A1AHI
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C18 | O04 | sing | 1.43Å | 1.39Å | |
| C18 | C13 | sing | 1.53Å | 1.51Å | |
| O04 | C11 | sing | 1.43Å | 1.41Å | |
| C20 | C11 | sing | 1.53Å | 1.53Å | |
| C11 | C21 | sing | 1.53Å | 1.52Å | |
| C11 | C10 | sing | 1.53Å | 1.52Å | |
| C13 | C08 | sing | 1.53Å | 1.52Å | |
| C10 | C08 | sing | 1.53Å | 1.52Å | |
| C08 | C09 | sing | 1.53Å | 1.52Å | |
| C09 | N06 | sing | 1.47Å | 1.31Å | |
| N06 | C15 | sing | 1.47Å | 1.31Å | |
| N06 | C14 | sing | 1.47Å | 1.31Å | |
| C15 | C17 | sing | 1.53Å | 1.51Å | |
| C14 | C16 | sing | 1.53Å | 1.52Å | |
| C17 | C12 | sing | 1.53Å | 1.52Å | |
| F03 | C12 | sing | 1.40Å | 1.34Å | |
| C12 | C16 | sing | 1.53Å | 1.50Å | |
| C12 | C19 | sing | 1.53Å | 1.50Å | |
| C19 | N07 | sing | 1.46Å | 1.43Å | |
| N07 | C22 | sing | 1.35Å | 1.42Å | |
| C22 | C23 | sing | 1.48Å | 1.51Å | |
| C22 | O05 | doub | 1.22Å | 1.16Å | |
| C25 | C23 | doub | 1.40Å | 1.37Å | Aromatic |
| C25 | C26 | sing | 1.38Å | 1.36Å | Aromatic |
| C23 | C24 | sing | 1.40Å | 1.37Å | Aromatic |
| CL1 | C26 | sing | 1.74Å | 1.75Å | |
| C26 | C28 | doub | 1.38Å | 1.36Å | Aromatic |
| C24 | C27 | doub | 1.38Å | 1.37Å | Aromatic |
| C28 | C27 | sing | 1.38Å | 1.37Å | Aromatic |
| C27 | CL2 | sing | 1.74Å | 1.76Å | |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C13 | H3 | sing | 1.09Å | 1.10Å | |
| C13 | H4 | sing | 1.09Å | 1.10Å | |
| C15 | H5 | sing | 1.09Å | 1.10Å | |
| C15 | H6 | sing | 1.09Å | 1.10Å | |
| C17 | H7 | sing | 1.09Å | 1.10Å | |
| C17 | H8 | sing | 1.09Å | 1.10Å | |
| C20 | H9 | sing | 1.09Å | 1.10Å | |
| C20 | H10 | sing | 1.09Å | 1.10Å | |
| C20 | H11 | sing | 1.09Å | 1.10Å | |
| C21 | H12 | sing | 1.09Å | 1.10Å | |
| C21 | H13 | sing | 1.09Å | 1.10Å | |
| C21 | H14 | sing | 1.09Å | 1.10Å | |
| C24 | H15 | sing | 1.08Å | 1.08Å | |
| C28 | H16 | sing | 1.08Å | 1.08Å | |
| C08 | H17 | sing | 1.09Å | 1.10Å | |
| C09 | H18 | sing | 1.09Å | 1.10Å | |
| C09 | H19 | sing | 1.09Å | 1.10Å | |
| C14 | H20 | sing | 1.09Å | 1.10Å | |
| C14 | H21 | sing | 1.09Å | 1.10Å | |
| C16 | H22 | sing | 1.09Å | 1.10Å | |
| C16 | H23 | sing | 1.09Å | 1.10Å | |
| C18 | H24 | sing | 1.09Å | 1.10Å | |
| C18 | H25 | sing | 1.09Å | 1.10Å | |
| C19 | H26 | sing | 1.09Å | 1.10Å | |
| C19 | H27 | sing | 1.09Å | 1.10Å | |
| C25 | H28 | sing | 1.08Å | 1.08Å | |
