Q0A
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F | C9 | sing | 1.35Å | 1.36Å | |
| C9 | C10 | doub | 1.38Å | 1.37Å | Aromatic |
| C9 | C8 | sing | 1.38Å | 1.37Å | Aromatic |
| C10 | C11 | sing | 1.38Å | 1.39Å | Aromatic |
| C8 | C7 | doub | 1.38Å | 1.39Å | Aromatic |
| C11 | C6 | doub | 1.38Å | 1.39Å | Aromatic |
| C7 | C6 | sing | 1.38Å | 1.39Å | Aromatic |
| C6 | C5 | sing | 1.51Å | 1.52Å | |
| C5 | N2 | sing | 1.47Å | 1.47Å | |
| N2 | C12 | sing | 1.47Å | 1.45Å | |
| N2 | C4 | sing | 1.47Å | 1.46Å | |
| C12 | C13 | sing | 1.53Å | 1.52Å | |
| C4 | C3 | sing | 1.53Å | 1.52Å | |
| C21 | C22 | doub | 1.38Å | 1.38Å | Aromatic |
| C21 | C20 | sing | 1.38Å | 1.39Å | Aromatic |
| C13 | N1 | sing | 1.47Å | 1.48Å | |
| C22 | C23 | sing | 1.38Å | 1.38Å | Aromatic |
| C20 | C19 | doub | 1.38Å | 1.39Å | Aromatic |
| C23 | C24 | doub | 1.38Å | 1.39Å | Aromatic |
| C19 | C24 | sing | 1.38Å | 1.39Å | Aromatic |
| C19 | C18 | sing | 1.51Å | 1.51Å | |
| C3 | N1 | sing | 1.47Å | 1.48Å | |
| C18 | C17 | sing | 1.53Å | 1.53Å | |
| N1 | S | sing | 1.66Å | 1.61Å | |
| O | C | doub | 1.22Å | 1.22Å | |
| C | O1 | sing | 1.35Å | 1.31Å | |
| C | C1 | sing | 1.47Å | 1.50Å | |
| O3 | S | doub | 1.42Å | 1.43Å | |
| C17 | S1 | sing | 1.81Å | 1.81Å | |
| C25 | C1 | doub | 1.40Å | 1.40Å | Aromatic |
| C25 | C16 | sing | 1.38Å | 1.38Å | Aromatic |
| C1 | C2 | sing | 1.40Å | 1.41Å | Aromatic |
| S | N | sing | 1.66Å | 1.64Å | |
| S | O2 | doub | 1.42Å | 1.43Å | |
| C16 | S1 | sing | 1.76Å | 1.77Å | |
| C16 | C15 | doub | 1.39Å | 1.39Å | Aromatic |
| C2 | N | sing | 1.39Å | 1.42Å | |
| C2 | C14 | doub | 1.39Å | 1.40Å | Aromatic |
| C15 | C14 | sing | 1.38Å | 1.39Å | Aromatic |
| C3 | H1 | sing | 1.09Å | 1.10Å | |
| C3 | H2 | sing | 1.09Å | 1.10Å | |
| O1 | H3 | sing | 0.97Å | 0.95Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H6 | sing | 1.09Å | 1.10Å | |
| C5 | H7 | sing | 1.09Å | 1.10Å | |
| C7 | H8 | sing | 1.08Å | 1.08Å | |
| C8 | H9 | sing | 1.08Å | 1.08Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C11 | H11 | sing | 1.08Å | 1.08Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H14 | sing | 1.09Å | 1.10Å | |
| C13 | H15 | sing | 1.09Å | 1.10Å | |
| C14 | H16 | sing | 1.08Å | 1.08Å | |
| C15 | H17 | sing | 1.08Å | 1.08Å | |
