YOS
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O32 | C16 | doub | 1.21Å | 1.31Å | |
| C19 | C21 | sing | 1.53Å | 1.53Å | |
| C19 | C24 | sing | 1.53Å | 1.53Å | |
| C21 | C25 | sing | 1.53Å | 1.53Å | |
| C16 | O31 | sing | 1.34Å | 1.22Å | |
| C16 | C27 | sing | 1.51Å | 1.51Å | |
| C17 | C14 | sing | 1.50Å | 1.50Å | |
| C17 | N30 | sing | 1.47Å | 1.47Å | |
| C14 | C15 | doub | 1.32Å | 1.38Å | |
| C27 | C24 | sing | 1.53Å | 1.53Å | |
| N29 | C13 | sing | 1.38Å | 1.37Å | Aromatic |
| N29 | C12 | sing | 1.38Å | 1.38Å | Aromatic |
| C24 | C20 | sing | 1.53Å | 1.53Å | |
| C25 | N30 | sing | 1.47Å | 1.48Å | |
| C25 | C22 | sing | 1.53Å | 1.53Å | |
| N28 | C13 | doub | 1.33Å | 1.35Å | Aromatic |
| N28 | C6 | sing | 1.32Å | 1.34Å | Aromatic |
| N30 | C23 | sing | 1.47Å | 1.47Å | |
| C15 | C12 | sing | 1.47Å | 1.46Å | |
| C15 | C18 | sing | 1.50Å | 1.51Å | |
| C13 | C7 | sing | 1.41Å | 1.41Å | Aromatic |
| C12 | C4 | doub | 1.36Å | 1.37Å | Aromatic |
| C6 | C3 | doub | 1.38Å | 1.38Å | Aromatic |
| C23 | C18 | sing | 1.53Å | 1.53Å | |
| C20 | C22 | sing | 1.53Å | 1.54Å | |
| C7 | C4 | sing | 1.41Å | 1.43Å | Aromatic |
| C7 | C8 | doub | 1.41Å | 1.41Å | Aromatic |
| C3 | C8 | sing | 1.39Å | 1.40Å | Aromatic |
| C8 | C9 | sing | 1.48Å | 1.49Å | |
| C5 | C9 | doub | 1.39Å | 1.40Å | Aromatic |
| C5 | C11 | sing | 1.38Å | 1.37Å | Aromatic |
| F34 | C11 | sing | 1.35Å | 1.35Å | |
| C9 | C10 | sing | 1.40Å | 1.40Å | Aromatic |
| C11 | C2 | doub | 1.39Å | 1.37Å | Aromatic |
| C10 | O33 | sing | 1.36Å | 1.37Å | |
| C10 | C1 | doub | 1.39Å | 1.40Å | Aromatic |
| C2 | C1 | sing | 1.38Å | 1.39Å | Aromatic |
| O33 | C26 | sing | 1.43Å | 1.43Å | |
| C4 | H1 | sing | 1.08Å | 1.08Å | |
| C5 | H2 | sing | 1.08Å | 1.08Å | |
| C6 | H3 | sing | 1.08Å | 1.08Å | |
| C17 | H4 | sing | 1.09Å | 1.10Å | |
| C17 | H5 | sing | 1.09Å | 1.10Å | |
| C20 | H6 | sing | 1.09Å | 1.10Å | |
| C20 | H7 | sing | 1.09Å | 1.10Å | |
| C21 | H8 | sing | 1.09Å | 1.10Å | |
| C21 | H9 | sing | 1.09Å | 1.10Å | |
| C22 | H10 | sing | 1.09Å | 1.10Å | |
| C22 | 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 | |
| C1 | H16 | sing | 1.08Å | 1.08Å | |
| C2 | H17 | sing | 1.08Å | 1.08Å | |
| C3 | H18 | sing | 1.08Å | 1.08Å | |
