67O
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
F39 | C29 | sing | 1.35Å | 1.35Å | |
C29 | C30 | doub | 1.38Å | 1.37Å | Aromatic |
C29 | C28 | sing | 1.39Å | 1.39Å | Aromatic |
C30 | C31 | sing | 1.39Å | 1.39Å | Aromatic |
O38 | C28 | sing | 1.36Å | 1.36Å | |
C28 | C27 | doub | 1.39Å | 1.40Å | Aromatic |
C31 | N33 | sing | 1.41Å | 1.42Å | |
C31 | C32 | doub | 1.39Å | 1.39Å | Aromatic |
C27 | C32 | sing | 1.38Å | 1.40Å | Aromatic |
C27 | C26 | sing | 1.50Å | 1.51Å | |
N33 | C35 | sing | 1.36Å | 1.35Å | |
C26 | N25 | sing | 1.48Å | 1.49Å | |
O24 | C13 | doub | 1.22Å | 1.21Å | |
C35 | O34 | sing | 1.35Å | 1.35Å | |
C35 | O36 | doub | 1.22Å | 1.21Å | |
C9 | C8 | sing | 1.51Å | 1.51Å | |
O34 | C2 | sing | 1.44Å | 1.45Å | |
C13 | N25 | sing | 1.36Å | 1.35Å | |
C13 | C10 | sing | 1.51Å | 1.49Å | |
N25 | C37 | sing | 1.46Å | 1.46Å | |
C7 | C8 | doub | 1.39Å | 1.39Å | Aromatic |
C7 | C6 | sing | 1.38Å | 1.39Å | Aromatic |
C8 | C3 | sing | 1.38Å | 1.41Å | Aromatic |
C2 | C1 | sing | 1.53Å | 1.55Å | |
N12 | C10 | sing | 1.46Å | 1.45Å | |
N12 | C14 | sing | 1.39Å | 1.40Å | |
C10 | C6 | sing | 1.51Å | 1.53Å | |
C6 | C5 | doub | 1.39Å | 1.39Å | Aromatic |
C1 | C3 | sing | 1.51Å | 1.53Å | |
C1 | C11 | sing | 1.53Å | 1.53Å | |
C3 | C4 | doub | 1.38Å | 1.39Å | Aromatic |
C19 | C14 | doub | 1.40Å | 1.39Å | Aromatic |
C19 | C18 | sing | 1.36Å | 1.36Å | Aromatic |
C14 | C15 | sing | 1.38Å | 1.38Å | Aromatic |
C5 | C4 | sing | 1.38Å | 1.38Å | Aromatic |
C18 | C17 | doub | 1.40Å | 1.42Å | Aromatic |
C15 | C16 | doub | 1.40Å | 1.42Å | Aromatic |
C17 | C16 | sing | 1.42Å | 1.43Å | Aromatic |
C17 | C23 | sing | 1.41Å | 1.45Å | Aromatic |
C16 | C20 | sing | 1.41Å | 1.42Å | Aromatic |
N40 | C23 | sing | 1.38Å | 1.35Å | |
C23 | N22 | doub | 1.32Å | 1.40Å | Aromatic |
C20 | C21 | doub | 1.36Å | 1.37Å | Aromatic |
N22 | C21 | sing | 1.33Å | 1.34Å | Aromatic |
C18 | H56 | sing | 1.08Å | 1.08Å | |
C15 | H55 | sing | 1.08Å | 1.08Å | |
C19 | H57 | sing | 1.08Å | 1.08Å | |
C20 | H58 | sing | 1.08Å | 1.08Å | |
C21 | H59 | sing | 1.08Å | 1.08Å | |
C11 | H53 | sing | 1.09Å | 1.10Å | |
C11 | H52 | sing | 1.09Å | 1.10Å | |
C11 | H51 | sing | 1.09Å | 1.10Å | |
C1 | H41 | sing | 1.09Å | 1.10Å | |
C2 | H42 | sing | 1.09Å | 1.10Å | |
C2 | H43 | sing | 1.09Å | 1.10Å | |
C4 | H44 | sing | 1.08Å | 1.08Å | |
C5 | H45 | sing | 1.08Å | 1.08Å | |
C7 | H46 | sing | 1.08Å | 1.08Å | |
C9 | H49 | sing | 1.09Å | 1.10Å | |
