F0H
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C43 | C44 | sing | 1.51Å | 1.50Å | |
C43 | C42 | doub | 1.32Å | 1.32Å | |
C44 | C45 | sing | 1.53Å | 1.53Å | |
C45 | C38 | sing | 1.55Å | 1.54Å | |
C33 | C32 | sing | 1.53Å | 1.53Å | |
C33 | N34 | sing | 1.47Å | 1.45Å | |
O36 | C35 | doub | 1.21Å | 1.22Å | |
N28 | C27 | doub | 1.32Å | 1.35Å | Aromatic |
N28 | C29 | sing | 1.33Å | 1.35Å | Aromatic |
C27 | C26 | sing | 1.38Å | 1.39Å | Aromatic |
C42 | C41 | sing | 1.51Å | 1.50Å | |
C32 | C31 | sing | 1.47Å | 1.47Å | |
C35 | N34 | sing | 1.35Å | 1.34Å | |
C35 | O37 | sing | 1.35Å | 1.35Å | |
C31 | C30 | trip | 1.17Å | 1.19Å | |
C30 | C29 | sing | 1.43Å | 1.44Å | |
C29 | C46 | doub | 1.39Å | 1.39Å | Aromatic |
C26 | C25 | doub | 1.40Å | 1.39Å | Aromatic |
O37 | C38 | sing | 1.45Å | 1.46Å | |
C38 | C39 | sing | 1.54Å | 1.54Å | |
C46 | C25 | sing | 1.39Å | 1.39Å | Aromatic |
O1 | C2 | sing | 1.43Å | 1.42Å | |
C25 | N24 | sing | 1.39Å | 1.41Å | |
C41 | C40 | sing | 1.49Å | 1.53Å | |
C40 | C39 | sing | 1.51Å | 1.53Å | |
N24 | C23 | sing | 1.39Å | 1.36Å | |
C2 | C3 | sing | 1.53Å | 1.53Å | |
C23 | N47 | doub | 1.32Å | 1.35Å | Aromatic |
C23 | N22 | sing | 1.33Å | 1.35Å | Aromatic |
N47 | C19 | sing | 1.33Å | 1.34Å | Aromatic |
C14 | C13 | doub | 1.35Å | 1.37Å | |
C14 | C15 | sing | 1.41Å | 1.39Å | |
C13 | N12 | sing | 1.36Å | 1.38Å | |
N22 | C21 | doub | 1.32Å | 1.34Å | Aromatic |
C19 | C15 | sing | 1.48Å | 1.49Å | |
C19 | C20 | doub | 1.40Å | 1.38Å | Aromatic |
C15 | C16 | doub | 1.38Å | 1.38Å | |
N12 | C3 | sing | 1.46Å | 1.50Å | |
N12 | C17 | sing | 1.35Å | 1.41Å | |
C3 | C4 | sing | 1.51Å | 1.52Å | |
C21 | C20 | sing | 1.39Å | 1.37Å | Aromatic |
C16 | C17 | sing | 1.41Å | 1.43Å | |
C17 | O18 | doub | 1.22Å | 1.25Å | |
C4 | C11 | doub | 1.38Å | 1.40Å | Aromatic |
C4 | C5 | sing | 1.38Å | 1.40Å | Aromatic |
C11 | C9 | sing | 1.38Å | 1.38Å | Aromatic |
C5 | C6 | doub | 1.38Å | 1.38Å | Aromatic |
C9 | F10 | sing | 1.35Å | 1.36Å | |
C9 | C7 | doub | 1.39Å | 1.38Å | Aromatic |
C6 | C7 | sing | 1.38Å | 1.38Å | Aromatic |
C7 | CL8 | sing | 1.74Å | 1.73Å | |
C2 | H49 | sing | 1.09Å | 1.10Å | |
C2 | H50 | sing | 1.09Å | 1.10Å | |
C3 | H51 | sing | 1.09Å | 1.10Å | |
C5 | H52 | sing | 1.08Å | 1.08Å | |
C6 | H53 | sing | 1.08Å | 1.08Å | |
C11 | H54 | sing | 1.08Å | 1.08Å | |
C13 | H55 | sing | 1.08Å | 1.08Å | |
C14 | H56 | sing | 1.08Å | 1.08Å | |
C16 | H57 | sing | 1.08Å | 1.08Å | |
C21 | H59 | sing | 1.08Å | 1.08Å | |