| C14 | H19 | sing | 1.08Å | 1.08Å | |
| C18 | H20 | sing | 1.09Å | 1.10Å | |
| C18 | H21 | sing | 1.09Å | 1.10Å | |
| C19 | H22 | sing | 1.09Å | 1.10Å | |
| C19 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H24 | sing | 1.09Å | 1.10Å | |
| C23 | H25 | sing | 1.09Å | 1.10Å | |
| C25 | H26 | sing | 1.09Å | 1.10Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C27 | H28 | sing | 1.09Å | 1.10Å | |
| N29 | H29 | sing | 0.97Å | 1.00Å | |
| O31 | H31 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O32 | C16 | O31 | 123.6° | 120.0° |
| O32 | C16 | C27 | 113.5° | 120.0° |
| C21 | C19 | C24 | 112.1° | 109.5° |
| C19 | C21 | C25 | 110.0° | 109.4° |
| C19 | C21 | H8 | 109.3° | 109.5° |
| C19 | C21 | H9 | 109.3° | 109.4° |
| C21 | C19 | H22 | 108.8° | 109.5° |
| C21 | C19 | H23 | 108.8° | 109.5° |
| C19 | C24 | C27 | 112.0° | 109.5° |
| C19 | C24 | C20 | 109.1° | 109.4° |
| C19 | C24 | H12 | 107.7° | 109.5° |
| C24 | C19 | H22 | 108.8° | 109.5° |
| C24 | C19 | H23 | 108.8° | 109.5° |
| C21 | C25 | N30 | 113.9° | 109.4° |
| C21 | C25 | C22 | 112.0° | 109.4° |
| C25 | C21 | H8 | 109.4° | 109.5° |
| C25 | C21 | H9 | 109.4° | 109.5° |
| C21 | C25 | H26 | 105.3° | 109.5° |
| O31 | C16 | C27 | 122.8° | 120.0° |
| C16 | O31 | H31 | 109.5° | 117.0° |
| C16 | C27 | C24 | 112.3° | 109.5° |
| C16 | C27 | H27 | 108.8° | 109.5° |
| C16 | C27 | H28 | 108.8° | 109.5° |
| C14 | C17 | N30 | 113.4° | 110.3° |
| C17 | C14 | C15 | 121.2° | 123.0° |
| C14 | C17 | H4 | 108.5° | 109.3° |
| C14 | C17 | H5 | 108.5° | 109.4° |
| C17 | C14 | H19 | 119.4° | 118.5° |
| C17 | N30 | C25 | 115.4° | 111.0° |
| C17 | N30 | C23 | 110.3° | 110.4° |
| N30 | C17 | H4 | 108.5° | 109.3° |
| N30 | C17 | H5 | 108.5° | 109.3° |
| C14 | C15 | C12 | 121.1° | 118.7° |
| C14 | C15 | C18 | 121.3° | 122.6° |
| C15 | C14 | H19 | 119.4° | 118.5° |
| C27 | C24 | C20 | 112.4° | 109.5° |
| C27 | C24 | H12 | 107.7° | 109.5° |
| C24 | C27 | H27 | 108.8° | 109.5° |
| C24 | C27 | H28 | 108.8° | 109.5° |
| C13 | N29 | C12 | 108.3° | 108.9° |
| N29 | C13 | N28 | 127.8° | 132.8° |
| N29 | C13 | C7 | 108.8° | 107.1° |
| C13 | N29 | H29 | 125.8° | 125.5° |
| N29 | C12 | C15 | 121.8° | 125.4° |
| N29 | C12 | C4 | 109.5° | 109.1° |
