S7C
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C23 | C24 | doub | 1.36Å | 1.37Å | Aromatic |
| C23 | C22 | sing | 1.40Å | 1.42Å | Aromatic |
| C21 | C22 | doub | 1.40Å | 1.42Å | Aromatic |
| C21 | N3 | sing | 1.31Å | 1.33Å | Aromatic |
| C24 | C25 | sing | 1.39Å | 1.39Å | Aromatic |
| C22 | C27 | sing | 1.42Å | 1.43Å | Aromatic |
| N3 | C20 | doub | 1.32Å | 1.34Å | Aromatic |
| C25 | C26 | doub | 1.36Å | 1.37Å | Aromatic |
| C27 | C26 | sing | 1.40Å | 1.42Å | Aromatic |
| C27 | C19 | doub | 1.41Å | 1.43Å | Aromatic |
| C20 | C19 | sing | 1.38Å | 1.39Å | Aromatic |
| C19 | N | sing | 1.40Å | 1.44Å | |
| C3 | N | sing | 1.47Å | 1.47Å | |
| C3 | C2 | sing | 1.55Å | 1.52Å | |
| N | C4 | sing | 1.34Å | 1.36Å | |
| C1 | C2 | sing | 1.53Å | 1.53Å | |
| C1 | C | sing | 1.53Å | 1.52Å | |
| C2 | C5 | sing | 1.54Å | 1.56Å | |
| C4 | C5 | sing | 1.51Å | 1.53Å | |
| C4 | O | doub | 1.21Å | 1.21Å | |
| C5 | C6 | sing | 1.53Å | 1.55Å | |
| C5 | C13 | sing | 1.50Å | 1.53Å | |
| C6 | N1 | sing | 1.47Å | 1.47Å | |
| C16 | C17 | sing | 1.53Å | 1.48Å | |
| C16 | C15 | sing | 1.53Å | 1.51Å | |
| O1 | S | doub | 1.42Å | 1.43Å | |
| C17 | C15 | sing | 1.53Å | 1.51Å | |
| C14 | C15 | sing | 1.53Å | 1.53Å | |
| C14 | S | sing | 1.81Å | 1.79Å | |
| C15 | C18 | sing | 1.47Å | 1.47Å | |
| C13 | C12 | doub | 1.39Å | 1.40Å | Aromatic |
| C13 | C8 | sing | 1.38Å | 1.41Å | Aromatic |
| C12 | C11 | sing | 1.38Å | 1.38Å | Aromatic |
| N1 | S | sing | 1.66Å | 1.63Å | |
| N1 | C7 | sing | 1.47Å | 1.47Å | |
| S | O2 | doub | 1.42Å | 1.43Å | |
| C8 | C7 | sing | 1.51Å | 1.52Å | |
| C8 | C9 | doub | 1.39Å | 1.40Å | Aromatic |
| CL | C11 | sing | 1.74Å | 1.75Å | |
| C11 | C10 | doub | 1.38Å | 1.38Å | Aromatic |
| C18 | N2 | trip | 1.14Å | 1.14Å | |
| C9 | C10 | sing | 1.38Å | 1.38Å | Aromatic |
| C6 | H1 | sing | 1.09Å | 1.10Å | |
| C6 | H2 | sing | 1.09Å | 1.10Å | |
| C7 | H3 | sing | 1.09Å | 1.10Å | |
| C7 | H4 | sing | 1.09Å | 1.10Å | |
| C10 | H5 | sing | 1.08Å | 1.08Å | |
| C17 | H6 | sing | 1.09Å | 1.10Å | |
| C17 | H7 | sing | 1.09Å | 1.10Å | |
| C20 | H8 | sing | 1.08Å | 1.08Å | |
| C21 | H9 | sing | 1.08Å | 1.08Å | |
| C24 | H10 | sing | 1.08Å | 1.08Å | |
| C26 | H11 | sing | 1.08Å | 1.08Å | |
| C16 | H12 | sing | 1.09Å | 1.10Å | |