C26 | H61 | sing | 1.08Å | 1.08Å | |
C27 | H62 | sing | 1.08Å | 1.08Å | |
C38 | H68 | sing | 1.09Å | 1.10Å | |
C39 | H69 | sing | 1.09Å | 1.10Å | |
C39 | H70 | sing | 1.09Å | 1.10Å | |
C40 | H72 | sing | 1.09Å | 1.10Å | |
C40 | H71 | sing | 1.09Å | 1.10Å | |
C42 | H75 | sing | 1.08Å | 1.08Å | |
C43 | H76 | sing | 1.08Å | 1.08Å | |
O1 | H48 | sing | 0.97Å | 0.95Å | |
C20 | H58 | sing | 1.08Å | 1.08Å | |
N24 | H60 | sing | 0.97Å | 1.00Å | |
C32 | H64 | sing | 1.09Å | 1.10Å | |
C32 | H63 | sing | 1.09Å | 1.10Å | |
C33 | H65 | sing | 1.09Å | 1.10Å | |
C33 | H66 | sing | 1.09Å | 1.10Å | |
N34 | H67 | sing | 0.97Å | 1.00Å | |
C41 | H74 | sing | 1.09Å | 1.10Å | |
C41 | H73 | sing | 1.09Å | 1.10Å | |
C44 | H77 | sing | 1.09Å | 1.10Å | |
C44 | H78 | sing | 1.09Å | 1.10Å | |
C45 | H79 | sing | 1.09Å | 1.10Å | |
C45 | H80 | sing | 1.09Å | 1.10Å | |
C46 | H81 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C44 | C43 | C42 | 126.3° | 118.1° |
C43 | C44 | C45 | 114.0° | 109.0° |
C44 | C43 | H76 | 116.9° | 121.0° |
C43 | C44 | H77 | 108.3° | 109.6° |
C43 | C44 | H78 | 108.3° | 109.5° |
C43 | C42 | C41 | 126.4° | 116.9° |
C43 | C42 | H75 | 116.8° | 121.5° |
C42 | C43 | H76 | 116.9° | 121.0° |
C44 | C45 | C38 | 116.4° | 108.6° |
C45 | C44 | H77 | 108.3° | 109.5° |
C45 | C44 | H78 | 108.3° | 109.6° |
C44 | C45 | H79 | 107.7° | 109.6° |
C44 | C45 | H80 | 107.7° | 109.6° |
C45 | C38 | O37 | 106.7° | 109.9° |
C45 | C38 | C39 | 118.0° | 107.8° |
C45 | C38 | H68 | 108.6° | 109.8° |
C38 | C45 | H79 | 107.7° | 109.6° |
C38 | C45 | H80 | 107.7° | 109.6° |
C32 | C33 | N34 | 112.3° | 109.5° |
C33 | C32 | C31 | 112.3° | 109.5° |
C33 | C32 | H64 | 108.8° | 109.5° |
C33 | C32 | H63 | 108.8° | 109.5° |
C32 | C33 | H65 | 108.8° | 109.5° |
C32 | C33 | H66 | 108.8° | 109.4° |
C33 | N34 | C35 | 122.7° | 120.0° |
N34 | C33 | H65 | 108.8° | 109.5° |
N34 | C33 | H66 | 108.8° | 109.4° |
C33 | N34 | H67 | 118.6° | 120.0° |
O36 | C35 | N34 | 125.2° | 120.0° |
O36 | C35 | O37 | 125.4° | 120.0° |
C27 | N28 | C29 | 117.3° | 121.8° |
N28 | C27 | C26 | 123.1° | 121.0° |
N28 | C27 | H62 | 118.5° | 119.5° |
N28 | C29 | C30 | 117.6° | 119.7° |
N28 | C29 | C46 | 123.0° | 120.6° |
C27 | C26 | C25 | 119.4° | 119.3° |
C27 | C26 | H61 | 120.3° | 120.4° |
C26 | C27 | H62 | 118.5° | 119.5° |
C42 | C41 | C40 | 114.6° | 113.1° |
C41 | C42 | H75 | 116.8° | 121.6° |
C42 | C41 | H74 | 108.2° | 108.7° |
C42 | C41 | H73 | 108.2° | 108.7° |
C32 | C31 | C30 | 180.0° | 180.0° |
