SKV
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F3 | C2 | sing | 1.40Å | 1.37Å | |
| C2 | F4 | sing | 1.40Å | 1.36Å | |
| C2 | C5 | sing | 1.51Å | 1.50Å | |
| C2 | F1 | sing | 1.40Å | 1.37Å | |
| C11 | C5 | doub | 1.38Å | 1.38Å | Aromatic |
| C11 | C10 | sing | 1.38Å | 1.39Å | Aromatic |
| C5 | C6 | sing | 1.38Å | 1.38Å | Aromatic |
| C10 | C8 | doub | 1.38Å | 1.37Å | Aromatic |
| C18 | C17 | sing | 1.53Å | 1.53Å | |
| C6 | C7 | doub | 1.40Å | 1.40Å | Aromatic |
| C8 | C7 | sing | 1.40Å | 1.40Å | Aromatic |
| C8 | F9 | sing | 1.35Å | 1.35Å | |
| C7 | C12 | sing | 1.48Å | 1.47Å | |
| C12 | O13 | doub | 1.22Å | 1.24Å | |
| C12 | N14 | sing | 1.35Å | 1.34Å | |
| C19 | C17 | sing | 1.53Å | 1.54Å | |
| C17 | C15 | sing | 1.53Å | 1.52Å | |
| N40 | N39 | sing | 1.40Å | 1.41Å | Aromatic |
| N40 | C42 | doub | 1.32Å | 1.37Å | Aromatic |
| N14 | C15 | sing | 1.46Å | 1.46Å | |
| C43 | C42 | sing | 1.41Å | 1.38Å | Aromatic |
| C43 | C44 | doub | 1.35Å | 1.36Å | Aromatic |
| C15 | C20 | sing | 1.51Å | 1.53Å | |
| N39 | C38 | sing | 1.34Å | 1.29Å | Aromatic |
| C42 | C37 | sing | 1.47Å | 1.40Å | Aromatic |
| C44 | C35 | sing | 1.40Å | 1.38Å | Aromatic |
| C38 | C37 | doub | 1.38Å | 1.46Å | Aromatic |
| C20 | O21 | doub | 1.21Å | 1.24Å | |
| C20 | N22 | sing | 1.35Å | 1.34Å | |
| C37 | C36 | sing | 1.41Å | 1.39Å | Aromatic |
| C35 | C36 | doub | 1.36Å | 1.38Å | Aromatic |
| C35 | N34 | sing | 1.40Å | 1.40Å | |
| C24 | C23 | sing | 1.53Å | 1.55Å | |
| C24 | C25 | sing | 1.52Å | 1.53Å | |
| C23 | N22 | sing | 1.47Å | 1.46Å | |
| N22 | C27 | sing | 1.47Å | 1.49Å | |
| N34 | C25 | sing | 1.47Å | 1.47Å | |
| N34 | C32 | sing | 1.35Å | 1.34Å | |
| C25 | C26 | sing | 1.53Å | 1.53Å | |
| C25 | C28 | sing | 1.51Å | 1.50Å | |
| C27 | C26 | sing | 1.53Å | 1.54Å | |
| C32 | O33 | doub | 1.22Å | 1.21Å | |
| C32 | N30 | sing | 1.34Å | 1.33Å | |
| C28 | N30 | sing | 1.35Å | 1.34Å | |
| C28 | O29 | doub | 1.21Å | 1.20Å | |
| N30 | C31 | sing | 1.46Å | 1.46Å | |
| C6 | H1 | sing | 1.08Å | 1.08Å | |
| C11 | H2 | sing | 1.08Å | 1.08Å | |
| C15 | H3 | sing | 1.09Å | 1.10Å | |
| C17 | H4 | sing | 1.09Å | 1.10Å | |
| C18 | H5 | sing | 1.09Å | 1.10Å | |
| C18 | H6 | sing | 1.09Å | 1.10Å | |
| C18 | H7 | sing | 1.09Å | 1.10Å | |
| C19 | H8 | sing | 1.09Å | 1.10Å | |
| C19 | H9 | sing | 1.09Å | 1.10Å | |
| C19 | H10 | sing | 1.09Å | 1.10Å | |
| C23 | H11 | sing | 1.09Å | 1.10Å | |
