1T6
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C3 | C10 | doub | 1.38Å | 1.39Å | Aromatic |
C3 | C1 | sing | 1.38Å | 1.38Å | Aromatic |
C10 | C21 | sing | 1.38Å | 1.40Å | Aromatic |
C1 | C2 | doub | 1.38Å | 1.38Å | Aromatic |
C31 | C30 | sing | 1.53Å | 1.55Å | |
C21 | C30 | sing | 1.51Å | 1.54Å | |
C21 | C9 | doub | 1.38Å | 1.40Å | Aromatic |
C2 | C9 | sing | 1.38Å | 1.39Å | Aromatic |
C30 | C28 | sing | 1.53Å | 1.55Å | |
C30 | C23 | sing | 1.51Å | 1.54Å | |
C28 | C29 | sing | 1.53Å | 1.54Å | |
C11 | C4 | doub | 1.38Å | 1.39Å | Aromatic |
C11 | C22 | sing | 1.38Å | 1.38Å | Aromatic |
C4 | C5 | sing | 1.38Å | 1.38Å | Aromatic |
C29 | C22 | sing | 1.51Å | 1.52Å | |
C29 | N33 | sing | 1.47Å | 1.50Å | |
C22 | C13 | doub | 1.38Å | 1.39Å | Aromatic |
C23 | C15 | doub | 1.38Å | 1.40Å | Aromatic |
C23 | C24 | sing | 1.39Å | 1.41Å | Aromatic |
C15 | C19 | sing | 1.39Å | 1.40Å | Aromatic |
C5 | C16 | doub | 1.40Å | 1.39Å | Aromatic |
N32 | C25 | doub | 1.30Å | 1.32Å | |
C13 | C16 | sing | 1.40Å | 1.39Å | Aromatic |
N33 | C24 | sing | 1.40Å | 1.40Å | |
C16 | C17 | sing | 1.48Å | 1.49Å | |
C24 | C12 | doub | 1.39Å | 1.40Å | Aromatic |
C19 | C25 | sing | 1.48Å | 1.54Å | |
C19 | C8 | doub | 1.40Å | 1.39Å | Aromatic |
C25 | N34 | sing | 1.38Å | 1.39Å | |
C6 | C17 | doub | 1.39Å | 1.40Å | Aromatic |
C6 | C7 | sing | 1.38Å | 1.39Å | Aromatic |
C17 | C20 | sing | 1.41Å | 1.40Å | Aromatic |
C12 | C8 | sing | 1.38Å | 1.38Å | Aromatic |
C7 | C18 | doub | 1.40Å | 1.39Å | Aromatic |
C20 | C27 | sing | 1.48Å | 1.49Å | |
C20 | C14 | doub | 1.39Å | 1.40Å | Aromatic |
O37 | C27 | doub | 1.22Å | 1.23Å | |
C27 | O38 | sing | 1.35Å | 1.29Å | |
C18 | C14 | sing | 1.39Å | 1.39Å | Aromatic |
C18 | C26 | sing | 1.48Å | 1.51Å | |
O36 | C26 | doub | 1.22Å | 1.24Å | |
C26 | N35 | sing | 1.35Å | 1.34Å | |
C13 | H51 | sing | 1.08Å | 1.08Å | |
C15 | H53 | sing | 1.08Å | 1.08Å | |
C11 | H49 | sing | 1.08Å | 1.08Å | |
C12 | H50 | sing | 1.08Å | 1.08Å | |
C1 | H39 | sing | 1.08Å | 1.08Å | |
C2 | H40 | sing | 1.08Å | 1.08Å | |
C3 | H41 | sing | 1.08Å | 1.08Å | |
C4 | H42 | sing | 1.08Å | 1.08Å | |
C5 | H43 | sing | 1.08Å | 1.08Å | |
C6 | H44 | sing | 1.08Å | 1.08Å | |
C7 | H45 | sing | 1.08Å | 1.08Å | |
C8 | H46 | sing | 1.08Å | 1.08Å | |
C9 | H47 | sing | 1.08Å | 1.08Å | |