| C12 | N29 | H29 | 125.9° | 125.6° |
| C24 | C20 | C22 | 112.0° | 109.5° |
| C24 | C20 | H6 | 108.8° | 109.5° |
| C24 | C20 | H7 | 108.8° | 109.4° |
| C20 | C24 | H12 | 107.7° | 109.5° |
| N30 | C25 | C22 | 113.7° | 109.5° |
| C25 | N30 | C23 | 114.4° | 111.0° |
| N30 | C25 | H26 | 105.8° | 109.4° |
| C25 | C22 | C20 | 110.5° | 109.5° |
| C25 | C22 | H10 | 109.2° | 109.5° |
| C25 | C22 | H11 | 109.2° | 109.5° |
| C22 | C25 | H26 | 105.2° | 109.5° |
| C13 | N28 | C6 | 117.4° | 122.0° |
| N28 | C13 | C7 | 123.4° | 120.0° |
| N28 | C6 | C3 | 124.1° | 121.7° |
| N28 | C6 | H3 | 117.9° | 119.1° |
| N30 | C23 | C18 | 112.4° | 108.5° |
| N30 | C23 | H24 | 108.7° | 109.6° |
| N30 | C23 | H25 | 108.7° | 109.8° |
| C12 | C15 | C18 | 117.6° | 118.7° |
| C15 | C12 | C4 | 128.6° | 125.5° |
| C15 | C18 | C23 | 112.5° | 109.7° |
| C15 | C18 | H20 | 108.7° | 109.5° |
| C15 | C18 | H21 | 108.7° | 109.4° |
| C13 | C7 | C4 | 106.3° | 107.2° |
| C13 | C7 | C8 | 117.8° | 119.1° |
| C12 | C4 | C7 | 107.1° | 107.6° |
| C12 | C4 | H1 | 126.5° | 126.2° |
| C6 | C3 | C8 | 118.6° | 119.3° |
| C3 | C6 | H3 | 118.0° | 119.2° |
| C6 | C3 | H18 | 120.7° | 120.3° |
| C23 | C18 | H20 | 108.7° | 109.4° |
| C23 | C18 | H21 | 108.7° | 109.4° |
| C18 | C23 | H24 | 108.7° | 109.6° |
| C18 | C23 | H25 | 108.7° | 109.6° |
| C22 | C20 | H6 | 108.8° | 109.5° |
| C22 | C20 | H7 | 108.8° | 109.5° |
| C20 | C22 | H10 | 109.2° | 109.5° |
| C20 | C22 | H11 | 109.2° | 109.5° |
| C4 | C7 | C8 | 135.7° | 133.7° |
| C7 | C4 | H1 | 126.5° | 126.2° |
| C7 | C8 | C3 | 118.7° | 117.8° |
| C7 | C8 | C9 | 124.0° | 121.1° |
| C3 | C8 | C9 | 117.3° | 121.1° |
| C8 | C3 | H18 | 120.7° | 120.4° |
| C8 | C9 | C5 | 118.2° | 120.1° |
| C8 | C9 | C10 | 123.3° | 120.2° |
| C9 | C5 | C11 | 119.0° | 119.9° |
| C5 | C9 | C10 | 118.4° | 119.7° |
| C9 | C5 | H2 | 120.5° | 120.1° |
| C5 | C11 | F34 | 117.9° | 119.9° |
| C5 | C11 | C2 | 123.6° | 120.2° |
| C11 | C5 | H2 | 120.5° | 120.0° |
| F34 | C11 | C2 | 118.5° | 119.9° |
| C9 | C10 | O33 | 115.5° | 120.1° |
| C9 | C10 | C1 | 120.9° | 119.8° |
| C11 | C2 | C1 | 118.4° | 120.3° |
| C11 | C2 | H17 | 120.8° | 119.8° |
| O33 | C10 | C1 | 123.5° | 120.1° |
| C10 | O33 | C26 | 118.1° | 117.0° |
| C10 | C1 | C2 | 119.7° | 120.1° |
