2WZ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C21 | C20 | sing | 1.53Å | 1.49Å | |
| C22 | C20 | sing | 1.53Å | 1.54Å | |
| C20 | O1 | sing | 1.43Å | 1.41Å | |
| C20 | C18 | sing | 1.51Å | 1.55Å | |
| C17 | C18 | doub | 1.39Å | 1.39Å | Aromatic |
| C17 | C16 | sing | 1.38Å | 1.39Å | Aromatic |
| C18 | C19 | sing | 1.38Å | 1.40Å | Aromatic |
| C16 | N3 | doub | 1.32Å | 1.32Å | Aromatic |
| C19 | C15 | doub | 1.39Å | 1.42Å | Aromatic |
| N3 | C15 | sing | 1.33Å | 1.33Å | Aromatic |
| C15 | C11 | sing | 1.48Å | 1.41Å | |
| C5 | N2 | doub | 1.32Å | 1.31Å | Aromatic |
| C5 | C4 | sing | 1.38Å | 1.39Å | Aromatic |
| N2 | C6 | sing | 1.32Å | 1.32Å | Aromatic |
| C11 | C12 | doub | 1.39Å | 1.39Å | Aromatic |
| C11 | C8 | sing | 1.41Å | 1.36Å | Aromatic |
| CL1 | C4 | sing | 1.74Å | 1.75Å | |
| C4 | C2 | doub | 1.39Å | 1.38Å | Aromatic |
| S1 | C8 | sing | 1.76Å | 1.70Å | Aromatic |
| S1 | C3 | sing | 1.75Å | 1.72Å | Aromatic |
| C6 | N4 | sing | 1.39Å | 1.32Å | |
| C6 | C7 | doub | 1.39Å | 1.38Å | Aromatic |
| C12 | C13 | sing | 1.39Å | 1.39Å | Aromatic |
| C8 | C9 | doub | 1.40Å | 1.42Å | Aromatic |
| C2 | C7 | sing | 1.38Å | 1.37Å | Aromatic |
| C2 | C1 | sing | 1.51Å | 1.54Å | |
| C7 | F1 | sing | 1.35Å | 1.35Å | |
| C13 | C14 | doub | 1.37Å | 1.38Å | Aromatic |
| C3 | C1 | sing | 1.51Å | 1.50Å | |
| C3 | C10 | doub | 1.32Å | 1.37Å | Aromatic |
| C9 | C14 | sing | 1.41Å | 1.41Å | Aromatic |
| C9 | C10 | sing | 1.45Å | 1.39Å | Aromatic |
| C1 | N1 | sing | 1.47Å | 1.48Å | |
| N1 | S2 | sing | 1.66Å | 1.59Å | |
| O3 | S2 | doub | 1.42Å | 1.50Å | |
| C25 | C23 | sing | 1.53Å | 1.51Å | |
| C25 | C24 | sing | 1.53Å | 1.55Å | |
| S2 | C23 | sing | 1.81Å | 1.79Å | |
| S2 | O2 | doub | 1.42Å | 1.46Å | |
| C23 | C24 | sing | 1.53Å | 1.49Å | |
| C5 | H1 | sing | 1.08Å | 1.08Å | |
| N4 | H2 | sing | 0.97Å | 1.00Å | |
| N4 | H3 | sing | 0.97Å | 1.00Å | |
| C1 | H4 | sing | 1.09Å | 1.10Å | |
| N1 | H5 | sing | 0.97Å | 1.00Å | |
| C23 | H6 | sing | 1.09Å | 1.10Å | |
| C24 | H7 | sing | 1.09Å | 1.10Å | |
| C24 | H8 | sing | 1.09Å | 1.10Å | |
| C25 | H9 | sing | 1.09Å | 1.10Å | |
| C25 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H11 | sing | 1.08Å | 1.08Å | |
