J20
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O41 | C40 | doub | 1.21Å | 1.23Å | |
C40 | C12 | sing | 1.46Å | 1.49Å | |
C11 | C12 | doub | 1.40Å | 1.40Å | Aromatic |
C11 | C10 | sing | 1.36Å | 1.39Å | Aromatic |
C12 | C13 | sing | 1.42Å | 1.41Å | Aromatic |
C10 | C7 | doub | 1.40Å | 1.39Å | Aromatic |
C13 | C16 | sing | 1.43Å | 1.29Å | |
C13 | C8 | doub | 1.39Å | 1.40Å | Aromatic |
C7 | C8 | sing | 1.39Å | 1.39Å | Aromatic |
C7 | C4 | sing | 1.48Å | 1.38Å | |
C16 | C17 | trip | 1.17Å | 1.19Å | |
C23 | C22 | doub | 1.38Å | 1.39Å | Aromatic |
C23 | C18 | sing | 1.40Å | 1.39Å | Aromatic |
C8 | C9 | sing | 1.51Å | 1.51Å | |
C17 | C18 | sing | 1.43Å | 1.29Å | |
C22 | C21 | sing | 1.39Å | 1.39Å | Aromatic |
C3 | C4 | doub | 1.40Å | 1.39Å | Aromatic |
C3 | C2 | sing | 1.38Å | 1.40Å | Aromatic |
C4 | C5 | sing | 1.39Å | 1.38Å | Aromatic |
C18 | C19 | doub | 1.40Å | 1.39Å | Aromatic |
C29 | C30 | doub | 1.38Å | 1.39Å | Aromatic |
C29 | C14 | sing | 1.38Å | 1.39Å | Aromatic |
C30 | C31 | sing | 1.39Å | 1.39Å | Aromatic |
C21 | O39 | sing | 1.36Å | 1.36Å | |
C21 | C20 | doub | 1.39Å | 1.39Å | Aromatic |
C2 | C1 | doub | 1.39Å | 1.40Å | Aromatic |
C9 | C5 | sing | 1.51Å | 1.50Å | |
C9 | C14 | sing | 1.51Å | 1.52Å | |
C9 | C15 | sing | 1.51Å | 1.52Å | |
C5 | C6 | doub | 1.38Å | 1.39Å | Aromatic |
C19 | C20 | sing | 1.38Å | 1.40Å | Aromatic |
C14 | C33 | doub | 1.38Å | 1.40Å | Aromatic |
C15 | C28 | doub | 1.38Å | 1.40Å | Aromatic |
C15 | C24 | sing | 1.38Å | 1.39Å | Aromatic |
C38 | O34 | sing | 1.43Å | 1.43Å | |
C28 | C27 | sing | 1.38Å | 1.39Å | Aromatic |
C31 | O34 | sing | 1.36Å | 1.37Å | |
C31 | C32 | doub | 1.39Å | 1.39Å | Aromatic |
C24 | C25 | doub | 1.38Å | 1.39Å | Aromatic |
C1 | C6 | sing | 1.39Å | 1.39Å | Aromatic |
C1 | O37 | sing | 1.36Å | 1.36Å | |
C27 | C26 | doub | 1.39Å | 1.38Å | Aromatic |
C33 | C32 | sing | 1.38Å | 1.39Å | Aromatic |
C25 | C26 | sing | 1.39Å | 1.39Å | Aromatic |
C26 | O35 | sing | 1.36Å | 1.37Å | |
C36 | O35 | sing | 1.43Å | 1.42Å | |
C40 | H1 | sing | 1.08Å | 1.08Å | |
C19 | H2 | sing | 1.08Å | 1.08Å | |
C20 | H3 | sing | 1.08Å | 1.08Å | |
O39 | H4 | sing | 0.97Å | 0.95Å | |
C22 | H5 | sing | 1.08Å | 1.08Å | |
C23 | H6 | sing | 1.08Å | 1.08Å | |
