5IV
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C11 | C10 | doub | 1.38Å | 1.39Å | Aromatic |
| C11 | C6 | sing | 1.38Å | 1.39Å | Aromatic |
| C10 | C9 | sing | 1.38Å | 1.38Å | Aromatic |
| O | C | doub | 1.22Å | 1.23Å | |
| C3 | C2 | doub | 1.36Å | 1.39Å | Aromatic |
| C3 | C4 | sing | 1.39Å | 1.38Å | Aromatic |
| F3 | C19 | sing | 1.40Å | 1.35Å | |
| C2 | C1 | sing | 1.40Å | 1.40Å | Aromatic |
| C23 | C24 | sing | 1.53Å | 1.49Å | |
| C23 | C22 | sing | 1.53Å | 1.50Å | |
| C5 | C6 | sing | 1.51Å | 1.50Å | |
| C5 | N | sing | 1.47Å | 1.46Å | |
| C6 | C7 | doub | 1.38Å | 1.39Å | Aromatic |
| C9 | C8 | doub | 1.38Å | 1.37Å | Aromatic |
| C24 | C22 | sing | 1.53Å | 1.50Å | |
| F1 | C19 | sing | 1.40Å | 1.31Å | |
| C22 | S | sing | 1.81Å | 1.78Å | |
| C | C1 | sing | 1.48Å | 1.49Å | |
| C | N1 | sing | 1.35Å | 1.33Å | |
| C4 | N | sing | 1.37Å | 1.38Å | Aromatic |
| C4 | C14 | doub | 1.41Å | 1.40Å | Aromatic |
| C1 | C15 | doub | 1.39Å | 1.40Å | Aromatic |
| C19 | C18 | sing | 1.51Å | 1.47Å | |
| C19 | F2 | sing | 1.40Å | 1.34Å | |
| C7 | C8 | sing | 1.38Å | 1.37Å | Aromatic |
| N | C12 | sing | 1.37Å | 1.38Å | Aromatic |
| C8 | F | sing | 1.35Å | 1.35Å | |
| C18 | C20 | doub | 1.38Å | 1.38Å | Aromatic |
| C18 | C17 | sing | 1.38Å | 1.40Å | Aromatic |
| C20 | C21 | sing | 1.39Å | 1.38Å | Aromatic |
| C17 | C16 | sing | 1.51Å | 1.52Å | |
| C17 | C26 | doub | 1.38Å | 1.40Å | Aromatic |
| N1 | C16 | sing | 1.46Å | 1.45Å | |
| C15 | C14 | sing | 1.39Å | 1.39Å | Aromatic |
| C14 | C13 | sing | 1.47Å | 1.43Å | Aromatic |
| C21 | N2 | sing | 1.40Å | 1.44Å | |
| C21 | C25 | doub | 1.39Å | 1.39Å | Aromatic |
| N2 | S | sing | 1.66Å | 1.62Å | |
| S | O1 | doub | 1.42Å | 1.44Å | |
| S | O2 | doub | 1.42Å | 1.43Å | |
| C26 | C25 | sing | 1.38Å | 1.39Å | Aromatic |
| C12 | C13 | doub | 1.34Å | 1.35Å | Aromatic |
| C2 | H1 | sing | 1.08Å | 1.08Å | |
| C3 | H2 | sing | 1.08Å | 1.08Å | |
| C5 | H3 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.09Å | 1.10Å | |
| C22 | H5 | sing | 1.09Å | 1.10Å | |
| C24 | H6 | sing | 1.09Å | 1.10Å | |
| C24 | H7 | sing | 1.09Å | 1.10Å | |
| C23 | H8 | sing | 1.09Å | 1.10Å | |
| C23 | H9 | sing | 1.09Å | 1.10Å | |