| N07 | H30 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O04 | C18 | C13 | 111.5° | 109.4° |
| C18 | O04 | C11 | 114.2° | 114.1° |
| O04 | C18 | H24 | 109.0° | 109.5° |
| O04 | C18 | H25 | 109.0° | 109.5° |
| C18 | C13 | C08 | 112.2° | 109.2° |
| C18 | C13 | H3 | 108.8° | 109.5° |
| C18 | C13 | H4 | 108.8° | 109.5° |
| C13 | C18 | H24 | 108.9° | 109.5° |
| C13 | C18 | H25 | 108.9° | 109.5° |
| O04 | C11 | C20 | 113.4° | 109.5° |
| O04 | C11 | C21 | 108.4° | 109.5° |
| O04 | C11 | C10 | 110.9° | 109.4° |
| C20 | C11 | C21 | 107.6° | 109.5° |
| C20 | C11 | C10 | 109.5° | 109.5° |
| C11 | C20 | H9 | 109.5° | 109.5° |
| C11 | C20 | H10 | 109.4° | 109.5° |
| C11 | C20 | H11 | 109.5° | 109.5° |
| C21 | C11 | C10 | 106.6° | 109.5° |
| C11 | C21 | H12 | 109.5° | 109.5° |
| C11 | C21 | H13 | 109.5° | 109.5° |
| C11 | C21 | H14 | 109.5° | 109.5° |
| C11 | C10 | C08 | 110.6° | 109.2° |
| C11 | C10 | H1 | 109.2° | 109.5° |
| C11 | C10 | H2 | 109.2° | 109.6° |
| C13 | C08 | C10 | 111.0° | 109.0° |
| C13 | C08 | C09 | 108.4° | 109.6° |
| C08 | C13 | H3 | 108.8° | 109.5° |
| C08 | C13 | H4 | 108.8° | 109.5° |
| C13 | C08 | H17 | 110.0° | 109.5° |
| C10 | C08 | C09 | 107.5° | 109.6° |
| C08 | C10 | H1 | 109.2° | 109.5° |
| C08 | C10 | H2 | 109.2° | 109.5° |
| C10 | C08 | H17 | 110.0° | 109.5° |
| C08 | C09 | N06 | 109.3° | 109.5° |
| C09 | C08 | H17 | 109.9° | 109.7° |
| C08 | C09 | H18 | 109.5° | 109.5° |
| C08 | C09 | H19 | 109.5° | 109.5° |
| C09 | N06 | C15 | 115.8° | 111.0° |
| C09 | N06 | C14 | 115.0° | 111.0° |
| N06 | C09 | H18 | 109.5° | 109.5° |
| N06 | C09 | H19 | 109.5° | 109.4° |
| C15 | N06 | C14 | 116.4° | 111.2° |
| N06 | C15 | C17 | 111.7° | 109.6° |
| N06 | C15 | H5 | 108.9° | 109.5° |
| N06 | C15 | H6 | 108.9° | 109.5° |
| N06 | C14 | C16 | 113.8° | 109.5° |
| N06 | C14 | H20 | 108.4° | 109.5° |
| N06 | C14 | H21 | 108.4° | 109.5° |
| C15 | C17 | C12 | 110.2° | 109.3° |
| C17 | C15 | H5 | 108.9° | 109.5° |
| C17 | C15 | H6 | 108.9° | 109.4° |
| C15 | C17 | H7 | 109.3° | 109.5° |
| C15 | C17 | H8 | 109.3° | 109.5° |
| C14 | C16 | C12 | 108.6° | 109.3° |
| C16 | C14 | H20 | 108.4° | 109.4° |
| C16 | C14 | H21 | 108.4° | 109.5° |
| C14 | C16 | H22 | 109.7° | 109.5° |
| C14 | C16 | H23 | 109.7° | 109.5° |
| C17 | C12 | F03 | 112.8° | 109.5° |
| C17 | C12 | C16 | 108.7° | 109.1° |
| C17 | C12 | C19 | 109.1° | 109.5° |
| C12 | C17 | H7 | 109.3° | 109.5° |
| C12 | C17 | H8 | 109.3° | 109.5° |