| C10 | C1 | H16 | 120.2° | 119.9° |
| C2 | C1 | H16 | 120.2° | 120.0° |
| C1 | C2 | H17 | 120.8° | 119.8° |
| O33 | C26 | H13 | 109.5° | 109.5° |
| O33 | C26 | H14 | 109.4° | 109.4° |
| O33 | C26 | H15 | 109.5° | 109.5° |
| H4 | C17 | H5 | 109.5° | 109.2° |
| H6 | C20 | H7 | 109.5° | 109.5° |
| H8 | C21 | H9 | 109.5° | 109.5° |
| H10 | C22 | H11 | 109.5° | 109.4° |
| H13 | C26 | H14 | 109.5° | 109.5° |
| H13 | C26 | H15 | 109.5° | 109.5° |
| H14 | C26 | H15 | 109.5° | 109.5° |
| H20 | C18 | H21 | 109.4° | 109.4° |
| H22 | C19 | H23 | 109.5° | 109.4° |
| H24 | C23 | H25 | 109.5° | 109.6° |
| H27 | C27 | H28 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O32 | C16 | O31 | C27 | 178.5° | 179.9° |
| O32 | C16 | C27 | C24 | 144.0° | 0.1° |
| O32 | C16 | C27 | H27 | 95.6° | 120.0° |
| O32 | C16 | C27 | H28 | 23.6° | 120.1° |
| O32 | C16 | O31 | H31 | 0.0° | 0.1° |
| C21 | C19 | C24 | H22 | 120.4° | 120.0° |
| C21 | C19 | C24 | H23 | 120.4° | 120.0° |
| C19 | C21 | C25 | H8 | 120.1° | 120.0° |
| C19 | C21 | C25 | H9 | 120.1° | 120.0° |
| C21 | C19 | C24 | C27 | 177.2° | 180.0° |
| C21 | C19 | C24 | C20 | 57.7° | 60.0° |
| C19 | C21 | C25 | N30 | 174.4° | 180.0° |
| C19 | C21 | C25 | C22 | 54.9° | 60.0° |
| C19 | C21 | H8 | H9 | 119.7° | 120.0° |
| C21 | C19 | C24 | H12 | 58.9° | 60.0° |
| C21 | C19 | H22 | H23 | 118.8° | 120.0° |
| C19 | C21 | C25 | H26 | 58.9° | 60.0° |
| C24 | C19 | C21 | C25 | 57.0° | 60.1° |
| C19 | C24 | C27 | C16 | 70.2° | 65.0° |
| C19 | C24 | C27 | C20 | 123.3° | 119.9° |
| C19 | C24 | C27 | H12 | 118.3° | 120.0° |
| C19 | C24 | C20 | H12 | 116.7° | 120.0° |
| C19 | C24 | C20 | C22 | 57.0° | 60.0° |
| C19 | C24 | C20 | H6 | 177.4° | 60.0° |
| C19 | C24 | C20 | H7 | 63.4° | 180.0° |
| C24 | C19 | C21 | H8 | 177.0° | 180.0° |
| C24 | C19 | C21 | H9 | 63.2° | 60.0° |
| C24 | C19 | H22 | H23 | 118.8° | 120.0° |
| C19 | C24 | C27 | H27 | 169.4° | 55.0° |
| C19 | C24 | C27 | H28 | 50.2° | 174.9° |
| C21 | C25 | N30 | C17 | 63.5° | 66.0° |
| C21 | C25 | N30 | C22 | 129.9° | 119.9° |
| C21 | C25 | N30 | H26 | 115.1° | 120.0° |
| C21 | C25 | C22 | H26 | 113.8° | 120.1° |
| C21 | C25 | N30 | C23 | 66.2° | 170.8° |
| C21 | C25 | C22 | C20 | 54.5° | 60.1° |
