3BV
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C6 | O1 | sing | 1.43Å | 1.42Å | |
| C6 | C5 | sing | 1.53Å | 1.49Å | |
| O1 | C2 | sing | 1.43Å | 1.46Å | |
| C2 | C3 | sing | 1.53Å | 1.45Å | |
| C5 | N4 | sing | 1.47Å | 1.49Å | |
| N4 | C3 | sing | 1.47Å | 1.49Å | |
| N4 | C7 | sing | 1.47Å | 1.48Å | |
| C7 | C8 | sing | 1.51Å | 1.54Å | |
| O9 | C8 | doub | 1.21Å | 1.23Å | |
| C8 | N10 | sing | 1.35Å | 1.33Å | |
| N10 | C11 | sing | 1.47Å | 1.46Å | |
| C11 | C20 | sing | 1.51Å | 1.51Å | |
| C11 | C12 | sing | 1.53Å | 1.50Å | |
| C27 | C25 | sing | 1.53Å | 1.54Å | |
| C19 | C18 | doub | 1.38Å | 1.39Å | Aromatic |
| C19 | C14 | sing | 1.38Å | 1.40Å | Aromatic |
| C13 | C12 | sing | 1.53Å | 1.52Å | |
| C13 | C14 | sing | 1.51Å | 1.42Å | |
| C26 | C25 | sing | 1.53Å | 1.54Å | |
| C20 | O21 | doub | 1.21Å | 1.23Å | |
| C20 | N22 | sing | 1.35Å | 1.33Å | |
| C25 | C24 | sing | 1.53Å | 1.54Å | |
| C18 | C17 | sing | 1.38Å | 1.39Å | Aromatic |
| C14 | C15 | doub | 1.38Å | 1.40Å | Aromatic |
| N22 | C23 | sing | 1.47Å | 1.46Å | |
| C23 | C24 | sing | 1.53Å | 1.50Å | |
| C23 | C28 | sing | 1.51Å | 1.52Å | |
| C17 | C16 | doub | 1.38Å | 1.39Å | Aromatic |
| C15 | C16 | sing | 1.38Å | 1.39Å | Aromatic |
| C35 | C34 | doub | 1.38Å | 1.39Å | Aromatic |
| C35 | C36 | sing | 1.38Å | 1.39Å | Aromatic |
| C28 | O29 | doub | 1.21Å | 1.23Å | |
| C28 | N30 | sing | 1.35Å | 1.34Å | |
| C34 | C33 | sing | 1.38Å | 1.39Å | Aromatic |
| N30 | C31 | sing | 1.46Å | 1.46Å | |
| C36 | C37 | doub | 1.38Å | 1.39Å | Aromatic |
| C33 | C32 | sing | 1.51Å | 1.39Å | |
| C33 | C38 | doub | 1.38Å | 1.39Å | Aromatic |
| C37 | C38 | sing | 1.38Å | 1.39Å | Aromatic |
| C31 | C32 | sing | 1.53Å | 1.50Å | |
| C31 | C39 | sing | 1.51Å | 1.52Å | |
| O40 | C39 | doub | 1.21Å | 1.23Å | |
| C39 | N41 | sing | 1.35Å | 1.34Å | |
| C46 | C44 | sing | 1.53Å | 1.54Å | |
| N41 | C42 | sing | 1.47Å | 1.46Å | |
| O60 | C59 | sing | 1.43Å | 1.41Å | |
| C42 | C43 | sing | 1.53Å | 1.52Å | |
| C42 | C47 | sing | 1.53Å | 1.54Å | |
| C58 | C51 | sing | 1.53Å | 1.55Å | |
| C44 | C43 | sing | 1.53Å | 1.54Å | |
| C44 | C45 | sing | 1.53Å | 1.54Å | |
| C59 | C51 | sing | 1.53Å | 1.54Å | |
| C51 | C47 | sing | 1.53Å | 1.59Å | |
| C47 | O48 | sing | 1.43Å | 1.43Å | |
| C5 | H1 | sing | 1.09Å | 1.10Å | |
| C5 | H2 | sing | 1.09Å | 1.10Å | |
| C6 | H3 | sing | 1.09Å | 1.10Å | |
| C6 | H4 | sing | 1.09Å | 1.10Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C7 | H6 | sing | 1.09Å | 1.10Å | |
| C13 | H7 | sing | 1.09Å | 1.10Å | |
| C13 | H8 | sing | 1.09Å | 1.10Å | |
| C15 | H9 | sing | 1.08Å | 1.08Å | |
| C17 | H10 | sing | 1.08Å | 1.08Å | |
| C24 | H11 | sing | 1.09Å | 1.10Å | |
| C24 | H12 | sing | 1.09Å | 1.10Å | |
| C26 | H13 | sing | 1.09Å | 1.10Å | |
| C26 | H14 | sing | 1.09Å | 1.10Å | |
| C26 | H15 | sing | 1.09Å | 1.10Å | |
| C3 | H16 | sing | 1.09Å | 1.10Å | |
| C3 | H17 | sing | 1.09Å | 1.10Å | |
| C2 | H18 | sing | 1.09Å | 1.10Å | |
| C2 | H19 | sing | 1.09Å | 1.10Å | |
| N10 | H21 | sing | 0.97Å | 1.00Å | |
| C11 | H22 | sing | 1.09Å | 1.10Å | |
| C12 | H23 | sing | 1.09Å | 1.10Å | |
| C12 | H24 | sing | 1.09Å | 1.10Å | |
| C19 | H25 | sing | 1.08Å | 1.08Å | |
| C18 | H26 | sing | 1.08Å | 1.08Å | |
| C16 | H27 | sing | 1.08Å | 1.08Å | |
| N22 | H28 | sing | 0.97Å | 1.00Å | |
| C23 | H29 | sing | 1.09Å | 1.10Å | |
| C25 | H30 | sing | 1.09Å | 1.10Å | |
| C27 | H31 | sing | 1.09Å | 1.10Å | |
| C27 | H32 | sing | 1.09Å | 1.10Å | |
| C27 | H33 | sing | 1.09Å | 1.10Å | |
| N30 | H34 | sing | 0.97Å | 1.00Å | |
| C31 | H35 | sing | 1.09Å | 1.10Å | |
| C32 | H36 | sing | 1.09Å | 1.10Å | |
| C32 | H37 | sing | 1.09Å | 1.10Å | |
| C38 | H38 | sing | 1.08Å | 1.08Å | |
| C37 | H39 | sing | 1.08Å | 1.08Å | |
| C36 | H40 | sing | 1.08Å | 1.08Å | |
| C35 | H41 | sing | 1.08Å | 1.08Å | |