| F03 | C12 | C16 | 108.5° | 109.5° |
| F03 | C12 | C19 | 108.8° | 109.6° |
| C16 | C12 | C19 | 108.9° | 109.5° |
| C12 | C16 | H22 | 109.7° | 109.5° |
| C12 | C16 | H23 | 109.7° | 109.6° |
| C12 | C19 | N07 | 105.7° | 109.5° |
| C12 | C19 | H26 | 110.4° | 109.5° |
| C12 | C19 | H27 | 110.4° | 109.5° |
| C19 | N07 | C22 | 120.2° | 120.0° |
| N07 | C19 | H26 | 110.4° | 109.5° |
| N07 | C19 | H27 | 110.4° | 109.4° |
| C19 | N07 | H30 | 119.9° | 120.0° |
| N07 | C22 | C23 | 123.4° | 120.0° |
| N07 | C22 | O05 | 117.8° | 120.0° |
| C22 | N07 | H30 | 119.9° | 120.0° |
| C23 | C22 | O05 | 118.8° | 120.0° |
| C22 | C23 | C25 | 120.1° | 120.2° |
| C22 | C23 | C24 | 120.4° | 120.1° |
| C23 | C25 | C26 | 120.1° | 119.8° |
| C25 | C23 | C24 | 119.5° | 119.8° |
| C23 | C25 | H28 | 119.9° | 120.1° |
| C25 | C26 | CL1 | 118.7° | 119.9° |
| C25 | C26 | C28 | 121.2° | 120.2° |
| C26 | C25 | H28 | 119.9° | 120.1° |
| C23 | C24 | C27 | 119.5° | 119.9° |
| C23 | C24 | H15 | 120.2° | 120.1° |
| CL1 | C26 | C28 | 120.1° | 119.9° |
| C26 | C28 | C27 | 118.5° | 120.2° |
| C26 | C28 | H16 | 120.7° | 119.9° |
| C24 | C27 | C28 | 121.1° | 120.1° |
| C24 | C27 | CL2 | 120.5° | 120.0° |
| C27 | C24 | H15 | 120.2° | 120.1° |
| C28 | C27 | CL2 | 118.4° | 119.9° |
| C27 | C28 | H16 | 120.8° | 119.9° |
| H1 | C10 | H2 | 109.5° | 109.5° |
| H3 | C13 | H4 | 109.5° | 109.5° |
| H5 | C15 | H6 | 109.5° | 109.4° |
| H7 | C17 | H8 | 109.5° | 109.5° |
| H9 | C20 | H10 | 109.5° | 109.4° |
| H9 | C20 | H11 | 109.4° | 109.5° |
| H10 | C20 | H11 | 109.5° | 109.5° |
| H12 | C21 | H13 | 109.5° | 109.4° |
| H12 | C21 | H14 | 109.4° | 109.5° |
| H13 | C21 | H14 | 109.5° | 109.5° |
| H18 | C09 | H19 | 109.5° | 109.5° |
| H20 | C14 | H21 | 109.5° | 109.5° |
| H22 | C16 | H23 | 109.5° | 109.5° |
| H24 | C18 | H25 | 109.5° | 109.5° |
| H26 | C19 | H27 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O04 | C18 | C13 | H24 | 120.3° | 120.0° |
| O04 | C18 | C13 | H25 | 120.3° | 120.0° |
| C18 | O04 | C11 | C20 | 54.9° | 178.9° |
| C18 | O04 | C11 | C21 | 174.4° | 58.8° |
| C18 | O04 | C11 | C10 | 68.9° | 61.2° |
| O04 | C18 | C13 | C08 | 20.4° | 57.6° |
| O04 | C18 | C13 | H3 | 100.0° | 177.6° |
| O04 | C18 | C13 | H4 | 140.8° | 62.3° |
| O04 | C18 | H24 | H25 | 119.1° | 120.0° |
| C13 | C18 | O04 | C11 | 41.9° | 61.2° |
| C18 | C13 | C08 | H3 | 120.4° | 119.9° |