| C17 | H19 | sing | 1.09Å | 1.10Å | |
| C17 | H20 | sing | 1.09Å | 1.10Å | |
| C18 | H21 | sing | 1.09Å | 1.10Å | |
| C18 | H22 | sing | 1.09Å | 1.10Å | |
| C20 | H23 | sing | 1.08Å | 1.08Å | |
| C21 | H24 | sing | 1.08Å | 1.08Å | |
| C22 | H25 | sing | 1.08Å | 1.08Å | |
| N | H26 | sing | 0.97Å | 1.00Å | |
| C25 | H27 | sing | 1.08Å | 1.08Å | |
| C24 | H28 | sing | 1.08Å | 1.08Å | |
| C23 | H29 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F | C9 | C10 | 118.7° | 120.0° |
| F | C9 | C8 | 118.5° | 120.1° |
| C10 | C9 | C8 | 122.8° | 119.9° |
| C9 | C10 | C11 | 118.2° | 120.0° |
| C9 | C10 | H10 | 120.9° | 120.0° |
| C9 | C8 | C7 | 118.2° | 120.0° |
| C9 | C8 | H9 | 120.9° | 120.0° |
| C10 | C11 | C6 | 121.2° | 120.0° |
| C11 | C10 | H10 | 120.9° | 120.0° |
| C10 | C11 | H11 | 119.4° | 120.0° |
| C8 | C7 | C6 | 121.3° | 120.0° |
| C8 | C7 | H8 | 119.3° | 120.0° |
| C7 | C8 | H9 | 120.9° | 120.0° |
| C11 | C6 | C7 | 118.3° | 120.1° |
| C11 | C6 | C5 | 120.9° | 120.0° |
| C6 | C11 | H11 | 119.4° | 120.0° |
| C7 | C6 | C5 | 120.8° | 120.0° |
| C6 | C7 | H8 | 119.4° | 120.0° |
| C6 | C5 | N2 | 112.8° | 109.5° |
| C6 | C5 | H6 | 108.6° | 109.5° |
| C6 | C5 | H7 | 108.6° | 109.5° |
| C5 | N2 | C12 | 113.1° | 111.0° |
| C5 | N2 | C4 | 113.0° | 111.0° |
| N2 | C5 | H6 | 108.7° | 109.5° |
| N2 | C5 | H7 | 108.6° | 109.4° |
| C12 | N2 | C4 | 107.6° | 111.3° |
| N2 | C12 | C13 | 109.7° | 109.3° |
| N2 | C12 | H12 | 109.4° | 109.5° |
| N2 | C12 | H13 | 109.4° | 109.5° |
| N2 | C4 | C3 | 109.7° | 109.3° |
| N2 | C4 | H4 | 109.4° | 109.5° |
| N2 | C4 | H5 | 109.4° | 109.5° |
| C12 | C13 | N1 | 110.4° | 108.5° |
| C13 | C12 | H12 | 109.4° | 109.5° |
| C13 | C12 | H13 | 109.4° | 109.5° |
| C12 | C13 | H14 | 109.2° | 109.7° |
| C12 | C13 | H15 | 109.2° | 109.6° |
| C4 | C3 | N1 | 110.1° | 108.5° |
| C4 | C3 | H1 | 109.3° | 109.6° |
| C4 | C3 | H2 | 109.3° | 109.8° |
| C3 | C4 | H4 | 109.4° | 109.5° |
| C3 | C4 | H5 | 109.4° | 109.5° |
| C22 | C21 | C20 | 120.3° | 120.0° |
| C21 | C22 | C23 | 119.5° | 120.0° |
| C22 | C21 | H24 | 119.8° | 120.0° |
| C21 | C22 | H25 | 120.2° | 120.0° |
| C21 | C20 | C19 | 120.8° | 120.0° |
| C21 | C20 | H23 | 119.6° | 120.0° |
| C20 | C21 | H24 | 119.9° | 120.0° |
| C13 | N1 | C3 | 115.0° | 118.2° |
| C13 | N1 | S | 123.3° | 120.9° |