| C16 | H13 | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H15 | sing | 1.09Å | 1.10Å | |
| C12 | H16 | sing | 1.08Å | 1.08Å | |
| C9 | H17 | sing | 1.08Å | 1.08Å | |
| C2 | H18 | sing | 1.09Å | 1.10Å | |
| C1 | H19 | sing | 1.09Å | 1.10Å | |
| C1 | H20 | sing | 1.09Å | 1.10Å | |
| C | H21 | sing | 1.09Å | 1.10Å | |
| C | H22 | sing | 1.09Å | 1.10Å | |
| C | H23 | sing | 1.09Å | 1.10Å | |
| C3 | H24 | sing | 1.09Å | 1.10Å | |
| C3 | H25 | sing | 1.09Å | 1.10Å | |
| C25 | H26 | sing | 1.08Å | 1.08Å | |
| C23 | H27 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C24 | C23 | C22 | 120.7° | 119.6° |
| C23 | C24 | C25 | 120.5° | 121.1° |
| C23 | C24 | H10 | 119.7° | 119.5° |
| C24 | C23 | H27 | 119.7° | 120.2° |
| C23 | C22 | C21 | 123.1° | 122.0° |
| C23 | C22 | C27 | 119.1° | 119.3° |
| C22 | C23 | H27 | 119.7° | 120.2° |
| C22 | C21 | N3 | 124.1° | 120.2° |
| C21 | C22 | C27 | 117.8° | 118.7° |
| C22 | C21 | H9 | 117.9° | 119.9° |
| C21 | N3 | C20 | 117.3° | 122.9° |
| N3 | C21 | H9 | 118.0° | 119.9° |
| C24 | C25 | C26 | 120.7° | 121.0° |
| C25 | C24 | H10 | 119.7° | 119.4° |
| C24 | C25 | H26 | 119.7° | 119.5° |
| C22 | C27 | C26 | 118.0° | 119.7° |
| C22 | C27 | C19 | 118.0° | 118.2° |
| N3 | C20 | C19 | 125.5° | 121.6° |
| N3 | C20 | H8 | 117.3° | 119.2° |
| C25 | C26 | C27 | 121.0° | 119.5° |
| C25 | C26 | H11 | 119.5° | 120.3° |
| C26 | C25 | H26 | 119.6° | 119.5° |
| C26 | C27 | C19 | 124.1° | 122.2° |
| C27 | C26 | H11 | 119.5° | 120.2° |
| C27 | C19 | C20 | 117.3° | 118.4° |
| C27 | C19 | N | 122.5° | 120.8° |
| C20 | C19 | N | 120.0° | 120.8° |
| C19 | C20 | H8 | 117.2° | 119.2° |
| C19 | N | C3 | 122.0° | 124.3° |
| C19 | N | C4 | 125.5° | 124.4° |
| N | C3 | C2 | 103.3° | 105.4° |
| C3 | N | C4 | 112.5° | 111.3° |
| N | C3 | H24 | 111.0° | 110.2° |
| N | C3 | H25 | 111.0° | 110.2° |
| C3 | C2 | C1 | 113.9° | 111.0° |
| C3 | C2 | C5 | 102.8° | 101.7° |
| C3 | C2 | H18 | 108.0° | 110.9° |
| C2 | C3 | H24 | 111.0° | 110.3° |
| C2 | C3 | H25 | 111.0° | 110.2° |
| N | C4 | C5 | 108.1° | 110.0° |
| N | C4 | O | 125.6° | 125.0° |
| C2 | C1 | C | 112.8° | 109.5° |
| C1 | C2 | C5 | 116.1° | 111.0° |
| C1 | C2 | H18 | 108.0° | 110.8° |
| C2 | C1 | H19 | 108.7° | 109.5° |