C9 | H48 | sing | 1.09Å | 1.10Å | |
C9 | H47 | sing | 1.09Å | 1.10Å | |
C10 | H50 | sing | 1.11Å | 1.10Å | |
N12 | H54 | sing | 0.97Å | 1.00Å | |
C26 | H61 | sing | 1.09Å | 1.10Å | |
C26 | H60 | sing | 1.09Å | 1.10Å | |
C30 | H62 | sing | 1.08Å | 1.08Å | |
C32 | H63 | sing | 1.08Å | 1.08Å | |
N33 | H64 | sing | 0.98Å | 1.00Å | |
C37 | H67 | sing | 1.09Å | 1.10Å | |
C37 | H66 | sing | 1.09Å | 1.10Å | |
C37 | H65 | sing | 1.09Å | 1.10Å | |
O38 | H68 | sing | 0.97Å | 0.95Å | |
N40 | H70 | sing | 0.97Å | 1.00Å | |
N40 | H69 | sing | 0.97Å | 1.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
F39 | C29 | C30 | 118.9° | 120.1° |
F39 | C29 | C28 | 117.0° | 120.1° |
C30 | C29 | C28 | 124.1° | 119.8° |
C29 | C30 | C31 | 117.8° | 120.1° |
C29 | C30 | H62 | 121.1° | 119.9° |
C29 | C28 | O38 | 121.0° | 119.8° |
C29 | C28 | C27 | 118.0° | 120.4° |
C30 | C31 | N33 | 120.2° | 118.2° |
C30 | C31 | C32 | 119.8° | 119.7° |
C31 | C30 | H62 | 121.1° | 119.9° |
O38 | C28 | C27 | 120.8° | 119.8° |
C28 | O38 | H68 | 109.5° | 114.0° |
C28 | C27 | C32 | 118.6° | 119.4° |
C28 | C27 | C26 | 120.6° | 118.5° |
N33 | C31 | C32 | 119.9° | 122.0° |
C31 | N33 | C35 | 125.9° | 119.3° |
C31 | N33 | H64 | 117.1° | 120.4° |
C31 | C32 | C27 | 121.7° | 120.5° |
C31 | C32 | H63 | 119.1° | 119.6° |
C32 | C27 | C26 | 120.8° | 122.1° |
C27 | C32 | H63 | 119.2° | 119.9° |
C27 | C26 | N25 | 113.5° | 110.8° |
C27 | C26 | H61 | 108.5° | 109.5° |
C27 | C26 | H60 | 108.4° | 109.3° |
N33 | C35 | O34 | 109.8° | 116.9° |
N33 | C35 | O36 | 125.7° | 121.9° |
C35 | N33 | H64 | 117.1° | 120.3° |
C26 | N25 | C13 | 118.3° | 115.0° |
C26 | N25 | C37 | 116.6° | 120.4° |
N25 | C26 | H61 | 108.4° | 108.7° |
N25 | C26 | H60 | 108.5° | 109.5° |
O24 | C13 | N25 | 121.1° | 118.9° |
O24 | C13 | C10 | 118.2° | 118.5° |
O34 | C35 | O36 | 124.4° | 121.2° |
C35 | O34 | C2 | 117.3° | 119.5° |
C9 | C8 | C7 | 118.4° | 118.4° |
C9 | C8 | C3 | 122.5° | 121.3° |
C8 | C9 | H49 | 109.5° | 109.5° |
C8 | C9 | H48 | 109.5° | 109.5° |
C8 | C9 | H47 | 109.5° | 109.5° |
O34 | C2 | C1 | 109.8° | 111.5° |
O34 | C2 | H42 | 109.4° | 109.4° |
O34 | C2 | H43 | 109.4° | 109.0° |
N25 | C13 | C10 | 120.6° | 122.6° |
C13 | N25 | C37 | 125.0° | 124.6° |
C13 | C10 | N12 | 108.8° | 111.9° |
C13 | C10 | C6 | 109.6° | 109.0° |
C13 | C10 | H50 | 108.6° | 108.0° |
N25 | C37 | H67 | 109.5° | 109.4° |
N25 | C37 | H66 | 109.5° | 109.4° |
N25 | C37 | H65 | 109.4° | 109.5° |