C10 | H48 | sing | 1.08Å | 1.08Å | |
C14 | H52 | sing | 1.08Å | 1.08Å | |
C28 | H54 | sing | 1.09Å | 1.10Å | |
C28 | H55 | sing | 1.09Å | 1.10Å | |
C29 | H56 | sing | 1.09Å | 1.10Å | |
C31 | H59 | sing | 1.09Å | 1.10Å | |
C31 | H58 | sing | 1.09Å | 1.10Å | |
C31 | H57 | sing | 1.09Å | 1.10Å | |
N32 | H60 | sing | 0.97Å | 1.00Å | |
N33 | H61 | sing | 0.97Å | 1.00Å | |
N34 | H63 | sing | 0.97Å | 1.00Å | |
N35 | H64 | sing | 0.97Å | 1.00Å | |
N35 | H65 | sing | 0.97Å | 1.00Å | |
O38 | H66 | sing | 0.97Å | 0.95Å | |
N34 | H62 | sing | 0.97Å | 1.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C10 | C3 | C1 | 120.4° | 120.0° |
C3 | C10 | C21 | 120.9° | 120.0° |
C10 | C3 | H41 | 119.9° | 120.1° |
C3 | C10 | H48 | 119.6° | 120.0° |
C3 | C1 | C2 | 119.6° | 120.0° |
C3 | C1 | H39 | 120.2° | 120.0° |
C1 | C3 | H41 | 119.8° | 120.0° |
C10 | C21 | C30 | 121.8° | 120.0° |
C10 | C21 | C9 | 117.9° | 120.0° |
C21 | C10 | H48 | 119.6° | 120.0° |
C1 | C2 | C9 | 120.5° | 120.0° |
C2 | C1 | H39 | 120.2° | 120.0° |
C1 | C2 | H40 | 119.8° | 119.9° |
C31 | C30 | C21 | 110.9° | 109.3° |
C31 | C30 | C28 | 107.0° | 109.2° |
C31 | C30 | C23 | 110.4° | 109.3° |
C30 | C31 | H59 | 109.5° | 109.5° |
C30 | C31 | H58 | 109.5° | 109.5° |
C30 | C31 | H57 | 109.5° | 109.5° |
C30 | C21 | C9 | 120.2° | 120.0° |
C21 | C30 | C28 | 104.3° | 109.3° |
C21 | C30 | C23 | 112.6° | 109.3° |
C21 | C9 | C2 | 120.8° | 120.0° |
C21 | C9 | H47 | 119.6° | 120.0° |
C9 | C2 | H40 | 119.7° | 120.1° |
C2 | C9 | H47 | 119.6° | 120.0° |
C28 | C30 | C23 | 111.3° | 110.5° |
C30 | C28 | C29 | 111.6° | 108.8° |
C30 | C28 | H54 | 108.9° | 109.6° |
C30 | C28 | H55 | 108.9° | 109.7° |
C30 | C23 | C15 | 120.5° | 118.9° |
C30 | C23 | C24 | 119.6° | 121.4° |
C28 | C29 | C22 | 106.2° | 109.7° |
C28 | C29 | N33 | 107.6° | 107.8° |
C29 | C28 | H54 | 108.9° | 109.6° |
C29 | C28 | H55 | 109.0° | 109.6° |
C28 | C29 | H56 | 110.0° | 109.8° |
C4 | C11 | C22 | 120.5° | 120.3° |
C11 | C4 | C5 | 120.3° | 120.1° |
C4 | C11 | H49 | 119.8° | 119.9° |
C11 | C4 | H42 | 119.8° | 119.9° |
C11 | C22 | C29 | 121.3° | 119.9° |
C11 | C22 | C13 | 118.6° | 120.2° |
C22 | C11 | H49 | 119.8° | 119.9° |
C4 | C5 | C16 | 120.3° | 119.9° |
C5 | C4 | H42 | 119.8° | 119.9° |
C4 | C5 | H43 | 119.9° | 120.1° |
C22 | C29 | N33 | 112.0° | 109.8° |