| N2 | H10 | sing | 0.97Å | 1.00Å | |
| C20 | H11 | sing | 1.08Å | 1.08Å | |
| C25 | H12 | sing | 1.08Å | 1.08Å | |
| C26 | H13 | sing | 1.08Å | 1.08Å | |
| C16 | H14 | sing | 1.09Å | 1.10Å | |
| C16 | H15 | sing | 1.09Å | 1.10Å | |
| N1 | H16 | sing | 0.97Å | 1.00Å | |
| C15 | H17 | sing | 1.08Å | 1.08Å | |
| C13 | H18 | sing | 1.08Å | 1.08Å | |
| C12 | H19 | sing | 1.08Å | 1.08Å | |
| C11 | H20 | sing | 1.08Å | 1.08Å | |
| C10 | H21 | sing | 1.08Å | 1.08Å | |
| C9 | H22 | sing | 1.08Å | 1.08Å | |
| C7 | H23 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C10 | C11 | C6 | 120.7° | 120.1° |
| C11 | C10 | C9 | 120.4° | 120.1° |
| C10 | C11 | H20 | 119.6° | 120.0° |
| C11 | C10 | H21 | 119.8° | 120.0° |
| C11 | C6 | C5 | 120.9° | 120.0° |
| C11 | C6 | C7 | 118.8° | 120.0° |
| C6 | C11 | H20 | 119.7° | 120.0° |
| C10 | C9 | C8 | 117.8° | 119.9° |
| C9 | C10 | H21 | 119.8° | 120.0° |
| C10 | C9 | H22 | 121.1° | 120.0° |
| O | C | C1 | 120.9° | 120.0° |
| O | C | N1 | 122.2° | 120.0° |
| C2 | C3 | C4 | 118.7° | 120.2° |
| C3 | C2 | C1 | 121.0° | 120.7° |
| C3 | C2 | H1 | 119.5° | 119.6° |
| C2 | C3 | H2 | 120.6° | 119.9° |
| C3 | C4 | N | 130.7° | 133.3° |
| C3 | C4 | C14 | 121.7° | 119.6° |
| C4 | C3 | H2 | 120.6° | 119.9° |
| F3 | C19 | F1 | 106.4° | 109.5° |
| F3 | C19 | C18 | 112.5° | 109.5° |
| F3 | C19 | F2 | 106.9° | 109.5° |
| C2 | C1 | C | 118.9° | 120.0° |
| C2 | C1 | C15 | 119.7° | 120.1° |
| C1 | C2 | H1 | 119.5° | 119.7° |
| C24 | C23 | C22 | 60.2° | 60.0° |
| C23 | C24 | C22 | 60.3° | 60.0° |
| C23 | C24 | H6 | 120.0° | 117.5° |
| C23 | C24 | H7 | 120.0° | 117.5° |
| C24 | C23 | H8 | 120.0° | 117.5° |
| C24 | C23 | H9 | 120.0° | 117.5° |
| C23 | C22 | C24 | 59.5° | 60.0° |
| C23 | C22 | S | 118.7° | 117.5° |
| C23 | C22 | H5 | 117.5° | 117.5° |
| C22 | C23 | H8 | 119.9° | 117.5° |
| C22 | C23 | H9 | 119.9° | 117.5° |
| C6 | C5 | N | 112.6° | 109.4° |
| C5 | C6 | C7 | 120.3° | 120.0° |
| C6 | C5 | H3 | 108.7° | 109.5° |
| C6 | C5 | H4 | 108.7° | 109.5° |
| C5 | N | C4 | 125.8° | 125.0° |
| C5 | N | C12 | 125.9° | 125.1° |
| N | C5 | H3 | 108.7° | 109.5° |
| N | C5 | H4 | 108.7° | 109.5° |
| C6 | C7 | C8 | 118.8° | 120.0° |
| C6 | C7 | H23 | 120.6° | 120.0° |