| N1 | C13 | H14 | 109.2° | 109.6° |
| N1 | C13 | H15 | 109.2° | 109.6° |
| C22 | C23 | C24 | 120.2° | 120.0° |
| C23 | C22 | H25 | 120.3° | 120.0° |
| C22 | C23 | H29 | 119.9° | 120.0° |
| C20 | C19 | C24 | 118.3° | 120.0° |
| C20 | C19 | C18 | 120.8° | 120.0° |
| C19 | C20 | H23 | 119.6° | 120.0° |
| C23 | C24 | C19 | 120.9° | 120.0° |
| C23 | C24 | H28 | 119.5° | 120.0° |
| C24 | C23 | H29 | 119.9° | 120.0° |
| C24 | C19 | C18 | 120.9° | 120.0° |
| C19 | C24 | H28 | 119.6° | 120.0° |
| C19 | C18 | C17 | 114.8° | 109.5° |
| C19 | C18 | H21 | 108.1° | 109.5° |
| C19 | C18 | H22 | 108.1° | 109.5° |
| C3 | N1 | S | 119.9° | 120.9° |
| N1 | C3 | H1 | 109.3° | 109.6° |
| N1 | C3 | H2 | 109.3° | 109.6° |
| C18 | C17 | S1 | 113.7° | 109.5° |
| C18 | C17 | H19 | 108.4° | 109.5° |
| C18 | C17 | H20 | 108.4° | 109.4° |
| C17 | C18 | H21 | 108.1° | 109.5° |
| C17 | C18 | H22 | 108.1° | 109.5° |
| N1 | S | O3 | 106.4° | 106.4° |
| N1 | S | N | 108.4° | 107.2° |
| N1 | S | O2 | 110.3° | 106.4° |
| O | C | O1 | 122.4° | 120.0° |
| O | C | C1 | 120.2° | 120.0° |
| O1 | C | C1 | 117.5° | 120.0° |
| C | O1 | H3 | 109.5° | 117.0° |
| C | C1 | C25 | 118.3° | 120.1° |
| C | C1 | C2 | 122.6° | 120.2° |
| O3 | S | N | 102.3° | 106.4° |
| O3 | S | O2 | 119.8° | 123.1° |
| C17 | S1 | C16 | 103.3° | 103.0° |
| S1 | C17 | H19 | 108.4° | 109.5° |
| S1 | C17 | H20 | 108.4° | 109.4° |
| C1 | C25 | C16 | 121.0° | 119.8° |
| C25 | C1 | C2 | 119.1° | 119.7° |
| C1 | C25 | H27 | 119.5° | 120.1° |
| C25 | C16 | S1 | 115.8° | 119.9° |
| C25 | C16 | C15 | 119.9° | 120.2° |
| C16 | C25 | H27 | 119.5° | 120.0° |
| C1 | C2 | N | 119.8° | 120.1° |
| C1 | C2 | C14 | 119.5° | 119.8° |
| N | S | O2 | 108.9° | 106.4° |
| S | N | C2 | 122.9° | 120.0° |
| S | N | H26 | 106.0° | 119.9° |
| S1 | C16 | C15 | 124.2° | 119.9° |
| C16 | C15 | C14 | 120.1° | 120.4° |
| C16 | C15 | H17 | 120.0° | 119.8° |
| N | C2 | C14 | 120.8° | 120.1° |
| C2 | N | H26 | 106.0° | 120.0° |
| C2 | C14 | C15 | 120.4° | 120.2° |
| C2 | C14 | H16 | 119.8° | 120.0° |
| C15 | C14 | H16 | 119.8° | 119.9° |
| C14 | C15 | H17 | 119.9° | 119.8° |
| H1 | C3 | H2 | 109.5° | 109.7° |
| H4 | C4 | H5 | 109.5° | 109.5° |
| H6 | C5 | H7 | 109.5° | 109.5° |
| H12 | C12 | H13 | 109.5° | 109.5° |
| H14 | C13 | H15 | 109.5° | 109.8° |