| C34 | H42 | sing | 1.08Å | 1.08Å | |
| N41 | H43 | sing | 0.97Å | 1.00Å | |
| C42 | H44 | sing | 1.09Å | 1.10Å | |
| C43 | H45 | sing | 1.09Å | 1.10Å | |
| C43 | H46 | sing | 1.09Å | 1.10Å | |
| C44 | H47 | sing | 1.09Å | 1.10Å | |
| C45 | H48 | sing | 1.09Å | 1.10Å | |
| C45 | H49 | sing | 1.09Å | 1.10Å | |
| C45 | H50 | sing | 1.09Å | 1.10Å | |
| C46 | H51 | sing | 1.09Å | 1.10Å | |
| C46 | H52 | sing | 1.09Å | 1.10Å | |
| C46 | H53 | sing | 1.09Å | 1.10Å | |
| C47 | H54 | sing | 1.09Å | 1.10Å | |
| O48 | H55 | sing | 0.97Å | 0.95Å | |
| C51 | H56 | sing | 1.09Å | 1.10Å | |
| C58 | H57 | sing | 1.09Å | 1.10Å | |
| C58 | H58 | sing | 1.09Å | 1.10Å | |
| C58 | H59 | sing | 1.09Å | 1.10Å | |
| C59 | H60 | sing | 1.09Å | 1.10Å | |
| C59 | H61 | sing | 1.09Å | 1.10Å | |
| O60 | H62 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C6 | C5 | 103.5° | 109.2° |
| C6 | O1 | C2 | 111.1° | 113.8° |
| O1 | C6 | H3 | 110.9° | 109.5° |
| O1 | C6 | H4 | 110.9° | 109.5° |
| C6 | C5 | N4 | 107.6° | 109.3° |
| C6 | C5 | H1 | 109.9° | 109.5° |
| C6 | C5 | H2 | 110.0° | 109.5° |
| C5 | C6 | H3 | 111.0° | 109.5° |
| C5 | C6 | H4 | 110.9° | 109.6° |
| O1 | C2 | C3 | 107.1° | 109.3° |
| O1 | C2 | H18 | 110.1° | 109.5° |
| O1 | C2 | H19 | 110.1° | 109.6° |
| C2 | C3 | N4 | 108.0° | 109.2° |
| C2 | C3 | H16 | 109.8° | 109.5° |
| C2 | C3 | H17 | 109.8° | 109.6° |
| C3 | C2 | H18 | 110.0° | 109.5° |
| C3 | C2 | H19 | 110.1° | 109.5° |
| C5 | N4 | C3 | 112.5° | 110.8° |
| C5 | N4 | C7 | 112.2° | 111.0° |
| N4 | C5 | H1 | 109.9° | 109.6° |
| N4 | C5 | H2 | 109.9° | 109.5° |
| C3 | N4 | C7 | 112.5° | 111.0° |
| N4 | C3 | H16 | 109.9° | 109.5° |
| N4 | C3 | H17 | 109.8° | 109.4° |
| N4 | C7 | C8 | 113.9° | 109.5° |
| N4 | C7 | H5 | 108.3° | 109.5° |
| N4 | C7 | H6 | 108.3° | 109.5° |
| C7 | C8 | O9 | 122.7° | 120.0° |
| C7 | C8 | N10 | 113.3° | 120.0° |
| C8 | C7 | H5 | 108.4° | 109.4° |
| C8 | C7 | H6 | 108.4° | 109.5° |
| O9 | C8 | N10 | 124.1° | 120.0° |
| C8 | N10 | C11 | 122.2° | 120.0° |
| C8 | N10 | H21 | 118.9° | 120.0° |
| N10 | C11 | C20 | 105.7° | 109.4° |
| N10 | C11 | C12 | 108.8° | 109.5° |
| C11 | N10 | H21 | 118.9° | 120.0° |
| N10 | C11 | H22 | 112.2° | 109.5° |
| C20 | C11 | C12 | 107.2° | 109.5° |
| C11 | C20 | O21 | 120.1° | 120.0° |
| C11 | C20 | N22 | 115.9° | 120.0° |
| C20 | C11 | H22 | 111.3° | 109.4° |
| C11 | C12 | C13 | 106.4° | 109.4° |
| C12 | C11 | H22 | 111.4° | 109.5° |
| C11 | C12 | H23 | 110.3° | 109.4° |
| C11 | C12 | H24 | 110.2° | 109.5° |
| C27 | C25 | C26 | 109.5° | 109.5° |
| C27 | C25 | C24 | 111.4° | 109.5° |
| C27 | C25 | H30 | 108.9° | 109.5° |
| C25 | C27 | H31 | 109.5° | 109.5° |
| C25 | C27 | H32 | 109.5° | 109.5° |
| C25 | C27 | H33 | 109.4° | 109.5° |
| C18 | C19 | C14 | 120.8° | 120.0° |
| C19 | C18 | C17 | 120.3° | 120.0° |
| C18 | C19 | H25 | 119.6° | 120.0° |
| C19 | C18 | H26 | 119.8° | 120.0° |
| C19 | C14 | C13 | 119.5° | 120.0° |
| C19 | C14 | C15 | 118.2° | 120.0° |
| C14 | C19 | H25 | 119.6° | 120.0° |
| C12 | C13 | C14 | 109.1° | 109.4° |
| C12 | C13 | H7 | 109.6° | 109.5° |
| C12 | C13 | H8 | 109.6° | 109.5° |
| C13 | C12 | H23 | 110.2° | 109.5° |
| C13 | C12 | H24 | 110.3° | 109.5° |
| C13 | C14 | C15 | 122.3° | 120.0° |
| C14 | C13 | H7 | 109.6° | 109.5° |
| C14 | C13 | H8 | 109.5° | 109.4° |
| C26 | C25 | C24 | 108.9° | 109.5° |
| C25 | C26 | H13 | 109.5° | 109.5° |
| C25 | C26 | H14 | 109.5° | 109.5° |
| C25 | C26 | H15 | 109.5° | 109.5° |
| C26 | C25 | H30 | 109.0° | 109.5° |
| O21 | C20 | N22 | 123.9° | 120.0° |
| C20 | N22 | C23 | 119.1° | 120.0° |
| C20 | N22 | H28 | 120.5° | 120.1° |
| C25 | C24 | C23 | 107.2° | 109.4° |
| C25 | C24 | H11 | 110.0° | 109.5° |
| C25 | C24 | H12 | 110.0° | 109.5° |
| C24 | C25 | H30 | 109.0° | 109.5° |
| C18 | C17 | C16 | 119.7° | 120.0° |
| C18 | C17 | H10 | 120.2° | 120.0° |