| C9 | C8 | C7 | 123.5° | 120.0° |
| C9 | C8 | F | 118.5° | 120.0° |
| C8 | C9 | H22 | 121.1° | 120.0° |
| C24 | C22 | S | 121.0° | 117.5° |
| C24 | C22 | H5 | 117.5° | 117.5° |
| C22 | C24 | H6 | 120.0° | 117.5° |
| C22 | C24 | H7 | 120.0° | 117.5° |
| F1 | C19 | C18 | 111.8° | 109.4° |
| F1 | C19 | F2 | 106.6° | 109.5° |
| C22 | S | N2 | 96.2° | 104.4° |
| C22 | S | O1 | 110.6° | 110.5° |
| C22 | S | O2 | 107.2° | 110.6° |
| S | C22 | H5 | 112.9° | 115.5° |
| C1 | C | N1 | 116.8° | 120.0° |
| C | C1 | C15 | 121.3° | 119.9° |
| C | N1 | C16 | 122.2° | 120.0° |
| C | N1 | H16 | 118.9° | 120.0° |
| N | C4 | C14 | 107.7° | 107.1° |
| C4 | N | C12 | 108.1° | 110.0° |
| C4 | C14 | C15 | 119.1° | 120.0° |
| C4 | C14 | C13 | 106.8° | 106.0° |
| C1 | C15 | C14 | 119.8° | 119.3° |
| C1 | C15 | H17 | 120.1° | 120.3° |
| C18 | C19 | F2 | 112.2° | 109.5° |
| C19 | C18 | C20 | 115.5° | 120.0° |
| C19 | C18 | C17 | 124.5° | 119.9° |
| C7 | C8 | F | 118.0° | 120.0° |
| C8 | C7 | H23 | 120.6° | 120.0° |
| N | C12 | C13 | 110.3° | 110.0° |
| N | C12 | H19 | 124.8° | 125.0° |
| C20 | C18 | C17 | 120.0° | 120.1° |
| C18 | C20 | C21 | 121.4° | 119.9° |
| C18 | C20 | H11 | 119.3° | 120.0° |
| C18 | C17 | C16 | 119.7° | 119.9° |
| C18 | C17 | C26 | 118.4° | 120.1° |
| C20 | C21 | N2 | 115.0° | 120.0° |
| C20 | C21 | C25 | 119.3° | 119.9° |
| C21 | C20 | H11 | 119.3° | 120.1° |
| C16 | C17 | C26 | 121.5° | 119.9° |
| C17 | C16 | N1 | 115.2° | 109.5° |
| C17 | C16 | H14 | 108.0° | 109.4° |
| C17 | C16 | H15 | 108.0° | 109.5° |
| C17 | C26 | C25 | 120.9° | 120.0° |
| C17 | C26 | H13 | 119.6° | 120.0° |
| N1 | C16 | H14 | 108.0° | 109.5° |
| N1 | C16 | H15 | 108.0° | 109.5° |
| C16 | N1 | H16 | 118.9° | 120.0° |
| C15 | C14 | C13 | 134.1° | 134.0° |
| C14 | C15 | H17 | 120.1° | 120.3° |
| C14 | C13 | C12 | 107.0° | 106.9° |
| C14 | C13 | H18 | 126.5° | 126.5° |
| N2 | C21 | C25 | 125.6° | 120.1° |
| C21 | N2 | S | 130.7° | 120.0° |
| C21 | N2 | H10 | 104.0° | 120.0° |
| C21 | C25 | C26 | 119.9° | 120.0° |
| C21 | C25 | H12 | 120.1° | 120.0° |
| N2 | S | O1 | 110.1° | 104.3° |
| N2 | S | O2 | 106.6° | 104.3° |
| S | N2 | H10 | 103.9° | 120.0° |
| O1 | S | O2 | 122.9° | 121.0° |