| C25 | C21 | H8 | H9 | 119.8° | 120.1° |
| C21 | C25 | C22 | H10 | 174.7° | 60.0° |
| C21 | C25 | C22 | H11 | 65.6° | 179.9° |
| C25 | C21 | C19 | H22 | 177.4° | 179.9° |
| C25 | C21 | C19 | H23 | 63.4° | 60.0° |
| O31 | C16 | C27 | C24 | 34.7° | 180.0° |
| O31 | C16 | C27 | H27 | 85.7° | 59.9° |
| O31 | C16 | C27 | H28 | 155.1° | 60.0° |
| C16 | C27 | C24 | H27 | 120.4° | 120.0° |
| C16 | C27 | C24 | H28 | 120.4° | 120.0° |
| C16 | C27 | C24 | C20 | 166.6° | 175.0° |
| C16 | C27 | C24 | H12 | 48.1° | 55.0° |
| C16 | C27 | H27 | H28 | 118.7° | 120.0° |
| C27 | C16 | O31 | H31 | 178.5° | 180.0° |
| C14 | C17 | N30 | H4 | 120.6° | 120.3° |
| C14 | C17 | N30 | H5 | 120.6° | 120.2° |
| C17 | C14 | C15 | H19 | 180.0° | 180.0° |
| C14 | C17 | N30 | C25 | 177.3° | 174.7° |
| C14 | C17 | N30 | C23 | 51.1° | 51.1° |
| C17 | C14 | C15 | C12 | 174.2° | 179.7° |
| C17 | C14 | C15 | C18 | 3.5° | 0.6° |
| C14 | C17 | H4 | H5 | 118.2° | 119.6° |
| N30 | C17 | C14 | C15 | 22.6° | 17.1° |
| C17 | N30 | C25 | C23 | 129.6° | 123.2° |
| C17 | N30 | C25 | C22 | 166.7° | 53.9° |
| C17 | N30 | C23 | C18 | 62.0° | 69.3° |
| N30 | C17 | H4 | H5 | 118.2° | 119.5° |
| N30 | C17 | C14 | H19 | 157.4° | 162.9° |
| C17 | N30 | C23 | H24 | 58.4° | 171.0° |
| C17 | N30 | C23 | H25 | 177.6° | 50.6° |
| C17 | N30 | C25 | H26 | 51.7° | 173.9° |
| C14 | C15 | C12 | N29 | 16.4° | 115.5° |
| C14 | C15 | C12 | C18 | 177.8° | 179.7° |
| C14 | C15 | C12 | C4 | 167.7° | 64.7° |
| C14 | C15 | C18 | C23 | 12.9° | 16.9° |
| C15 | C14 | C17 | H4 | 98.0° | 103.2° |
| C15 | C14 | C17 | H5 | 143.2° | 137.3° |
| C14 | C15 | C18 | H20 | 107.6° | 103.2° |
| C14 | C15 | C18 | H21 | 133.4° | 136.8° |
| C27 | C24 | C20 | H12 | 118.4° | 120.0° |
| C27 | C24 | C20 | C22 | 178.1° | 180.0° |
| C27 | C24 | C20 | H6 | 57.7° | 60.0° |
| C27 | C24 | C20 | H7 | 61.5° | 60.0° |
| C27 | C24 | C19 | H22 | 56.8° | 60.0° |
| C27 | C24 | C19 | H23 | 62.4° | 60.0° |
| C24 | C27 | H27 | H28 | 118.7° | 120.0° |
| C13 | N29 | C12 | H29 | 180.0° | 179.7° |
| N29 | C13 | N28 | C7 | 177.4° | 180.0° |
| N29 | C13 | N28 | C6 | 177.2° | 180.0° |
| C13 | N29 | C12 | C15 | 175.4° | 179.7° |
| C13 | N29 | C12 | C4 | 1.2° | 0.5° |
| N29 | C13 | C7 | C4 | 0.5° | 0.0° |