| C2 | C1 | H20 | 108.6° | 109.4° |
| C | C1 | H19 | 108.6° | 109.5° |
| C | C1 | H20 | 108.7° | 109.4° |
| C1 | C | H21 | 109.5° | 109.5° |
| C1 | C | H22 | 109.5° | 109.5° |
| C1 | C | H23 | 109.5° | 109.5° |
| C2 | C5 | C4 | 100.8° | 104.5° |
| C2 | C5 | C6 | 112.3° | 109.7° |
| C2 | C5 | C13 | 116.0° | 109.6° |
| C5 | C2 | H18 | 107.6° | 111.0° |
| C5 | C4 | O | 126.2° | 125.0° |
| C4 | C5 | C6 | 104.7° | 110.5° |
| C4 | C5 | C13 | 108.0° | 110.4° |
| C6 | C5 | C13 | 113.4° | 111.9° |
| C5 | C6 | N1 | 107.9° | 107.9° |
| C5 | C6 | H1 | 109.8° | 109.7° |
| C5 | C6 | H2 | 109.9° | 109.8° |
| C5 | C13 | C12 | 120.7° | 117.8° |
| C5 | C13 | C8 | 119.7° | 122.7° |
| C6 | N1 | S | 122.5° | 121.3° |
| C6 | N1 | C7 | 112.9° | 117.4° |
| N1 | C6 | H1 | 109.9° | 109.8° |
| N1 | C6 | H2 | 109.8° | 109.8° |
| C17 | C16 | C15 | 60.7° | 60.0° |
| C16 | C17 | C15 | 60.7° | 60.0° |
| C16 | C17 | H6 | 119.9° | 117.5° |
| C16 | C17 | H7 | 119.9° | 117.6° |
| C17 | C16 | H12 | 119.9° | 117.5° |
| C17 | C16 | H13 | 119.9° | 117.5° |
| C16 | C15 | C17 | 58.6° | 60.0° |
| C16 | C15 | C14 | 121.4° | 117.5° |
| C16 | C15 | C18 | 114.5° | 117.5° |
| C15 | C16 | H12 | 119.9° | 117.5° |
| C15 | C16 | H13 | 119.9° | 117.5° |
| O1 | S | C14 | 108.1° | 110.5° |
| O1 | S | N1 | 107.2° | 104.3° |
| O1 | S | O2 | 119.2° | 121.0° |
| C17 | C15 | C14 | 121.8° | 117.5° |
| C17 | C15 | C18 | 115.4° | 117.5° |
| C15 | C17 | H6 | 119.9° | 117.5° |
| C15 | C17 | H7 | 119.9° | 117.5° |
| C15 | C14 | S | 120.5° | 109.5° |
| C14 | C15 | C18 | 114.1° | 115.6° |
| C15 | C14 | H14 | 106.7° | 109.4° |
| C15 | C14 | H15 | 106.7° | 109.5° |
| C14 | S | N1 | 106.5° | 104.5° |
| C14 | S | O2 | 108.1° | 110.6° |
| S | C14 | H14 | 106.6° | 109.5° |
| S | C14 | H15 | 106.6° | 109.5° |
| C15 | C18 | N2 | 177.6° | 180.0° |
| C12 | C13 | C8 | 119.6° | 119.4° |
| C13 | C12 | C11 | 119.6° | 120.6° |
| C13 | C12 | H16 | 120.2° | 119.7° |
| C13 | C8 | C7 | 122.0° | 122.2° |
| C13 | C8 | C9 | 119.0° | 119.9° |
| C12 | C11 | CL | 119.0° | 120.0° |
| C12 | C11 | C10 | 121.6° | 119.9° |
| C11 | C12 | H16 | 120.2° | 119.8° |
| S | N1 | C7 | 121.9° | 121.3° |
| N1 | S | O2 | 107.1° | 104.3° |
| N1 | C7 | C8 | 111.2° | 109.8° |
| N1 | C7 | H3 | 109.0° | 109.4° |
| N1 | C7 | H4 | 109.0° | 109.5° |