| C26 | C25 | H12 | 120.1° | 120.0° |
| C25 | C26 | H13 | 119.6° | 120.0° |
| C12 | C13 | H18 | 126.5° | 126.6° |
| C13 | C12 | H19 | 124.8° | 125.0° |
| H3 | C5 | H4 | 109.4° | 109.5° |
| H6 | C24 | H7 | 109.4° | 115.5° |
| H8 | C23 | H9 | 109.5° | 115.5° |
| H14 | C16 | H15 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C10 | C11 | C6 | H20 | 180.0° | 180.0° |
| C11 | C10 | C9 | H21 | 180.0° | 179.9° |
| C10 | C11 | C6 | C5 | 177.7° | 180.0° |
| C10 | C11 | C6 | C7 | 0.6° | 0.2° |
| C11 | C10 | C9 | C8 | 0.1° | 0.0° |
| C11 | C10 | C9 | H22 | 179.9° | 180.0° |
| C6 | C11 | C10 | C9 | 0.2° | 0.0° |
| C11 | C6 | C5 | C7 | 178.3° | 179.8° |
| C11 | C6 | C5 | N | 173.1° | 89.8° |
| C11 | C6 | C7 | C8 | 0.6° | 0.5° |
| C11 | C6 | C5 | H3 | 52.6° | 30.2° |
| C11 | C6 | C5 | H4 | 66.5° | 150.2° |
| C6 | C11 | C10 | H21 | 179.8° | 180.0° |
| C11 | C6 | C7 | H23 | 179.3° | 179.7° |
| C10 | C9 | C8 | H22 | 180.0° | 180.0° |
| C10 | C9 | C8 | C7 | 0.0° | 0.2° |
| C10 | C9 | C8 | F | 179.1° | 180.0° |
| C9 | C10 | C11 | H20 | 179.7° | 180.0° |
| O | C | C1 | C2 | 12.9° | 179.7° |
| O | C | C1 | N1 | 176.9° | 179.9° |
| O | C | C1 | C15 | 163.2° | 0.1° |
| O | C | N1 | C16 | 13.6° | 0.1° |
| O | C | N1 | H16 | 166.4° | 180.0° |
| C2 | C3 | C4 | H2 | 180.0° | 179.9° |
| C3 | C2 | C1 | H1 | 180.0° | 180.0° |
| C3 | C2 | C1 | C | 173.5° | 179.7° |
| C2 | C3 | C4 | N | 179.1° | 180.0° |
| C2 | C3 | C4 | C14 | 1.0° | 0.1° |
| C3 | C2 | C1 | C15 | 2.7° | 0.1° |
| C4 | C3 | C2 | C1 | 1.6° | 0.0° |
| C3 | C4 | N | C5 | 6.5° | 0.1° |
| C3 | C4 | N | C14 | 180.0° | 180.0° |
| C3 | C4 | N | C12 | 177.8° | 180.0° |
| C3 | C4 | C14 | C15 | 2.5° | 0.1° |
| C3 | C4 | C14 | C13 | 178.0° | 180.0° |
| C4 | C3 | C2 | H1 | 178.4° | 179.9° |
| F3 | C19 | F1 | C18 | 123.2° | 120.0° |
| F3 | C19 | F1 | F2 | 113.8° | 120.0° |
| F3 | C19 | C18 | F2 | 120.6° | 120.0° |
| F3 | C19 | C18 | C20 | 120.1° | 120.0° |
| F3 | C19 | C18 | C17 | 58.4° | 60.0° |
| C2 | C1 | C | C15 | 176.1° | 179.7° |
| C2 | C1 | C | N1 | 164.0° | 0.3° |
| C2 | C1 | C15 | C14 | 1.2° | 0.1° |
| C1 | C2 | C3 | H2 | 178.4° | 180.0° |
| C2 | C1 | C15 | H17 | 178.8° | 179.9° |
| C24 | C23 | C22 | H8 | 109.5° | 107.5° |