| N29 | C13 | C7 | C8 | 175.8° | 180.0° |
| C12 | N29 | C13 | N28 | 177.3° | 179.7° |
| N29 | C12 | C15 | C4 | 175.9° | 179.8° |
| N29 | C12 | C15 | C18 | 165.8° | 64.8° |
| C12 | N29 | C13 | C7 | 0.4° | 0.3° |
| N29 | C12 | C4 | C7 | 1.6° | 0.5° |
| N29 | C12 | C4 | H1 | 178.5° | 179.9° |
| C24 | C20 | C22 | C25 | 55.9° | 60.1° |
| C24 | C20 | C22 | H6 | 120.4° | 120.0° |
| C24 | C20 | C22 | H7 | 120.4° | 120.0° |
| C24 | C20 | H6 | H7 | 118.8° | 120.0° |
| C24 | C20 | C22 | H10 | 176.0° | 60.0° |
| C24 | C20 | C22 | H11 | 64.3° | 179.9° |
| C20 | C24 | C19 | H22 | 178.1° | 180.0° |
| C20 | C24 | C19 | H23 | 62.7° | 60.0° |
| C20 | C24 | C27 | H27 | 46.1° | 65.0° |
| C20 | C24 | C27 | H28 | 73.0° | 55.0° |
| N30 | C25 | C22 | H26 | 115.4° | 120.0° |
| C25 | N30 | C23 | C18 | 165.9° | 167.2° |
| N30 | C25 | C22 | C20 | 174.7° | 180.0° |
| C25 | N30 | C17 | H4 | 62.1° | 54.4° |
| C25 | N30 | C17 | H5 | 56.7° | 65.1° |
| N30 | C25 | C21 | H8 | 54.3° | 60.0° |
| N30 | C25 | C21 | H9 | 65.5° | 60.0° |
| N30 | C25 | C22 | H10 | 54.5° | 60.0° |
| N30 | C25 | C22 | H11 | 65.2° | 60.0° |
| C25 | N30 | C23 | H24 | 73.7° | 47.5° |
| C25 | N30 | C23 | H25 | 45.4° | 73.0° |
| C22 | C25 | N30 | C23 | 63.7° | 69.3° |
| C25 | C22 | C20 | H10 | 120.1° | 120.0° |
| C25 | C22 | C20 | H11 | 120.1° | 120.0° |
| C25 | C22 | C20 | H6 | 176.2° | 60.0° |
| C25 | C22 | C20 | H7 | 64.5° | 180.0° |
| C22 | C25 | C21 | H8 | 174.9° | 180.0° |
| C22 | C25 | C21 | H9 | 65.2° | 59.9° |
| C25 | C22 | H10 | H11 | 119.5° | 120.0° |
| C13 | N28 | C6 | C3 | 1.7° | 0.0° |
| N28 | C13 | C7 | C4 | 178.4° | 180.0° |
| N28 | C13 | C7 | C8 | 2.0° | 0.0° |
| C13 | N28 | C6 | H3 | 178.3° | 180.0° |
| N28 | C13 | N29 | H29 | 2.7° | 0.0° |
| C6 | N28 | C13 | C7 | 0.1° | 0.0° |
| N28 | C6 | C3 | H3 | 180.0° | 180.0° |
| N28 | C6 | C3 | C8 | 1.6° | 0.0° |
| N28 | C6 | C3 | H18 | 178.4° | 180.0° |
| N30 | C23 | C18 | C15 | 41.9° | 49.3° |
| N30 | C23 | C18 | H24 | 120.4° | 119.7° |
| N30 | C23 | C18 | H25 | 120.5° | 120.0° |
| C23 | N30 | C17 | H4 | 69.5° | 69.2° |
| C23 | N30 | C17 | H5 | 171.7° | 171.3° |
| N30 | C23 | C18 | H20 | 78.6° | 70.8° |
| N30 | C23 | C18 | H21 | 162.3° | 169.3° |
| N30 | C23 | H24 | H25 | 118.7° | 120.6° |