| C18 | C13 | C08 | H4 | 120.4° | 119.9° |
| C18 | C13 | C08 | C10 | 56.7° | 57.0° |
| C18 | C13 | C08 | C09 | 174.5° | 176.8° |
| C18 | C13 | H3 | H4 | 118.8° | 120.1° |
| C18 | C13 | C08 | H17 | 65.3° | 62.8° |
| C13 | C18 | H24 | H25 | 119.0° | 120.0° |
| O04 | C11 | C20 | C21 | 120.0° | 120.0° |
| O04 | C11 | C20 | C10 | 124.5° | 120.0° |
| O04 | C11 | C21 | C10 | 119.5° | 120.0° |
| O04 | C11 | C10 | C08 | 27.1° | 57.6° |
| O04 | C11 | C10 | H1 | 93.1° | 62.3° |
| O04 | C11 | C10 | H2 | 147.2° | 177.5° |
| O04 | C11 | C20 | H9 | 180.0° | 60.0° |
| O04 | C11 | C20 | H10 | 60.0° | 60.0° |
| O04 | C11 | C20 | H11 | 60.0° | 180.0° |
| O04 | C11 | C21 | H12 | 180.0° | 179.9° |
| O04 | C11 | C21 | H13 | 60.0° | 60.0° |
| O04 | C11 | C21 | H14 | 60.0° | 60.1° |
| C11 | O04 | C18 | H24 | 78.4° | 58.9° |
| C11 | O04 | C18 | H25 | 162.2° | 178.8° |
| C20 | C11 | C21 | C10 | 117.4° | 120.0° |
| C20 | C11 | C10 | C08 | 98.9° | 177.6° |
| C20 | C11 | C10 | H1 | 141.0° | 57.7° |
| C20 | C11 | C10 | H2 | 21.3° | 62.4° |
| C11 | C20 | H9 | H10 | 120.0° | 120.0° |
| C11 | C20 | H9 | H11 | 120.0° | 120.1° |
| C11 | C20 | H10 | H11 | 120.0° | 120.1° |
| C20 | C11 | C21 | H12 | 56.9° | 60.0° |
| C20 | C11 | C21 | H13 | 176.9° | 180.0° |
| C20 | C11 | C21 | H14 | 63.1° | 60.0° |
| C21 | C11 | C10 | C08 | 144.9° | 62.4° |
| C21 | C11 | C10 | H1 | 24.8° | 177.7° |
| C21 | C11 | C10 | H2 | 94.9° | 57.5° |
| C21 | C11 | C20 | H9 | 60.0° | 60.0° |
| C21 | C11 | C20 | H10 | 60.0° | 180.0° |
| C21 | C11 | C20 | H11 | 180.0° | 60.0° |
| C11 | C21 | H12 | H13 | 120.0° | 120.0° |
| C11 | C21 | H12 | H14 | 120.0° | 120.0° |
| C11 | C21 | H13 | H14 | 120.0° | 120.0° |
| C11 | C10 | C08 | C13 | 30.9° | 56.9° |
| C11 | C10 | C08 | H1 | 120.2° | 119.9° |
| C11 | C10 | C08 | H2 | 120.2° | 120.0° |
| C11 | C10 | C08 | C09 | 149.3° | 176.8° |
| C11 | C10 | H1 | H2 | 119.5° | 120.2° |
| C10 | C11 | C20 | H9 | 55.5° | 180.0° |
| C10 | C11 | C20 | H10 | 175.5° | 60.0° |
| C10 | C11 | C20 | H11 | 64.5° | 60.0° |
| C10 | C11 | C21 | H12 | 60.5° | 60.0° |
| C10 | C11 | C21 | H13 | 59.5° | 60.0° |
| C10 | C11 | C21 | H14 | 179.5° | 180.0° |
| C11 | C10 | C08 | H17 | 91.1° | 62.8° |
| C13 | C08 | C10 | C09 | 118.4° | 119.9° |
| C13 | C08 | C10 | H17 | 122.0° | 119.8° |
| C13 | C08 | C09 | H17 | 120.2° | 120.2° |
| C13 | C08 | C09 | N06 | 116.5° | 65.4° |
| C13 | C08 | C10 | H1 | 151.1° | 63.0° |