C8 | C7 | C6 | 121.9° | 120.4° |
C7 | C8 | C3 | 119.0° | 120.3° |
C8 | C7 | H46 | 119.1° | 118.5° |
C7 | C6 | C10 | 120.2° | 122.0° |
C7 | C6 | C5 | 118.4° | 119.4° |
C6 | C7 | H46 | 119.1° | 121.1° |
C8 | C3 | C1 | 121.3° | 120.7° |
C8 | C3 | C4 | 118.9° | 119.2° |
C2 | C1 | C3 | 112.4° | 109.2° |
C2 | C1 | C11 | 109.3° | 109.7° |
C2 | C1 | H41 | 107.0° | 109.0° |
C1 | C2 | H42 | 109.4° | 109.5° |
C1 | C2 | H43 | 109.4° | 108.9° |
C10 | N12 | C14 | 124.9° | 120.0° |
N12 | C10 | C6 | 112.3° | 112.0° |
N12 | C10 | H50 | 109.2° | 108.0° |
C10 | N12 | H54 | 105.4° | 120.0° |
N12 | C14 | C19 | 118.7° | 119.7° |
N12 | C14 | C15 | 121.7° | 119.6° |
C14 | N12 | H54 | 105.5° | 120.0° |
C10 | C6 | C5 | 121.4° | 118.6° |
C6 | C10 | H50 | 108.2° | 107.8° |
C6 | C5 | C4 | 120.8° | 120.4° |
C6 | C5 | H45 | 119.6° | 119.7° |
C3 | C1 | C11 | 113.3° | 110.8° |
C1 | C3 | C4 | 119.7° | 120.1° |
C3 | C1 | H41 | 107.2° | 110.4° |
C1 | C11 | H53 | 109.5° | 109.5° |
C1 | C11 | H52 | 109.4° | 109.5° |
C1 | C11 | H51 | 109.5° | 109.5° |
C11 | C1 | H41 | 107.2° | 107.7° |
C3 | C4 | C5 | 120.9° | 120.3° |
C3 | C4 | H44 | 119.6° | 121.3° |
C14 | C19 | C18 | 121.2° | 120.9° |
C19 | C14 | C15 | 119.6° | 120.7° |
C14 | C19 | H57 | 119.4° | 119.5° |
C19 | C18 | C17 | 121.4° | 119.8° |
C19 | C18 | H56 | 119.3° | 120.1° |
C18 | C19 | H57 | 119.4° | 119.5° |
C14 | C15 | C16 | 120.9° | 119.3° |
C14 | C15 | H55 | 119.6° | 120.4° |
C5 | C4 | H44 | 119.5° | 118.3° |
C4 | C5 | H45 | 119.6° | 119.9° |
C18 | C17 | C16 | 117.9° | 119.6° |
C18 | C17 | C23 | 124.7° | 121.9° |
C17 | C18 | H56 | 119.3° | 120.1° |
C15 | C16 | C17 | 119.0° | 119.6° |
C15 | C16 | C20 | 122.0° | 122.1° |
C16 | C15 | H55 | 119.5° | 120.3° |
C16 | C17 | C23 | 117.4° | 118.5° |
C17 | C16 | C20 | 119.0° | 118.3° |
C17 | C23 | N40 | 121.4° | 120.1° |
C17 | C23 | N22 | 121.2° | 119.7° |
C16 | C20 | C21 | 119.8° | 118.8° |
C16 | C20 | H58 | 120.1° | 120.5° |
N40 | C23 | N22 | 117.3° | 120.2° |
C23 | N40 | H70 | 109.5° | 120.0° |
C23 | N40 | H69 | 109.5° | 120.0° |
C23 | N22 | C21 | 118.4° | 122.7° |
C20 | C21 | N22 | 124.2° | 122.0° |
C21 | C20 | H58 | 120.1° | 120.6° |
C20 | C21 | H59 | 117.9° | 119.0° |
N22 | C21 | H59 | 117.9° | 119.0° |
H53 | C11 | H52 | 109.5° | 109.5° |
H53 | C11 | H51 | 109.5° | 109.5° |
H52 | C11 | H51 | 109.5° | 109.5° |
H42 | C2 | H43 | 109.5° | 108.5° |
H49 | C9 | H48 | 109.4° | 109.5° |
H49 | C9 | H47 | 109.4° | 109.4° |