C31 | C32 | H64 | 108.7° | 109.5° |
C31 | C32 | H63 | 108.7° | 109.5° |
N34 | C35 | O37 | 109.4° | 120.0° |
C35 | N34 | H67 | 118.7° | 120.1° |
C35 | O37 | C38 | 119.4° | 117.0° |
C31 | C30 | C29 | 180.0° | 180.0° |
C30 | C29 | C46 | 119.4° | 119.7° |
C29 | C46 | C25 | 119.4° | 118.9° |
C29 | C46 | H81 | 120.3° | 120.6° |
C26 | C25 | C46 | 117.8° | 118.3° |
C26 | C25 | N24 | 126.3° | 120.8° |
C25 | C26 | H61 | 120.3° | 120.3° |
O37 | C38 | C39 | 105.1° | 109.8° |
O37 | C38 | H68 | 109.6° | 109.8° |
C38 | C39 | C40 | 118.0° | 110.5° |
C39 | C38 | H68 | 108.5° | 109.7° |
C38 | C39 | H69 | 107.3° | 109.2° |
C38 | C39 | H70 | 107.3° | 109.3° |
C46 | C25 | N24 | 115.8° | 120.8° |
C25 | C46 | H81 | 120.3° | 120.5° |
O1 | C2 | C3 | 111.7° | 109.5° |
O1 | C2 | H49 | 108.9° | 109.4° |
O1 | C2 | H50 | 108.9° | 109.5° |
C2 | O1 | H48 | 109.5° | 114.0° |
C25 | N24 | C23 | 133.9° | 120.0° |
C25 | N24 | H60 | 113.1° | 120.0° |
C41 | C40 | C39 | 116.6° | 117.5° |
C41 | C40 | H72 | 107.7° | 107.9° |
C41 | C40 | H71 | 107.7° | 107.8° |
C40 | C41 | H74 | 108.2° | 108.8° |
C40 | C41 | H73 | 108.2° | 108.8° |
C40 | C39 | H69 | 107.3° | 109.3° |
C40 | C39 | H70 | 107.3° | 109.3° |
C39 | C40 | H72 | 107.6° | 107.8° |
C39 | C40 | H71 | 107.7° | 107.8° |
N24 | C23 | N47 | 117.2° | 119.1° |
N24 | C23 | N22 | 117.1° | 119.2° |
C23 | N24 | H60 | 113.1° | 120.1° |
C2 | C3 | N12 | 111.5° | 109.5° |
C2 | C3 | C4 | 111.0° | 109.5° |
C3 | C2 | H49 | 108.9° | 109.5° |
C3 | C2 | H50 | 108.9° | 109.5° |
C2 | C3 | H51 | 106.8° | 109.5° |
N47 | C23 | N22 | 125.7° | 121.7° |
C23 | N47 | C19 | 117.1° | 120.6° |
C23 | N22 | C21 | 115.7° | 120.9° |
N47 | C19 | C15 | 116.5° | 120.5° |
N47 | C19 | C20 | 120.6° | 119.0° |
C13 | C14 | C15 | 120.6° | 119.8° |
C14 | C13 | N12 | 121.4° | 121.0° |
C14 | C13 | H55 | 119.3° | 119.4° |
C13 | C14 | H56 | 119.7° | 120.1° |
C14 | C15 | C19 | 120.5° | 120.5° |
C14 | C15 | C16 | 118.1° | 118.9° |
C15 | C14 | H56 | 119.7° | 120.1° |
C13 | N12 | C3 | 121.8° | 119.4° |
C13 | N12 | C17 | 121.2° | 121.2° |
N12 | C13 | H55 | 119.3° | 119.6° |
N22 | C21 | C20 | 122.2° | 119.3° |
N22 | C21 | H59 | 118.9° | 120.4° |
C15 | C19 | C20 | 122.8° | 120.5° |
C19 | C15 | C16 | 121.3° | 120.5° |
C19 | C20 | C21 | 118.5° | 118.4° |
C19 | C20 | H58 | 120.7° | 120.7° |
C15 | C16 | C17 | 123.2° | 119.0° |
C15 | C16 | H57 | 118.4° | 120.5° |
C3 | N12 | C17 | 117.0° | 119.4° |
N12 | C3 | C4 | 113.1° | 109.5° |
N12 | C3 | H51 | 107.2° | 109.4° |
N12 | C17 | C16 | 115.6° | 120.1° |