| H19 | C17 | H20 | 109.5° | 109.5° |
| H21 | C18 | H22 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F | C9 | C10 | C8 | 178.5° | 179.8° |
| F | C9 | C10 | C11 | 177.8° | 180.0° |
| F | C9 | C8 | C7 | 178.0° | 179.8° |
| F | C9 | C8 | H9 | 2.0° | 0.2° |
| F | C9 | C10 | H10 | 2.2° | 0.3° |
| C9 | C10 | C11 | H10 | 180.0° | 179.7° |
| C10 | C9 | C8 | C7 | 0.5° | 0.0° |
| C9 | C10 | C11 | C6 | 0.6° | 0.5° |
| C10 | C9 | C8 | H9 | 179.5° | 179.9° |
| C9 | C10 | C11 | H11 | 179.4° | 180.0° |
| C8 | C9 | C10 | C11 | 0.7° | 0.2° |
| C9 | C8 | C7 | H9 | 180.0° | 179.9° |
| C9 | C8 | C7 | C6 | 0.2° | 0.0° |
| C9 | C8 | C7 | H8 | 179.8° | 179.9° |
| C8 | C9 | C10 | H10 | 179.3° | 180.0° |
| C10 | C11 | C6 | H11 | 180.0° | 179.5° |
| C10 | C11 | C6 | C7 | 0.3° | 0.5° |
| C10 | C11 | C6 | C5 | 179.2° | 179.8° |
| C8 | C7 | C6 | C11 | 0.1° | 0.3° |
| C8 | C7 | C6 | H8 | 180.0° | 179.9° |
| C8 | C7 | C6 | C5 | 179.0° | 180.0° |
| C11 | C6 | C7 | C5 | 178.9° | 179.7° |
| C11 | C6 | C5 | N2 | 142.7° | 90.3° |
| C11 | C6 | C5 | H6 | 96.8° | 29.7° |
| C11 | C6 | C5 | H7 | 22.2° | 149.7° |
| C11 | C6 | C7 | H8 | 179.9° | 179.8° |
| C6 | C11 | C10 | H10 | 179.4° | 179.8° |
| C7 | C6 | C5 | N2 | 36.2° | 90.0° |
| C7 | C6 | C5 | H6 | 84.3° | 149.9° |
| C7 | C6 | C5 | H7 | 156.7° | 29.9° |
| C6 | C7 | C8 | H9 | 179.8° | 179.9° |
| C7 | C6 | C11 | H11 | 179.7° | 179.9° |
| C6 | C5 | N2 | H6 | 120.5° | 120.0° |
| C6 | C5 | N2 | H7 | 120.5° | 120.0° |
| C6 | C5 | N2 | C12 | 161.4° | 170.0° |
| C6 | C5 | N2 | C4 | 76.1° | 65.7° |
| C6 | C5 | H6 | H7 | 118.5° | 120.0° |
| C5 | C6 | C7 | H8 | 1.0° | 0.1° |
| C5 | C6 | C11 | H11 | 0.8° | 0.3° |
| C5 | N2 | C12 | C4 | 125.6° | 124.2° |
| C5 | N2 | C12 | C13 | 168.4° | 172.7° |
| C5 | N2 | C4 | C3 | 167.6° | 172.7° |
| C5 | N2 | C4 | H4 | 72.4° | 52.8° |
| C5 | N2 | C4 | H5 | 47.5° | 67.3° |
| N2 | C5 | H6 | H7 | 118.5° | 120.0° |
| C5 | N2 | C12 | H12 | 48.4° | 67.3° |
| C5 | N2 | C12 | H13 | 71.6° | 52.7° |
| N2 | C12 | C13 | H12 | 120.0° | 119.9° |
| N2 | C12 | C13 | H13 | 120.0° | 120.0° |
| C12 | N2 | C4 | C3 | 66.8° | 63.1° |
| N2 | C12 | C13 | N1 | 55.7° | 53.9° |
| C12 | N2 | C4 | H4 | 53.2° | 177.0° |
| C12 | N2 | C4 | H5 | 173.2° | 56.9° |
| C12 | N2 | C5 | H6 | 40.9° | 50.0° |