| C23 | H12 | sing | 1.09Å | 1.10Å | |
| C24 | H13 | sing | 1.09Å | 1.10Å | |
| C24 | H14 | sing | 1.09Å | 1.10Å | |
| C27 | H15 | sing | 1.09Å | 1.10Å | |
| C27 | H16 | sing | 1.09Å | 1.10Å | |
| C31 | H17 | sing | 1.09Å | 1.10Å | |
| C31 | H18 | sing | 1.09Å | 1.10Å | |
| C31 | H19 | sing | 1.09Å | 1.10Å | |
| C36 | H20 | sing | 1.08Å | 1.08Å | |
| C38 | H21 | sing | 1.08Å | 1.08Å | |
| C10 | H22 | sing | 1.08Å | 1.08Å | |
| N14 | H23 | sing | 0.97Å | 1.00Å | |
| C26 | H24 | sing | 1.09Å | 1.10Å | |
| C26 | H25 | sing | 1.09Å | 1.10Å | |
| N39 | H26 | sing | 0.97Å | 1.00Å | |
| C43 | H27 | sing | 1.08Å | 1.08Å | |
| C44 | H28 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F3 | C2 | F4 | 107.8° | 109.5° |
| F3 | C2 | C5 | 109.6° | 109.5° |
| F3 | C2 | F1 | 114.3° | 109.5° |
| F4 | C2 | C5 | 114.1° | 109.5° |
| F4 | C2 | F1 | 102.1° | 109.4° |
| C5 | C2 | F1 | 108.9° | 109.5° |
| C2 | C5 | C11 | 120.8° | 119.9° |
| C2 | C5 | C6 | 119.5° | 119.9° |
| C5 | C11 | C10 | 120.2° | 120.3° |
| C11 | C5 | C6 | 119.7° | 120.2° |
| C5 | C11 | H2 | 119.9° | 119.9° |
| C11 | C10 | C8 | 120.5° | 120.1° |
| C10 | C11 | H2 | 119.9° | 119.9° |
| C11 | C10 | H22 | 119.7° | 119.9° |
| C5 | C6 | C7 | 120.7° | 119.9° |
| C5 | C6 | H1 | 119.7° | 120.0° |
| C10 | C8 | C7 | 119.9° | 119.8° |
| C10 | C8 | F9 | 119.0° | 120.1° |
| C8 | C10 | H22 | 119.8° | 119.9° |
| C18 | C17 | C19 | 110.0° | 109.5° |
| C18 | C17 | C15 | 110.3° | 109.5° |
| C18 | C17 | H4 | 107.8° | 109.4° |
| C17 | C18 | H5 | 109.5° | 109.5° |
| C17 | C18 | H6 | 109.5° | 109.5° |
| C17 | C18 | H7 | 109.5° | 109.4° |
| C6 | C7 | C8 | 118.9° | 119.7° |
| C6 | C7 | C12 | 117.3° | 120.1° |
| C7 | C6 | H1 | 119.7° | 120.1° |
| C7 | C8 | F9 | 121.1° | 120.1° |
| C8 | C7 | C12 | 123.7° | 120.2° |
| C7 | C12 | O13 | 120.3° | 120.0° |
| C7 | C12 | N14 | 120.6° | 120.0° |
| O13 | C12 | N14 | 119.1° | 120.0° |
| C12 | N14 | C15 | 123.0° | 120.0° |
| C12 | N14 | H23 | 118.5° | 120.0° |
| C19 | C17 | C15 | 113.1° | 109.5° |
| C19 | C17 | H4 | 107.7° | 109.5° |
| C17 | C19 | H8 | 109.5° | 109.5° |
| C17 | C19 | H9 | 109.5° | 109.5° |
| C17 | C19 | H10 | 109.5° | 109.5° |
| C17 | C15 | N14 | 113.1° | 109.5° |
| C17 | C15 | C20 | 114.8° | 109.5° |
| C17 | C15 | H3 | 108.4° | 109.5° |
| C15 | C17 | H4 | 107.8° | 109.5° |
| N39 | N40 | C42 | 107.4° | 108.9° |
| N40 | N39 | C38 | 111.5° | 109.9° |
| N40 | N39 | H26 | 124.2° | 125.0° |