| C7 | C8 | C9 | 119.1° | 117.9° |
| C8 | C7 | H3 | 109.1° | 109.4° |
| C8 | C7 | H4 | 109.1° | 109.4° |
| C8 | C9 | C10 | 121.3° | 120.6° |
| C8 | C9 | H17 | 119.3° | 119.7° |
| CL | C11 | C10 | 119.3° | 120.1° |
| C11 | C10 | C9 | 118.9° | 119.7° |
| C11 | C10 | H5 | 120.5° | 120.1° |
| C9 | C10 | H5 | 120.5° | 120.2° |
| C10 | C9 | H17 | 119.4° | 119.7° |
| H1 | C6 | H2 | 109.5° | 109.8° |
| H3 | C7 | H4 | 109.5° | 109.4° |
| H6 | C17 | H7 | 109.4° | 115.5° |
| H12 | C16 | H13 | 109.5° | 115.6° |
| H14 | C14 | H15 | 109.5° | 109.5° |
| H19 | C1 | H20 | 109.5° | 109.5° |
| H21 | C | H22 | 109.5° | 109.5° |
| H21 | C | H23 | 109.5° | 109.4° |
| H22 | C | H23 | 109.4° | 109.5° |
| H24 | C3 | H25 | 109.5° | 110.3° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C24 | C23 | C22 | H27 | 180.0° | 180.0° |
| C24 | C23 | C22 | C21 | 179.6° | 179.9° |
| C23 | C24 | C25 | H10 | 180.0° | 179.9° |
| C24 | C23 | C22 | C27 | 0.6° | 0.1° |
| C23 | C24 | C25 | C26 | 0.5° | 0.1° |
| C23 | C24 | C25 | H26 | 179.5° | 180.0° |
| C23 | C22 | C21 | C27 | 179.8° | 180.0° |
| C23 | C22 | C21 | N3 | 179.3° | 180.0° |
| C22 | C23 | C24 | C25 | 0.1° | 0.1° |
| C23 | C22 | C27 | C26 | 0.5° | 0.0° |
| C23 | C22 | C27 | C19 | 179.1° | 180.0° |
| C23 | C22 | C21 | H9 | 0.7° | 0.0° |
| C22 | C23 | C24 | H10 | 179.9° | 180.0° |
| C22 | C21 | N3 | H9 | 180.0° | 180.0° |
| C22 | C21 | N3 | C20 | 0.2° | 0.0° |
| C21 | C22 | C27 | C26 | 179.7° | 179.9° |
| C21 | C22 | C27 | C19 | 0.7° | 0.0° |
| C21 | C22 | C23 | H27 | 0.4° | 0.1° |
| N3 | C21 | C22 | C27 | 0.5° | 0.0° |
| C21 | N3 | C20 | C19 | 0.1° | 0.1° |
| C21 | N3 | C20 | H8 | 179.9° | 180.0° |
| C24 | C25 | C26 | H26 | 180.0° | 179.9° |
| C24 | C25 | C26 | C27 | 0.6° | 0.0° |
| C24 | C25 | C26 | H11 | 179.4° | 180.0° |
| C25 | C24 | C23 | H27 | 179.9° | 179.9° |
| C22 | C27 | C26 | C25 | 0.1° | 0.0° |
| C22 | C27 | C26 | C19 | 179.6° | 179.9° |
| C22 | C27 | C19 | C20 | 0.6° | 0.0° |
| C22 | C27 | C19 | N | 175.4° | 180.0° |
| C27 | C22 | C21 | H9 | 179.6° | 180.0° |
| C22 | C27 | C26 | H11 | 179.9° | 180.0° |
| C27 | C22 | C23 | H27 | 179.4° | 180.0° |
| N3 | C20 | C19 | C27 | 0.4° | 0.1° |
| N3 | C20 | C19 | H8 | 180.0° | 180.0° |
| N3 | C20 | C19 | N | 175.7° | 180.0° |