| C24 | C23 | C22 | H9 | 109.6° | 107.5° |
| C23 | C24 | C22 | H6 | 109.5° | 107.4° |
| C23 | C24 | C22 | H7 | 109.6° | 107.5° |
| C24 | C23 | C22 | S | 111.0° | 107.5° |
| C24 | C23 | C22 | H5 | 107.3° | 107.5° |
| C23 | C24 | H6 | H7 | 144.6° | 145.6° |
| C24 | C23 | H8 | H9 | 144.6° | 145.8° |
| C23 | C22 | S | H5 | 143.3° | 145.7° |
| C23 | C22 | S | N2 | 45.5° | 106.2° |
| C23 | C22 | S | O1 | 159.6° | 5.3° |
| C23 | C22 | S | O2 | 64.1° | 142.1° |
| C22 | C23 | H8 | H9 | 144.6° | 145.7° |
| C6 | C5 | N | H3 | 120.5° | 120.0° |
| C6 | C5 | N | H4 | 120.5° | 120.0° |
| C6 | C5 | N | C4 | 99.0° | 85.0° |
| C5 | C6 | C7 | C8 | 177.7° | 179.7° |
| C6 | C5 | N | C12 | 86.0° | 95.0° |
| C6 | C5 | H3 | H4 | 118.6° | 120.0° |
| C5 | C6 | C11 | H20 | 2.3° | 0.1° |
| C5 | C6 | C7 | H23 | 2.4° | 0.1° |
| N | C5 | C6 | C7 | 5.2° | 90.0° |
| C5 | N | C4 | C12 | 175.7° | 179.9° |
| C5 | N | C4 | C14 | 173.5° | 180.0° |
| C5 | N | C12 | C13 | 174.2° | 180.0° |
| N | C5 | H3 | H4 | 118.6° | 120.0° |
| C5 | N | C12 | H19 | 5.8° | 0.1° |
| C6 | C7 | C8 | C9 | 0.3° | 0.5° |
| C6 | C7 | C8 | H23 | 180.0° | 179.8° |
| C6 | C7 | C8 | F | 178.8° | 179.7° |
| C7 | C6 | C5 | H3 | 125.7° | 150.0° |
| C7 | C6 | C5 | H4 | 115.3° | 30.0° |
| C7 | C6 | C11 | H20 | 179.4° | 179.7° |
| C9 | C8 | C7 | F | 179.1° | 179.8° |
| C8 | C9 | C10 | H21 | 179.9° | 180.0° |
| C9 | C8 | C7 | H23 | 179.6° | 179.7° |
| C24 | C22 | S | H5 | 147.0° | 145.6° |
| C24 | C22 | S | N2 | 115.2° | 174.9° |
| C24 | C22 | S | O1 | 130.6° | 63.3° |
| C24 | C22 | S | O2 | 5.6° | 73.4° |
| C22 | C24 | H6 | H7 | 144.6° | 145.8° |
| F1 | C19 | C18 | F2 | 119.7° | 120.0° |
| F1 | C19 | C18 | C20 | 0.4° | 120.0° |
| F1 | C19 | C18 | C17 | 178.1° | 60.0° |
| C22 | S | N2 | C21 | 110.2° | 65.0° |
| C22 | S | N2 | O1 | 114.6° | 116.0° |
| C22 | S | N2 | O2 | 110.0° | 116.1° |
| C22 | S | O1 | O2 | 128.2° | 131.5° |
| S | C22 | C24 | H6 | 2.3° | 145.0° |
| S | C22 | C24 | H7 | 143.2° | 0.1° |
| S | C22 | C23 | H8 | 139.5° | 0.0° |
| S | C22 | C23 | H9 | 1.5° | 145.0° |
| C22 | S | N2 | H10 | 127.1° | 115.0° |
| C1 | C | N1 | C16 | 169.5° | 180.0° |
| C | C1 | C15 | C14 | 174.9° | 179.7° |
| C | C1 | C2 | H1 | 6.5° | 0.3° |