| C23 | N30 | C25 | H26 | 178.7° | 50.7° |
| C12 | C15 | C18 | C23 | 164.9° | 163.5° |
| C15 | C12 | C4 | C7 | 174.8° | 179.7° |
| C15 | C12 | C4 | H1 | 5.2° | 0.1° |
| C12 | C15 | C14 | H19 | 5.8° | 0.3° |
| C12 | C15 | C18 | H20 | 74.6° | 76.5° |
| C12 | C15 | C18 | H21 | 44.5° | 43.5° |
| C15 | C12 | N29 | H29 | 4.6° | 0.0° |
| C18 | C15 | C12 | C4 | 10.2° | 114.9° |
| C15 | C18 | C23 | H20 | 120.5° | 120.1° |
| C15 | C18 | C23 | H21 | 120.5° | 120.0° |
| C18 | C15 | C14 | H19 | 176.5° | 179.4° |
| C15 | C18 | H20 | H21 | 118.6° | 120.0° |
| C15 | C18 | C23 | H24 | 78.6° | 169.0° |
| C15 | C18 | C23 | H25 | 162.3° | 70.7° |
| C13 | C7 | C4 | C12 | 1.3° | 0.3° |
| C13 | C7 | C4 | C8 | 175.4° | 180.0° |
| C13 | C7 | C8 | C3 | 2.0° | 0.0° |
| C13 | C7 | C8 | C9 | 179.7° | 180.0° |
| C13 | C7 | C4 | H1 | 178.7° | 180.0° |
| C7 | C13 | N29 | H29 | 179.6° | 180.0° |
| C12 | C4 | C7 | H1 | 180.0° | 179.6° |
| C12 | C4 | C7 | C8 | 174.1° | 179.7° |
| C4 | C12 | N29 | H29 | 178.7° | 179.8° |
| C6 | C3 | C8 | C7 | 0.3° | 0.0° |
| C6 | C3 | C8 | H18 | 180.0° | 179.9° |
| C6 | C3 | C8 | C9 | 178.7° | 180.0° |
| C23 | C18 | H20 | H21 | 118.6° | 119.8° |
| C18 | C23 | H24 | H25 | 118.7° | 120.3° |
| C22 | C20 | H6 | H7 | 118.8° | 120.0° |
| C20 | C22 | H10 | H11 | 119.6° | 120.0° |
| C22 | C20 | C24 | H12 | 59.6° | 60.0° |
| C20 | C22 | C25 | H26 | 59.3° | 60.0° |
| C4 | C7 | C8 | C3 | 177.0° | 180.0° |
| C4 | C7 | C8 | C9 | 4.7° | 0.0° |
| C7 | C8 | C3 | C9 | 178.4° | 180.0° |
| C7 | C8 | C9 | C5 | 122.3° | 115.0° |
| C7 | C8 | C9 | C10 | 54.0° | 65.0° |
| C8 | C7 | C4 | H1 | 5.9° | 0.1° |
| C7 | C8 | C3 | H18 | 179.6° | 180.0° |
| C3 | C8 | C9 | C5 | 56.0° | 65.0° |
| C3 | C8 | C9 | C10 | 127.7° | 115.0° |
| C8 | C3 | C6 | H3 | 178.3° | 180.0° |
| C8 | C9 | C5 | C10 | 176.4° | 180.0° |
| C8 | C9 | C5 | C11 | 174.5° | 180.0° |
| C8 | C9 | C10 | O33 | 6.7° | 0.0° |
| C8 | C9 | C10 | C1 | 173.9° | 180.0° |
| C8 | C9 | C5 | H2 | 5.5° | 0.3° |
| C9 | C8 | C3 | H18 | 1.3° | 0.1° |
| C9 | C5 | C11 | H2 | 180.0° | 179.6° |
| C9 | C5 | C11 | F34 | 177.4° | 180.0° |
| C9 | C5 | C11 | C2 | 0.2° | 0.0° |
| C5 | C9 | C10 | O33 | 177.1° | 180.0° |
| C5 | C9 | C10 | C1 | 2.3° | 0.0° |