| C14 | H12 | sing | 1.08Å | 1.08Å | |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C12 | H14 | sing | 1.08Å | 1.08Å | |
| C19 | H15 | sing | 1.08Å | 1.08Å | |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| C17 | H17 | sing | 1.08Å | 1.08Å | |
| C21 | H18 | sing | 1.09Å | 1.10Å | |
| C21 | H19 | sing | 1.09Å | 1.10Å | |
| C21 | H20 | sing | 1.09Å | 1.10Å | |
| C22 | H21 | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H23 | sing | 1.09Å | 1.10Å | |
| O1 | H24 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C21 | C20 | C22 | 111.1° | 109.4° |
| C21 | C20 | O1 | 106.9° | 109.5° |
| C21 | C20 | C18 | 110.4° | 109.5° |
| C20 | C21 | H18 | 109.5° | 109.4° |
| C20 | C21 | H19 | 109.5° | 109.5° |
| C20 | C21 | H20 | 109.5° | 109.5° |
| C22 | C20 | O1 | 109.0° | 109.5° |
| C22 | C20 | C18 | 109.3° | 109.5° |
| C20 | C22 | H21 | 109.5° | 109.5° |
| C20 | C22 | H22 | 109.5° | 109.5° |
| C20 | C22 | H23 | 109.5° | 109.5° |
| O1 | C20 | C18 | 110.0° | 109.5° |
| C20 | O1 | H24 | 109.5° | 114.0° |
| C20 | C18 | C17 | 119.4° | 120.7° |
| C20 | C18 | C19 | 122.0° | 120.7° |
| C18 | C17 | C16 | 116.8° | 119.4° |
| C17 | C18 | C19 | 118.6° | 118.5° |
| C18 | C17 | H17 | 121.6° | 120.4° |
| C17 | C16 | N3 | 124.2° | 120.9° |
| C17 | C16 | H16 | 117.9° | 119.6° |
| C16 | C17 | H17 | 121.6° | 120.2° |
| C18 | C19 | C15 | 121.1° | 119.1° |
| C18 | C19 | H15 | 119.4° | 120.5° |
| C16 | N3 | C15 | 121.1° | 121.6° |
| N3 | C16 | H16 | 117.9° | 119.5° |
| C19 | C15 | N3 | 118.0° | 120.6° |
| C19 | C15 | C11 | 123.3° | 119.7° |
| C15 | C19 | H15 | 119.4° | 120.5° |
| N3 | C15 | C11 | 118.7° | 119.7° |
| C15 | C11 | C12 | 122.3° | 119.9° |
| C15 | C11 | C8 | 119.0° | 120.0° |
| N2 | C5 | C4 | 121.7° | 120.9° |
| C5 | N2 | C6 | 121.0° | 121.6° |
| N2 | C5 | H1 | 119.2° | 119.5° |
| C5 | C4 | CL1 | 120.2° | 120.3° |
| C5 | C4 | C2 | 117.9° | 119.3° |
| C4 | C5 | H1 | 119.1° | 119.6° |
| N2 | C6 | N4 | 121.1° | 119.7° |
| N2 | C6 | C7 | 120.2° | 120.6° |
| C12 | C11 | C8 | 118.6° | 120.1° |
| C11 | C12 | C13 | 121.3° | 120.0° |
| C11 | C12 | H14 | 119.3° | 120.0° |
| C11 | C8 | S1 | 129.5° | 130.5° |
| C11 | C8 | C9 | 121.8° | 119.7° |
| CL1 | C4 | C2 | 121.9° | 120.4° |
| C4 | C2 | C7 | 119.1° | 118.5° |