| N40 | C42 | C43 | 133.4° | 134.5° |
| N40 | C42 | C37 | 107.5° | 106.8° |
| N14 | C15 | C20 | 102.8° | 109.5° |
| N14 | C15 | H3 | 109.2° | 109.5° |
| C15 | N14 | H23 | 118.5° | 120.0° |
| C42 | C43 | C44 | 119.7° | 119.7° |
| C43 | C42 | C37 | 119.1° | 118.6° |
| C42 | C43 | H27 | 120.1° | 120.2° |
| C43 | C44 | C35 | 122.1° | 121.8° |
| C44 | C43 | H27 | 120.1° | 120.2° |
| C43 | C44 | H28 | 119.0° | 119.1° |
| C15 | C20 | O21 | 118.2° | 120.0° |
| C15 | C20 | N22 | 123.2° | 120.0° |
| C20 | C15 | H3 | 108.3° | 109.4° |
| N39 | C38 | C37 | 107.2° | 107.9° |
| N39 | C38 | H21 | 126.4° | 126.0° |
| C38 | N39 | H26 | 124.3° | 125.1° |
| C42 | C37 | C38 | 106.4° | 106.4° |
| C42 | C37 | C36 | 120.4° | 118.9° |
| C44 | C35 | C36 | 119.4° | 121.6° |
| C44 | C35 | N34 | 120.1° | 119.2° |
| C35 | C44 | H28 | 118.9° | 119.1° |
| C38 | C37 | C36 | 133.2° | 134.8° |
| C37 | C38 | H21 | 126.4° | 126.0° |
| O21 | C20 | N22 | 118.4° | 120.0° |
| C20 | N22 | C23 | 125.3° | 120.6° |
| C20 | N22 | C27 | 122.6° | 120.6° |
| C37 | C36 | C35 | 119.2° | 119.5° |
| C37 | C36 | H20 | 120.4° | 120.3° |
| C36 | C35 | N34 | 120.5° | 119.2° |
| C35 | C36 | H20 | 120.4° | 120.3° |
| C35 | N34 | C25 | 126.7° | 126.7° |
| C35 | N34 | C32 | 126.8° | 126.8° |
| C23 | C24 | C25 | 113.9° | 109.4° |
| C24 | C23 | N22 | 101.8° | 108.7° |
| C24 | C23 | H11 | 111.3° | 109.6° |
| C24 | C23 | H12 | 111.4° | 109.7° |
| C23 | C24 | H13 | 108.4° | 109.5° |
| C23 | C24 | H14 | 108.4° | 109.5° |
| C24 | C25 | N34 | 111.7° | 110.5° |
| C24 | C25 | C26 | 111.8° | 110.8° |
| C24 | C25 | C28 | 108.3° | 110.4° |
| C25 | C24 | H13 | 108.4° | 109.5° |
| C25 | C24 | H14 | 108.3° | 109.5° |
| C23 | N22 | C27 | 111.8° | 118.8° |
| N22 | C23 | H11 | 111.4° | 109.6° |
| N22 | C23 | H12 | 111.4° | 109.6° |
| N22 | C27 | C26 | 106.8° | 108.7° |
| N22 | C27 | H15 | 110.1° | 109.6° |
| N22 | C27 | H16 | 110.1° | 109.6° |
| C25 | N34 | C32 | 106.5° | 106.4° |
| N34 | C25 | C26 | 109.8° | 110.5° |
| N34 | C25 | C28 | 103.3° | 104.0° |
| N34 | C32 | O33 | 123.0° | 123.8° |
| N34 | C32 | N30 | 112.6° | 112.5° |
| C26 | C25 | C28 | 111.6° | 110.4° |
| C25 | C26 | C27 | 112.6° | 109.4° |
| C25 | C26 | H24 | 108.7° | 109.5° |
| C25 | C26 | H25 | 108.7° | 109.5° |
| C25 | C28 | N30 | 106.2° | 105.5° |
| C25 | C28 | O29 | 126.7° | 127.2° |
| C26 | C27 | H15 | 110.1° | 109.6° |
| C26 | C27 | H16 | 110.1° | 109.6° |
| C27 | C26 | H24 | 108.7° | 109.5° |