C10 | H7 | sing | 1.08Å | 1.08Å | |
C11 | H8 | sing | 1.08Å | 1.08Å | |
C6 | H9 | sing | 1.08Å | 1.08Å | |
O37 | H10 | sing | 0.97Å | 0.95Å | |
C2 | H11 | sing | 1.08Å | 1.08Å | |
C3 | H12 | sing | 1.08Å | 1.08Å | |
C29 | H13 | sing | 1.08Å | 1.08Å | |
C30 | H14 | sing | 1.08Å | 1.08Å | |
C38 | H15 | sing | 1.09Å | 1.10Å | |
C38 | H16 | sing | 1.09Å | 1.10Å | |
C38 | H17 | sing | 1.09Å | 1.10Å | |
C32 | H18 | sing | 1.08Å | 1.08Å | |
C33 | H19 | sing | 1.08Å | 1.08Å | |
C24 | H20 | sing | 1.08Å | 1.08Å | |
C25 | H21 | sing | 1.08Å | 1.08Å | |
C36 | H22 | sing | 1.09Å | 1.10Å | |
C36 | H23 | sing | 1.09Å | 1.10Å | |
C36 | H24 | sing | 1.09Å | 1.10Å | |
C27 | H25 | sing | 1.08Å | 1.08Å | |
C28 | H26 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O41 | C40 | C12 | 120.1° | 120.0° |
O41 | C40 | H1 | 120.0° | 119.9° |
C40 | C12 | C11 | 118.4° | 120.3° |
C40 | C12 | C13 | 121.3° | 120.2° |
C12 | C40 | H1 | 120.0° | 120.1° |
C12 | C11 | C10 | 120.3° | 120.4° |
C11 | C12 | C13 | 120.3° | 119.5° |
C12 | C11 | H8 | 119.9° | 119.8° |
C11 | C10 | C7 | 118.6° | 120.8° |
C11 | C10 | H7 | 120.7° | 119.6° |
C10 | C11 | H8 | 119.9° | 119.9° |
C12 | C13 | C16 | 121.5° | 120.3° |
C12 | C13 | C8 | 119.6° | 119.4° |
C10 | C7 | C8 | 122.8° | 119.7° |
C10 | C7 | C4 | 126.7° | 130.9° |
C7 | C10 | H7 | 120.7° | 119.6° |
C16 | C13 | C8 | 118.8° | 120.3° |
C13 | C16 | C17 | 178.7° | 179.9° |
C13 | C8 | C7 | 118.4° | 120.3° |
C13 | C8 | C9 | 132.6° | 132.0° |
C8 | C7 | C4 | 110.5° | 109.5° |
C7 | C8 | C9 | 108.9° | 107.6° |
C7 | C4 | C3 | 128.9° | 131.1° |
C7 | C4 | C5 | 109.1° | 109.4° |
C16 | C17 | C18 | 178.5° | 179.9° |
C22 | C23 | C18 | 120.6° | 119.9° |
C23 | C22 | C21 | 120.1° | 120.1° |
C23 | C22 | H5 | 119.9° | 120.0° |
C22 | C23 | H6 | 119.7° | 120.1° |
C23 | C18 | C17 | 118.3° | 120.1° |
C23 | C18 | C19 | 119.3° | 119.8° |
C18 | C23 | H6 | 119.7° | 120.1° |
C8 | C9 | C5 | 100.8° | 106.0° |
C8 | C9 | C14 | 113.1° | 110.2° |
C8 | C9 | C15 | 107.5° | 110.1° |
C17 | C18 | C19 | 122.4° | 120.1° |
C22 | C21 | O39 | 119.2° | 119.9° |
C22 | C21 | C20 | 119.7° | 120.2° |
C21 | C22 | H5 | 119.9° | 119.9° |
C4 | C3 | C2 | 118.0° | 120.0° |
C3 | C4 | C5 | 122.0° | 119.5° |
C4 | C3 | H12 | 121.0° | 120.0° |