| C12 | N2 | C5 | H7 | 78.2° | 70.0° |
| N2 | C12 | H12 | H13 | 119.9° | 120.1° |
| N2 | C12 | C13 | H14 | 64.4° | 65.9° |
| N2 | C12 | C13 | H15 | 175.8° | 173.5° |
| C4 | N2 | C12 | C13 | 66.0° | 63.1° |
| N2 | C4 | C3 | H4 | 120.0° | 119.9° |
| N2 | C4 | C3 | H5 | 120.0° | 120.0° |
| N2 | C4 | C3 | N1 | 56.7° | 53.9° |
| N2 | C4 | C3 | H1 | 176.8° | 173.5° |
| N2 | C4 | C3 | H2 | 63.4° | 65.9° |
| N2 | C4 | H4 | H5 | 119.9° | 120.1° |
| C4 | N2 | C5 | H6 | 163.4° | 174.3° |
| C4 | N2 | C5 | H7 | 44.4° | 54.3° |
| C4 | N2 | C12 | H12 | 173.9° | 56.9° |
| C4 | N2 | C12 | H13 | 54.0° | 176.9° |
| C12 | C13 | N1 | H14 | 120.1° | 119.8° |
| C12 | C13 | N1 | H15 | 120.1° | 119.7° |
| C12 | C13 | N1 | C3 | 47.3° | 51.2° |
| C12 | C13 | N1 | S | 148.2° | 128.8° |
| C13 | C12 | H12 | H13 | 119.9° | 120.0° |
| C12 | C13 | H14 | H15 | 119.6° | 120.5° |
| C4 | C3 | N1 | C13 | 47.8° | 51.2° |
| C4 | C3 | N1 | H1 | 120.1° | 119.7° |
| C4 | C3 | N1 | H2 | 120.1° | 119.9° |
| C4 | C3 | N1 | S | 147.1° | 128.8° |
| C4 | C3 | H1 | H2 | 119.7° | 120.7° |
| C3 | C4 | H4 | H5 | 119.9° | 120.1° |
| C22 | C21 | C20 | H24 | 180.0° | 180.0° |
| C21 | C22 | C23 | H25 | 180.0° | 179.9° |
| C22 | C21 | C20 | C19 | 0.6° | 0.0° |
| C21 | C22 | C23 | C24 | 0.7° | 0.1° |
| C22 | C21 | C20 | H23 | 179.4° | 180.0° |
| C21 | C22 | C23 | H29 | 179.3° | 180.0° |
| C20 | C21 | C22 | C23 | 0.4° | 0.0° |
| C21 | C20 | C19 | H23 | 180.0° | 179.9° |
| C21 | C20 | C19 | C24 | 1.3° | 0.0° |
| C21 | C20 | C19 | C18 | 176.7° | 179.7° |
| C20 | C21 | C22 | H25 | 179.6° | 179.9° |
| C13 | N1 | C3 | S | 165.1° | 180.0° |
| C13 | N1 | S | O3 | 55.3° | 23.6° |
| C13 | N1 | S | N | 54.1° | 90.0° |
| C13 | N1 | S | O2 | 173.3° | 156.4° |
| C13 | N1 | C3 | H1 | 167.9° | 170.9° |
| C13 | N1 | C3 | H2 | 72.3° | 68.7° |
| N1 | C13 | C12 | H12 | 175.7° | 66.1° |
| N1 | C13 | C12 | H13 | 64.3° | 173.9° |
| N1 | C13 | H14 | H15 | 119.6° | 120.5° |
| C22 | C23 | C24 | H29 | 180.0° | 179.9° |
| C22 | C23 | C24 | C19 | 0.0° | 0.1° |
| C23 | C22 | C21 | H24 | 179.6° | 180.0° |
| C22 | C23 | C24 | H28 | 180.0° | 179.7° |
| C20 | C19 | C24 | C23 | 1.0° | 0.0° |
| C20 | C19 | C24 | C18 | 177.9° | 179.7° |
| C20 | C19 | C18 | C17 | 114.9° | 89.7° |
| C20 | C19 | C18 | H21 | 5.8° | 150.3° |