| C17 | C18 | H26 | 119.8° | 120.0° |
| C14 | C15 | C16 | 121.1° | 120.0° |
| C14 | C15 | H9 | 119.4° | 120.0° |
| N22 | C23 | C24 | 111.8° | 109.5° |
| N22 | C23 | C28 | 106.7° | 109.5° |
| C23 | N22 | H28 | 120.4° | 119.9° |
| N22 | C23 | H29 | 110.6° | 109.5° |
| C24 | C23 | C28 | 107.9° | 109.5° |
| C23 | C24 | H11 | 110.0° | 109.5° |
| C23 | C24 | H12 | 110.0° | 109.4° |
| C24 | C23 | H29 | 110.0° | 109.4° |
| C23 | C28 | O29 | 120.3° | 120.0° |
| C23 | C28 | N30 | 114.6° | 120.0° |
| C28 | C23 | H29 | 109.8° | 109.5° |
| C17 | C16 | C15 | 120.0° | 120.0° |
| C16 | C17 | H10 | 120.2° | 120.0° |
| C17 | C16 | H27 | 120.0° | 120.0° |
| C16 | C15 | H9 | 119.5° | 120.0° |
| C15 | C16 | H27 | 120.0° | 120.0° |
| C34 | C35 | C36 | 120.0° | 120.0° |
| C35 | C34 | C33 | 120.1° | 120.0° |
| C34 | C35 | H41 | 120.0° | 120.0° |
| C35 | C34 | H42 | 119.9° | 119.9° |
| C35 | C36 | C37 | 120.0° | 120.0° |
| C35 | C36 | H40 | 120.0° | 120.0° |
| C36 | C35 | H41 | 120.0° | 120.0° |
| O29 | C28 | N30 | 125.1° | 120.0° |
| C28 | N30 | C31 | 121.5° | 120.0° |
| C28 | N30 | H34 | 119.2° | 120.0° |
| C34 | C33 | C32 | 120.0° | 120.0° |
| C34 | C33 | C38 | 119.9° | 120.0° |
| C33 | C34 | H42 | 119.9° | 120.0° |
| N30 | C31 | C32 | 112.0° | 109.5° |
| N30 | C31 | C39 | 106.1° | 109.5° |
| C31 | N30 | H34 | 119.2° | 120.0° |
| N30 | C31 | H35 | 109.7° | 109.5° |
| C36 | C37 | C38 | 120.1° | 120.0° |
| C36 | C37 | H39 | 120.0° | 120.0° |
| C37 | C36 | H40 | 120.0° | 120.0° |
| C32 | C33 | C38 | 120.1° | 120.0° |
| C33 | C32 | C31 | 104.1° | 109.5° |
| C33 | C32 | H36 | 110.8° | 109.5° |
| C33 | C32 | H37 | 110.8° | 109.5° |
| C33 | C38 | C37 | 120.0° | 120.0° |
| C33 | C38 | H38 | 120.0° | 120.0° |
| C37 | C38 | H38 | 120.0° | 120.0° |
| C38 | C37 | H39 | 119.9° | 120.0° |
| C32 | C31 | C39 | 110.6° | 109.5° |
| C32 | C31 | H35 | 109.3° | 109.4° |
| C31 | C32 | H36 | 110.8° | 109.4° |
| C31 | C32 | H37 | 110.8° | 109.5° |
| C31 | C39 | O40 | 120.6° | 120.0° |
| C31 | C39 | N41 | 114.5° | 120.0° |
| C39 | C31 | H35 | 109.0° | 109.5° |
| O40 | C39 | N41 | 124.8° | 120.0° |
| C39 | N41 | C42 | 121.4° | 120.0° |
| C39 | N41 | H43 | 119.3° | 120.0° |
| C46 | C44 | C43 | 113.0° | 109.5° |
| C46 | C44 | C45 | 108.7° | 109.5° |
| C46 | C44 | H47 | 109.2° | 109.5° |
| C44 | C46 | H51 | 109.5° | 109.5° |
| C44 | C46 | H52 | 109.5° | 109.5° |
| C44 | C46 | H53 | 109.5° | 109.5° |
| N41 | C42 | C43 | 100.7° | 109.5° |
| N41 | C42 | C47 | 114.0° | 109.5° |
| C42 | N41 | H43 | 119.3° | 120.0° |
| N41 | C42 | H44 | 111.9° | 109.4° |
| O60 | C59 | C51 | 113.5° | 109.5° |
| O60 | C59 | H60 | 108.4° | 109.5° |
| O60 | C59 | H61 | 108.5° | 109.4° |
| C59 | O60 | H62 | 109.5° | 114.0° |
| C43 | C42 | C47 | 108.3° | 109.5° |
| C42 | C43 | C44 | 112.2° | 109.5° |
| C43 | C42 | H44 | 111.0° | 109.5° |
| C42 | C43 | H45 | 108.8° | 109.5° |
| C42 | C43 | H46 | 108.8° | 109.5° |
| C42 | C47 | C51 | 117.2° | 109.5° |
| C42 | C47 | O48 | 108.4° | 109.4° |
| C47 | C42 | H44 | 110.5° | 109.5° |
| C42 | C47 | H54 | 106.8° | 109.5° |
| C58 | C51 | C59 | 109.4° | 109.5° |
| C58 | C51 | C47 | 110.0° | 109.5° |
| C58 | C51 | H56 | 108.8° | 109.4° |
| C51 | C58 | H57 | 109.5° | 109.5° |
| C51 | C58 | H58 | 109.4° | 109.5° |
| C51 | C58 | H59 | 109.5° | 109.5° |
| C43 | C44 | C45 | 107.6° | 109.5° |
| C44 | C43 | H45 | 108.8° | 109.4° |
| C44 | C43 | H46 | 108.8° | 109.5° |
| C43 | C44 | H47 | 109.1° | 109.5° |
| C45 | C44 | H47 | 109.2° | 109.4° |
| C44 | C45 | H48 | 109.5° | 109.4° |
| C44 | C45 | H49 | 109.5° | 109.4° |
| C44 | C45 | H50 | 109.5° | 109.5° |
| C59 | C51 | C47 | 111.2° | 109.5° |
| C59 | C51 | H56 | 108.9° | 109.5° |
| C51 | C59 | H60 | 108.5° | 109.5° |
| C51 | C59 | H61 | 108.5° | 109.5° |
| C51 | C47 | O48 | 109.5° | 109.5° |
| C51 | C47 | H54 | 106.3° | 109.4° |