| C27 | C26 | H25 | 108.7° | 109.5° |
| O33 | C32 | N30 | 124.4° | 123.7° |
| C32 | N30 | C28 | 111.3° | 111.6° |
| C32 | N30 | C31 | 125.5° | 124.2° |
| N30 | C28 | O29 | 127.0° | 127.3° |
| C28 | N30 | C31 | 123.2° | 124.1° |
| N30 | C31 | H17 | 109.5° | 109.4° |
| N30 | C31 | H18 | 109.4° | 109.5° |
| N30 | C31 | H19 | 109.5° | 109.5° |
| H5 | C18 | H6 | 109.4° | 109.5° |
| H5 | C18 | H7 | 109.5° | 109.5° |
| H6 | C18 | H7 | 109.5° | 109.5° |
| H8 | C19 | H9 | 109.4° | 109.5° |
| H8 | C19 | H10 | 109.5° | 109.5° |
| H9 | C19 | H10 | 109.5° | 109.4° |
| H11 | C23 | H12 | 109.5° | 109.6° |
| H13 | C24 | H14 | 109.5° | 109.5° |
| H15 | C27 | H16 | 109.5° | 109.6° |
| H17 | C31 | H18 | 109.5° | 109.5° |
| H17 | C31 | H19 | 109.4° | 109.5° |
| H18 | C31 | H19 | 109.5° | 109.4° |
| H24 | C26 | H25 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F3 | C2 | F4 | C5 | 122.0° | 120.0° |
| F3 | C2 | F4 | F1 | 120.7° | 120.0° |
| F3 | C2 | C5 | F1 | 125.7° | 120.0° |
| F3 | C2 | C5 | C11 | 75.7° | 149.7° |
| F3 | C2 | C5 | C6 | 102.9° | 30.0° |
| F4 | C2 | C5 | F1 | 113.3° | 120.0° |
| F4 | C2 | C5 | C11 | 45.4° | 90.2° |
| F4 | C2 | C5 | C6 | 136.1° | 90.0° |
| C2 | C5 | C11 | C6 | 178.5° | 179.8° |
| C2 | C5 | C11 | C10 | 179.5° | 179.7° |
| C2 | C5 | C6 | C7 | 179.4° | 180.0° |
| C2 | C5 | C6 | H1 | 0.6° | 0.1° |
| C2 | C5 | C11 | H2 | 0.5° | 0.1° |
| F1 | C2 | C5 | C11 | 158.6° | 29.7° |
| F1 | C2 | C5 | C6 | 22.8° | 150.0° |
| C5 | C11 | C10 | H2 | 180.0° | 179.8° |
| C5 | C11 | C10 | C8 | 1.5° | 0.5° |
| C11 | C5 | C6 | C7 | 0.8° | 0.2° |
| C11 | C5 | C6 | H1 | 179.2° | 179.8° |
| C5 | C11 | C10 | H22 | 178.5° | 180.0° |
| C10 | C11 | C5 | C6 | 1.9° | 0.5° |
| C11 | C10 | C8 | H22 | 180.0° | 179.4° |
| C11 | C10 | C8 | C7 | 0.0° | 0.3° |
| C11 | C10 | C8 | F9 | 178.3° | 179.7° |
| C5 | C6 | C7 | H1 | 180.0° | 180.0° |
| C5 | C6 | C7 | C8 | 0.7° | 0.0° |
| C5 | C6 | C7 | C12 | 178.3° | 180.0° |
| C6 | C5 | C11 | H2 | 178.1° | 179.7° |
| C10 | C8 | C7 | C6 | 1.1° | 0.0° |
| C10 | C8 | C7 | F9 | 178.3° | 180.0° |
| C10 | C8 | C7 | C12 | 178.6° | 180.0° |
| C8 | C10 | C11 | H2 | 178.5° | 179.7° |
| C18 | C17 | C19 | C15 | 123.8° | 120.0° |
| C18 | C17 | C19 | H4 | 117.2° | 120.0° |
| C18 | C17 | C15 | H4 | 117.5° | 120.0° |
| C18 | C17 | C15 | N14 | 55.8° | 55.5° |
| C18 | C17 | C15 | C20 | 173.3° | 175.5° |
| C18 | C17 | C15 | H3 | 65.5° | 64.5° |