C3 | C2 | C1 | 120.3° | 120.2° |
C3 | C2 | H11 | 119.9° | 119.9° |
C2 | C3 | H12 | 121.0° | 120.0° |
C4 | C5 | C9 | 110.6° | 107.5° |
C4 | C5 | C6 | 120.0° | 120.3° |
C18 | C19 | C20 | 120.1° | 119.9° |
C18 | C19 | H2 | 119.9° | 120.1° |
C30 | C29 | C14 | 121.4° | 120.0° |
C29 | C30 | C31 | 120.2° | 120.0° |
C30 | C29 | H13 | 119.3° | 120.0° |
C29 | C30 | H14 | 119.9° | 120.0° |
C29 | C14 | C9 | 119.6° | 119.9° |
C29 | C14 | C33 | 118.2° | 120.1° |
C14 | C29 | H13 | 119.3° | 120.0° |
C30 | C31 | O34 | 122.8° | 120.1° |
C30 | C31 | C32 | 118.9° | 119.9° |
C31 | C30 | H14 | 119.9° | 120.0° |
O39 | C21 | C20 | 121.0° | 119.9° |
C21 | O39 | H4 | 109.5° | 114.0° |
C21 | C20 | C19 | 120.1° | 120.2° |
C21 | C20 | H3 | 119.9° | 119.9° |
C2 | C1 | C6 | 120.6° | 120.0° |
C2 | C1 | O37 | 121.0° | 120.0° |
C1 | C2 | H11 | 119.9° | 119.8° |
C5 | C9 | C14 | 111.8° | 110.2° |
C5 | C9 | C15 | 107.7° | 110.1° |
C9 | C5 | C6 | 129.3° | 132.2° |
C14 | C9 | C15 | 114.9° | 110.2° |
C9 | C14 | C33 | 122.2° | 120.0° |
C9 | C15 | C28 | 120.5° | 119.9° |
C9 | C15 | C24 | 122.1° | 119.9° |
C5 | C6 | C1 | 119.2° | 120.0° |
C5 | C6 | H9 | 120.4° | 120.1° |
C20 | C19 | H2 | 119.9° | 120.1° |
C19 | C20 | H3 | 120.0° | 119.9° |
C14 | C33 | C32 | 120.5° | 120.1° |
C14 | C33 | H19 | 119.7° | 120.0° |
C28 | C15 | C24 | 117.4° | 120.2° |
C15 | C28 | C27 | 121.3° | 120.1° |
C15 | C28 | H26 | 119.4° | 120.0° |
C15 | C24 | C25 | 121.2° | 120.0° |
C15 | C24 | H20 | 119.4° | 120.0° |
C38 | O34 | C31 | 124.7° | 117.0° |
O34 | C38 | H15 | 109.5° | 109.5° |
O34 | C38 | H16 | 109.4° | 109.5° |
O34 | C38 | H17 | 109.4° | 109.5° |
C28 | C27 | C26 | 120.3° | 119.9° |
C28 | C27 | H25 | 119.9° | 120.1° |
C27 | C28 | H26 | 119.3° | 119.9° |
O34 | C31 | C32 | 118.3° | 120.1° |
C31 | C32 | C33 | 120.8° | 119.9° |
C31 | C32 | H18 | 119.6° | 120.0° |
C24 | C25 | C26 | 120.7° | 120.0° |
C25 | C24 | H20 | 119.4° | 120.0° |
C24 | C25 | H21 | 119.6° | 120.1° |
C6 | C1 | O37 | 118.4° | 120.0° |
C1 | C6 | H9 | 120.4° | 119.9° |
C1 | O37 | H10 | 109.5° | 114.0° |
C27 | C26 | C25 | 119.0° | 119.9° |
C27 | C26 | O35 | 119.5° | 120.0° |
C26 | C27 | H25 | 119.8° | 120.0° |
C33 | C32 | H18 | 119.6° | 120.0° |
C32 | C33 | H19 | 119.8° | 119.9° |