C29 | C22 | C13 | 120.1° | 119.9° |
C22 | C29 | H56 | 110.3° | 109.8° |
C29 | N33 | C24 | 121.0° | 119.0° |
N33 | C29 | H56 | 110.6° | 109.9° |
C29 | N33 | H61 | 106.5° | 120.5° |
C22 | C13 | C16 | 121.9° | 119.9° |
C22 | C13 | H51 | 119.1° | 120.1° |
C15 | C23 | C24 | 119.1° | 119.7° |
C23 | C15 | C19 | 121.1° | 120.2° |
C23 | C15 | H53 | 119.4° | 119.8° |
C23 | C24 | N33 | 121.1° | 120.8° |
C23 | C24 | C12 | 119.5° | 120.2° |
C15 | C19 | C25 | 120.9° | 120.0° |
C15 | C19 | C8 | 118.8° | 119.9° |
C19 | C15 | H53 | 119.4° | 119.9° |
C5 | C16 | C13 | 118.5° | 119.7° |
C5 | C16 | C17 | 121.2° | 120.1° |
C16 | C5 | H43 | 119.8° | 120.1° |
N32 | C25 | C19 | 122.3° | 120.0° |
N32 | C25 | N34 | 117.4° | 120.0° |
C25 | N32 | H60 | 112.0° | 119.9° |
C13 | C16 | C17 | 120.1° | 120.2° |
C16 | C13 | H51 | 119.1° | 120.0° |
N33 | C24 | C12 | 119.3° | 119.0° |
C24 | N33 | H61 | 106.5° | 120.5° |
C16 | C17 | C6 | 119.8° | 120.1° |
C16 | C17 | C20 | 121.7° | 120.1° |
C24 | C12 | C8 | 120.5° | 120.2° |
C24 | C12 | H50 | 119.8° | 119.9° |
C25 | C19 | C8 | 120.0° | 120.1° |
C19 | C25 | N34 | 120.1° | 120.0° |
C19 | C8 | C12 | 120.8° | 119.8° |
C19 | C8 | H46 | 119.6° | 120.1° |
C25 | N34 | H63 | 120.0° | 120.0° |
C25 | N34 | H62 | 120.0° | 120.0° |
C17 | C6 | C7 | 120.7° | 120.2° |
C6 | C17 | C20 | 118.4° | 119.9° |
C17 | C6 | H44 | 119.6° | 119.9° |
C6 | C7 | C18 | 120.9° | 120.3° |
C7 | C6 | H44 | 119.7° | 119.9° |
C6 | C7 | H45 | 119.5° | 119.9° |
C17 | C20 | C27 | 121.6° | 120.2° |
C17 | C20 | C14 | 120.6° | 119.7° |
C8 | C12 | H50 | 119.7° | 119.9° |
C12 | C8 | H46 | 119.6° | 120.1° |
C7 | C18 | C14 | 118.9° | 120.1° |
C7 | C18 | C26 | 119.0° | 119.9° |
C18 | C7 | H45 | 119.5° | 119.9° |
C27 | C20 | C14 | 117.7° | 120.1° |
C20 | C27 | O37 | 122.1° | 120.0° |
C20 | C27 | O38 | 113.2° | 120.0° |
C20 | C14 | C18 | 120.3° | 119.8° |
C20 | C14 | H52 | 119.8° | 120.1° |
O37 | C27 | O38 | 124.4° | 120.0° |
C27 | O38 | H66 | 109.5° | 117.0° |
C14 | C18 | C26 | 122.1° | 120.0° |
C18 | C14 | H52 | 119.8° | 120.1° |
C18 | C26 | O36 | 119.4° | 120.0° |
C18 | C26 | N35 | 118.4° | 120.0° |
O36 | C26 | N35 | 122.1° | 120.0° |
C26 | N35 | H64 | 120.0° | 120.0° |
C26 | N35 | H65 | 120.0° | 120.0° |
H54 | C28 | H55 | 109.5° | 109.6° |
H59 | C31 | H58 | 109.5° | 109.4° |
H59 | C31 | H57 | 109.5° | 109.5° |