| C47 | C51 | H56 | 108.4° | 109.5° |
| O48 | C47 | H54 | 108.3° | 109.5° |
| C47 | O48 | H55 | 109.5° | 114.0° |
| H1 | C5 | H2 | 109.5° | 109.5° |
| H3 | C6 | H4 | 109.5° | 109.5° |
| H5 | C7 | H6 | 109.5° | 109.5° |
| H7 | C13 | H8 | 109.5° | 109.5° |
| H11 | C24 | H12 | 109.5° | 109.5° |
| H13 | C26 | H14 | 109.4° | 109.4° |
| H13 | C26 | H15 | 109.5° | 109.5° |
| H14 | C26 | H15 | 109.5° | 109.5° |
| H16 | C3 | H17 | 109.5° | 109.5° |
| H18 | C2 | H19 | 109.5° | 109.5° |
| H23 | C12 | H24 | 109.4° | 109.5° |
| H31 | C27 | H32 | 109.4° | 109.4° |
| H31 | C27 | H33 | 109.5° | 109.5° |
| H32 | C27 | H33 | 109.5° | 109.5° |
| H36 | C32 | H37 | 109.5° | 109.5° |
| H45 | C43 | H46 | 109.5° | 109.4° |
| H48 | C45 | H49 | 109.5° | 109.5° |
| H48 | C45 | H50 | 109.5° | 109.5° |
| H49 | C45 | H50 | 109.4° | 109.5° |
| H51 | C46 | H52 | 109.5° | 109.4° |
| H51 | C46 | H53 | 109.5° | 109.5° |
| H52 | C46 | H53 | 109.5° | 109.5° |
| H57 | C58 | H58 | 109.5° | 109.5° |
| H57 | C58 | H59 | 109.5° | 109.5° |
| H58 | C58 | H59 | 109.5° | 109.5° |
| H60 | C59 | H61 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C6 | C5 | H3 | 119.0° | 119.9° |
| O1 | C6 | C5 | H4 | 119.0° | 120.0° |
| C6 | O1 | C2 | C3 | 69.6° | 58.7° |
| O1 | C6 | C5 | N4 | 62.7° | 56.8° |
| O1 | C6 | C5 | H1 | 177.6° | 63.2° |
| O1 | C6 | C5 | H2 | 57.0° | 176.8° |
| O1 | C6 | H3 | H4 | 122.7° | 120.1° |
| C6 | O1 | C2 | H18 | 170.8° | 178.6° |
| C6 | O1 | C2 | H19 | 50.0° | 61.3° |
| C5 | C6 | O1 | C2 | 70.8° | 58.7° |
| C6 | C5 | N4 | H1 | 119.7° | 119.9° |
| C6 | C5 | N4 | H2 | 119.7° | 120.0° |
| C6 | C5 | N4 | C3 | 58.6° | 58.6° |
| C6 | C5 | N4 | C7 | 173.4° | 177.6° |
| C6 | C5 | H1 | H2 | 120.9° | 120.0° |
| C5 | C6 | H3 | H4 | 122.8° | 120.2° |
| O1 | C2 | C3 | H18 | 119.6° | 119.9° |
| O1 | C2 | C3 | H19 | 119.6° | 120.0° |
| O1 | C2 | C3 | N4 | 57.3° | 56.8° |
| C2 | O1 | C6 | H3 | 48.2° | 61.3° |
| C2 | O1 | C6 | H4 | 170.1° | 178.7° |
| O1 | C2 | C3 | H16 | 62.5° | 176.8° |
| O1 | C2 | C3 | H17 | 177.0° | 63.0° |
| O1 | C2 | H18 | H19 | 121.1° | 120.1° |
| C2 | C3 | N4 | C5 | 55.5° | 58.6° |
| C2 | C3 | N4 | H16 | 119.8° | 120.0° |
| C2 | C3 | N4 | H17 | 119.7° | 119.9° |
| C2 | C3 | N4 | C7 | 176.7° | 177.6° |
| C2 | C3 | H16 | H17 | 120.7° | 120.2° |
| C3 | C2 | H18 | H19 | 121.1° | 120.1° |
| C5 | N4 | C3 | C7 | 127.9° | 123.8° |
| C5 | N4 | C7 | C8 | 74.3° | 66.4° |
| N4 | C5 | H1 | H2 | 120.9° | 120.1° |
| N4 | C5 | C6 | H3 | 56.4° | 63.1° |
| N4 | C5 | C6 | H4 | 178.3° | 176.8° |
| C5 | N4 | C7 | H5 | 165.0° | 173.7° |
| C5 | N4 | C7 | H6 | 46.3° | 53.6° |
| C5 | N4 | C3 | H16 | 64.3° | 178.6° |
| C5 | N4 | C3 | H17 | 175.2° | 61.3° |
| C3 | N4 | C7 | C8 | 53.7° | 169.9° |
| C3 | N4 | C5 | H1 | 178.2° | 61.3° |
| C3 | N4 | C5 | H2 | 61.2° | 178.6° |
| C3 | N4 | C7 | H5 | 67.0° | 50.0° |
| C3 | N4 | C7 | H6 | 174.3° | 70.0° |
| N4 | C3 | H16 | H17 | 120.7° | 120.0° |
| N4 | C3 | C2 | H18 | 176.9° | 176.8° |
| N4 | C3 | C2 | H19 | 62.4° | 63.2° |
| N4 | C7 | C8 | H5 | 120.7° | 119.9° |
| N4 | C7 | C8 | H6 | 120.6° | 120.1° |
| N4 | C7 | C8 | O9 | 44.3° | 0.2° |
| N4 | C7 | C8 | N10 | 135.9° | 180.0° |
| C7 | N4 | C5 | H1 | 53.7° | 62.4° |
| C7 | N4 | C5 | H2 | 66.9° | 57.7° |
| N4 | C7 | H5 | H6 | 117.9° | 120.1° |
| C7 | N4 | C3 | H16 | 63.6° | 57.7° |
| C7 | N4 | C3 | H17 | 56.9° | 62.4° |
| C7 | C8 | O9 | N10 | 179.7° | 179.8° |
| C7 | C8 | N10 | C11 | 177.6° | 179.8° |
| C8 | C7 | H5 | H6 | 118.0° | 120.0° |
| C7 | C8 | N10 | H21 | 2.4° | 0.2° |
| O9 | C8 | N10 | C11 | 2.2° | 0.0° |
| O9 | C8 | C7 | H5 | 165.0° | 119.7° |
| O9 | C8 | C7 | H6 | 76.3° | 120.3° |
| O9 | C8 | N10 | H21 | 177.9° | 180.0° |
| C8 | N10 | C11 | H21 | 180.0° | 180.0° |
| C8 | N10 | C11 | C20 | 97.3° | 155.0° |
| C8 | N10 | C11 | C12 | 147.9° | 85.0° |
| N10 | C8 | C7 | H5 | 15.3° | 60.1° |