C25 | C26 | O35 | 121.5° | 120.1° |
C26 | C25 | H21 | 119.6° | 120.0° |
C26 | O35 | C36 | 124.8° | 117.1° |
O35 | C36 | H22 | 109.5° | 109.5° |
O35 | C36 | H23 | 109.5° | 109.4° |
O35 | C36 | H24 | 109.5° | 109.4° |
H15 | C38 | H16 | 109.5° | 109.4° |
H15 | C38 | H17 | 109.5° | 109.5° |
H16 | C38 | H17 | 109.5° | 109.4° |
H22 | C36 | H23 | 109.5° | 109.5° |
H22 | C36 | H24 | 109.5° | 109.5° |
H23 | C36 | H24 | 109.4° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O41 | C40 | C12 | H1 | 180.0° | 179.7° |
O41 | C40 | C12 | C11 | 2.6° | 0.3° |
O41 | C40 | C12 | C13 | 176.5° | 180.0° |
C40 | C12 | C11 | C13 | 179.1° | 179.7° |
C40 | C12 | C11 | C10 | 179.4° | 179.7° |
C40 | C12 | C13 | C16 | 2.8° | 0.1° |
C40 | C12 | C13 | C8 | 179.9° | 180.0° |
C40 | C12 | C11 | H8 | 0.5° | 0.0° |
C12 | C11 | C10 | H8 | 180.0° | 179.8° |
C12 | C11 | C10 | C7 | 0.2° | 0.6° |
C11 | C12 | C13 | C16 | 178.2° | 179.7° |
C11 | C12 | C13 | C8 | 1.0° | 0.3° |
C11 | C12 | C40 | H1 | 177.5° | 180.0° |
C12 | C11 | C10 | H7 | 179.7° | 179.7° |
C10 | C11 | C12 | C13 | 0.4° | 0.6° |
C11 | C10 | C7 | H7 | 180.0° | 179.8° |
C11 | C10 | C7 | C8 | 0.2° | 0.3° |
C11 | C10 | C7 | C4 | 179.9° | 179.7° |
C12 | C13 | C16 | C8 | 177.2° | 179.9° |
C12 | C13 | C8 | C7 | 1.1° | 0.1° |
C12 | C13 | C16 | C17 | 16.0° | 53.6° |
C12 | C13 | C8 | C9 | 179.1° | 180.0° |
C13 | C12 | C40 | H1 | 3.5° | 0.3° |
C13 | C12 | C11 | H8 | 179.6° | 179.6° |
C10 | C7 | C8 | C13 | 0.5° | 0.0° |
C10 | C7 | C8 | C4 | 180.0° | 180.0° |
C10 | C7 | C8 | C9 | 179.0° | 180.0° |
C10 | C7 | C4 | C3 | 0.4° | 0.1° |
C10 | C7 | C4 | C5 | 179.4° | 180.0° |
C7 | C10 | C11 | H8 | 179.8° | 179.7° |
C16 | C13 | C8 | C7 | 178.3° | 180.0° |
C16 | C13 | C8 | C9 | 3.6° | 0.0° |
C13 | C16 | C17 | C18 | 57.0° | 164.6° |
C13 | C8 | C7 | C9 | 178.5° | 180.0° |
C13 | C8 | C7 | C4 | 179.5° | 180.0° |
C8 | C13 | C16 | C17 | 161.2° | 126.5° |
C13 | C8 | C9 | C5 | 179.8° | 180.0° |
C13 | C8 | C9 | C14 | 60.3° | 60.9° |
C13 | C8 | C9 | C15 | 67.6° | 60.9° |
C8 | C7 | C4 | C3 | 179.5° | 179.9° |
C8 | C7 | C4 | C5 | 0.6° | 0.0° |
C7 | C8 | C9 | C5 | 2.0° | 0.0° |
C7 | C8 | C9 | C14 | 121.5° | 119.1° |
C7 | C8 | C9 | C15 | 110.6° | 119.1° |
C8 | C7 | C10 | H7 | 179.8° | 179.9° |