| C20 | C19 | C18 | H22 | 124.3° | 30.3° |
| C19 | C20 | C21 | H24 | 179.4° | 179.9° |
| C20 | C19 | C24 | H28 | 179.1° | 179.7° |
| C23 | C24 | C19 | H28 | 180.0° | 179.7° |
| C23 | C24 | C19 | C18 | 177.0° | 179.7° |
| C24 | C23 | C22 | H25 | 179.3° | 179.9° |
| C24 | C19 | C18 | C17 | 62.9° | 90.0° |
| C24 | C19 | C18 | H21 | 176.3° | 30.0° |
| C24 | C19 | C18 | H22 | 57.9° | 150.0° |
| C24 | C19 | C20 | H23 | 178.8° | 180.0° |
| C19 | C24 | C23 | H29 | 180.0° | 180.0° |
| C19 | C18 | C17 | H21 | 120.8° | 120.0° |
| C19 | C18 | C17 | H22 | 120.8° | 120.0° |
| C19 | C18 | C17 | S1 | 159.2° | 179.9° |
| C19 | C18 | C17 | H19 | 80.1° | 60.0° |
| C19 | C18 | C17 | H20 | 38.6° | 60.0° |
| C19 | C18 | H21 | H22 | 117.6° | 120.0° |
| C18 | C19 | C20 | H23 | 3.3° | 0.3° |
| C18 | C19 | C24 | H28 | 3.0° | 0.0° |
| C3 | N1 | S | O3 | 108.5° | 156.5° |
| C3 | N1 | S | N | 142.1° | 90.0° |
| C3 | N1 | S | O2 | 22.9° | 23.6° |
| N1 | C3 | H1 | H2 | 119.7° | 120.4° |
| N1 | C3 | C4 | H4 | 63.3° | 173.8° |
| N1 | C3 | C4 | H5 | 176.7° | 66.1° |
| C3 | N1 | C13 | H14 | 72.9° | 68.5° |
| C3 | N1 | C13 | H15 | 167.4° | 170.9° |
| C18 | C17 | S1 | H19 | 120.6° | 120.0° |
| C18 | C17 | S1 | H20 | 120.6° | 120.0° |
| C18 | C17 | S1 | C16 | 71.3° | 180.0° |
| C18 | C17 | H19 | H20 | 118.0° | 120.0° |
| C17 | C18 | H21 | H22 | 117.5° | 120.0° |
| N1 | S | O3 | N | 113.6° | 114.1° |
| N1 | S | O3 | O2 | 125.9° | 122.9° |
| N1 | S | N | O2 | 120.1° | 113.5° |
| N1 | S | N | C2 | 54.6° | 59.8° |
| S | N1 | C3 | H1 | 27.0° | 9.2° |
| S | N1 | C3 | H2 | 92.8° | 111.3° |
| S | N1 | C13 | H14 | 91.6° | 111.4° |
| S | N1 | C13 | H15 | 28.1° | 9.1° |
| N1 | S | N | H26 | 176.5° | 120.3° |
| O | C | O1 | C1 | 179.1° | 179.9° |
| O | C | C1 | C25 | 3.6° | 179.7° |
| O | C | C1 | C2 | 176.4° | 0.0° |
| O | C | O1 | H3 | 0.0° | 0.1° |
| O1 | C | C1 | C25 | 177.2° | 0.3° |
| O1 | C | C1 | C2 | 2.7° | 180.0° |
| C | C1 | C25 | C2 | 179.9° | 179.7° |
| C | C1 | C25 | C16 | 179.6° | 179.8° |
| C | C1 | C2 | N | 0.1° | 0.3° |
| C | C1 | C2 | C14 | 179.6° | 179.7° |
| C1 | C | O1 | H3 | 179.1° | 180.0° |
| C | C1 | C25 | H27 | 0.4° | 0.3° |
| O3 | S | N | O2 | 127.8° | 132.9° |
| O3 | S | N | C2 | 166.7° | 53.8° |
| O3 | S | N | H26 | 71.4° | 126.2° |
| C17 | S1 | C16 | C25 | 137.0° | 180.0° |