H58 | C31 | H57 | 109.5° | 109.5° |
H63 | N34 | H62 | 120.0° | 120.0° |
H64 | N35 | H65 | 120.0° | 119.9° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C10 | C3 | C1 | H41 | 180.0° | 180.0° |
C3 | C10 | C21 | H48 | 180.0° | 179.9° |
C10 | C3 | C1 | C2 | 0.5° | 0.3° |
C3 | C10 | C21 | C30 | 175.5° | 180.0° |
C3 | C10 | C21 | C9 | 0.4° | 0.3° |
C10 | C3 | C1 | H39 | 179.5° | 180.0° |
C1 | C3 | C10 | C21 | 0.7° | 0.0° |
C3 | C1 | C2 | H39 | 180.0° | 179.8° |
C3 | C1 | C2 | C9 | 0.1° | 0.2° |
C3 | C1 | C2 | H40 | 179.9° | 180.0° |
C1 | C3 | C10 | H48 | 179.3° | 179.9° |
C10 | C21 | C30 | C31 | 15.0° | 179.8° |
C10 | C21 | C30 | C9 | 175.8° | 179.7° |
C10 | C21 | C9 | C2 | 0.2° | 0.3° |
C10 | C21 | C30 | C28 | 99.9° | 60.4° |
C10 | C21 | C30 | C23 | 139.3° | 60.7° |
C21 | C10 | C3 | H41 | 179.3° | 180.0° |
C10 | C21 | C9 | H47 | 179.8° | 179.8° |
C1 | C2 | C9 | C21 | 0.4° | 0.1° |
C1 | C2 | C9 | H40 | 180.0° | 179.8° |
C2 | C1 | C3 | H41 | 179.6° | 179.8° |
C1 | C2 | C9 | H47 | 179.6° | 180.0° |
C31 | C30 | C21 | C28 | 114.9° | 119.4° |
C31 | C30 | C21 | C23 | 124.3° | 119.5° |
C31 | C30 | C21 | C9 | 169.2° | 0.5° |
C31 | C30 | C28 | C23 | 120.7° | 120.2° |
C31 | C30 | C28 | C29 | 70.6° | 69.0° |
C31 | C30 | C23 | C15 | 77.4° | 80.3° |
C31 | C30 | C23 | C24 | 92.5° | 99.5° |
C31 | C30 | C28 | H54 | 49.7° | 171.2° |
C31 | C30 | C28 | H55 | 169.1° | 50.9° |
C30 | C31 | H59 | H58 | 120.0° | 120.0° |
C30 | C31 | H59 | H57 | 120.0° | 120.1° |
C30 | C31 | H58 | H57 | 120.0° | 120.1° |
C30 | C21 | C9 | C2 | 176.1° | 180.0° |
C21 | C30 | C28 | C23 | 121.6° | 120.3° |
C21 | C30 | C28 | C29 | 171.8° | 171.6° |
C21 | C30 | C23 | C15 | 47.2° | 39.2° |
C21 | C30 | C23 | C24 | 142.9° | 141.0° |
C30 | C21 | C9 | H47 | 3.9° | 0.1° |
C30 | C21 | C10 | H48 | 4.5° | 0.1° |
C21 | C30 | C28 | H54 | 67.9° | 51.7° |
C21 | C30 | C28 | H55 | 51.5° | 68.6° |
C21 | C30 | C31 | H59 | 180.0° | 60.0° |
C21 | C30 | C31 | H58 | 60.0° | 180.0° |
C21 | C30 | C31 | H57 | 60.0° | 60.0° |
C21 | C9 | C2 | H47 | 180.0° | 179.9° |
C9 | C21 | C30 | C28 | 75.9° | 119.9° |
C9 | C21 | C30 | C23 | 44.9° | 119.1° |
C21 | C9 | C2 | H40 | 179.6° | 179.7° |
C9 | C21 | C10 | H48 | 179.6° | 179.7° |
C9 | C2 | C1 | H39 | 179.9° | 180.0° |
C30 | C28 | C29 | H54 | 120.3° | 119.8° |