| N10 | C8 | C7 | H6 | 103.4° | 59.9° |
| C8 | N10 | C11 | H22 | 24.2° | 35.1° |
| N10 | C11 | C20 | C12 | 115.9° | 120.1° |
| N10 | C11 | C20 | H22 | 122.0° | 119.9° |
| N10 | C11 | C12 | H22 | 124.2° | 120.1° |
| N10 | C11 | C12 | C13 | 105.7° | 65.0° |
| N10 | C11 | C20 | O21 | 28.7° | 0.0° |
| N10 | C11 | C20 | N22 | 153.3° | 180.0° |
| N10 | C11 | C12 | H23 | 13.8° | 55.0° |
| N10 | C11 | C12 | H24 | 134.8° | 175.0° |
| C20 | C11 | C12 | H22 | 122.0° | 119.9° |
| C20 | C11 | C12 | C13 | 140.5° | 175.0° |
| C11 | C20 | O21 | N22 | 177.8° | 180.0° |
| C11 | C20 | N22 | C23 | 177.0° | 175.0° |
| C20 | C11 | N10 | H21 | 82.7° | 25.1° |
| C20 | C11 | C12 | H23 | 100.0° | 65.0° |
| C20 | C11 | C12 | H24 | 21.0° | 55.0° |
| C11 | C20 | N22 | H28 | 3.0° | 5.0° |
| C11 | C12 | C13 | H23 | 119.5° | 119.9° |
| C11 | C12 | C13 | H24 | 119.5° | 120.0° |
| C11 | C12 | C13 | C14 | 168.1° | 180.0° |
| C12 | C11 | C20 | O21 | 87.3° | 120.0° |
| C12 | C11 | C20 | N22 | 90.7° | 60.0° |
| C11 | C12 | C13 | H7 | 71.9° | 60.1° |
| C11 | C12 | C13 | H8 | 48.2° | 60.0° |
| C12 | C11 | N10 | H21 | 32.1° | 95.0° |
| C11 | C12 | H23 | H24 | 121.4° | 120.0° |
| C27 | C25 | C26 | C24 | 122.1° | 120.0° |
| C27 | C25 | C26 | H30 | 119.1° | 120.0° |
| C27 | C25 | C24 | H30 | 120.2° | 120.0° |
| C27 | C25 | C24 | C23 | 64.4° | 173.4° |
| C27 | C25 | C24 | H11 | 55.3° | 66.6° |
| C27 | C25 | C24 | H12 | 176.0° | 53.4° |
| C27 | C25 | C26 | H13 | 180.0° | 64.1° |
| C27 | C25 | C26 | H14 | 60.0° | 176.0° |
| C27 | C25 | C26 | H15 | 60.0° | 55.9° |
| C25 | C27 | H31 | H32 | 120.0° | 119.9° |
| C25 | C27 | H31 | H33 | 120.0° | 120.0° |
| C25 | C27 | H32 | H33 | 120.0° | 120.0° |
| C18 | C19 | C14 | H25 | 180.0° | 180.0° |
| C18 | C19 | C14 | C13 | 179.5° | 180.0° |
| C19 | C18 | C17 | H26 | 180.0° | 180.0° |
| C18 | C19 | C14 | C15 | 0.7° | 0.2° |
| C19 | C18 | C17 | C16 | 0.1° | 0.2° |
| C19 | C18 | C17 | H10 | 179.9° | 180.0° |
| C19 | C14 | C13 | C12 | 140.2° | 89.7° |
| C19 | C14 | C13 | C15 | 178.7° | 179.8° |
| C14 | C19 | C18 | C17 | 0.3° | 0.0° |
| C19 | C14 | C15 | C16 | 0.9° | 0.2° |
| C19 | C14 | C13 | H7 | 99.9° | 150.3° |
| C19 | C14 | C13 | H8 | 20.2° | 30.2° |
| C19 | C14 | C15 | H9 | 179.1° | 179.7° |
| C14 | C19 | C18 | H26 | 179.8° | 180.0° |
| C12 | C13 | C14 | H7 | 120.0° | 120.0° |
| C12 | C13 | C14 | H8 | 119.9° | 120.0° |
| C12 | C13 | C14 | C15 | 41.1° | 90.0° |
| C12 | C13 | H7 | H8 | 120.2° | 120.0° |
| C13 | C12 | C11 | H22 | 18.5° | 55.1° |
| C13 | C12 | H23 | H24 | 121.5° | 120.1° |
| C13 | C14 | C15 | C16 | 179.6° | 180.0° |
| C14 | C13 | H7 | H8 | 120.1° | 120.0° |
| C13 | C14 | C15 | H9 | 0.4° | 0.1° |
| C14 | C13 | C12 | H23 | 48.6° | 60.1° |
| C14 | C13 | C12 | H24 | 72.3° | 60.0° |
| C13 | C14 | C19 | H25 | 0.5° | 0.0° |
| C26 | C25 | C24 | H30 | 118.8° | 120.0° |
| C26 | C25 | C24 | C23 | 174.7° | 66.6° |
| C26 | C25 | C24 | H11 | 65.7° | 53.4° |
| C26 | C25 | C24 | H12 | 55.0° | 173.4° |
| C25 | C26 | H13 | H14 | 120.0° | 120.0° |
| C25 | C26 | H13 | H15 | 120.0° | 120.1° |
| C25 | C26 | H14 | H15 | 120.0° | 120.0° |
| C26 | C25 | C27 | H31 | 180.0° | 179.9° |
| C26 | C25 | C27 | H32 | 60.0° | 60.0° |
| C26 | C25 | C27 | H33 | 60.0° | 60.0° |
| O21 | C20 | N22 | C23 | 0.9° | 5.0° |
| O21 | C20 | C11 | H22 | 150.7° | 120.0° |
| O21 | C20 | N22 | H28 | 179.1° | 175.0° |
| C20 | N22 | C23 | H28 | 180.0° | 180.0° |
| C20 | N22 | C23 | C24 | 152.4° | 88.2° |
| C20 | N22 | C23 | C28 | 89.9° | 151.8° |
| N22 | C20 | C11 | H22 | 31.3° | 60.0° |
| C20 | N22 | C23 | H29 | 29.4° | 31.7° |
| C25 | C24 | C23 | N22 | 66.0° | 174.4° |
| C25 | C24 | C23 | H11 | 119.7° | 120.0° |
| C25 | C24 | C23 | H12 | 119.6° | 120.0° |
| C25 | C24 | C23 | C28 | 176.9° | 65.6° |
| C25 | C24 | H11 | H12 | 121.0° | 120.1° |
| C24 | C25 | C26 | H13 | 57.9° | 175.9° |