| C20 | N3 | C21 | H9 | 179.9° | 180.0° |
| C25 | C26 | C27 | H11 | 180.0° | 180.0° |
| C25 | C26 | C27 | C19 | 179.7° | 179.9° |
| C26 | C25 | C24 | H10 | 179.4° | 180.0° |
| C26 | C27 | C19 | C20 | 179.8° | 180.0° |
| C26 | C27 | C19 | N | 4.2° | 0.1° |
| C27 | C26 | C25 | H26 | 179.4° | 180.0° |
| C27 | C19 | C20 | N | 176.1° | 179.9° |
| C27 | C19 | N | C3 | 93.0° | 90.1° |
| C27 | C19 | N | C4 | 88.8° | 90.0° |
| C27 | C19 | C20 | H8 | 179.6° | 180.0° |
| C19 | C27 | C26 | H11 | 0.3° | 0.1° |
| C20 | C19 | N | C3 | 91.1° | 90.0° |
| C20 | C19 | N | C4 | 87.1° | 89.9° |
| C19 | N | C3 | C4 | 178.4° | 179.9° |
| C19 | N | C3 | C2 | 161.6° | 163.1° |
| C19 | N | C4 | C5 | 175.8° | 179.5° |
| C19 | N | C4 | O | 2.7° | 0.5° |
| N | C19 | C20 | H8 | 4.3° | 0.0° |
| C19 | N | C3 | H24 | 79.4° | 77.8° |
| C19 | N | C3 | H25 | 42.6° | 44.2° |
| N | C3 | C2 | H24 | 119.0° | 119.0° |
| N | C3 | C2 | H25 | 119.0° | 118.9° |
| N | C3 | C2 | C1 | 157.9° | 93.0° |
| N | C3 | C2 | C5 | 31.4° | 25.2° |
| C3 | N | C4 | C5 | 5.8° | 0.6° |
| C3 | N | C4 | O | 175.7° | 179.4° |
| N | C3 | C2 | H18 | 82.1° | 143.3° |
| N | C3 | H24 | H25 | 122.8° | 121.9° |
| C2 | C3 | N | C4 | 16.8° | 17.0° |
| C3 | C2 | C1 | C5 | 119.2° | 112.4° |
| C3 | C2 | C1 | H18 | 120.0° | 123.8° |
| C3 | C2 | C1 | C | 169.1° | 72.6° |
| C3 | C2 | C5 | H18 | 113.9° | 118.0° |
| C3 | C2 | C5 | C4 | 34.1° | 24.6° |
| C3 | C2 | C5 | C6 | 76.9° | 143.0° |
| C3 | C2 | C5 | C13 | 150.4° | 93.7° |
| C3 | C2 | C1 | H19 | 70.4° | 167.4° |
| C3 | C2 | C1 | H20 | 48.6° | 47.3° |
| C2 | C3 | H24 | H25 | 122.9° | 122.0° |
| N | C4 | C5 | C2 | 25.1° | 16.0° |
| N | C4 | C5 | O | 178.5° | 180.0° |
| N | C4 | C5 | C6 | 91.6° | 134.0° |
| N | C4 | C5 | C13 | 147.3° | 101.8° |
| C4 | N | C3 | H24 | 102.2° | 102.1° |
| C4 | N | C3 | H25 | 135.8° | 135.9° |
| C2 | C1 | C | H19 | 120.5° | 120.0° |
| C2 | C1 | C | H20 | 120.5° | 120.0° |
| C1 | C2 | C5 | H18 | 121.0° | 123.8° |
| C1 | C2 | C5 | C4 | 159.1° | 93.6° |
| C1 | C2 | C5 | C6 | 48.2° | 24.8° |
| C1 | C2 | C5 | C13 | 84.5° | 148.1° |
| C2 | C1 | H19 | H20 | 118.5° | 120.0° |
| C2 | C1 | C | H21 | 180.0° | 60.0° |
| C2 | C1 | C | H22 | 60.0° | 60.0° |
| C2 | C1 | C | H23 | 60.0° | 180.0° |