C30 | C28 | C29 | H55 | 120.3° | 119.9° |
C30 | C28 | C29 | C22 | 177.3° | 177.2° |
C30 | C28 | C29 | N33 | 57.2° | 63.2° |
C28 | C30 | C23 | C15 | 163.9° | 159.5° |
C28 | C30 | C23 | C24 | 26.2° | 20.7° |
C30 | C28 | H54 | H55 | 119.0° | 120.4° |
C30 | C28 | C29 | H56 | 63.3° | 56.5° |
C28 | C30 | C31 | H59 | 66.8° | 59.4° |
C28 | C30 | C31 | H58 | 173.2° | 60.5° |
C28 | C30 | C31 | H57 | 53.2° | 179.5° |
C23 | C30 | C28 | C29 | 50.2° | 51.3° |
C30 | C23 | C15 | C24 | 169.9° | 179.8° |
C30 | C23 | C15 | C19 | 168.4° | 179.6° |
C30 | C23 | C24 | N33 | 10.9° | 0.7° |
C30 | C23 | C24 | C12 | 167.1° | 179.5° |
C30 | C23 | C15 | H53 | 11.5° | 0.2° |
C23 | C30 | C28 | H54 | 170.5° | 68.6° |
C23 | C30 | C28 | H55 | 70.2° | 171.1° |
C23 | C30 | C31 | H59 | 54.5° | 179.6° |
C23 | C30 | C31 | H58 | 65.5° | 60.5° |
C23 | C30 | C31 | H57 | 174.5° | 59.5° |
C28 | C29 | C22 | C11 | 111.2° | 80.0° |
C28 | C29 | C22 | N33 | 117.2° | 118.3° |
C28 | C29 | C22 | H56 | 119.2° | 120.8° |
C28 | C29 | N33 | H56 | 120.2° | 119.7° |
C28 | C29 | C22 | C13 | 69.1° | 100.0° |
C28 | C29 | N33 | C24 | 43.0° | 45.0° |
C29 | C28 | H54 | H55 | 119.1° | 120.3° |
C28 | C29 | N33 | H61 | 164.6° | 135.1° |
C4 | C11 | C22 | H49 | 180.0° | 179.7° |
C11 | C4 | C5 | H42 | 180.0° | 179.7° |
C4 | C11 | C22 | C29 | 178.6° | 180.0° |
C4 | C11 | C22 | C13 | 1.1° | 0.1° |
C11 | C4 | C5 | C16 | 0.6° | 0.6° |
C11 | C4 | C5 | H43 | 179.4° | 179.9° |
C22 | C11 | C4 | C5 | 1.0° | 0.3° |
C11 | C22 | C29 | C13 | 179.8° | 179.9° |
C11 | C22 | C29 | N33 | 131.6° | 38.3° |
C11 | C22 | C13 | C16 | 0.9° | 0.1° |
C11 | C22 | C13 | H51 | 179.1° | 179.7° |
C22 | C11 | C4 | H42 | 179.0° | 180.0° |
C11 | C22 | C29 | H56 | 8.0° | 159.2° |
C4 | C5 | C16 | H43 | 180.0° | 179.5° |
C4 | C5 | C16 | C13 | 0.3° | 0.5° |
C4 | C5 | C16 | C17 | 173.7° | 179.5° |
C5 | C4 | C11 | H49 | 179.0° | 180.0° |
C22 | C29 | N33 | H56 | 123.5° | 120.8° |
C29 | C22 | C13 | C16 | 178.9° | 180.0° |
C22 | C29 | N33 | C24 | 159.3° | 164.5° |
C29 | C22 | C13 | H51 | 1.2° | 0.3° |
C29 | C22 | C11 | H49 | 1.4° | 0.3° |
C22 | C29 | C28 | H54 | 62.4° | 63.0° |
C22 | C29 | C28 | H55 | 57.0° | 57.3° |
C22 | C29 | N33 | H61 | 79.0° | 15.6° |
N33 | C29 | C22 | C13 | 48.1° | 141.6° |
C29 | N33 | C24 | C23 | 20.4° | 13.9° |
C29 | N33 | C24 | H61 | 121.6° | 180.0° |