H48 | C9 | H47 | 109.5° | 109.5° |
H61 | C26 | H60 | 109.5° | 109.0° |
H67 | C37 | H66 | 109.5° | 109.5° |
H67 | C37 | H65 | 109.4° | 109.5° |
H66 | C37 | H65 | 109.5° | 109.5° |
H70 | N40 | H69 | 109.4° | 120.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
F39 | C29 | C30 | C28 | 178.2° | 180.0° |
F39 | C29 | C30 | C31 | 176.9° | 179.1° |
F39 | C29 | C28 | O38 | 7.7° | 0.2° |
F39 | C29 | C28 | C27 | 176.4° | 179.8° |
F39 | C29 | C30 | H62 | 3.1° | 0.7° |
C29 | C30 | C31 | H62 | 180.0° | 179.8° |
C30 | C29 | C28 | O38 | 174.1° | 179.8° |
C30 | C29 | C28 | C27 | 1.8° | 0.2° |
C29 | C30 | C31 | N33 | 176.2° | 179.6° |
C29 | C30 | C31 | C32 | 0.6° | 1.8° |
C28 | C29 | C30 | C31 | 1.3° | 0.9° |
C29 | C28 | O38 | C27 | 175.8° | 180.0° |
C29 | C28 | C27 | C32 | 0.4° | 0.4° |
C29 | C28 | C27 | C26 | 178.5° | 179.1° |
C28 | C29 | C30 | H62 | 178.7° | 179.4° |
C29 | C28 | O38 | H68 | 180.0° | 90.0° |
C30 | C31 | N33 | C32 | 176.8° | 178.5° |
C30 | C31 | C32 | C27 | 1.9° | 1.7° |
C30 | C31 | N33 | C35 | 141.1° | 152.4° |
C30 | C31 | C32 | H63 | 178.1° | 177.1° |
C30 | C31 | N33 | H64 | 38.9° | 27.5° |
O38 | C28 | C27 | C32 | 175.4° | 179.7° |
O38 | C28 | C27 | C26 | 2.6° | 0.9° |
C28 | C27 | C32 | C31 | 1.4° | 0.6° |
C28 | C27 | C32 | C26 | 178.0° | 179.4° |
C28 | C27 | C26 | N25 | 170.8° | 156.7° |
C28 | C27 | C26 | H61 | 50.2° | 36.8° |
C28 | C27 | C26 | H60 | 68.6° | 82.5° |
C28 | C27 | C32 | H63 | 178.7° | 178.2° |
C27 | C28 | O38 | H68 | 4.2° | 90.0° |
N33 | C31 | C32 | C27 | 174.9° | 179.8° |
C31 | N33 | C35 | H64 | 180.0° | 179.9° |
C31 | N33 | C35 | O34 | 169.8° | 168.3° |
C31 | N33 | C35 | O36 | 6.5° | 13.0° |
N33 | C31 | C30 | H62 | 3.8° | 0.1° |
N33 | C31 | C32 | H63 | 5.1° | 1.4° |
C31 | C32 | C27 | H63 | 180.0° | 178.8° |
C31 | C32 | C27 | C26 | 176.7° | 180.0° |
C32 | C31 | N33 | C35 | 35.7° | 29.1° |
C32 | C31 | C30 | H62 | 179.4° | 178.4° |
C32 | C31 | N33 | H64 | 144.3° | 151.0° |
C32 | C27 | C26 | N25 | 11.2° | 23.8° |
C32 | C27 | C26 | H61 | 131.8° | 143.7° |
C32 | C27 | C26 | H60 | 109.4° | 96.9° |
C27 | C26 | N25 | H61 | 120.6° | 120.4° |
C27 | C26 | N25 | H60 | 120.6° | 120.6° |
C27 | C26 | N25 | C13 | 75.4° | 117.0° |
C27 | C26 | N25 | C37 | 102.4° | 63.1° |
C27 | C26 | H61 | H60 | 118.2° | 119.5° |
C26 | C27 | C32 | H63 | 3.3° | 1.3° |
N33 | C35 | O34 | O36 | 176.4° | 178.7° |
N33 | C35 | O34 | C2 | 168.4° | 169.1° |
C26 | N25 | C13 | O24 | 3.1° | 11.7° |