C4 | C7 | C8 | C9 | 1.0° | 0.0° |
C7 | C4 | C3 | C5 | 179.8° | 179.9° |
C7 | C4 | C3 | C2 | 179.8° | 180.0° |
C7 | C4 | C5 | C9 | 2.0° | 0.0° |
C7 | C4 | C5 | C6 | 179.2° | 180.0° |
C4 | C7 | C10 | H7 | 0.2° | 0.1° |
C7 | C4 | C3 | H12 | 0.1° | 0.0° |
C16 | C17 | C18 | C23 | 98.5° | 141.7° |
C16 | C17 | C18 | C19 | 80.8° | 38.1° |
C22 | C23 | C18 | H6 | 180.0° | 179.5° |
C22 | C23 | C18 | C17 | 179.8° | 179.7° |
C23 | C22 | C21 | H5 | 180.0° | 179.7° |
C22 | C23 | C18 | C19 | 0.5° | 0.5° |
C23 | C22 | C21 | O39 | 179.4° | 179.7° |
C23 | C22 | C21 | C20 | 0.1° | 0.3° |
C23 | C18 | C17 | C19 | 179.3° | 179.8° |
C18 | C23 | C22 | C21 | 0.0° | 0.5° |
C23 | C18 | C19 | C20 | 0.9° | 0.2° |
C23 | C18 | C19 | H2 | 179.1° | 179.8° |
C18 | C23 | C22 | H5 | 180.0° | 179.8° |
C8 | C9 | C5 | C4 | 2.4° | 0.0° |
C8 | C9 | C14 | C29 | 28.5° | 66.3° |
C8 | C9 | C5 | C14 | 120.4° | 119.2° |
C8 | C9 | C5 | C15 | 112.4° | 119.1° |
C8 | C9 | C14 | C15 | 123.9° | 121.7° |
C8 | C9 | C5 | C6 | 179.3° | 180.0° |
C8 | C9 | C14 | C33 | 152.1° | 113.4° |
C8 | C9 | C15 | C28 | 86.0° | 177.5° |
C8 | C9 | C15 | C24 | 93.7° | 2.7° |
C17 | C18 | C19 | C20 | 179.8° | 180.0° |
C17 | C18 | C19 | H2 | 0.2° | 0.0° |
C17 | C18 | C23 | H6 | 0.1° | 0.2° |
C22 | C21 | O39 | C20 | 179.3° | 180.0° |
C22 | C21 | C20 | C19 | 0.3° | 0.0° |
C22 | C21 | C20 | H3 | 179.7° | 179.9° |
C22 | C21 | O39 | H4 | 180.0° | 90.0° |
C21 | C22 | C23 | H6 | 180.0° | 180.0° |
C4 | C3 | C2 | H12 | 180.0° | 180.0° |
C4 | C3 | C2 | C1 | 0.2° | 0.0° |
C3 | C4 | C5 | C9 | 178.1° | 179.9° |
C3 | C4 | C5 | C6 | 0.9° | 0.1° |
C4 | C3 | C2 | H11 | 179.9° | 179.9° |
C2 | C3 | C4 | C5 | 0.3° | 0.1° |
C3 | C2 | C1 | H11 | 180.0° | 179.9° |
C3 | C2 | C1 | C6 | 0.0° | 0.0° |
C3 | C2 | C1 | O37 | 180.0° | 180.0° |
C4 | C5 | C9 | C6 | 176.9° | 180.0° |
C4 | C5 | C9 | C14 | 122.9° | 119.1° |
C4 | C5 | C9 | C15 | 110.0° | 119.1° |
C4 | C5 | C6 | C1 | 1.0° | 0.0° |
C4 | C5 | C6 | H9 | 178.9° | 180.0° |
C5 | C4 | C3 | H12 | 179.7° | 179.9° |
C18 | C19 | C20 | C21 | 0.8° | 0.0° |
C18 | C19 | C20 | H2 | 180.0° | 180.0° |
C18 | C19 | C20 | H3 | 179.2° | 179.9° |
C19 | C18 | C23 | H6 | 179.5° | 180.0° |
C30 | C29 | C14 | H13 | 180.0° | 180.0° |