| C13 | C08 | C10 | H2 | 89.3° | 177.0° |
| C08 | C13 | H3 | H4 | 118.7° | 120.2° |
| C13 | C08 | C09 | H18 | 123.6° | 174.6° |
| C13 | C08 | C09 | H19 | 3.5° | 54.5° |
| C08 | C13 | C18 | H24 | 140.7° | 62.4° |
| C08 | C13 | C18 | H25 | 99.9° | 177.6° |
| C10 | C08 | C09 | H17 | 119.7° | 120.2° |
| C10 | C08 | C09 | N06 | 123.5° | 175.0° |
| C08 | C10 | H1 | H2 | 119.5° | 120.1° |
| C10 | C08 | C13 | H3 | 63.8° | 176.9° |
| C10 | C08 | C13 | H4 | 177.1° | 63.0° |
| C10 | C08 | C09 | H18 | 3.5° | 55.0° |
| C10 | C08 | C09 | H19 | 116.5° | 65.0° |
| C08 | C09 | N06 | H18 | 120.0° | 120.0° |
| C08 | C09 | N06 | H19 | 120.0° | 120.0° |
| C08 | C09 | N06 | C15 | 128.4° | 170.0° |
| C08 | C09 | N06 | C14 | 91.1° | 65.8° |
| C09 | C08 | C10 | H1 | 90.6° | 56.9° |
| C09 | C08 | C10 | H2 | 29.1° | 63.1° |
| C09 | C08 | C13 | H3 | 54.1° | 63.2° |
| C09 | C08 | C13 | H4 | 65.1° | 56.9° |
| C08 | C09 | H18 | H19 | 120.1° | 120.0° |
| C09 | N06 | C15 | C14 | 139.9° | 124.1° |
| C09 | N06 | C15 | C17 | 72.9° | 174.2° |
| C09 | N06 | C14 | C16 | 113.2° | 174.2° |
| C09 | N06 | C15 | H5 | 47.4° | 54.1° |
| C09 | N06 | C15 | H6 | 166.7° | 65.8° |
| N06 | C09 | C08 | H17 | 3.8° | 54.8° |
| N06 | C09 | H18 | H19 | 120.1° | 120.0° |
| C09 | N06 | C14 | H20 | 126.2° | 65.8° |
| C09 | N06 | C14 | H21 | 7.5° | 54.2° |
| N06 | C15 | C17 | H5 | 120.3° | 120.0° |
| N06 | C15 | C17 | H6 | 120.3° | 120.0° |
| C15 | N06 | C14 | C16 | 27.0° | 61.7° |
| N06 | C15 | C17 | C12 | 36.9° | 59.2° |
| N06 | C15 | H5 | H6 | 119.0° | 120.0° |
| N06 | C15 | C17 | H7 | 83.2° | 179.2° |
| N06 | C15 | C17 | H8 | 157.1° | 60.8° |
| C15 | N06 | C09 | H18 | 111.6° | 70.0° |
| C15 | N06 | C09 | H19 | 8.5° | 50.0° |
| C15 | N06 | C14 | H20 | 93.6° | 58.3° |
| C15 | N06 | C14 | H21 | 147.7° | 178.3° |
| C14 | N06 | C15 | C17 | 67.0° | 61.7° |
| N06 | C14 | C16 | H20 | 120.7° | 120.0° |
| N06 | C14 | C16 | H21 | 120.6° | 120.0° |
| N06 | C14 | C16 | C12 | 36.4° | 59.2° |
| C14 | N06 | C15 | H5 | 172.7° | 178.2° |
| C14 | N06 | C15 | H6 | 53.4° | 58.3° |
| C14 | N06 | C09 | H18 | 28.8° | 54.2° |
| C14 | N06 | C09 | H19 | 148.9° | 174.2° |
| N06 | C14 | H20 | H21 | 118.0° | 120.0° |
| N06 | C14 | C16 | H22 | 83.4° | 179.1° |
| N06 | C14 | C16 | H23 | 156.3° | 60.8° |
| C15 | C17 | C12 | H7 | 120.1° | 120.0° |
| C15 | C17 | C12 | H8 | 120.1° | 119.9° |
| C15 | C17 | C12 | F03 | 97.3° | 62.3° |