| C5 | C11 | F34 | C2 | 177.7° | 180.0° |
| C11 | C5 | C9 | C10 | 1.9° | 0.0° |
| C5 | C11 | C2 | C1 | 1.1° | 0.1° |
| C5 | C11 | C2 | H17 | 178.9° | 180.0° |
| F34 | C11 | C2 | C1 | 178.7° | 180.0° |
| F34 | C11 | C5 | H2 | 2.6° | 0.4° |
| F34 | C11 | C2 | H17 | 1.3° | 0.1° |
| C9 | C10 | O33 | C1 | 179.4° | 180.0° |
| C9 | C10 | C1 | C2 | 1.0° | 0.1° |
| C9 | C10 | O33 | C26 | 177.8° | 180.0° |
| C10 | C9 | C5 | H2 | 178.1° | 179.7° |
| C9 | C10 | C1 | H16 | 179.0° | 180.0° |
| C11 | C2 | C1 | C10 | 0.7° | 0.1° |
| C11 | C2 | C1 | H17 | 180.0° | 179.9° |
| C2 | C11 | C5 | H2 | 179.8° | 179.6° |
| C11 | C2 | C1 | H16 | 179.3° | 180.0° |
| O33 | C10 | C1 | C2 | 178.3° | 179.9° |
| C10 | O33 | C26 | H13 | 180.0° | 180.0° |
| C10 | O33 | C26 | H14 | 60.0° | 60.0° |
| C10 | O33 | C26 | H15 | 60.0° | 60.0° |
| O33 | C10 | C1 | H16 | 1.7° | 0.0° |
| C10 | C1 | C2 | H16 | 180.0° | 179.9° |
| C1 | C10 | O33 | C26 | 2.8° | 0.0° |
| C10 | C1 | C2 | H17 | 179.3° | 180.0° |
| O33 | C26 | H13 | H14 | 120.0° | 120.0° |
| O33 | C26 | H13 | H15 | 120.0° | 120.0° |
| O33 | C26 | H14 | H15 | 120.0° | 120.0° |
| H3 | C6 | C3 | H18 | 1.6° | 0.1° |
| H4 | C17 | C14 | H19 | 82.0° | 76.8° |
| H5 | C17 | C14 | H19 | 36.8° | 42.7° |
| H6 | C20 | C22 | H10 | 63.6° | 180.0° |
| H6 | C20 | C22 | H11 | 56.1° | 60.0° |
| H6 | C20 | C24 | H12 | 60.7° | 180.0° |
| H7 | C20 | C22 | H10 | 55.6° | 60.0° |
| H7 | C20 | C22 | H11 | 175.3° | 60.0° |
| H7 | C20 | C24 | H12 | 180.0° | 60.0° |
| H8 | C21 | C19 | H22 | 62.6° | 60.0° |
| H8 | C21 | C19 | H23 | 56.7° | 60.0° |
| H8 | C21 | C25 | H26 | 61.1° | 59.9° |
| H9 | C21 | C19 | H22 | 57.2° | 60.0° |
| H9 | C21 | C19 | H23 | 176.5° | 180.0° |
| H9 | C21 | C25 | H26 | 179.0° | 180.0° |
| H10 | C22 | C25 | H26 | 60.8° | 180.0° |
| H11 | C22 | C25 | H26 | 179.5° | 60.0° |
| H12 | C24 | C19 | H22 | 61.5° | 60.0° |
| H12 | C24 | C19 | H23 | 179.3° | 180.0° |
| H12 | C24 | C27 | H27 | 72.3° | 175.0° |
| H12 | C24 | C27 | H28 | 168.5° | 65.0° |
| H13 | C26 | H14 | H15 | 120.0° | 120.0° |
| H16 | C1 | C2 | H17 | 0.7° | 0.1° |
| H20 | C18 | C23 | H24 | 161.0° | 48.9° |
| H20 | C18 | C23 | H25 | 41.9° | 169.2° |
| H21 | C18 | C23 | H24 | 41.9° | 71.0° |
| H21 | C18 | C23 | H25 | 77.2° | 49.4° |