| C17 | S1 | C16 | C15 | 46.8° | 0.1° |
| S1 | C17 | H19 | H20 | 118.1° | 120.0° |
| S1 | C17 | C18 | H21 | 38.4° | 59.9° |
| S1 | C17 | C18 | H22 | 80.0° | 60.0° |
| C1 | C25 | C16 | H27 | 180.0° | 180.0° |
| C1 | C25 | C16 | S1 | 175.1° | 180.0° |
| C1 | C25 | C16 | C15 | 1.3° | 0.1° |
| C25 | C1 | C2 | N | 179.9° | 180.0° |
| C25 | C1 | C2 | C14 | 0.5° | 0.0° |
| C16 | C25 | C1 | C2 | 0.4° | 0.1° |
| C25 | C16 | S1 | C15 | 176.3° | 179.9° |
| C25 | C16 | C15 | C14 | 1.5° | 0.1° |
| C25 | C16 | C15 | H17 | 178.5° | 180.0° |
| C1 | C2 | N | S | 134.1° | 144.3° |
| C1 | C2 | N | C14 | 179.4° | 180.0° |
| C1 | C2 | C14 | C15 | 0.4° | 0.0° |
| C1 | C2 | C14 | H16 | 179.6° | 180.0° |
| C1 | C2 | N | H26 | 104.0° | 35.8° |
| C2 | C1 | C25 | H27 | 179.6° | 180.0° |
| S | N | C2 | H26 | 121.8° | 180.0° |
| S | N | C2 | C14 | 45.3° | 35.7° |
| O2 | S | N | C2 | 65.5° | 173.3° |
| O2 | S | N | H26 | 56.4° | 6.7° |
| S1 | C16 | C15 | C14 | 174.6° | 180.0° |
| S1 | C16 | C15 | H17 | 5.3° | 0.1° |
| C16 | S1 | C17 | H19 | 168.0° | 59.9° |
| C16 | S1 | C17 | H20 | 49.3° | 60.1° |
| S1 | C16 | C25 | H27 | 4.9° | 0.0° |
| C16 | C15 | C14 | C2 | 0.6° | 0.0° |
| C16 | C15 | C14 | H17 | 180.0° | 180.0° |
| C16 | C15 | C14 | H16 | 179.4° | 180.0° |
| C15 | C16 | C25 | H27 | 178.7° | 179.9° |
| N | C2 | C14 | C15 | 179.8° | 180.0° |
| N | C2 | C14 | H16 | 0.2° | 0.0° |
| C2 | C14 | C15 | H16 | 180.0° | 180.0° |
| C2 | C14 | C15 | H17 | 179.4° | 180.0° |
| C14 | C2 | N | H26 | 76.5° | 144.3° |
| H1 | C3 | C4 | H4 | 56.8° | 66.6° |
| H1 | C3 | C4 | H5 | 63.2° | 53.5° |
| H2 | C3 | C4 | H4 | 176.6° | 54.0° |
| H2 | C3 | C4 | H5 | 56.7° | 174.1° |
| H8 | C7 | C8 | H9 | 0.2° | 0.0° |
| H10 | C10 | C11 | H11 | 0.6° | 0.2° |
| H12 | C12 | C13 | H14 | 55.6° | 174.2° |
| H12 | C12 | C13 | H15 | 64.1° | 53.6° |
| H13 | C12 | C13 | H14 | 175.5° | 54.1° |
| H13 | C12 | C13 | H15 | 55.8° | 66.5° |
| H16 | C14 | C15 | H17 | 0.6° | 0.0° |
| H19 | C17 | C18 | H21 | 159.1° | 180.0° |
| H19 | C17 | C18 | H22 | 40.7° | 60.0° |
| H20 | C17 | C18 | H21 | 82.2° | 60.0° |
| H20 | C17 | C18 | H22 | 159.4° | 180.0° |
| H23 | C20 | C21 | H24 | 0.5° | 0.0° |
| H24 | C21 | C22 | H25 | 0.4° | 0.1° |
| H25 | C22 | C23 | H29 | 0.7° | 0.0° |
| H28 | C24 | C23 | H29 | 0.0° | 0.4° |