C29 | N33 | C24 | C12 | 157.6° | 166.3° |
N33 | C29 | C28 | H54 | 177.5° | 56.6° |
N33 | C29 | C28 | H55 | 63.1° | 176.9° |
C22 | C13 | C16 | C5 | 0.5° | 0.3° |
C22 | C13 | C16 | H51 | 180.0° | 179.7° |
C22 | C13 | C16 | C17 | 173.6° | 179.7° |
C13 | C22 | C11 | H49 | 178.8° | 179.7° |
C13 | C22 | C29 | H56 | 171.7° | 20.7° |
C23 | C15 | C19 | H53 | 180.0° | 179.8° |
C15 | C23 | C24 | N33 | 179.1° | 179.5° |
C15 | C23 | C24 | C12 | 2.9° | 0.3° |
C23 | C15 | C19 | C25 | 175.4° | 179.7° |
C23 | C15 | C19 | C8 | 0.8° | 0.2° |
C24 | C23 | C15 | C19 | 1.5° | 0.2° |
C23 | C24 | N33 | C12 | 178.0° | 179.8° |
C23 | C24 | C12 | C8 | 2.2° | 0.5° |
C24 | C23 | C15 | H53 | 178.5° | 180.0° |
C23 | C24 | C12 | H50 | 177.8° | 179.8° |
C23 | C24 | N33 | H61 | 142.0° | 166.2° |
C15 | C19 | C25 | N32 | 20.5° | 0.1° |
C15 | C19 | C25 | C8 | 174.6° | 180.0° |
C15 | C19 | C25 | N34 | 165.4° | 180.0° |
C15 | C19 | C8 | C12 | 1.6° | 0.4° |
C15 | C19 | C8 | H46 | 178.4° | 179.9° |
C5 | C16 | C13 | C17 | 174.1° | 180.0° |
C5 | C16 | C17 | C6 | 62.0° | 121.7° |
C5 | C16 | C17 | C20 | 115.2° | 58.3° |
C5 | C16 | C13 | H51 | 179.5° | 180.0° |
C16 | C5 | C4 | H42 | 179.4° | 179.8° |
N32 | C25 | C19 | N34 | 174.2° | 179.9° |
N32 | C25 | C19 | C8 | 165.0° | 180.0° |
N32 | C25 | N34 | H63 | 174.5° | 180.0° |
N32 | C25 | N34 | H62 | 5.5° | 0.1° |
C13 | C16 | C17 | C6 | 124.1° | 58.3° |
C13 | C16 | C17 | C20 | 58.8° | 121.7° |
C13 | C16 | C5 | H43 | 179.7° | 180.0° |
N33 | C24 | C12 | C8 | 179.8° | 179.3° |
N33 | C24 | C12 | H50 | 0.2° | 0.4° |
C24 | N33 | C29 | H56 | 77.2° | 74.7° |
C16 | C17 | C6 | C20 | 177.3° | 180.0° |
C16 | C17 | C6 | C7 | 175.4° | 179.2° |
C16 | C17 | C20 | C27 | 4.1° | 0.1° |
C16 | C17 | C20 | C14 | 175.2° | 179.5° |
C17 | C16 | C13 | H51 | 6.5° | 0.0° |
C17 | C16 | C5 | H43 | 6.3° | 0.0° |
C16 | C17 | C6 | H44 | 4.6° | 0.0° |
C24 | C12 | C8 | C19 | 0.1° | 0.6° |
C24 | C12 | C8 | H50 | 180.0° | 179.7° |
C24 | C12 | C8 | H46 | 179.9° | 180.0° |
C12 | C24 | N33 | H61 | 36.0° | 13.6° |
C25 | C19 | C8 | C12 | 176.3° | 179.5° |
C25 | C19 | C15 | H53 | 4.6° | 0.1° |
C25 | C19 | C8 | H46 | 3.7° | 0.1° |
C19 | C25 | N32 | H60 | 174.3° | 180.0° |
C19 | C25 | N34 | H63 | 0.0° | 0.1° |
C19 | C25 | N34 | H62 | 180.0° | 180.0° |
C8 | C19 | C25 | N34 | 9.2° | 0.0° |