N12 | C17 | O18 | 119.3° | 120.0° |
C3 | C4 | C11 | 122.3° | 120.0° |
C3 | C4 | C5 | 118.9° | 120.0° |
C4 | C3 | H51 | 106.9° | 109.5° |
C20 | C21 | H59 | 118.9° | 120.4° |
C21 | C20 | H58 | 120.7° | 120.8° |
C16 | C17 | O18 | 125.1° | 119.9° |
C17 | C16 | H57 | 118.4° | 120.5° |
C11 | C4 | C5 | 118.8° | 120.0° |
C4 | C11 | C9 | 119.8° | 120.0° |
C4 | C11 | H54 | 120.1° | 120.0° |
C4 | C5 | C6 | 120.8° | 120.1° |
C4 | C5 | H52 | 119.6° | 120.0° |
C11 | C9 | F10 | 120.4° | 120.1° |
C11 | C9 | C7 | 121.1° | 119.9° |
C9 | C11 | H54 | 120.1° | 120.0° |
C5 | C6 | C7 | 119.6° | 120.0° |
C6 | C5 | H52 | 119.6° | 120.0° |
C5 | C6 | H53 | 120.2° | 120.0° |
F10 | C9 | C7 | 118.6° | 120.0° |
C9 | C7 | C6 | 119.8° | 120.0° |
C9 | C7 | CL8 | 121.3° | 120.0° |
C6 | C7 | CL8 | 118.9° | 120.0° |
C7 | C6 | H53 | 120.2° | 120.0° |
H49 | C2 | H50 | 109.5° | 109.5° |
H69 | C39 | H70 | 109.5° | 109.2° |
H72 | C40 | H71 | 109.5° | 107.6° |
H64 | C32 | H63 | 109.5° | 109.4° |
H65 | C33 | H66 | 109.5° | 109.5° |
H74 | C41 | H73 | 109.5° | 108.6° |
H77 | C44 | H78 | 109.5° | 109.6° |
H79 | C45 | H80 | 109.5° | 109.7° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C44 | C43 | C42 | H76 | 180.0° | 180.0° |
C43 | C44 | C45 | H77 | 120.6° | 119.9° |
C43 | C44 | C45 | H78 | 120.7° | 119.9° |
C43 | C44 | C45 | C38 | 109.1° | 57.8° |
C44 | C43 | C42 | C41 | 0.3° | 0.2° |
C44 | C43 | C42 | H75 | 179.7° | 179.6° |
C43 | C44 | H77 | H78 | 117.9° | 120.2° |
C43 | C44 | C45 | H79 | 129.9° | 61.9° |
C43 | C44 | C45 | H80 | 11.9° | 177.6° |
C42 | C43 | C44 | C45 | 74.7° | 104.8° |
C43 | C42 | C41 | H75 | 180.0° | 179.9° |
C43 | C42 | C41 | C40 | 62.8° | 84.5° |
C43 | C42 | C41 | H74 | 176.4° | 36.5° |
C43 | C42 | C41 | H73 | 57.9° | 154.5° |
C42 | C43 | C44 | H77 | 45.9° | 15.0° |
C42 | C43 | C44 | H78 | 164.6° | 135.3° |
C44 | C45 | C38 | H79 | 121.0° | 119.7° |
C44 | C45 | C38 | H80 | 121.0° | 119.8° |
C44 | C45 | C38 | O37 | 61.9° | 176.6° |
C44 | C45 | C38 | C39 | 56.1° | 57.0° |
C44 | C45 | C38 | H68 | 179.9° | 62.5° |
C45 | C44 | C43 | H76 | 105.3° | 75.1° |
C45 | C44 | H77 | H78 | 118.0° | 120.3° |
C44 | C45 | H79 | H80 | 116.9° | 120.4° |
C45 | C38 | O37 | C35 | 81.6° | 91.6° |
C45 | C38 | O37 | C39 | 126.1° | 118.4° |
C45 | C38 | O37 | H68 | 117.4° | 120.9° |
C45 | C38 | C39 | H68 | 124.0° | 119.6° |
C45 | C38 | C39 | C40 | 25.8° | 105.8° |
C45 | C38 | C39 | H69 | 95.4° | 14.4° |
C45 | C38 | C39 | H70 | 147.0° | 133.8° |