| C4 | C2 | C1 | 120.6° | 120.8° |
| C8 | S1 | C3 | 94.1° | 92.2° |
| S1 | C8 | C9 | 108.7° | 109.7° |
| S1 | C3 | C1 | 123.5° | 124.3° |
| S1 | C3 | C10 | 110.2° | 111.4° |
| N4 | C6 | C7 | 118.6° | 119.7° |
| C6 | N4 | H2 | 109.5° | 120.0° |
| C6 | N4 | H3 | 109.5° | 120.0° |
| C6 | C7 | C2 | 120.0° | 119.1° |
| C6 | C7 | F1 | 117.4° | 120.4° |
| C12 | C13 | C14 | 120.1° | 120.6° |
| C12 | C13 | H13 | 120.0° | 119.7° |
| C13 | C12 | H14 | 119.3° | 120.0° |
| C8 | C9 | C14 | 118.5° | 119.0° |
| C8 | C9 | C10 | 113.9° | 111.8° |
| C7 | C2 | C1 | 120.3° | 120.7° |
| C2 | C7 | F1 | 122.5° | 120.5° |
| C2 | C1 | C3 | 110.5° | 109.5° |
| C2 | C1 | N1 | 111.2° | 109.4° |
| C2 | C1 | H4 | 106.6° | 109.5° |
| C13 | C14 | C9 | 119.4° | 120.6° |
| C13 | C14 | H12 | 120.3° | 119.7° |
| C14 | C13 | H13 | 119.9° | 119.7° |
| C1 | C3 | C10 | 126.1° | 124.3° |
| C3 | C1 | N1 | 113.7° | 109.5° |
| C3 | C1 | H4 | 107.1° | 109.5° |
| C3 | C10 | C9 | 113.1° | 114.9° |
| C3 | C10 | H11 | 123.5° | 122.5° |
| C14 | C9 | C10 | 127.4° | 129.2° |
| C9 | C14 | H12 | 120.3° | 119.7° |
| C9 | C10 | H11 | 123.4° | 122.5° |
| C1 | N1 | S2 | 117.8° | 120.0° |
| N1 | C1 | H4 | 107.3° | 109.4° |
| C1 | N1 | H5 | 107.3° | 120.0° |
| N1 | S2 | O3 | 110.6° | 104.3° |
| N1 | S2 | C23 | 108.1° | 104.4° |
| N1 | S2 | O2 | 108.7° | 104.3° |
| S2 | N1 | H5 | 107.3° | 120.0° |
| O3 | S2 | C23 | 119.6° | 110.5° |
| O3 | S2 | O2 | 107.4° | 121.1° |
| C23 | C25 | C24 | 57.9° | 60.0° |
| C25 | C23 | S2 | 116.3° | 117.5° |
| C25 | C23 | C24 | 62.3° | 60.0° |
| C25 | C23 | H6 | 122.3° | 117.5° |
| C23 | C25 | H9 | 120.3° | 117.5° |
| C23 | C25 | H10 | 120.3° | 117.5° |
| C25 | C24 | C23 | 59.7° | 60.0° |
| C25 | C24 | H7 | 120.0° | 117.5° |
| C25 | C24 | H8 | 120.1° | 117.5° |
| C24 | C25 | H9 | 120.3° | 117.5° |
| C24 | C25 | H10 | 120.3° | 117.5° |
| C23 | S2 | O2 | 101.6° | 110.5° |
| S2 | C23 | C24 | 102.9° | 117.5° |
| S2 | C23 | H6 | 116.9° | 115.6° |
| C24 | C23 | H6 | 123.0° | 117.5° |
| C23 | C24 | H7 | 120.0° | 117.5° |
| C23 | C24 | H8 | 120.0° | 117.5° |
| H2 | N4 | H3 | 109.5° | 120.1° |
| H7 | C24 | H8 | 109.5° | 115.5° |
| H9 | C25 | H10 | 109.5° | 115.5° |
| H18 | C21 | H19 | 109.4° | 109.4° |
| H18 | C21 | H20 | 109.5° | 109.4° |