| C24 | C25 | C26 | H14 | 62.1° | 56.0° |
| C24 | C25 | C26 | H15 | 177.9° | 64.1° |
| C25 | C24 | C23 | H29 | 57.2° | 54.4° |
| C24 | C25 | C27 | H31 | 59.4° | 60.0° |
| C24 | C25 | C27 | H32 | 179.4° | 179.9° |
| C24 | C25 | C27 | H33 | 60.6° | 60.0° |
| C18 | C17 | C16 | H10 | 180.0° | 179.9° |
| C18 | C17 | C16 | C15 | 0.0° | 0.2° |
| C17 | C18 | C19 | H25 | 179.7° | 180.0° |
| C18 | C17 | C16 | H27 | 180.0° | 179.7° |
| C14 | C15 | C16 | C17 | 0.5° | 0.0° |
| C14 | C15 | C16 | H9 | 180.0° | 179.9° |
| C15 | C14 | C13 | H7 | 78.9° | 30.0° |
| C15 | C14 | C13 | H8 | 161.0° | 150.0° |
| C15 | C14 | C19 | H25 | 179.3° | 179.8° |
| C14 | C15 | C16 | H27 | 179.5° | 179.9° |
| N22 | C23 | C24 | C28 | 117.0° | 120.0° |
| N22 | C23 | C24 | H29 | 123.3° | 119.9° |
| N22 | C23 | C28 | H29 | 119.9° | 120.0° |
| N22 | C23 | C28 | O29 | 49.2° | 20.2° |
| N22 | C23 | C28 | N30 | 129.4° | 159.7° |
| N22 | C23 | C24 | H11 | 174.3° | 54.4° |
| N22 | C23 | C24 | H12 | 53.6° | 65.6° |
| C24 | C23 | C28 | H29 | 119.8° | 120.0° |
| C24 | C23 | C28 | O29 | 71.1° | 99.8° |
| C24 | C23 | C28 | N30 | 110.4° | 80.3° |
| C23 | C24 | H11 | H12 | 121.0° | 120.0° |
| C24 | C23 | N22 | H28 | 27.6° | 91.8° |
| C23 | C24 | C25 | H30 | 55.9° | 53.4° |
| C23 | C28 | O29 | N30 | 178.4° | 179.9° |
| C23 | C28 | N30 | C31 | 177.5° | 175.3° |
| C28 | C23 | C24 | H11 | 57.2° | 174.5° |
| C28 | C23 | C24 | H12 | 63.5° | 54.5° |
| C28 | C23 | N22 | H28 | 90.1° | 28.2° |
| C23 | C28 | N30 | H34 | 2.5° | 4.7° |
| C17 | C16 | C15 | H27 | 180.0° | 179.9° |
| C17 | C16 | C15 | H9 | 179.5° | 179.9° |
| C16 | C17 | C18 | H26 | 179.9° | 179.8° |
| C15 | C16 | C17 | H10 | 180.0° | 180.0° |
| C34 | C35 | C36 | H41 | 180.0° | 180.0° |
| C35 | C34 | C33 | H42 | 180.0° | 180.0° |
| C34 | C35 | C36 | C37 | 0.0° | 0.3° |
| C35 | C34 | C33 | C32 | 179.9° | 180.0° |
| C35 | C34 | C33 | C38 | 0.4° | 0.3° |
| C34 | C35 | C36 | H40 | 180.0° | 180.0° |
| C36 | C35 | C34 | C33 | 0.3° | 0.0° |
| C35 | C36 | C37 | H40 | 180.0° | 179.7° |
| C35 | C36 | C37 | C38 | 0.1° | 0.3° |
| C35 | C36 | C37 | H39 | 179.9° | 179.7° |
| C36 | C35 | C34 | H42 | 179.7° | 179.9° |
| O29 | C28 | N30 | C31 | 4.0° | 4.6° |
| O29 | C28 | C23 | H29 | 169.1° | 140.2° |
| O29 | C28 | N30 | H34 | 176.1° | 175.4° |
| C28 | N30 | C31 | H34 | 180.0° | 179.9° |
| C28 | N30 | C31 | C32 | 129.1° | 85.0° |
| C28 | N30 | C31 | C39 | 110.1° | 155.0° |
| N30 | C28 | C23 | H29 | 9.5° | 39.7° |
| C28 | N30 | C31 | H35 | 7.5° | 34.9° |
| C34 | C33 | C32 | C38 | 179.5° | 179.7° |
| C34 | C33 | C38 | C37 | 0.2° | 0.3° |
| C34 | C33 | C32 | C31 | 96.4° | 89.7° |
| C34 | C33 | C32 | H36 | 144.4° | 150.3° |
| C34 | C33 | C32 | H37 | 22.7° | 30.3° |
| C34 | C33 | C38 | H38 | 179.8° | 179.7° |
| C33 | C34 | C35 | H41 | 179.7° | 180.0° |
| N30 | C31 | C32 | C33 | 76.8° | 65.0° |
| N30 | C31 | C32 | C39 | 118.2° | 120.0° |
| N30 | C31 | C32 | H35 | 121.8° | 120.0° |
| N30 | C31 | C39 | H35 | 118.1° | 120.0° |
| N30 | C31 | C39 | O40 | 8.8° | 0.0° |
| N30 | C31 | C39 | N41 | 170.8° | 180.0° |
| N30 | C31 | C32 | H36 | 164.0° | 55.0° |
| N30 | C31 | C32 | H37 | 42.3° | 175.0° |
| C36 | C37 | C38 | C33 | 0.0° | 0.0° |
| C36 | C37 | C38 | H39 | 180.0° | 180.0° |
| C36 | C37 | C38 | H38 | 179.9° | 180.0° |
| C37 | C36 | C35 | H41 | 180.0° | 179.7° |
| C32 | C33 | C38 | C37 | 179.7° | 180.0° |
| C33 | C32 | C31 | H36 | 119.1° | 120.0° |
| C33 | C32 | C31 | H37 | 119.1° | 120.0° |
| C33 | C32 | C31 | C39 | 165.0° | 175.0° |
| C33 | C32 | C31 | H35 | 45.0° | 55.0° |
| C33 | C32 | H36 | H37 | 122.5° | 120.0° |
| C32 | C33 | C38 | H38 | 0.3° | 0.0° |
| C32 | C33 | C34 | H42 | 0.1° | 0.0° |
| C33 | C38 | C37 | H38 | 180.0° | 180.0° |
| C38 | C33 | C32 | C31 | 83.1° | 90.0° |
| C38 | C33 | C32 | H36 | 36.1° | 30.0° |
| C38 | C33 | C32 | H37 | 157.8° | 150.0° |