| C1 | C | N1 | H16 | 10.5° | 0.1° |
| C | C1 | C15 | H17 | 5.1° | 0.4° |
| N1 | C | C1 | C15 | 19.9° | 180.0° |
| C | N1 | C16 | C17 | 88.3° | 180.0° |
| C | N1 | C16 | H16 | 180.0° | 179.9° |
| C | N1 | C16 | H14 | 32.6° | 60.1° |
| C | N1 | C16 | H15 | 150.9° | 59.9° |
| N | C4 | C14 | C15 | 177.6° | 180.0° |
| N | C4 | C14 | C13 | 2.0° | 0.1° |
| C4 | N | C12 | C13 | 1.5° | 0.0° |
| N | C4 | C3 | H2 | 1.0° | 0.1° |
| C4 | N | C5 | H3 | 140.5° | 35.0° |
| C4 | N | C5 | H4 | 21.5° | 155.0° |
| C4 | N | C12 | H19 | 178.5° | 180.0° |
| C4 | C14 | C15 | C1 | 1.3° | 0.1° |
| C14 | C4 | N | C12 | 2.2° | 0.1° |
| C4 | C14 | C15 | C13 | 179.4° | 179.9° |
| C4 | C14 | C13 | C12 | 1.1° | 0.0° |
| C14 | C4 | C3 | H2 | 179.0° | 180.0° |
| C4 | C14 | C15 | H17 | 178.7° | 180.0° |
| C4 | C14 | C13 | H18 | 178.9° | 180.0° |
| C1 | C15 | C14 | H17 | 180.0° | 179.9° |
| C1 | C15 | C14 | C13 | 179.2° | 180.0° |
| C15 | C1 | C2 | H1 | 177.4° | 179.9° |
| C19 | C18 | C20 | C17 | 178.6° | 180.0° |
| C19 | C18 | C20 | C21 | 173.1° | 180.0° |
| C19 | C18 | C17 | C16 | 13.1° | 0.0° |
| C19 | C18 | C17 | C26 | 173.6° | 179.7° |
| C19 | C18 | C20 | H11 | 6.9° | 0.0° |
| F2 | C19 | C18 | C20 | 119.3° | 0.0° |
| F2 | C19 | C18 | C17 | 62.2° | 180.0° |
| C7 | C8 | C9 | H22 | 180.0° | 179.8° |
| N | C12 | C13 | C14 | 0.3° | 0.0° |
| N | C12 | C13 | H19 | 180.0° | 179.9° |
| C12 | N | C5 | H3 | 34.4° | 145.0° |
| C12 | N | C5 | H4 | 153.5° | 24.9° |
| N | C12 | C13 | H18 | 179.7° | 179.9° |
| F | C8 | C9 | H22 | 0.9° | 0.0° |
| F | C8 | C7 | H23 | 1.3° | 0.0° |
| C18 | C20 | C21 | H11 | 180.0° | 179.9° |
| C20 | C18 | C17 | C16 | 168.5° | 180.0° |
| C20 | C18 | C17 | C26 | 4.8° | 0.3° |
| C18 | C20 | C21 | N2 | 178.6° | 180.0° |
| C18 | C20 | C21 | C25 | 3.1° | 0.3° |
| C17 | C18 | C20 | C21 | 5.5° | 0.0° |
| C18 | C17 | C16 | C26 | 173.1° | 179.7° |
| C18 | C17 | C16 | N1 | 158.4° | 80.0° |
| C18 | C17 | C26 | C25 | 1.9° | 0.3° |
| C17 | C18 | C20 | H11 | 174.5° | 179.9° |
| C18 | C17 | C26 | H13 | 178.1° | 179.7° |
| C18 | C17 | C16 | H14 | 37.6° | 160.0° |
| C18 | C17 | C16 | H15 | 80.7° | 40.1° |
| C20 | C21 | N2 | C25 | 178.2° | 179.7° |
| C20 | C21 | N2 | S | 170.1° | 134.7° |