| H19 | C21 | H20 | 109.4° | 109.5° |
| H21 | C22 | H22 | 109.5° | 109.5° |
| H21 | C22 | H23 | 109.5° | 109.5° |
| H22 | C22 | H23 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C21 | C20 | C22 | O1 | 117.6° | 120.0° |
| C21 | C20 | C22 | C18 | 122.1° | 120.0° |
| C21 | C20 | O1 | C18 | 119.9° | 120.0° |
| C21 | C20 | C18 | C17 | 84.0° | 30.0° |
| C21 | C20 | C18 | C19 | 94.2° | 150.2° |
| C20 | C21 | H18 | H19 | 120.0° | 120.0° |
| C20 | C21 | H18 | H20 | 120.0° | 120.0° |
| C20 | C21 | H19 | H20 | 120.0° | 120.1° |
| C21 | C20 | C22 | H21 | 180.0° | 60.1° |
| C21 | C20 | C22 | H22 | 60.0° | 60.0° |
| C21 | C20 | C22 | H23 | 60.0° | 180.0° |
| C21 | C20 | O1 | H24 | 180.0° | 180.0° |
| C22 | C20 | O1 | C18 | 119.9° | 120.0° |
| C22 | C20 | C18 | C17 | 38.5° | 90.0° |
| C22 | C20 | C18 | C19 | 143.4° | 89.8° |
| C22 | C20 | C21 | H18 | 180.0° | 180.0° |
| C22 | C20 | C21 | H19 | 60.0° | 60.0° |
| C22 | C20 | C21 | H20 | 60.0° | 60.1° |
| C20 | C22 | H21 | H22 | 120.0° | 120.1° |
| C20 | C22 | H21 | H23 | 120.0° | 120.0° |
| C20 | C22 | H22 | H23 | 120.0° | 120.0° |
| C22 | C20 | O1 | H24 | 59.8° | 60.0° |
| O1 | C20 | C18 | C17 | 158.2° | 150.0° |
| O1 | C20 | C18 | C19 | 23.6° | 30.2° |
| O1 | C20 | C21 | H18 | 61.1° | 60.0° |
| O1 | C20 | C21 | H19 | 178.9° | 179.9° |
| O1 | C20 | C21 | H20 | 58.9° | 59.9° |
| O1 | C20 | C22 | H21 | 62.4° | 60.0° |
| O1 | C20 | C22 | H22 | 57.6° | 180.0° |
| O1 | C20 | C22 | H23 | 177.6° | 60.0° |
| C20 | C18 | C17 | C19 | 178.2° | 179.8° |
| C20 | C18 | C17 | C16 | 177.9° | 180.0° |
| C20 | C18 | C19 | C15 | 178.2° | 179.8° |
| C20 | C18 | C19 | H15 | 1.8° | 0.3° |
| C20 | C18 | C17 | H17 | 2.1° | 0.3° |
| C18 | C20 | C21 | H18 | 58.6° | 60.0° |
| C18 | C20 | C21 | H19 | 61.4° | 59.9° |
| C18 | C20 | C21 | H20 | 178.6° | 179.9° |
| C18 | C20 | C22 | H21 | 58.0° | 180.0° |
| C18 | C20 | C22 | H22 | 178.0° | 60.0° |
| C18 | C20 | C22 | H23 | 62.1° | 60.0° |
| C18 | C20 | O1 | H24 | 60.1° | 60.0° |
| C18 | C17 | C16 | H17 | 180.0° | 179.7° |
| C18 | C17 | C16 | N3 | 0.8° | 0.2° |
| C17 | C18 | C19 | C15 | 3.6° | 0.0° |
| C17 | C18 | C19 | H15 | 176.4° | 180.0° |
| C18 | C17 | C16 | H16 | 179.2° | 179.8° |
| C16 | C17 | C18 | C19 | 3.9° | 0.2° |