| C1 | C2 | C3 | H24 | 38.9° | 148.0° |
| C1 | C2 | C3 | H25 | 83.1° | 25.9° |
| C | C1 | C2 | C5 | 71.7° | 175.0° |
| C | C1 | C2 | H18 | 49.1° | 51.2° |
| C | C1 | H19 | H20 | 118.5° | 120.0° |
| C1 | C | H21 | H22 | 120.0° | 120.0° |
| C1 | C | H21 | H23 | 120.0° | 120.0° |
| C1 | C | H22 | H23 | 120.0° | 120.0° |
| C2 | C5 | C4 | C6 | 116.7° | 118.0° |
| C2 | C5 | C4 | C13 | 122.1° | 117.8° |
| C2 | C5 | C4 | O | 156.3° | 164.0° |
| C2 | C5 | C6 | C13 | 134.0° | 121.9° |
| C2 | C5 | C6 | N1 | 179.5° | 168.0° |
| C2 | C5 | C13 | C12 | 34.5° | 39.6° |
| C2 | C5 | C13 | C8 | 146.3° | 140.8° |
| C2 | C5 | C6 | H1 | 60.7° | 48.4° |
| C2 | C5 | C6 | H2 | 59.8° | 72.4° |
| C5 | C2 | C1 | H19 | 48.7° | 55.0° |
| C5 | C2 | C1 | H20 | 167.8° | 65.0° |
| C5 | C2 | C3 | H24 | 87.6° | 93.8° |
| C5 | C2 | C3 | H25 | 150.4° | 144.1° |
| C4 | C5 | C6 | C13 | 117.5° | 123.4° |
| C4 | C5 | C6 | N1 | 71.9° | 77.3° |
| C4 | C5 | C13 | C12 | 77.7° | 75.0° |
| C4 | C5 | C13 | C8 | 101.5° | 104.6° |
| C4 | C5 | C6 | H1 | 47.8° | 163.2° |
| C4 | C5 | C6 | H2 | 168.3° | 42.3° |
| C4 | C5 | C2 | H18 | 79.8° | 142.6° |
| O | C4 | C5 | C6 | 86.9° | 46.0° |
| O | C4 | C5 | C13 | 34.2° | 78.2° |
| C5 | C6 | N1 | H1 | 119.7° | 119.6° |
| C5 | C6 | N1 | H2 | 119.8° | 119.6° |
| C6 | C5 | C13 | C12 | 166.7° | 161.6° |
| C6 | C5 | C13 | C8 | 14.0° | 18.9° |
| C5 | C6 | N1 | S | 131.2° | 116.5° |
| C5 | C6 | N1 | C7 | 67.1° | 63.3° |
| C5 | C6 | H1 | H2 | 120.7° | 120.8° |
| C6 | C5 | C2 | H18 | 169.2° | 98.9° |
| C13 | C5 | C6 | N1 | 45.5° | 46.1° |
| C5 | C13 | C12 | C8 | 179.2° | 179.6° |
| C5 | C13 | C12 | C11 | 178.7° | 179.6° |
| C5 | C13 | C8 | C7 | 0.5° | 1.0° |
| C5 | C13 | C8 | C9 | 179.4° | 179.2° |
| C13 | C5 | C6 | H1 | 165.3° | 73.5° |
| C13 | C5 | C6 | H2 | 74.2° | 165.7° |
| C5 | C13 | C12 | H16 | 1.3° | 0.4° |
| C13 | C5 | C2 | H18 | 36.5° | 24.3° |
| C6 | N1 | S | O1 | 21.4° | 147.7° |
| C6 | N1 | S | C14 | 94.2° | 96.2° |
| C6 | N1 | S | C7 | 160.1° | 179.8° |
| C6 | N1 | S | O2 | 150.4° | 19.9° |
| C6 | N1 | C7 | C8 | 52.3° | 44.7° |
| N1 | C6 | H1 | H2 | 120.7° | 120.8° |
| C6 | N1 | C7 | H3 | 172.6° | 164.7° |
| C6 | N1 | C7 | H4 | 67.9° | 75.4° |
| C17 | C16 | C15 | H12 | 109.7° | 107.5° |
| C17 | C16 | C15 | H13 | 109.7° | 107.5° |