| C15 | C17 | C12 | C16 | 23.1° | 57.6° |
| C15 | C17 | C12 | C19 | 141.7° | 177.5° |
| C17 | C15 | H5 | H6 | 119.0° | 119.9° |
| C15 | C17 | H7 | H8 | 119.6° | 120.0° |
| C14 | C16 | C12 | C17 | 58.3° | 57.7° |
| C14 | C16 | C12 | F03 | 64.7° | 62.2° |
| C14 | C16 | C12 | H22 | 119.8° | 119.9° |
| C14 | C16 | C12 | H23 | 119.8° | 119.9° |
| C14 | C16 | C12 | C19 | 177.1° | 177.5° |
| C16 | C14 | H20 | H21 | 118.0° | 120.0° |
| C14 | C16 | H22 | H23 | 120.4° | 120.0° |
| C17 | C12 | F03 | C16 | 120.5° | 119.7° |
| C17 | C12 | F03 | C19 | 121.2° | 120.2° |
| C17 | C12 | C16 | C19 | 118.7° | 119.9° |
| C17 | C12 | C19 | N07 | 102.0° | 175.0° |
| C12 | C17 | C15 | H5 | 157.3° | 179.2° |
| C12 | C17 | C15 | H6 | 83.4° | 60.9° |
| C12 | C17 | H7 | H8 | 119.7° | 120.1° |
| C17 | C12 | C16 | H22 | 61.5° | 177.6° |
| C17 | C12 | C16 | H23 | 178.1° | 62.3° |
| C17 | C12 | C19 | H26 | 17.5° | 55.0° |
| C17 | C12 | C19 | H27 | 138.7° | 65.0° |
| F03 | C12 | C16 | C19 | 118.3° | 120.2° |
| F03 | C12 | C19 | N07 | 21.4° | 54.9° |
| F03 | C12 | C17 | H7 | 22.8° | 57.7° |
| F03 | C12 | C17 | H8 | 142.6° | 177.8° |
| F03 | C12 | C16 | H22 | 175.5° | 57.7° |
| F03 | C12 | C16 | H23 | 55.2° | 177.8° |
| F03 | C12 | C19 | H26 | 140.9° | 65.2° |
| F03 | C12 | C19 | H27 | 97.9° | 174.8° |
| C16 | C12 | C19 | N07 | 139.6° | 65.3° |
| C16 | C12 | C17 | H7 | 143.1° | 177.6° |
| C16 | C12 | C17 | H8 | 97.0° | 62.3° |
| C12 | C16 | C14 | H20 | 157.1° | 60.8° |
| C12 | C16 | C14 | H21 | 84.2° | 179.2° |
| C12 | C16 | H22 | H23 | 120.4° | 120.2° |
| C16 | C12 | C19 | H26 | 101.0° | 174.6° |
| C16 | C12 | C19 | H27 | 20.2° | 54.6° |
| C12 | C19 | N07 | H26 | 119.4° | 120.0° |
| C12 | C19 | N07 | H27 | 119.4° | 120.0° |
| C12 | C19 | N07 | C22 | 105.3° | 180.0° |
| C19 | C12 | C17 | H7 | 98.2° | 62.5° |
| C19 | C12 | C17 | H8 | 21.6° | 57.6° |
| C19 | C12 | C16 | H22 | 57.2° | 62.5° |
| C19 | C12 | C16 | H23 | 63.1° | 57.6° |
| C12 | C19 | H26 | H27 | 121.8° | 120.0° |
| C12 | C19 | N07 | H30 | 74.7° | 0.0° |
| C19 | N07 | C22 | H30 | 180.0° | 180.0° |
| C19 | N07 | C22 | C23 | 178.9° | 180.0° |
| C19 | N07 | C22 | O05 | 0.3° | 0.1° |
| N07 | C19 | H26 | H27 | 121.7° | 120.0° |
| N07 | C22 | C23 | O05 | 178.6° | 180.0° |
| N07 | C22 | C23 | C25 | 36.6° | 0.0° |
| N07 | C22 | C23 | C24 | 144.9° | 180.0° |
| C22 | N07 | C19 | H26 | 135.3° | 60.0° |
| C22 | N07 | C19 | H27 | 14.1° | 60.1° |