| C17 | C18 | H5 | H6 | 120.0° | 120.0° |
| C17 | C18 | H5 | H7 | 120.0° | 120.0° |
| C17 | C18 | H6 | H7 | 120.0° | 120.0° |
| C18 | C17 | C19 | H8 | 180.0° | 173.1° |
| C18 | C17 | C19 | H9 | 60.0° | 53.0° |
| C18 | C17 | C19 | H10 | 60.0° | 66.9° |
| C6 | C7 | C8 | C12 | 177.5° | 180.0° |
| C6 | C7 | C8 | F9 | 177.2° | 180.0° |
| C6 | C7 | C12 | O13 | 4.5° | 180.0° |
| C6 | C7 | C12 | N14 | 175.5° | 0.0° |
| C8 | C7 | C12 | O13 | 178.0° | 0.0° |
| C8 | C7 | C12 | N14 | 2.0° | 179.9° |
| C8 | C7 | C6 | H1 | 179.3° | 179.9° |
| C7 | C8 | C10 | H22 | 180.0° | 179.7° |
| F9 | C8 | C7 | C12 | 0.3° | 0.0° |
| F9 | C8 | C10 | H22 | 1.7° | 0.3° |
| C7 | C12 | O13 | N14 | 179.9° | 180.0° |
| C7 | C12 | N14 | C15 | 178.0° | 180.0° |
| C12 | C7 | C6 | H1 | 1.7° | 0.0° |
| C7 | C12 | N14 | H23 | 2.0° | 0.1° |
| O13 | C12 | N14 | C15 | 2.0° | 0.1° |
| O13 | C12 | N14 | H23 | 178.0° | 180.0° |
| C12 | N14 | C15 | C17 | 106.1° | 84.9° |
| C12 | N14 | C15 | H23 | 180.0° | 179.9° |
| C12 | N14 | C15 | C20 | 129.5° | 155.0° |
| C12 | N14 | C15 | H3 | 14.6° | 35.1° |
| C19 | C17 | C15 | H4 | 118.9° | 120.0° |
| C19 | C17 | C15 | N14 | 67.8° | 175.5° |
| C19 | C17 | C15 | C20 | 49.7° | 64.5° |
| C19 | C17 | C15 | H3 | 170.9° | 55.5° |
| C19 | C17 | C18 | H5 | 180.0° | 60.0° |
| C19 | C17 | C18 | H6 | 60.0° | 60.0° |
| C19 | C17 | C18 | H7 | 60.0° | 180.0° |
| C17 | C19 | H8 | H9 | 120.0° | 120.1° |
| C17 | C19 | H8 | H10 | 120.0° | 120.0° |
| C17 | C19 | H9 | H10 | 120.0° | 120.0° |
| C17 | C15 | N14 | C20 | 124.4° | 120.0° |
| C17 | C15 | N14 | H3 | 120.8° | 120.0° |
| C17 | C15 | C20 | H3 | 121.2° | 120.0° |
| C17 | C15 | C20 | O21 | 107.8° | 6.6° |
| C17 | C15 | C20 | N22 | 76.7° | 173.4° |
| C15 | C17 | C18 | H5 | 54.6° | 60.0° |
| C15 | C17 | C18 | H6 | 174.6° | 180.0° |
| C15 | C17 | C18 | H7 | 65.4° | 60.0° |
| C15 | C17 | C19 | H8 | 56.2° | 66.9° |
| C15 | C17 | C19 | H9 | 63.8° | 173.1° |
| C15 | C17 | C19 | H10 | 176.2° | 53.1° |
| C17 | C15 | N14 | H23 | 73.9° | 95.0° |
| N39 | N40 | C42 | C43 | 179.8° | 180.0° |
| N40 | N39 | C38 | H26 | 180.0° | 180.0° |
| N39 | N40 | C42 | C37 | 0.3° | 0.0° |
| N40 | N39 | C38 | C37 | 0.1° | 0.0° |
| N40 | N39 | C38 | H21 | 179.9° | 180.0° |
| N40 | C42 | C43 | C37 | 179.5° | 180.0° |
| N40 | C42 | C43 | C44 | 178.6° | 179.8° |
| C42 | N40 | N39 | C38 | 0.3° | 0.0° |
| N40 | C42 | C37 | C38 | 0.2° | 0.0° |
| N40 | C42 | C37 | C36 | 180.0° | 180.0° |