C38 | C45 | C44 | H77 | 11.5° | 62.0° |
C38 | C45 | C44 | H78 | 130.2° | 177.7° |
C38 | C45 | H79 | H80 | 116.8° | 120.5° |
C32 | C33 | N34 | H65 | 120.4° | 120.0° |
C32 | C33 | N34 | H66 | 120.4° | 119.9° |
C33 | C32 | C31 | H64 | 120.4° | 120.1° |
C33 | C32 | C31 | H63 | 120.4° | 120.0° |
C32 | C33 | N34 | C35 | 169.0° | 180.0° |
C33 | C32 | C31 | C30 | 65.9° | 163.5° |
C33 | C32 | H64 | H63 | 118.7° | 120.0° |
C32 | C33 | H65 | H66 | 118.7° | 120.0° |
C32 | C33 | N34 | H67 | 11.0° | 0.0° |
C33 | N34 | C35 | O36 | 0.1° | 0.0° |
N34 | C33 | C32 | C31 | 150.0° | 180.0° |
C33 | N34 | C35 | H67 | 180.0° | 180.0° |
C33 | N34 | C35 | O37 | 179.9° | 180.0° |
N34 | C33 | C32 | H64 | 29.6° | 59.9° |
N34 | C33 | C32 | H63 | 89.5° | 60.0° |
N34 | C33 | H65 | H66 | 118.7° | 120.0° |
O36 | C35 | N34 | O37 | 180.0° | 180.0° |
O36 | C35 | O37 | C38 | 1.4° | 0.1° |
O36 | C35 | N34 | H67 | 179.9° | 180.0° |
N28 | C27 | C26 | H62 | 180.0° | 180.0° |
C27 | N28 | C29 | C30 | 180.0° | 180.0° |
C27 | N28 | C29 | C46 | 0.1° | 0.3° |
N28 | C27 | C26 | C25 | 0.7° | 0.0° |
N28 | C27 | C26 | H61 | 179.3° | 180.0° |
C29 | N28 | C27 | C26 | 0.2° | 0.0° |
N28 | C29 | C30 | C31 | 63.5° | 79.6° |
N28 | C29 | C30 | C46 | 179.9° | 179.7° |
N28 | C29 | C46 | C25 | 0.5° | 0.6° |
C29 | N28 | C27 | H62 | 179.8° | 180.0° |
N28 | C29 | C46 | H81 | 179.5° | 180.0° |
C27 | C26 | C25 | H61 | 180.0° | 180.0° |
C27 | C26 | C25 | C46 | 1.0° | 0.3° |
C27 | C26 | C25 | N24 | 178.1° | 180.0° |
C42 | C41 | C40 | H74 | 120.7° | 121.0° |
C42 | C41 | C40 | H73 | 120.8° | 120.9° |
C42 | C41 | C40 | C39 | 100.8° | 79.7° |
C42 | C41 | C40 | H72 | 20.2° | 158.2° |
C42 | C41 | C40 | H71 | 138.2° | 42.3° |
C41 | C42 | C43 | H76 | 179.7° | 179.8° |
C42 | C41 | H74 | H73 | 117.7° | 118.1° |
C32 | C31 | C30 | C29 | 124.2° | 176.8° |
C31 | C32 | H64 | H63 | 118.7° | 120.0° |
C31 | C32 | C33 | H65 | 29.6° | 60.0° |
C31 | C32 | C33 | H66 | 89.5° | 60.1° |
N34 | C35 | O37 | C38 | 178.7° | 180.0° |
C35 | N34 | C33 | H65 | 48.5° | 60.0° |
C35 | N34 | C33 | H66 | 70.6° | 60.1° |
C35 | O37 | C38 | C39 | 152.2° | 150.0° |
C35 | O37 | C38 | H68 | 35.8° | 29.3° |
O37 | C35 | N34 | H67 | 0.1° | 0.0° |
C31 | C30 | C29 | C46 | 116.6° | 100.6° |
C30 | C31 | C32 | H64 | 173.6° | 76.4° |
C30 | C31 | C32 | H63 | 54.5° | 43.5° |
C30 | C29 | C46 | C25 | 179.6° | 179.7° |
C30 | C29 | C46 | H81 | 0.4° | 0.3° |
C29 | C46 | C25 | C26 | 0.9° | 0.6° |
C29 | C46 | C25 | H81 | 180.0° | 179.4° |