C26 | N25 | C13 | C37 | 177.6° | 179.9° |
C26 | N25 | C13 | C10 | 171.9° | 168.7° |
N25 | C26 | H61 | H60 | 118.2° | 119.3° |
C26 | N25 | C37 | H67 | 180.0° | 179.9° |
C26 | N25 | C37 | H66 | 60.0° | 60.1° |
C26 | N25 | C37 | H65 | 60.0° | 59.9° |
O24 | C13 | N25 | C10 | 175.0° | 179.7° |
O24 | C13 | N25 | C37 | 179.3° | 168.2° |
O24 | C13 | C10 | N12 | 25.6° | 117.9° |
O24 | C13 | C10 | C6 | 97.5° | 117.6° |
O24 | C13 | C10 | H50 | 144.4° | 0.8° |
C35 | O34 | C2 | C1 | 97.1° | 91.0° |
C35 | O34 | C2 | H42 | 23.0° | 30.2° |
C35 | O34 | C2 | H43 | 142.8° | 148.7° |
O34 | C35 | N33 | H64 | 10.2° | 11.8° |
O36 | C35 | O34 | C2 | 8.0° | 9.6° |
O36 | C35 | N33 | H64 | 173.4° | 166.9° |
C9 | C8 | C7 | C3 | 176.4° | 179.7° |
C9 | C8 | C7 | C6 | 174.6° | 179.4° |
C9 | C8 | C3 | C1 | 11.3° | 0.1° |
C9 | C8 | C3 | C4 | 172.9° | 179.2° |
C9 | C8 | C7 | H46 | 5.5° | 0.6° |
C8 | C9 | H49 | H48 | 120.0° | 120.0° |
C8 | C9 | H49 | H47 | 120.0° | 120.0° |
C8 | C9 | H48 | H47 | 120.0° | 120.0° |
O34 | C2 | C1 | H42 | 120.1° | 121.2° |
O34 | C2 | C1 | H43 | 120.0° | 120.3° |
O34 | C2 | C1 | C3 | 57.9° | 62.5° |
O34 | C2 | C1 | C11 | 175.4° | 59.1° |
O34 | C2 | C1 | H41 | 59.6° | 176.8° |
O34 | C2 | H42 | H43 | 119.8° | 118.8° |
N25 | C13 | C10 | N12 | 159.2° | 61.8° |
N25 | C13 | C10 | C6 | 77.6° | 62.7° |
N25 | C13 | C10 | H50 | 40.4° | 179.5° |
C13 | N25 | C26 | H61 | 45.2° | 122.6° |
C13 | N25 | C26 | H60 | 164.0° | 3.6° |
C13 | N25 | C37 | H67 | 2.3° | 0.0° |
C13 | N25 | C37 | H66 | 122.4° | 120.0° |
C13 | N25 | C37 | H65 | 117.6° | 120.0° |
C10 | C13 | N25 | C37 | 5.7° | 11.5° |
C13 | C10 | C6 | C7 | 62.9° | 127.6° |
C13 | C10 | N12 | C6 | 121.5° | 122.7° |
C13 | C10 | N12 | H50 | 118.4° | 118.7° |
C13 | C10 | N12 | C14 | 158.0° | 85.0° |
C13 | C10 | C6 | H50 | 118.3° | 117.0° |
C13 | C10 | C6 | C5 | 115.7° | 52.2° |
C13 | C10 | N12 | H54 | 79.9° | 94.9° |
C37 | N25 | C26 | H61 | 137.0° | 57.3° |
C37 | N25 | C26 | H60 | 18.2° | 176.2° |
N25 | C37 | H67 | H66 | 120.0° | 119.9° |
N25 | C37 | H67 | H65 | 120.0° | 120.0° |
N25 | C37 | H66 | H65 | 120.0° | 120.0° |
C8 | C7 | C6 | H46 | 180.0° | 180.0° |
C8 | C7 | C6 | C10 | 177.7° | 179.4° |
C8 | C7 | C6 | C5 | 1.0° | 0.4° |
C7 | C8 | C3 | C1 | 172.5° | 179.7° |
C7 | C8 | C3 | C4 | 3.3° | 0.5° |
C7 | C8 | C9 | H49 | 88.3° | 90.0° |
C7 | C8 | C9 | H48 | 151.8° | 150.0° |
C7 | C8 | C9 | H47 | 31.7° | 30.0° |
C6 | C7 | C8 | C3 | 1.8° | 0.3° |