| C42 | N40 | N39 | H26 | 179.8° | 180.0° |
| N40 | C42 | C43 | H27 | 1.4° | 0.0° |
| N14 | C15 | C20 | H3 | 115.5° | 120.0° |
| N14 | C15 | C20 | O21 | 15.5° | 113.4° |
| N14 | C15 | C20 | N22 | 160.0° | 66.6° |
| N14 | C15 | C17 | H4 | 173.2° | 64.5° |
| C42 | C43 | C44 | H27 | 180.0° | 179.8° |
| C42 | C43 | C44 | C35 | 1.7° | 0.5° |
| C43 | C42 | C37 | C38 | 179.8° | 180.0° |
| C43 | C42 | C37 | C36 | 0.4° | 0.0° |
| C42 | C43 | C44 | H28 | 178.3° | 180.0° |
| C44 | C43 | C42 | C37 | 0.9° | 0.2° |
| C43 | C44 | C35 | H28 | 180.0° | 179.5° |
| C43 | C44 | C35 | C36 | 1.2° | 0.6° |
| C43 | C44 | C35 | N34 | 177.2° | 179.8° |
| C15 | C20 | O21 | N22 | 175.7° | 180.0° |
| C15 | C20 | N22 | C23 | 6.9° | 5.7° |
| C15 | C20 | N22 | C27 | 179.8° | 174.0° |
| C20 | C15 | C17 | H4 | 69.2° | 55.6° |
| C20 | C15 | N14 | H23 | 50.5° | 25.1° |
| N39 | C38 | C37 | C42 | 0.0° | 0.0° |
| N39 | C38 | C37 | H21 | 180.0° | 180.0° |
| N39 | C38 | C37 | C36 | 179.8° | 180.0° |
| C42 | C37 | C38 | C36 | 179.8° | 180.0° |
| C42 | C37 | C36 | C35 | 0.9° | 0.0° |
| C42 | C37 | C36 | H20 | 179.1° | 180.0° |
| C42 | C37 | C38 | H21 | 180.0° | 180.0° |
| C37 | C42 | C43 | H27 | 179.1° | 180.0° |
| C44 | C35 | C36 | C37 | 0.1° | 0.3° |
| C44 | C35 | C36 | N34 | 178.4° | 179.6° |
| C44 | C35 | N34 | C25 | 82.9° | 179.7° |
| C44 | C35 | N34 | C32 | 98.1° | 0.3° |
| C44 | C35 | C36 | H20 | 179.9° | 179.7° |
| C35 | C44 | C43 | H27 | 178.3° | 179.7° |
| C38 | C37 | C36 | C35 | 179.3° | 180.0° |
| C38 | C37 | C36 | H20 | 0.7° | 0.0° |
| C37 | C38 | N39 | H26 | 179.9° | 180.0° |
| O21 | C20 | N22 | C23 | 177.6° | 174.3° |
| O21 | C20 | N22 | C27 | 4.8° | 6.0° |
| O21 | C20 | C15 | H3 | 131.0° | 126.6° |
| C20 | N22 | C23 | C24 | 101.8° | 125.6° |
| C20 | N22 | C23 | C27 | 173.5° | 179.7° |
| C20 | N22 | C27 | C26 | 103.6° | 125.6° |
| N22 | C20 | C15 | H3 | 44.5° | 53.4° |
| C20 | N22 | C23 | H11 | 139.5° | 114.6° |
| C20 | N22 | C23 | H12 | 17.0° | 5.7° |
| C20 | N22 | C27 | H15 | 136.8° | 5.8° |
| C20 | N22 | C27 | H16 | 16.0° | 114.6° |
| C37 | C36 | C35 | H20 | 180.0° | 180.0° |
| C37 | C36 | C35 | N34 | 178.5° | 180.0° |
| C36 | C37 | C38 | H21 | 0.2° | 0.0° |
| C36 | C35 | N34 | C25 | 95.5° | 0.0° |
| C36 | C35 | N34 | C32 | 83.5° | 180.0° |
| C36 | C35 | C44 | H28 | 178.8° | 179.9° |
| C35 | N34 | C25 | C24 | 63.9° | 61.5° |
| C35 | N34 | C25 | C32 | 179.1° | 180.0° |
