C28 | C30 | 90.0° | 0.2° |
| C27 | C29 | N4 | O9 | 90.0° | 180.0° |
| C27 | C29 | N4 | C30 | 90.0° | 0.1° |
| C27 | C29 | N4 | C31 | 90.0° | 180.0° |
| C29 | C27 | C26 | H47 | 90.0° | 0.0° |
| C28 | C30 | N4 | C29 | 90.0° | 0.0° |
| C28 | C30 | N4 | O10 | 90.0° | 179.8° |
| C28 | C30 | N4 | C31 | 90.0° | 179.9° |
| C29 | N4 | C30 | C31 | 90.0° | 179.9° |
| C29 | N4 | C30 | O10 | 90.0° | 179.9° |
| C29 | N4 | C31 | C32 | 90.0° | 114.6° |
| C29 | N4 | C31 | C47 | 90.0° | 5.0° |
| C29 | N4 | C31 | H48 | 90.0° | 125.2° |
| C30 | N4 | C29 | O9 | 90.0° | 179.8° |
| C30 | N4 | C31 | C32 | 90.0° | 65.4° |
| C30 | N4 | C31 | C47 | 90.0° | 174.9° |
| C30 | N4 | C31 | H48 | 90.0° | 54.7° |
| O9 | C29 | N4 | C31 | 90.0° | 0.1° |
| O10 | C30 | N4 | C31 | 90.0° | 0.1° |
| N4 | C31 | C32 | C47 | 90.0° | 119.9° |
| N4 | C31 | C32 | H48 | 90.0° | 120.2° |
| N4 | C31 | C32 | C33 | 90.0° | 64.3° |
| N4 | C31 | C47 | N5 | 90.0° | 90.8° |
| N4 | C31 | C47 | H48 | 90.0° | 120.2° |
| N4 | C31 | C47 | O12 | 90.0° | 89.2° |
| N4 | C31 | C32 | H49 | 90.0° | 176.0° |
| N4 | C31 | C32 | H50 | 90.0° | 55.5° |
| C31 | C32 | C33 | H49 | 90.0° | 119.7° |
| C31 | C32 | C33 | H50 | 90.0° | 119.7° |
| C31 | C32 | C33 | C34 | 90.0° | 55.6° |
| C32 | C31 | C47 | N5 | 90.0° | 29.1° |
| C32 | C31 | C47 | H48 | 90.0° | 120.0° |
| C32 | C31 | C47 | O12 | 90.0° | 150.9° |
| C31 | C32 | H49 | H50 | 90.0° | 120.4° |
| C31 | C32 | C33 | H51 | 90.0° | 175.6° |
| C31 | C32 | C33 | H52 | 90.0° | 64.3° |
| C32 | C33 | C34 | H51 | 90.0° | 119.9° |
| C32 | C33 | C34 | H52 | 90.0° | 119.9° |
| C32 | C33 | C34 | N5 | 90.0° | 29.1° |
| C33 | C32 | C31 | C47 | 90.0° | 55.6° |
| C32 | C33 | C34 | O11 | 90.0° | 150.9° |
| C33 | C32 | C31 | H48 | 90.0° | 175.6° |
| C33 | C32 | H49 | H50 | 90.0° | 120.5° |
| C32 | C33 | H51 | H52 | 90.0° | 120.1° |
| C33 | C34 | N5 | O11 | 90.0° | 180.0° |
| C33 | C34 | N5 | C47 | 90.0° | 0.6° |
| C34 | C33 | C32 | H49 | 90.0° | 64.1° |
| C34 | C33 | C32 | H50 | 90.0° | 175.4° |
| C34 | C33 | H51 | H52 | 90.0° | 120.1° |
| C33 | C34 | N5 | H53 | 90.0° | 179.5° |
| C34 | N5 | C47 | H53 | 90.0° | 179.9° |
| C34 | N5 | C47 | C31 | 90.0° | 0.6° |
| C34 | N5 | C47 | O12 | 90.0° | 179.4° |
| N5 | C34 | C33 | H51 | 90.0° | 149.1° |
| N5 | C34 | C33 | H52 | 90.0° | 90.8° |
| N5 | C47 | C31 | O12 | 90.0° | 180.0° |
| C47 | N5 | C34 | O11 | 90.0° | 179.4° |
| N5 | C47 | C31 | H48 | 90.0° | 149.0° |
| C47 | C31 | C32 | H49 | 90.0° | 64.2° |
| C47 | C31 | C32 | H50 | 90.0° | 175.4° |
| C31 | C47 | N5 | H53 | 90.0° | 179.5° |
| O11 | C34 | C33 | H51 | 90.0° | 31.0° |
| O11 | C34 | C33 | H52 | 90.0° | 89.2° |
| O11 | C34 | N5 | H53 | 90.0° | 0.5° |
| O12 | C47 | C31 | H48 | 90.0° | 31.0° |
| O12 | C47 | N5 | H53 | 90.0° | 0.5° |
| O8 | C21 | N3 | H42 | 90.0° | 180.0° |
| O8 | C21 | C22 | H43 | 90.0° | 120.0° |
| O8 | C21 | C22 | H44 | 90.0° | 120.0° |
| H11 | C11 | C12 | H24 | 90.0° | 65.1° |
| H11 | C11 | C12 | H25 | 90.0° | 175.0° |
| H23 | C11 | C12 | H24 | 90.0° | 55.1° |
| H23 | C11 | C12 | H25 | 90.0° | 64.9° |
| H26 | C13 | C14 | H28 | 90.0° | 65.0° |
| H26 | C13 | C14 | H29 | 90.0° | 175.1° |
| H27 | C13 | C14 | H28 | 90.0° | 55.0° |
| H27 | C13 | C14 | H29 | 90.0° | 65.0° |
| H30 | C15 | C16 | H32 | 90.0° | 65.0° |
| H30 | C15 | C16 | H33 | 90.0° | 175.0° |
| H31 | C15 | C16 | H32 | 90.0° | 55.0° |
| H31 | C15 | C16 | H33 | 90.0° | 65.0° |
| H34 | C17 | C18 | H36 | 90.0° | 65.0° |
| H34 | C17 | C18 | H37 | 90.0° | 175.0° |
| H35 | C17 | C18 | H36 | 90.0° | 55.1° |
| H35 | C17 | C18 | H37 | 90.0° | 65.0° |
| H38 | C19 | C20 | H40 | 90.0° | 65.0° |
| H38 | C19 | C20 | H41 | 90.0° | 175.0° |
| H39 | C19 | C20 | H40 | 90.0° | 55.1° |
| H39 | C19 | C20 | H41 | 90.0° | 65.0° |
| H40 | C20 | N3 | H42 | 90.0° | 120.0° |
| H41 | C20 | N3 | H42 | 90.0° | 120.0° |
| H45 | C24 | C25 | H46 | 90.0° | 0.0° |
| H46 | C25 | C26 | H47 | 90.0° | 0.0° |
| H48 | C31 | C32 | H49 | 90.0° | 55.8° |
| H48 | C31 | C32 | H50 | 90.0° | 64.7° |
| H49 | C32 | C33 | H51 | 90.0° | 55.8° |
| H49 | C32 | C33 | H52 | 90.0° | 176.0° |
| H50 | C32 | C33 | H51 | 90.0° | 64.7° |
| H50 | C32 | C33 | H52 | 90.0° | 55.5° |