C7 | C6 | C10 | N12 | 58.1° | 3.2° |
C7 | C6 | C10 | C5 | 178.6° | 179.8° |
C7 | C6 | C5 | C4 | 2.2° | 0.7° |
C7 | C6 | C5 | H45 | 177.8° | 179.5° |
C7 | C6 | C10 | H50 | 178.8° | 115.5° |
C8 | C3 | C1 | C2 | 91.4° | 90.0° |
C8 | C3 | C1 | C4 | 175.8° | 179.3° |
C8 | C3 | C1 | C11 | 144.0° | 149.0° |
C8 | C3 | C4 | C5 | 2.1° | 0.8° |
C8 | C3 | C1 | H41 | 25.9° | 29.8° |
C8 | C3 | C4 | H44 | 177.9° | 178.5° |
C3 | C8 | C7 | H46 | 178.2° | 179.7° |
C3 | C8 | C9 | H49 | 87.9° | 90.3° |
C3 | C8 | C9 | H48 | 32.0° | 29.7° |
C3 | C8 | C9 | H47 | 152.1° | 149.7° |
C2 | C1 | C3 | C11 | 124.6° | 121.0° |
C2 | C1 | C3 | H41 | 117.3° | 119.8° |
C2 | C1 | C11 | H41 | 115.7° | 118.5° |
C2 | C1 | C3 | C4 | 84.3° | 89.3° |
C2 | C1 | C11 | H53 | 180.0° | 60.6° |
C2 | C1 | C11 | H52 | 60.0° | 59.4° |
C2 | C1 | C11 | H51 | 60.0° | 179.4° |
C1 | C2 | H42 | H43 | 119.9° | 118.8° |
C10 | N12 | C14 | H54 | 122.1° | 179.9° |
N12 | C10 | C6 | H50 | 120.7° | 118.7° |
N12 | C10 | C6 | C5 | 123.3° | 176.6° |
C10 | N12 | C14 | C19 | 169.8° | 0.1° |
C10 | N12 | C14 | C15 | 10.8° | 179.6° |
C14 | N12 | C10 | C6 | 80.5° | 152.3° |
N12 | C14 | C19 | C15 | 179.4° | 179.5° |
N12 | C14 | C19 | C18 | 179.9° | 180.0° |
N12 | C14 | C15 | C16 | 178.2° | 179.7° |
N12 | C14 | C15 | H55 | 1.8° | 0.2° |
N12 | C14 | C19 | H57 | 0.1° | 0.5° |
C14 | N12 | C10 | H50 | 39.6° | 33.7° |
C10 | C6 | C5 | C4 | 176.4° | 179.1° |
C10 | C6 | C5 | H45 | 3.6° | 0.7° |
C10 | C6 | C7 | H46 | 2.3° | 0.6° |
C6 | C10 | N12 | H54 | 41.6° | 27.8° |
C6 | C5 | C4 | C3 | 0.7° | 0.9° |
C6 | C5 | C4 | H45 | 180.0° | 179.8° |
C6 | C5 | C4 | H44 | 179.3° | 178.4° |
C5 | C6 | C7 | H46 | 179.1° | 179.6° |
C5 | C6 | C10 | H50 | 2.6° | 64.8° |
C3 | C1 | C11 | H41 | 118.1° | 120.9° |
C1 | C3 | C4 | C5 | 173.8° | 179.9° |
C3 | C1 | C11 | H53 | 53.8° | 60.0° |
C3 | C1 | C11 | H52 | 66.2° | 180.0° |
C3 | C1 | C11 | H51 | 173.8° | 60.0° |
C3 | C1 | C2 | H42 | 62.2° | 58.7° |
C3 | C1 | C2 | H43 | 177.9° | 177.2° |
C1 | C3 | C4 | H44 | 6.2° | 0.8° |
C11 | C1 | C3 | C4 | 40.2° | 31.7° |
C1 | C11 | H53 | H52 | 120.0° | 120.0° |
C1 | C11 | H53 | H51 | 120.0° | 120.0° |
C1 | C11 | H52 | H51 | 120.0° | 120.0° |
C11 | C1 | C2 | H42 | 64.6° | 179.7° |
C11 | C1 | C2 | H43 | 55.3° | 61.2° |
C3 | C4 | C5 | H44 | 180.0° | 179.3° |
C4 | C3 | C1 | H41 | 158.3° | 151.0° |
C3 | C4 | C5 | H45 | 179.3° | 179.3° |
C14 | C19 | C18 | H57 | 180.0° | 179.4° |