| C35 | N34 | C25 | C26 | 60.7° | 61.6° |
| C35 | N34 | C25 | C28 | 179.9° | 180.0° |
| C35 | N34 | C32 | O33 | 0.4° | 0.0° |
| C35 | N34 | C32 | N30 | 179.7° | 180.0° |
| N34 | C35 | C36 | H20 | 1.5° | 0.0° |
| N34 | C35 | C44 | H28 | 2.8° | 0.3° |
| C23 | C24 | C25 | H13 | 120.7° | 120.0° |
| C23 | C24 | C25 | H14 | 120.7° | 119.9° |
| C24 | C23 | N22 | H11 | 118.7° | 119.8° |
| C24 | C23 | N22 | H12 | 118.8° | 119.9° |
| C24 | C23 | N22 | C27 | 71.7° | 54.2° |
| C23 | C24 | C25 | N34 | 172.5° | 62.9° |
| C23 | C24 | C25 | C26 | 49.0° | 60.0° |
| C23 | C24 | C25 | C28 | 74.4° | 177.4° |
| C24 | C23 | H11 | H12 | 123.6° | 120.4° |
| C23 | C24 | H13 | H14 | 118.0° | 120.0° |
| C25 | C24 | C23 | N22 | 59.9° | 53.8° |
| C24 | C25 | N34 | C26 | 124.6° | 123.1° |
| C24 | C25 | N34 | C28 | 116.2° | 118.5° |
| C24 | C25 | N34 | C32 | 117.0° | 118.5° |
| C24 | C25 | C26 | C28 | 121.5° | 122.6° |
| C24 | C25 | C26 | C27 | 43.8° | 60.0° |
| C24 | C25 | C28 | N30 | 118.7° | 118.6° |
| C24 | C25 | C28 | O29 | 61.2° | 61.5° |
| C25 | C24 | C23 | H11 | 58.8° | 66.0° |
| C25 | C24 | C23 | H12 | 178.7° | 173.6° |
| C25 | C24 | H13 | H14 | 118.0° | 120.0° |
| C24 | C25 | C26 | H24 | 76.7° | 60.0° |
| C24 | C25 | C26 | H25 | 164.2° | 179.9° |
| C23 | N22 | C27 | C26 | 70.1° | 54.2° |
| N22 | C23 | H11 | H12 | 123.6° | 120.3° |
| N22 | C23 | C24 | H13 | 60.7° | 173.8° |
| N22 | C23 | C24 | H14 | 179.4° | 66.1° |
| C23 | N22 | C27 | H15 | 49.5° | 174.0° |
| C23 | N22 | C27 | H16 | 170.3° | 65.6° |
| N22 | C27 | C26 | C25 | 52.0° | 53.8° |
| N22 | C27 | C26 | H15 | 119.6° | 119.8° |
| N22 | C27 | C26 | H16 | 119.6° | 119.8° |
| C27 | N22 | C23 | H11 | 47.0° | 65.6° |
| C27 | N22 | C23 | H12 | 169.5° | 174.0° |
| N22 | C27 | H15 | H16 | 121.2° | 120.4° |
| N22 | C27 | C26 | H24 | 68.4° | 66.2° |
| N22 | C27 | C26 | H25 | 172.5° | 173.8° |
| N34 | C25 | C26 | C28 | 114.0° | 114.5° |
| N34 | C25 | C26 | C27 | 168.3° | 62.9° |
| C25 | N34 | C32 | O33 | 178.7° | 180.0° |
| C25 | N34 | C32 | N30 | 1.2° | 0.0° |
| N34 | C25 | C28 | N30 | 0.1° | 0.0° |
| N34 | C25 | C28 | O29 | 179.8° | 180.0° |
| N34 | C25 | C24 | H13 | 51.8° | 57.1° |
| N34 | C25 | C24 | H14 | 66.9° | 177.2° |
| N34 | C25 | C26 | H24 | 47.8° | 177.1° |
| N34 | C25 | C26 | H25 | 71.2° | 57.0° |
| C32 | N34 | C25 | C26 | 118.4° | 118.4° |
| C32 | N34 | C25 | C28 | 0.7° | 0.0° |
| N34 | C32 | O33 | N30 | 179.9° | 180.0° |