| C20 | C21 | C25 | C26 | 0.1° | 0.3° |
| C20 | C21 | N2 | H10 | 67.2° | 45.3° |
| C20 | C21 | C25 | H12 | 179.9° | 179.7° |
| C17 | C16 | N1 | H14 | 120.8° | 120.0° |
| C17 | C16 | N1 | H15 | 120.9° | 120.1° |
| C16 | C17 | C26 | C25 | 171.2° | 180.0° |
| C16 | C17 | C26 | H13 | 8.7° | 0.0° |
| C17 | C16 | H14 | H15 | 117.4° | 120.0° |
| C17 | C16 | N1 | H16 | 91.7° | 0.1° |
| C26 | C17 | C16 | N1 | 28.5° | 99.7° |
| C17 | C26 | C25 | C21 | 0.4° | 0.0° |
| C17 | C26 | C25 | H13 | 180.0° | 180.0° |
| C17 | C26 | C25 | H12 | 179.6° | 180.0° |
| C26 | C17 | C16 | H14 | 149.3° | 20.3° |
| C26 | C17 | C16 | H15 | 92.4° | 140.2° |
| N1 | C16 | H14 | H15 | 117.4° | 120.0° |
| C15 | C14 | C13 | C12 | 178.4° | 179.9° |
| C15 | C14 | C13 | H18 | 1.6° | 0.1° |
| C14 | C13 | C12 | H18 | 180.0° | 179.9° |
| C13 | C14 | C15 | H17 | 0.7° | 0.2° |
| C14 | C13 | C12 | H19 | 179.7° | 179.9° |
| C21 | N2 | S | H10 | 122.7° | 180.0° |
| C21 | N2 | S | O1 | 4.5° | 51.0° |
| C21 | N2 | S | O2 | 139.8° | 178.9° |
| N2 | C21 | C25 | C26 | 178.3° | 180.0° |
| N2 | C21 | C20 | H11 | 1.5° | 0.1° |
| N2 | C21 | C25 | H12 | 1.7° | 0.0° |
| C25 | C21 | N2 | S | 11.6° | 45.0° |
| C21 | C25 | C26 | H12 | 180.0° | 180.0° |
| C25 | C21 | N2 | H10 | 111.1° | 135.0° |
| C25 | C21 | C20 | H11 | 176.9° | 179.8° |
| C21 | C25 | C26 | H13 | 179.6° | 180.0° |
| N2 | S | O1 | O2 | 126.8° | 116.8° |
| N2 | S | C22 | H5 | 97.9° | 39.4° |
| O1 | S | C22 | H5 | 16.3° | 151.0° |
| O1 | S | N2 | H10 | 118.3° | 129.0° |
| O2 | S | C22 | H5 | 152.6° | 72.2° |
| O2 | S | N2 | H10 | 17.1° | 1.1° |
| H1 | C2 | C3 | H2 | 1.5° | 0.0° |
| H5 | C22 | C24 | H6 | 143.2° | 0.1° |
| H5 | C22 | C24 | H7 | 2.3° | 145.0° |
| H5 | C22 | C23 | H8 | 2.2° | 145.0° |
| H5 | C22 | C23 | H9 | 143.1° | 0.0° |
| H6 | C24 | C23 | H8 | 140.9° | 145.0° |
| H6 | C24 | C23 | H9 | 0.1° | 0.1° |
| H7 | C24 | C23 | H8 | 0.0° | 0.1° |
| H7 | C24 | C23 | H9 | 140.9° | 145.0° |
| H12 | C25 | C26 | H13 | 0.4° | 0.0° |
| H14 | C16 | N1 | H16 | 147.5° | 120.0° |
| H15 | C16 | N1 | H16 | 29.2° | 120.0° |
| H18 | C13 | C12 | H19 | 0.3° | 0.0° |
| H20 | C11 | C10 | H21 | 0.2° | 0.1° |
| H21 | C10 | C9 | H22 | 0.1° | 0.0° |