C29 | C46 | C25 | N24 | 178.3° | 179.7° |
C26 | C25 | C46 | N24 | 177.4° | 179.7° |
C26 | C25 | N24 | C23 | 28.3° | 145.8° |
C25 | C26 | C27 | H62 | 179.3° | 180.0° |
C26 | C25 | N24 | H60 | 151.7° | 34.1° |
C26 | C25 | C46 | H81 | 179.1° | 179.9° |
O37 | C38 | C39 | H68 | 117.2° | 120.8° |
O37 | C38 | C39 | C40 | 144.6° | 134.5° |
O37 | C38 | C39 | H69 | 23.4° | 105.2° |
O37 | C38 | C39 | H70 | 94.2° | 14.2° |
O37 | C38 | C45 | H79 | 59.1° | 63.7° |
O37 | C38 | C45 | H80 | 177.1° | 56.8° |
C38 | C39 | C40 | C41 | 92.7° | 73.8° |
C38 | C39 | C40 | H69 | 121.2° | 120.2° |
C38 | C39 | C40 | H70 | 121.2° | 120.3° |
C38 | C39 | H69 | H70 | 116.1° | 119.4° |
C38 | C39 | C40 | H72 | 28.3° | 164.2° |
C38 | C39 | C40 | H71 | 146.3° | 48.2° |
C39 | C38 | C45 | H79 | 177.1° | 176.7° |
C39 | C38 | C45 | H80 | 64.9° | 62.8° |
C46 | C25 | N24 | C23 | 154.5° | 34.5° |
C46 | C25 | C26 | H61 | 179.0° | 179.7° |
C46 | C25 | N24 | H60 | 25.4° | 145.5° |
O1 | C2 | C3 | H49 | 120.3° | 120.0° |
O1 | C2 | C3 | H50 | 120.4° | 120.0° |
O1 | C2 | C3 | N12 | 44.4° | 65.9° |
O1 | C2 | C3 | C4 | 171.5° | 54.1° |
O1 | C2 | H49 | H50 | 119.0° | 120.0° |
O1 | C2 | C3 | H51 | 72.3° | 174.1° |
C25 | N24 | C23 | H60 | 180.0° | 180.0° |
C25 | N24 | C23 | N47 | 6.9° | 174.2° |
C25 | N24 | C23 | N22 | 173.8° | 5.7° |
N24 | C25 | C26 | H61 | 1.9° | 0.1° |
N24 | C25 | C46 | H81 | 1.7° | 0.4° |
C41 | C40 | C39 | H72 | 121.0° | 122.1° |
C41 | C40 | C39 | H71 | 121.0° | 122.0° |
C41 | C40 | C39 | H69 | 28.5° | 46.5° |
C41 | C40 | C39 | H70 | 146.1° | 165.9° |
C41 | C40 | H72 | H71 | 116.8° | 116.1° |
C40 | C41 | C42 | H75 | 117.2° | 95.3° |
C40 | C41 | H74 | H73 | 117.7° | 118.3° |
C40 | C39 | C38 | H68 | 98.2° | 13.7° |
C40 | C39 | H69 | H70 | 116.1° | 119.5° |
C39 | C40 | H72 | H71 | 116.7° | 116.1° |
C39 | C40 | C41 | H74 | 138.5° | 41.2° |
C39 | C40 | C41 | H73 | 20.0° | 159.4° |
N24 | C23 | N47 | N22 | 179.2° | 179.9° |
N24 | C23 | N47 | C19 | 179.9° | 180.0° |
N24 | C23 | N22 | C21 | 179.4° | 179.7° |
C2 | C3 | N12 | C13 | 31.5° | 3.8° |
C2 | C3 | N12 | C4 | 125.9° | 120.0° |
C2 | C3 | N12 | H51 | 116.5° | 120.0° |
C2 | C3 | N12 | C17 | 146.6° | 176.6° |
C2 | C3 | C4 | H51 | 116.1° | 120.0° |
C2 | C3 | C4 | C11 | 75.2° | 100.7° |
C2 | C3 | C4 | C5 | 102.3° | 79.3° |
C3 | C2 | H49 | H50 | 118.9° | 120.0° |
C3 | C2 | O1 | H48 | 180.0° | 180.0° |
N47 | C23 | N22 | C21 | 1.3° | 0.2° |
C23 | N47 | C19 | C15 | 177.7° | 180.0° |
C23 | N47 | C19 | C20 | 0.9° | 0.3° |