| C16 | C17 | C15 | H6 | 109.7° | 107.5° |
| C16 | C17 | C15 | H7 | 109.7° | 107.6° |
| C16 | C17 | C15 | C14 | 109.9° | 107.5° |
| C17 | C16 | C15 | C18 | 105.9° | 107.5° |
| C16 | C17 | H6 | H7 | 144.4° | 145.7° |
| C17 | C16 | H12 | H13 | 144.4° | 145.7° |
| C16 | C15 | C14 | C18 | 143.8° | 145.7° |
| C16 | C15 | C14 | S | 125.3° | 111.3° |
| C16 | C15 | C18 | N2 | 31.0° | 40.6° |
| C15 | C16 | H12 | H13 | 144.4° | 145.7° |
| C16 | C15 | C14 | H14 | 3.7° | 128.7° |
| C16 | C15 | C14 | H15 | 113.2° | 8.8° |
| O1 | S | C14 | C15 | 71.7° | 75.4° |
| O1 | S | C14 | N1 | 114.9° | 111.6° |
| O1 | S | C14 | O2 | 130.2° | 136.7° |
| O1 | S | N1 | O2 | 129.0° | 127.8° |
| O1 | S | N1 | C7 | 138.8° | 32.1° |
| O1 | S | C14 | H14 | 49.9° | 44.5° |
| O1 | S | C14 | H15 | 166.8° | 164.5° |
| C17 | C15 | C14 | C18 | 146.1° | 145.7° |
| C17 | C15 | C14 | S | 55.1° | 179.9° |
| C17 | C15 | C18 | N2 | 96.4° | 109.2° |
| C15 | C17 | H6 | H7 | 144.4° | 145.6° |
| C17 | C15 | C14 | H14 | 66.4° | 60.1° |
| C17 | C15 | C14 | H15 | 176.6° | 59.9° |
| C15 | C14 | S | H14 | 121.6° | 120.0° |
| C15 | C14 | S | H15 | 121.5° | 120.0° |
| C15 | C14 | S | N1 | 173.4° | 172.9° |
| C15 | C14 | S | O2 | 58.6° | 61.3° |
| C14 | C15 | C18 | N2 | 115.3° | 105.1° |
| C14 | C15 | C17 | H6 | 140.4° | 0.0° |
| C14 | C15 | C17 | H7 | 0.2° | 145.0° |
| C14 | C15 | C16 | H12 | 0.8° | 145.0° |
| C14 | C15 | C16 | H13 | 139.8° | 0.1° |
| C15 | C14 | H14 | H15 | 115.0° | 120.0° |
| S | C14 | C15 | C18 | 91.0° | 34.4° |
| C14 | S | N1 | O2 | 115.5° | 116.1° |
| C14 | S | N1 | C7 | 105.7° | 84.0° |
| S | C14 | H14 | H15 | 115.0° | 120.0° |
| C18 | C15 | C17 | H6 | 5.3° | 145.0° |
| C18 | C15 | C17 | H7 | 145.9° | 0.1° |
| C18 | C15 | C16 | H12 | 144.5° | 0.0° |
| C18 | C15 | C16 | H13 | 3.8° | 145.1° |
| C18 | C15 | C14 | H14 | 147.5° | 85.6° |
| C18 | C15 | C14 | H15 | 30.6° | 154.4° |
| C13 | C12 | C11 | H16 | 180.0° | 180.0° |
| C12 | C13 | C8 | C7 | 178.8° | 179.5° |
| C12 | C13 | C8 | C9 | 0.2° | 0.4° |
| C13 | C12 | C11 | CL | 179.0° | 180.0° |
| C13 | C12 | C11 | C10 | 0.6° | 0.0° |
| C8 | C13 | C12 | C11 | 0.5° | 0.0° |
| C13 | C8 | C7 | N1 | 17.4° | 12.0° |
| C13 | C8 | C7 | C9 | 178.9° | 179.9° |
| C13 | C8 | C9 | C10 | 0.8° | 0.8° |