C29 | C30 | C31 | H14 | 180.0° | 179.9° |
C30 | C29 | C14 | C9 | 179.8° | 180.0° |
C30 | C29 | C14 | C33 | 0.8° | 0.3° |
C29 | C30 | C31 | O34 | 179.9° | 180.0° |
C29 | C30 | C31 | C32 | 0.3° | 0.1° |
C14 | C29 | C30 | C31 | 0.6° | 0.0° |
C29 | C14 | C9 | C5 | 84.4° | 50.3° |
C29 | C14 | C9 | C33 | 179.4° | 179.7° |
C29 | C14 | C9 | C15 | 152.4° | 172.0° |
C29 | C14 | C33 | C32 | 0.7° | 0.5° |
C14 | C29 | C30 | H14 | 179.4° | 179.9° |
C29 | C14 | C33 | H19 | 179.3° | 179.7° |
C30 | C31 | O34 | C38 | 15.0° | 180.0° |
C30 | C31 | O34 | C32 | 179.6° | 179.9° |
C30 | C31 | C32 | C33 | 0.2° | 0.2° |
C31 | C30 | C29 | H13 | 179.4° | 180.0° |
C30 | C31 | C32 | H18 | 179.9° | 180.0° |
O39 | C21 | C20 | C19 | 179.0° | 180.0° |
O39 | C21 | C20 | H3 | 1.0° | 0.1° |
O39 | C21 | C22 | H5 | 0.6° | 0.0° |
C21 | C20 | C19 | H3 | 180.0° | 179.9° |
C21 | C20 | C19 | H2 | 179.2° | 179.9° |
C20 | C21 | O39 | H4 | 0.7° | 90.0° |
C20 | C21 | C22 | H5 | 179.9° | 180.0° |
C2 | C1 | C6 | C5 | 0.6° | 0.0° |
C2 | C1 | C6 | O37 | 179.9° | 180.0° |
C2 | C1 | C6 | H9 | 179.4° | 179.9° |
C2 | C1 | O37 | H10 | 180.0° | 90.0° |
C1 | C2 | C3 | H12 | 179.8° | 179.9° |
C5 | C9 | C14 | C15 | 123.2° | 121.7° |
C5 | C9 | C14 | C33 | 94.9° | 130.1° |
C5 | C9 | C15 | C28 | 21.8° | 65.9° |
C5 | C9 | C15 | C24 | 158.5° | 113.8° |
C9 | C5 | C6 | C1 | 177.6° | 180.0° |
C9 | C5 | C6 | H9 | 2.3° | 0.0° |
C14 | C9 | C5 | C6 | 60.3° | 60.8° |
C14 | C9 | C15 | C28 | 147.2° | 55.8° |
C14 | C9 | C15 | C24 | 33.1° | 124.5° |
C9 | C14 | C33 | C32 | 179.9° | 179.8° |
C9 | C14 | C29 | H13 | 0.2° | 0.0° |
C9 | C14 | C33 | H19 | 0.1° | 0.0° |
C15 | C9 | C5 | C6 | 66.8° | 60.9° |
C15 | C9 | C14 | C33 | 28.2° | 8.3° |
C9 | C15 | C28 | C24 | 179.7° | 179.7° |
C9 | C15 | C28 | C27 | 179.8° | 179.7° |
C9 | C15 | C24 | C25 | 179.8° | 180.0° |
C9 | C15 | C24 | H20 | 0.2° | 0.1° |
C9 | C15 | C28 | H26 | 0.2° | 0.0° |
C5 | C6 | C1 | H9 | 180.0° | 180.0° |
C5 | C6 | C1 | O37 | 179.4° | 180.0° |
C14 | C33 | C32 | C31 | 0.4° | 0.5° |
C14 | C33 | C32 | H19 | 180.0° | 179.8° |
C33 | C14 | C29 | H13 | 179.2° | 179.7° |
C14 | C33 | C32 | H18 | 179.7° | 179.7° |
C15 | C28 | C27 | H26 | 180.0° | 179.7° |
C28 | C15 | C24 | C25 | 0.5° | 0.3° |
C15 | C28 | C27 | C26 | 0.8° | 0.5° |