N47 | C23 | N24 | H60 | 173.1° | 5.8° |
N22 | C23 | N47 | C19 | 0.7° | 0.1° |
C23 | N22 | C21 | C20 | 0.4° | 0.2° |
C23 | N22 | C21 | H59 | 179.6° | 179.8° |
N22 | C23 | N24 | H60 | 6.2° | 174.2° |
N47 | C19 | C15 | C14 | 1.1° | 0.3° |
N47 | C19 | C15 | C20 | 176.8° | 179.7° |
N47 | C19 | C15 | C16 | 176.9° | 179.7° |
N47 | C19 | C20 | C21 | 1.7° | 0.3° |
N47 | C19 | C20 | H58 | 178.3° | 179.7° |
C13 | C14 | C15 | H56 | 180.0° | 179.9° |
C14 | C13 | N12 | H55 | 180.0° | 179.7° |
C13 | C14 | C15 | C19 | 178.2° | 180.0° |
C13 | C14 | C15 | C16 | 2.3° | 0.1° |
C14 | C13 | N12 | C3 | 178.7° | 179.7° |
C14 | C13 | N12 | C17 | 0.7° | 0.0° |
C15 | C14 | C13 | N12 | 1.1° | 0.0° |
C14 | C15 | C19 | C16 | 175.8° | 179.9° |
C14 | C15 | C19 | C20 | 175.6° | 179.9° |
C14 | C15 | C16 | C17 | 2.0° | 0.0° |
C15 | C14 | C13 | H55 | 178.9° | 179.8° |
C14 | C15 | C16 | H57 | 178.0° | 180.0° |
C13 | N12 | C3 | C17 | 178.1° | 179.7° |
C13 | N12 | C3 | C4 | 94.3° | 116.3° |
C13 | N12 | C17 | C16 | 1.0° | 0.1° |
C13 | N12 | C17 | O18 | 179.4° | 180.0° |
C13 | N12 | C3 | H51 | 148.0° | 123.7° |
N12 | C13 | C14 | H56 | 178.9° | 179.9° |
N22 | C21 | C20 | C19 | 1.0° | 0.0° |
N22 | C21 | C20 | H59 | 180.0° | 180.0° |
N22 | C21 | C20 | H58 | 179.0° | 180.0° |
C15 | C19 | C20 | C21 | 178.3° | 180.0° |
C19 | C15 | C16 | C17 | 177.8° | 180.0° |
C19 | C15 | C14 | H56 | 1.8° | 0.1° |
C19 | C15 | C16 | H57 | 2.2° | 0.0° |
C15 | C19 | C20 | H58 | 1.6° | 0.0° |
C20 | C19 | C15 | C16 | 0.2° | 0.0° |
C19 | C20 | C21 | H58 | 180.0° | 180.0° |
C19 | C20 | C21 | H59 | 179.0° | 180.0° |
C15 | C16 | C17 | N12 | 0.3° | 0.0° |
C15 | C16 | C17 | H57 | 180.0° | 180.0° |
C15 | C16 | C17 | O18 | 178.0° | 179.9° |
C16 | C15 | C14 | H56 | 177.7° | 180.0° |
N12 | C3 | C4 | H51 | 117.8° | 120.0° |
C3 | N12 | C17 | C16 | 179.2° | 179.7° |
C3 | N12 | C17 | O18 | 2.4° | 0.4° |
N12 | C3 | C4 | C11 | 51.0° | 139.3° |
N12 | C3 | C4 | C5 | 131.6° | 40.7° |
N12 | C3 | C2 | H49 | 75.9° | 54.1° |
N12 | C3 | C2 | H50 | 164.8° | 174.1° |
C3 | N12 | C13 | H55 | 1.3° | 0.0° |
C17 | N12 | C3 | C4 | 87.5° | 63.4° |
N12 | C17 | C16 | O18 | 178.3° | 179.9° |
C17 | N12 | C3 | H51 | 30.1° | 56.6° |
C17 | N12 | C13 | H55 | 179.3° | 179.7° |
N12 | C17 | C16 | H57 | 179.7° | 180.0° |
C3 | C4 | C11 | C5 | 177.4° | 180.0° |
C3 | C4 | C11 | C9 | 179.1° | 179.4° |
C3 | C4 | C5 | C6 | 179.0° | 180.0° |
C4 | C3 | C2 | H49 | 51.1° | 174.1° |
C4 | C3 | C2 | H50 | 68.2° | 65.8° |
C3 | C4 | C5 | H52 | 1.0° | 0.2° |