C19 | C8 | C12 | H46 | 180.0° | 179.4° |
C8 | C19 | C15 | H53 | 179.2° | 180.0° |
C19 | C8 | C12 | H50 | 179.9° | 179.7° |
N34 | C25 | N32 | H60 | 0.0° | 0.1° |
C25 | N34 | H63 | H62 | 180.0° | 180.0° |
C17 | C6 | C7 | H44 | 180.0° | 179.2° |
C17 | C6 | C7 | C18 | 0.4° | 0.5° |
C6 | C17 | C20 | C27 | 178.7° | 180.0° |
C6 | C17 | C20 | C14 | 2.1° | 0.6° |
C17 | C6 | C7 | H45 | 179.6° | 179.5° |
C7 | C6 | C17 | C20 | 1.9° | 0.8° |
C6 | C7 | C18 | H45 | 180.0° | 179.9° |
C6 | C7 | C18 | C14 | 2.5° | 0.1° |
C6 | C7 | C18 | C26 | 179.2° | 179.7° |
C17 | C20 | C27 | C14 | 179.3° | 179.4° |
C17 | C20 | C27 | O37 | 62.7° | 7.2° |
C17 | C20 | C27 | O38 | 112.3° | 172.8° |
C17 | C20 | C14 | C18 | 0.0° | 0.0° |
C20 | C17 | C6 | H44 | 178.1° | 180.0° |
C17 | C20 | C14 | H52 | 180.0° | 180.0° |
C7 | C18 | C14 | C20 | 2.3° | 0.3° |
C7 | C18 | C14 | C26 | 178.3° | 179.6° |
C7 | C18 | C26 | O36 | 8.4° | 179.7° |
C7 | C18 | C26 | N35 | 175.3° | 0.4° |
C18 | C7 | C6 | H44 | 179.6° | 179.7° |
C7 | C18 | C14 | H52 | 177.8° | 179.7° |
C20 | C27 | O37 | O38 | 174.4° | 180.0° |
C27 | C20 | C14 | C18 | 179.3° | 179.4° |
C27 | C20 | C14 | H52 | 0.7° | 0.6° |
C20 | C27 | O38 | H66 | 174.8° | 180.0° |
C14 | C20 | C27 | O37 | 116.6° | 173.4° |
C14 | C20 | C27 | O38 | 68.4° | 6.6° |
C20 | C14 | C18 | H52 | 180.0° | 180.0° |
C20 | C14 | C18 | C26 | 179.4° | 179.9° |
O37 | C27 | O38 | H66 | 0.0° | 0.0° |
C14 | C18 | C26 | O36 | 169.9° | 0.1° |
C14 | C18 | C26 | N35 | 6.4° | 180.0° |
C14 | C18 | C7 | H45 | 177.5° | 180.0° |
C18 | C26 | O36 | N35 | 176.2° | 179.9° |
C26 | C18 | C7 | H45 | 0.8° | 0.4° |
C26 | C18 | C14 | H52 | 0.5° | 0.1° |
C18 | C26 | N35 | H64 | 176.2° | 0.1° |
C18 | C26 | N35 | H65 | 3.8° | 180.0° |
O36 | C26 | N35 | H64 | 0.0° | 180.0° |
O36 | C26 | N35 | H65 | 180.0° | 0.1° |
C26 | N35 | H64 | H65 | 180.0° | 179.9° |
H49 | C11 | C4 | H42 | 1.0° | 0.3° |
H50 | C12 | C8 | H46 | 0.1° | 0.3° |
H39 | C1 | C2 | H40 | 0.1° | 0.2° |
H39 | C1 | C3 | H41 | 0.4° | 0.0° |
H40 | C2 | C9 | H47 | 0.4° | 0.2° |
H41 | C3 | C10 | H48 | 0.7° | 0.1° |
H42 | C4 | C5 | H43 | 0.6° | 0.2° |
H44 | C6 | C7 | H45 | 0.4° | 0.2° |
H54 | C28 | C29 | H56 | 57.0° | 176.3° |
H55 | C28 | C29 | H56 | 176.4° | 63.4° |
H56 | C29 | N33 | H61 | 44.5° | 105.3° |
H59 | C31 | H58 | H57 | 120.0° | 120.0° |