C14 | C19 | C18 | C17 | 1.7° | 0.5° |
C19 | C14 | C15 | C16 | 1.3° | 0.2° |
C14 | C19 | C18 | H56 | 178.4° | 179.7° |
C19 | C14 | C15 | H55 | 178.8° | 179.7° |
C19 | C14 | N12 | H54 | 47.7° | 180.0° |
C18 | C19 | C14 | C15 | 0.7° | 0.5° |
C19 | C18 | C17 | H56 | 180.0° | 179.8° |
C19 | C18 | C17 | C16 | 0.7° | 0.3° |
C19 | C18 | C17 | C23 | 178.7° | 179.7° |
C14 | C15 | C16 | H55 | 180.0° | 180.0° |
C14 | C15 | C16 | C17 | 2.1° | 0.0° |
C14 | C15 | C16 | C20 | 177.9° | 179.9° |
C15 | C14 | C19 | H57 | 179.3° | 179.9° |
C15 | C14 | N12 | H54 | 132.9° | 0.5° |
C18 | C17 | C16 | C15 | 1.2° | 0.0° |
C18 | C17 | C16 | C23 | 179.4° | 180.0° |
C18 | C17 | C16 | C20 | 178.9° | 180.0° |
C18 | C17 | C23 | N40 | 1.4° | 0.0° |
C18 | C17 | C23 | N22 | 178.9° | 180.0° |
C17 | C18 | C19 | H57 | 178.3° | 180.0° |
C15 | C16 | C17 | C20 | 179.9° | 179.9° |
C15 | C16 | C17 | C23 | 179.4° | 180.0° |
C15 | C16 | C20 | C21 | 179.4° | 180.0° |
C15 | C16 | C20 | H58 | 0.7° | 0.1° |
C16 | C17 | C23 | N40 | 179.3° | 179.9° |
C16 | C17 | C23 | N22 | 0.5° | 0.0° |
C17 | C16 | C20 | C21 | 0.6° | 0.1° |
C16 | C17 | C18 | H56 | 179.3° | 179.9° |
C17 | C16 | C15 | H55 | 177.9° | 180.0° |
C17 | C16 | C20 | H58 | 179.4° | 180.0° |
C23 | C17 | C16 | C20 | 0.5° | 0.0° |
C17 | C23 | N40 | N22 | 179.8° | 180.0° |
C17 | C23 | N22 | C21 | 0.6° | 0.0° |
C23 | C17 | C18 | H56 | 1.3° | 0.1° |
C17 | C23 | N40 | H70 | 179.8° | 0.0° |
C17 | C23 | N40 | H69 | 59.8° | 180.0° |
C16 | C20 | C21 | H58 | 180.0° | 180.0° |
C16 | C20 | C21 | N22 | 0.6° | 0.1° |
C20 | C16 | C15 | H55 | 2.0° | 0.1° |
C16 | C20 | C21 | H59 | 179.3° | 180.0° |
N40 | C23 | N22 | C21 | 179.2° | 180.0° |
C23 | N40 | H70 | H69 | 120.0° | 180.0° |
C23 | N22 | C21 | C20 | 0.6° | 0.0° |
C23 | N22 | C21 | H59 | 179.3° | 180.0° |
N22 | C23 | N40 | H70 | 0.0° | 180.0° |
N22 | C23 | N40 | H69 | 120.0° | 0.0° |
C20 | C21 | N22 | H59 | 180.0° | 180.0° |
N22 | C21 | C20 | H58 | 179.3° | 180.0° |
H56 | C18 | C19 | H57 | 1.6° | 0.3° |
H58 | C20 | C21 | H59 | 0.7° | 0.0° |
H53 | C11 | H52 | H51 | 120.0° | 120.0° |
H53 | C11 | C1 | H41 | 64.3° | 179.1° |
H52 | C11 | C1 | H41 | 175.7° | 59.1° |
H51 | C11 | C1 | H41 | 55.7° | 60.9° |
H41 | C1 | C2 | H42 | 179.7° | 62.0° |
H41 | C1 | C2 | H43 | 60.4° | 56.5° |
H44 | C4 | C5 | H45 | 0.7° | 1.4° |
H49 | C9 | H48 | H47 | 120.0° | 120.0° |
H50 | C10 | N12 | H54 | 161.7° | 146.4° |
H67 | C37 | H66 | H65 | 120.0° | 120.0° |