| C13 | C8 | C7 | H3 | 137.7° | 132.1° |
| C13 | C8 | C7 | H4 | 102.8° | 108.1° |
| C8 | C13 | C12 | H16 | 179.5° | 180.0° |
| C13 | C8 | C9 | H17 | 179.2° | 179.7° |
| C12 | C11 | CL | C10 | 179.7° | 179.9° |
| C12 | C11 | C10 | C9 | 0.1° | 0.4° |
| C12 | C11 | C10 | H5 | 179.9° | 179.8° |
| S | N1 | C7 | C8 | 145.8° | 135.1° |
| S | N1 | C6 | H1 | 11.4° | 123.9° |
| S | N1 | C6 | H2 | 109.1° | 3.1° |
| S | N1 | C7 | H3 | 25.5° | 15.0° |
| S | N1 | C7 | H4 | 94.0° | 104.8° |
| N1 | S | C14 | H14 | 65.0° | 67.1° |
| N1 | S | C14 | H15 | 51.9° | 52.9° |
| C7 | N1 | S | O2 | 9.8° | 159.9° |
| N1 | C7 | C8 | H3 | 120.3° | 120.1° |
| N1 | C7 | C8 | H4 | 120.2° | 120.1° |
| N1 | C7 | C8 | C9 | 161.5° | 168.1° |
| C7 | N1 | C6 | H1 | 173.2° | 56.3° |
| C7 | N1 | C6 | H2 | 52.7° | 177.1° |
| N1 | C7 | H3 | H4 | 119.2° | 119.9° |
| O2 | S | C14 | H14 | 179.9° | 178.7° |
| O2 | S | C14 | H15 | 62.9° | 58.7° |
| C7 | C8 | C9 | C10 | 178.1° | 179.1° |
| C8 | C7 | H3 | H4 | 119.2° | 119.8° |
| C7 | C8 | C9 | H17 | 1.8° | 0.4° |
| C8 | C9 | C10 | C11 | 0.8° | 0.8° |
| C8 | C9 | C10 | H17 | 180.0° | 179.5° |
| C9 | C8 | C7 | H3 | 41.3° | 48.1° |
| C9 | C8 | C7 | H4 | 78.2° | 71.7° |
| C8 | C9 | C10 | H5 | 179.2° | 179.8° |
| CL | C11 | C10 | C9 | 179.7° | 179.6° |
| CL | C11 | C10 | H5 | 0.3° | 0.2° |
| CL | C11 | C12 | H16 | 1.0° | 0.0° |
| C11 | C10 | C9 | H5 | 180.0° | 179.4° |
| C10 | C11 | C12 | H16 | 179.4° | 180.0° |
| C11 | C10 | C9 | H17 | 179.2° | 179.7° |
| H5 | C10 | C9 | H17 | 0.8° | 0.3° |
| H6 | C17 | C16 | H12 | 140.7° | 145.0° |
| H6 | C17 | C16 | H13 | 0.0° | 0.0° |
| H7 | C17 | C16 | H12 | 0.0° | 0.0° |
| H7 | C17 | C16 | H13 | 140.7° | 145.0° |
| H10 | C24 | C25 | H26 | 0.6° | 0.1° |
| H10 | C24 | C23 | H27 | 0.1° | 0.0° |
| H11 | C26 | C25 | H26 | 0.6° | 0.0° |
| H18 | C2 | C1 | H19 | 169.6° | 68.9° |
| H18 | C2 | C1 | H20 | 71.4° | 171.1° |
| H18 | C2 | C3 | H24 | 158.9° | 24.3° |
| H18 | C2 | C3 | H25 | 36.9° | 97.8° |
| H19 | C1 | C | H21 | 59.5° | 180.0° |
| H19 | C1 | C | H22 | 179.5° | 60.0° |
| H19 | C1 | C | H23 | 60.5° | 60.0° |
| H20 | C1 | C | H21 | 59.5° | 59.9° |
| H20 | C1 | C | H22 | 60.5° | 180.0° |
| H20 | C1 | C | H23 | 179.5° | 60.0° |
| H21 | C | H22 | H23 | 120.0° | 119.9° |