C3 | C4 | C11 | H54 | 0.9° | 0.6° |
O18 | C17 | C16 | H57 | 2.0° | 0.1° |
C4 | C11 | C9 | H54 | 180.0° | 180.0° |
C11 | C4 | C5 | C6 | 1.5° | 0.0° |
C4 | C11 | C9 | F10 | 179.3° | 180.0° |
C4 | C11 | C9 | C7 | 1.0° | 0.8° |
C11 | C4 | C3 | H51 | 168.7° | 19.3° |
C11 | C4 | C5 | H52 | 178.5° | 179.8° |
C5 | C4 | C11 | C9 | 1.7° | 0.6° |
C4 | C5 | C6 | H52 | 180.0° | 179.8° |
C4 | C5 | C6 | C7 | 0.6° | 0.2° |
C5 | C4 | C3 | H51 | 13.8° | 160.7° |
C4 | C5 | C6 | H53 | 179.4° | 179.8° |
C5 | C4 | C11 | H54 | 178.3° | 179.4° |
C11 | C9 | F10 | C7 | 179.7° | 179.2° |
C11 | C9 | C7 | C6 | 0.1° | 0.6° |
C11 | C9 | C7 | CL8 | 179.3° | 179.4° |
C5 | C6 | C7 | C9 | 0.1° | 0.1° |
C5 | C6 | C7 | H53 | 180.0° | 180.0° |
C5 | C6 | C7 | CL8 | 179.5° | 180.0° |
F10 | C9 | C7 | C6 | 179.8° | 179.8° |
F10 | C9 | C7 | CL8 | 0.4° | 0.3° |
F10 | C9 | C11 | H54 | 0.7° | 0.0° |
C9 | C7 | C6 | CL8 | 179.5° | 180.0° |
C9 | C7 | C6 | H53 | 179.9° | 180.0° |
C7 | C9 | C11 | H54 | 179.0° | 179.2° |
C7 | C6 | C5 | H52 | 179.4° | 180.0° |
CL8 | C7 | C6 | H53 | 0.5° | 0.0° |
H49 | C2 | C3 | H51 | 167.3° | 65.9° |
H49 | C2 | O1 | H48 | 59.7° | 60.0° |
H50 | C2 | C3 | H51 | 48.0° | 54.2° |
H50 | C2 | O1 | H48 | 59.7° | 60.0° |
H52 | C5 | C6 | H53 | 0.6° | 0.1° |
H55 | C13 | C14 | H56 | 1.1° | 0.3° |
H59 | C21 | C20 | H58 | 1.0° | 0.1° |
H61 | C26 | C27 | H62 | 0.7° | 0.0° |
H68 | C38 | C39 | H69 | 140.6° | 134.0° |
H68 | C38 | C39 | H70 | 23.0° | 106.6° |
H68 | C38 | C45 | H79 | 58.9° | 57.2° |
H68 | C38 | C45 | H80 | 59.0° | 177.7° |
H69 | C39 | C40 | H72 | 149.6° | 75.6° |
H69 | C39 | C40 | H71 | 92.5° | 168.4° |
H70 | C39 | C40 | H72 | 92.9° | 43.8° |
H70 | C39 | C40 | H71 | 25.0° | 72.1° |
H72 | C40 | C41 | H74 | 100.5° | 80.8° |
H72 | C40 | C41 | H73 | 141.0° | 37.3° |
H71 | C40 | C41 | H74 | 17.4° | 163.2° |
H71 | C40 | C41 | H73 | 101.1° | 78.6° |
H75 | C42 | C43 | H76 | 0.3° | 0.3° |
H75 | C42 | C41 | H74 | 3.5° | 143.7° |
H75 | C42 | C41 | H73 | 122.0° | 25.6° |
H76 | C43 | C44 | H77 | 134.1° | 165.1° |
H76 | C43 | C44 | H78 | 15.4° | 44.8° |
H64 | C32 | C33 | H65 | 90.8° | 180.0° |
H64 | C32 | C33 | H66 | 150.0° | 60.0° |
H63 | C32 | C33 | H65 | 150.0° | 60.0° |
H63 | C32 | C33 | H66 | 30.9° | 180.0° |
H65 | C33 | N34 | H67 | 131.4° | 120.0° |
H66 | C33 | N34 | H67 | 109.4° | 120.0° |
H77 | C44 | C45 | H79 | 109.4° | 178.2° |
H77 | C44 | C45 | H80 | 132.6° | 57.7° |
H78 | C44 | C45 | H79 | 9.2° | 57.9° |
H78 | C44 | C45 | H80 | 108.8° | 62.5° |