C28 | C15 | C24 | H20 | 179.5° | 179.7° |
C15 | C28 | C27 | H25 | 179.2° | 179.7° |
C24 | C15 | C28 | C27 | 0.5° | 0.5° |
C15 | C24 | C25 | H20 | 180.0° | 179.9° |
C15 | C24 | C25 | C26 | 0.8° | 0.0° |
C15 | C24 | C25 | H21 | 179.2° | 180.0° |
C24 | C15 | C28 | H26 | 179.5° | 179.8° |
C38 | O34 | C31 | C32 | 165.5° | 0.1° |
O34 | C38 | H15 | H16 | 120.0° | 120.0° |
O34 | C38 | H15 | H17 | 120.0° | 120.0° |
O34 | C38 | H16 | H17 | 120.0° | 120.1° |
C28 | C27 | C26 | H25 | 180.0° | 179.8° |
C28 | C27 | C26 | C25 | 1.1° | 0.2° |
C28 | C27 | C26 | O35 | 178.8° | 179.7° |
O34 | C31 | C32 | C33 | 179.8° | 179.7° |
O34 | C31 | C30 | H14 | 0.1° | 0.1° |
C31 | O34 | C38 | H15 | 180.0° | 60.0° |
C31 | O34 | C38 | H16 | 60.0° | 60.0° |
C31 | O34 | C38 | H17 | 60.0° | 180.0° |
O34 | C31 | C32 | H18 | 0.3° | 0.1° |
C31 | C32 | C33 | H18 | 180.0° | 179.9° |
C32 | C31 | C30 | H14 | 179.7° | 180.0° |
C31 | C32 | C33 | H19 | 179.6° | 179.8° |
C24 | C25 | C26 | C27 | 1.1° | 0.0° |
C24 | C25 | C26 | H21 | 180.0° | 180.0° |
C24 | C25 | C26 | O35 | 178.8° | 180.0° |
C6 | C1 | O37 | H10 | 0.0° | 90.1° |
C6 | C1 | C2 | H11 | 180.0° | 180.0° |
O37 | C1 | C6 | H9 | 0.6° | 0.1° |
O37 | C1 | C2 | H11 | 0.0° | 0.1° |
C27 | C26 | C25 | O35 | 177.7° | 179.9° |
C27 | C26 | O35 | C36 | 108.0° | 0.1° |
C27 | C26 | C25 | H21 | 178.9° | 180.0° |
C26 | C27 | C28 | H26 | 179.2° | 179.8° |
C25 | C26 | O35 | C36 | 74.3° | 180.0° |
C26 | C25 | C24 | H20 | 179.2° | 180.0° |
C25 | C26 | C27 | H25 | 178.9° | 180.0° |
O35 | C26 | C25 | H21 | 1.2° | 0.0° |
C26 | O35 | C36 | H22 | 180.0° | 180.0° |
C26 | O35 | C36 | H23 | 60.0° | 60.0° |
C26 | O35 | C36 | H24 | 60.0° | 60.0° |
O35 | C26 | C27 | H25 | 1.1° | 0.1° |
O35 | C36 | H22 | H23 | 120.0° | 120.0° |
O35 | C36 | H22 | H24 | 120.0° | 120.0° |
O35 | C36 | H23 | H24 | 120.0° | 119.9° |
H2 | C19 | C20 | H3 | 0.8° | 0.0° |
H5 | C22 | C23 | H6 | 0.0° | 0.3° |
H7 | C10 | C11 | H8 | 0.2° | 0.1° |
H11 | C2 | C3 | H12 | 0.2° | 0.1° |
H13 | C29 | C30 | H14 | 0.6° | 0.1° |
H15 | C38 | H16 | H17 | 120.0° | 119.9° |
H18 | C32 | C33 | H19 | 0.3° | 0.1° |
H20 | C24 | C25 | H21 | 0.8° | 0.1° |
H22 | C36 | H23 | H24 | 120.0° | 120.0° |
H25 | C27 | C28 | H26 | 0.8° | 0.0° |