| C33 | C38 | C37 | H39 | 180.0° | 180.0° |
| C38 | C33 | C34 | H42 | 179.6° | 179.7° |
| C38 | C37 | C36 | H40 | 179.9° | 179.9° |
| C32 | C31 | C39 | H35 | 120.2° | 120.0° |
| C32 | C31 | C39 | O40 | 113.0° | 120.0° |
| C32 | C31 | C39 | N41 | 67.5° | 60.0° |
| C32 | C31 | N30 | H34 | 51.0° | 95.0° |
| C31 | C32 | H36 | H37 | 122.5° | 120.0° |
| C31 | C39 | O40 | N41 | 179.5° | 179.9° |
| C31 | C39 | N41 | C42 | 172.6° | 175.0° |
| C39 | C31 | N30 | H34 | 69.9° | 25.0° |
| C39 | C31 | C32 | H36 | 45.8° | 65.0° |
| C39 | C31 | C32 | H37 | 75.9° | 55.0° |
| C31 | C39 | N41 | H43 | 7.4° | 5.0° |
| O40 | C39 | N41 | C42 | 7.0° | 5.1° |
| O40 | C39 | C31 | H35 | 126.9° | 120.1° |
| O40 | C39 | N41 | H43 | 173.0° | 175.0° |
| C39 | N41 | C42 | H43 | 180.0° | 180.0° |
| C39 | N41 | C42 | C43 | 105.1° | 88.3° |
| C39 | N41 | C42 | C47 | 139.2° | 151.7° |
| N41 | C39 | C31 | H35 | 52.7° | 60.0° |
| C39 | N41 | C42 | H44 | 12.8° | 31.7° |
| C46 | C44 | C43 | C42 | 52.9° | 174.0° |
| C46 | C44 | C43 | C45 | 120.0° | 120.0° |
| C46 | C44 | C43 | H47 | 121.6° | 120.0° |
| C46 | C44 | C45 | H47 | 119.0° | 120.0° |
| C46 | C44 | C43 | H45 | 67.5° | 66.0° |
| C46 | C44 | C43 | H46 | 173.4° | 53.9° |
| C46 | C44 | C45 | H48 | 180.0° | 176.1° |
| C46 | C44 | C45 | H49 | 60.0° | 56.1° |
| C46 | C44 | C45 | H50 | 60.0° | 63.9° |
| C44 | C46 | H51 | H52 | 120.0° | 120.0° |
| C44 | C46 | H51 | H53 | 120.0° | 120.0° |
| C44 | C46 | H52 | H53 | 120.0° | 120.0° |
| N41 | C42 | C43 | C47 | 119.9° | 120.1° |
| N41 | C42 | C43 | H44 | 118.6° | 119.9° |
| N41 | C42 | C47 | H44 | 127.1° | 119.9° |
| N41 | C42 | C43 | C44 | 117.4° | 173.7° |
| N41 | C42 | C47 | C51 | 79.9° | 57.9° |
| N41 | C42 | C47 | O48 | 44.6° | 62.1° |
| N41 | C42 | C43 | H45 | 3.0° | 53.7° |
| N41 | C42 | C43 | H46 | 122.2° | 66.3° |
| N41 | C42 | C47 | H54 | 161.1° | 177.9° |
| O60 | C59 | C51 | C58 | 68.6° | 65.0° |
| O60 | C59 | C51 | H60 | 120.6° | 120.0° |
| O60 | C59 | C51 | H61 | 120.6° | 119.9° |
| O60 | C59 | C51 | C47 | 53.2° | 175.0° |
| O60 | C59 | C51 | H56 | 172.6° | 55.0° |
| O60 | C59 | H60 | H61 | 118.2° | 120.0° |
| C43 | C42 | C47 | H44 | 121.7° | 120.0° |
| C42 | C43 | C44 | H45 | 120.4° | 120.0° |
| C42 | C43 | C44 | H46 | 120.4° | 120.0° |
| C42 | C43 | C44 | C45 | 173.0° | 66.0° |
| C43 | C42 | C47 | C51 | 168.9° | 177.9° |
| C43 | C42 | C47 | O48 | 66.6° | 58.0° |
| C43 | C42 | N41 | H43 | 74.9° | 91.7° |
| C42 | C43 | H45 | H46 | 118.8° | 120.0° |
| C42 | C43 | C44 | H47 | 68.7° | 54.0° |
| C43 | C42 | C47 | H54 | 49.9° | 62.1° |
| C42 | C47 | C51 | C58 | 42.5° | 178.1° |
| C47 | C42 | C43 | C44 | 122.7° | 66.2° |
| C42 | C47 | C51 | C59 | 78.9° | 58.0° |
| C42 | C47 | C51 | O48 | 124.0° | 120.0° |
| C42 | C47 | C51 | H54 | 119.3° | 120.0° |
| C42 | C47 | O48 | H54 | 115.5° | 120.0° |
| C47 | C42 | N41 | H43 | 40.8° | 28.4° |
| C47 | C42 | C43 | H45 | 116.9° | 173.8° |
| C47 | C42 | C43 | H46 | 2.3° | 53.8° |
| C42 | C47 | O48 | H55 | 180.0° | 60.0° |
| C42 | C47 | C51 | H56 | 161.4° | 62.0° |
| C58 | C51 | C59 | C47 | 121.8° | 120.0° |
| C58 | C51 | C59 | H56 | 118.9° | 119.9° |
| C58 | C51 | C47 | H56 | 118.9° | 119.9° |
| C58 | C51 | C47 | O48 | 166.5° | 61.9° |
| C58 | C51 | C47 | H54 | 76.8° | 58.1° |
| C51 | C58 | H57 | H58 | 120.0° | 120.0° |
| C51 | C58 | H57 | H59 | 120.0° | 120.0° |
| C51 | C58 | H58 | H59 | 120.0° | 120.0° |
| C58 | C51 | C59 | H60 | 170.9° | 175.1° |
| C58 | C51 | C59 | H61 | 52.0° | 55.0° |
| C43 | C44 | C45 | H47 | 118.3° | 120.0° |
| C44 | C43 | C42 | H44 | 1.2° | 53.8° |
| C44 | C43 | H45 | H46 | 118.7° | 119.9° |
| C43 | C44 | C45 | H48 | 57.3° | 56.0° |
| C43 | C44 | C45 | H49 | 177.3° | 63.9° |
| C43 | C44 | C45 | H50 | 62.7° | 176.1° |
| C43 | C44 | C46 | H51 | 180.0° | 60.0° |
| C43 | C44 | C46 | H52 | 60.0° | 180.0° |