| N34 | C32 | N30 | C28 | 1.2° | 0.0° |
| N34 | C32 | N30 | C31 | 179.9° | 180.0° |
| C25 | C26 | C27 | H24 | 120.5° | 120.0° |
| C25 | C26 | C27 | H25 | 120.4° | 120.0° |
| C26 | C25 | C28 | N30 | 117.9° | 118.6° |
| C26 | C25 | C28 | O29 | 62.3° | 61.4° |
| C26 | C25 | C24 | H13 | 71.7° | 180.0° |
| C26 | C25 | C24 | H14 | 169.7° | 59.9° |
| C25 | C26 | C27 | H15 | 67.6° | 173.6° |
| C25 | C26 | C27 | H16 | 171.6° | 66.0° |
| C25 | C26 | H24 | H25 | 118.6° | 120.0° |
| C28 | C25 | C26 | C27 | 77.7° | 177.4° |
| C25 | C28 | N30 | C32 | 0.6° | 0.0° |
| C25 | C28 | N30 | O29 | 179.9° | 180.0° |
| C25 | C28 | N30 | C31 | 179.6° | 180.0° |
| C28 | C25 | C24 | H13 | 165.0° | 57.4° |
| C28 | C25 | C24 | H14 | 46.3° | 62.6° |
| C28 | C25 | C26 | H24 | 161.8° | 62.6° |
| C28 | C25 | C26 | H25 | 42.7° | 57.5° |
| C26 | C27 | H15 | H16 | 121.2° | 120.4° |
| C27 | C26 | H24 | H25 | 118.6° | 120.0° |
| O33 | C32 | N30 | C28 | 178.7° | 180.0° |
| O33 | C32 | N30 | C31 | 0.2° | 0.0° |
| C32 | N30 | C28 | C31 | 178.9° | 180.0° |
| C32 | N30 | C28 | O29 | 179.5° | 180.0° |
| C32 | N30 | C31 | H17 | 180.0° | 0.0° |
| C32 | N30 | C31 | H18 | 60.0° | 120.0° |
| C32 | N30 | C31 | H19 | 60.0° | 120.0° |
| C28 | N30 | C31 | H17 | 1.2° | 180.0° |
| C28 | N30 | C31 | H18 | 118.8° | 60.0° |
| C28 | N30 | C31 | H19 | 121.2° | 60.0° |
| O29 | C28 | N30 | C31 | 0.6° | 0.0° |
| N30 | C31 | H17 | H18 | 120.0° | 120.0° |
| N30 | C31 | H17 | H19 | 120.0° | 120.0° |
| N30 | C31 | H18 | H19 | 120.0° | 120.1° |
| H2 | C11 | C10 | H22 | 1.5° | 0.2° |
| H3 | C15 | C17 | H4 | 52.0° | 175.5° |
| H3 | C15 | N14 | H23 | 165.4° | 145.0° |
| H4 | C17 | C18 | H5 | 62.9° | 180.0° |
| H4 | C17 | C18 | H6 | 57.1° | 60.0° |
| H4 | C17 | C18 | H7 | 177.1° | 60.0° |
| H4 | C17 | C19 | H8 | 62.8° | 53.2° |
| H4 | C17 | C19 | H9 | 177.2° | 66.9° |
| H4 | C17 | C19 | H10 | 57.2° | 173.1° |
| H5 | C18 | H6 | H7 | 120.0° | 120.0° |
| H8 | C19 | H9 | H10 | 120.0° | 120.0° |
| H11 | C23 | C24 | H13 | 179.5° | 54.0° |
| H11 | C23 | C24 | H14 | 61.8° | 174.1° |
| H12 | C23 | C24 | H13 | 58.0° | 66.4° |
| H12 | C23 | C24 | H14 | 60.7° | 53.7° |
| H15 | C27 | C26 | H24 | 172.0° | 53.6° |
| H15 | C27 | C26 | H25 | 52.9° | 66.4° |
| H16 | C27 | C26 | H24 | 51.1° | 174.0° |
| H16 | C27 | C26 | H25 | 67.9° | 54.0° |
| H17 | C31 | H18 | H19 | 120.0° | 120.0° |
| H21 | C38 | N39 | H26 | 0.1° | 0.0° |
| H27 | C43 | C44 | H28 | 1.7° | 0.2° |