| C22 | C23 | C25 | C24 | 178.5° | 180.0° |
| C22 | C23 | C25 | C26 | 179.3° | 180.0° |
| C22 | C23 | C24 | C27 | 179.4° | 180.0° |
| C22 | C23 | C24 | H15 | 0.6° | 0.3° |
| C22 | C23 | C25 | H28 | 0.7° | 0.0° |
| C23 | C22 | N07 | H30 | 1.1° | 0.0° |
| O05 | C22 | C23 | C25 | 142.0° | 180.0° |
| O05 | C22 | C23 | C24 | 36.5° | 0.0° |
| O05 | C22 | N07 | H30 | 179.8° | 180.0° |
| C23 | C25 | C26 | H28 | 180.0° | 180.0° |
| C23 | C25 | C26 | CL1 | 178.9° | 179.7° |
| C23 | C25 | C26 | C28 | 0.3° | 0.2° |
| C25 | C23 | C24 | C27 | 0.9° | 0.0° |
| C25 | C23 | C24 | H15 | 179.1° | 179.7° |
| C26 | C25 | C23 | C24 | 0.8° | 0.0° |
| C25 | C26 | CL1 | C28 | 179.3° | 179.5° |
| C25 | C26 | C28 | C27 | 0.0° | 0.5° |
| C25 | C26 | C28 | H16 | 180.0° | 180.0° |
| C23 | C24 | C27 | H15 | 180.0° | 179.7° |
| C23 | C24 | C27 | C28 | 0.6° | 0.2° |
| C23 | C24 | C27 | CL2 | 179.2° | 179.8° |
| C24 | C23 | C25 | H28 | 179.2° | 180.0° |
| CL1 | C26 | C28 | C27 | 179.2° | 180.0° |
| CL1 | C26 | C28 | H16 | 0.8° | 0.5° |
| CL1 | C26 | C25 | H28 | 1.1° | 0.2° |
| C26 | C28 | C27 | C24 | 0.2° | 0.5° |
| C26 | C28 | C27 | H16 | 180.0° | 179.5° |
| C26 | C28 | C27 | CL2 | 179.7° | 179.5° |
| C28 | C26 | C25 | H28 | 179.7° | 179.8° |
| C24 | C27 | C28 | CL2 | 179.9° | 180.0° |
| C24 | C27 | C28 | H16 | 179.8° | 180.0° |
| C28 | C27 | C24 | H15 | 179.4° | 180.0° |
| CL2 | C27 | C24 | H15 | 0.7° | 0.0° |
| CL2 | C27 | C28 | H16 | 0.3° | 0.0° |
| H1 | C10 | C08 | H17 | 29.1° | 177.2° |
| H2 | C10 | C08 | H17 | 148.7° | 57.2° |
| H3 | C13 | C08 | H17 | 174.3° | 57.1° |
| H3 | C13 | C18 | H24 | 20.3° | 57.5° |
| H3 | C13 | C18 | H25 | 139.6° | 62.5° |
| H4 | C13 | C08 | H17 | 55.1° | 177.2° |
| H4 | C13 | C18 | H24 | 98.9° | 177.7° |
| H4 | C13 | C18 | H25 | 20.5° | 57.7° |
| H5 | C15 | C17 | H7 | 37.2° | 60.8° |
| H5 | C15 | C17 | H8 | 82.6° | 59.2° |
| H6 | C15 | C17 | H7 | 156.5° | 59.1° |
| H6 | C15 | C17 | H8 | 36.7° | 179.2° |
| H9 | C20 | H10 | H11 | 120.0° | 120.0° |
| H12 | C21 | H13 | H14 | 120.0° | 120.0° |
| H17 | C08 | C09 | H18 | 116.2° | 65.2° |
| H17 | C08 | C09 | H19 | 123.8° | 174.7° |
| H20 | C14 | C16 | H22 | 37.3° | 59.1° |
| H20 | C14 | C16 | H23 | 83.1° | 179.2° |
| H21 | C14 | C16 | H22 | 156.0° | 60.9° |
| H21 | C14 | C16 | H23 | 35.6° | 59.2° |
| H26 | C19 | N07 | H30 | 44.8° | 120.0° |
| H27 | C19 | N07 | H30 | 165.9° | 120.0° |