| C43 | C44 | C46 | H53 | 60.0° | 60.0° |
| C45 | C44 | C43 | H45 | 52.5° | 54.0° |
| C45 | C44 | C43 | H46 | 66.6° | 173.9° |
| C44 | C45 | H48 | H49 | 120.0° | 119.9° |
| C44 | C45 | H48 | H50 | 120.0° | 120.0° |
| C44 | C45 | H49 | H50 | 120.0° | 120.0° |
| C45 | C44 | C46 | H51 | 60.6° | 180.0° |
| C45 | C44 | C46 | H52 | 179.4° | 60.0° |
| C45 | C44 | C46 | H53 | 59.4° | 60.0° |
| C59 | C51 | C47 | H56 | 119.7° | 120.0° |
| C59 | C51 | C47 | O48 | 45.1° | 178.0° |
| C59 | C51 | C47 | H54 | 161.8° | 62.0° |
| C59 | C51 | C58 | H57 | 180.0° | 64.9° |
| C59 | C51 | C58 | H58 | 60.0° | 55.1° |
| C59 | C51 | C58 | H59 | 60.0° | 175.1° |
| C51 | C59 | H60 | H61 | 118.2° | 120.0° |
| C51 | C59 | O60 | H62 | 180.0° | 180.0° |
| C51 | C47 | O48 | H54 | 115.5° | 120.0° |
| C51 | C47 | C42 | H44 | 47.2° | 62.0° |
| C51 | C47 | O48 | H55 | 51.0° | 60.0° |
| C47 | C51 | C58 | H57 | 57.5° | 175.1° |
| C47 | C51 | C58 | H58 | 177.5° | 64.9° |
| C47 | C51 | C58 | H59 | 62.4° | 55.1° |
| C47 | C51 | C59 | H60 | 67.4° | 55.0° |
| C47 | C51 | C59 | H61 | 173.8° | 65.1° |
| O48 | C47 | C42 | H44 | 171.7° | 178.0° |
| O48 | C47 | C51 | H56 | 74.7° | 58.0° |
| H1 | C5 | C6 | H3 | 63.3° | 176.9° |
| H1 | C5 | C6 | H4 | 58.6° | 56.8° |
| H2 | C5 | C6 | H3 | 176.1° | 56.9° |
| H2 | C5 | C6 | H4 | 62.0° | 63.3° |
| H7 | C13 | C12 | H23 | 168.6° | 180.0° |
| H7 | C13 | C12 | H24 | 47.6° | 59.9° |
| H8 | C13 | C12 | H23 | 71.3° | 59.9° |
| H8 | C13 | C12 | H24 | 167.7° | 180.0° |
| H9 | C15 | C16 | H27 | 0.5° | 0.0° |
| H10 | C17 | C18 | H26 | 0.2° | 0.1° |
| H10 | C17 | C16 | H27 | 0.0° | 0.2° |
| H11 | C24 | C23 | H29 | 62.4° | 65.5° |
| H11 | C24 | C25 | H30 | 175.5° | 173.4° |
| H12 | C24 | C23 | H29 | 176.9° | 174.5° |
| H12 | C24 | C25 | H30 | 63.8° | 66.5° |
| H13 | C26 | H14 | H15 | 120.0° | 119.9° |
| H13 | C26 | C25 | H30 | 60.9° | 55.9° |
| H14 | C26 | C25 | H30 | 179.1° | 64.1° |
| H15 | C26 | C25 | H30 | 59.1° | 175.9° |
| H16 | C3 | C2 | H18 | 57.1° | 63.3° |
| H16 | C3 | C2 | H19 | 177.9° | 56.8° |
| H17 | C3 | C2 | H18 | 63.3° | 56.9° |
| H17 | C3 | C2 | H19 | 57.4° | 177.0° |
| H21 | N10 | C11 | H22 | 155.8° | 145.0° |
| H22 | C11 | C12 | H23 | 138.0° | 175.0° |
| H22 | C11 | C12 | H24 | 101.0° | 65.0° |
| H25 | C19 | C18 | H26 | 0.2° | 0.0° |
| H28 | N22 | C23 | H29 | 150.5° | 148.3° |
| H30 | C25 | C27 | H31 | 60.8° | 60.0° |
| H30 | C25 | C27 | H32 | 59.1° | 60.0° |
| H30 | C25 | C27 | H33 | 179.1° | 180.0° |
| H31 | C27 | H32 | H33 | 120.0° | 120.0° |
| H34 | N30 | C31 | H35 | 172.5° | 145.0° |
| H35 | C31 | C32 | H36 | 74.2° | 175.0° |
| H35 | C31 | C32 | H37 | 164.1° | 65.0° |
| H38 | C38 | C37 | H39 | 0.0° | 0.0° |
| H39 | C37 | C36 | H40 | 0.1° | 0.0° |
| H40 | C36 | C35 | H41 | 0.0° | 0.0° |
| H41 | C35 | C34 | H42 | 0.3° | 0.1° |
| H43 | N41 | C42 | H44 | 167.2° | 148.4° |
| H44 | C42 | C43 | H45 | 121.6° | 66.2° |
| H44 | C42 | C43 | H46 | 119.2° | 173.8° |
| H44 | C42 | C47 | H54 | 71.8° | 58.0° |
| H45 | C43 | C44 | H47 | 170.9° | 174.0° |
| H46 | C43 | C44 | H47 | 51.7° | 66.1° |
| H47 | C44 | C45 | H48 | 61.0° | 63.9° |
| H47 | C44 | C45 | H49 | 59.0° | 176.1° |
| H47 | C44 | C45 | H50 | 179.0° | 56.1° |
| H47 | C44 | C46 | H51 | 58.4° | 60.0° |
| H47 | C44 | C46 | H52 | 61.6° | 60.0° |
| H47 | C44 | C46 | H53 | 178.4° | 180.0° |
| H48 | C45 | H49 | H50 | 120.0° | 120.1° |
| H51 | C46 | H52 | H53 | 120.0° | 120.0° |
| H54 | C47 | O48 | H55 | 64.5° | 180.0° |
| H54 | C47 | C51 | H56 | 42.1° | 178.0° |
| H56 | C51 | C58 | H57 | 61.1° | 55.1° |
| H56 | C51 | C58 | H58 | 58.9° | 175.1° |
| H56 | C51 | C58 | H59 | 178.9° | 64.9° |
| H56 | C51 | C59 | H60 | 52.0° | 65.0° |
| H56 | C51 | C59 | H61 | 66.8° | 174.9° |
| H57 | C58 | H58 | H59 | 120.0° | 120.0° |
| H60 | C59 | O60 | H62 | 59.4° | 60.0° |
| H61 | C59 | O60 | H62 | 59.4° | 60.0° |