| C17 | C16 | N3 | H16 | 180.0° | 180.0° |
| C17 | C16 | N3 | C15 | 2.9° | 0.0° |
| C18 | C19 | C15 | H15 | 180.0° | 179.9° |
| C18 | C19 | C15 | N3 | 0.1° | 0.2° |
| C18 | C19 | C15 | C11 | 178.3° | 179.9° |
| C19 | C18 | C17 | H17 | 176.1° | 180.0° |
| C16 | N3 | C15 | C19 | 3.1° | 0.2° |
| C16 | N3 | C15 | C11 | 178.4° | 180.0° |
| N3 | C16 | C17 | H17 | 179.2° | 180.0° |
| C19 | C15 | N3 | C11 | 178.5° | 179.7° |
| C19 | C15 | C11 | C12 | 3.1° | 0.0° |
| C19 | C15 | C11 | C8 | 174.5° | 179.7° |
| N3 | C15 | C11 | C12 | 175.3° | 179.8° |
| N3 | C15 | C11 | C8 | 7.1° | 0.6° |
| N3 | C15 | C19 | H15 | 179.9° | 179.7° |
| C15 | N3 | C16 | H16 | 177.1° | 180.0° |
| C15 | C11 | C12 | C8 | 177.6° | 179.7° |
| C15 | C11 | C8 | S1 | 0.6° | 0.2° |
| C15 | C11 | C12 | C13 | 179.0° | 180.0° |
| C15 | C11 | C8 | C9 | 178.0° | 180.0° |
| C15 | C11 | C12 | H14 | 1.0° | 0.2° |
| C11 | C15 | C19 | H15 | 1.7° | 0.0° |
| N2 | C5 | C4 | H1 | 180.0° | 179.9° |
| N2 | C5 | C4 | CL1 | 179.3° | 180.0° |
| N2 | C5 | C4 | C2 | 1.3° | 0.3° |
| C5 | N2 | C6 | N4 | 179.1° | 180.0° |
| C5 | N2 | C6 | C7 | 1.1° | 0.0° |
| C4 | C5 | N2 | C6 | 2.2° | 0.1° |
| C5 | C4 | CL1 | C2 | 177.9° | 179.7° |
| C5 | C4 | C2 | C7 | 0.7° | 0.5° |
| C5 | C4 | C2 | C1 | 177.6° | 179.7° |
| N2 | C6 | N4 | C7 | 178.1° | 180.0° |
| N2 | C6 | C7 | C2 | 1.0° | 0.3° |
| N2 | C6 | C7 | F1 | 178.2° | 180.0° |
| C6 | N2 | C5 | H1 | 177.7° | 180.0° |
| N2 | C6 | N4 | H2 | 0.0° | 0.0° |
| N2 | C6 | N4 | H3 | 120.0° | 180.0° |
| C12 | C11 | C8 | S1 | 178.2° | 179.9° |
| C11 | C12 | C13 | H14 | 180.0° | 179.8° |
| C12 | C11 | C8 | C9 | 4.4° | 0.3° |
| C11 | C12 | C13 | C14 | 0.4° | 0.2° |
| C11 | C12 | C13 | H13 | 179.6° | 179.8° |
| C11 | C8 | S1 | C9 | 177.7° | 179.8° |
| C11 | C8 | S1 | C3 | 177.3° | 180.0° |
| C8 | C11 | C12 | C13 | 1.5° | 0.4° |
| C11 | C8 | C9 | C14 | 6.1° | 0.2° |
| C11 | C8 | C9 | C10 | 178.0° | 179.9° |
| C8 | C11 | C12 | H14 | 178.6° | 179.8° |
| CL1 | C4 | C2 | C7 | 177.2° | 179.8° |
| CL1 | C4 | C2 | C1 | 0.4° | 0.0° |
| CL1 | C4 | C5 | H1 | 0.7° | 0.1° |
| C4 | C2 | C7 | C6 | 1.8° | 0.5° |
| C4 | C2 | C7 | C1 | 176.8° | 179.8° |
| C4 | C2 | C7 | F1 | 178.9° | 179.8° |
| C4 | C2 | C1 | C3 | 98.5° | 75.0° |
| C4 | C2 | C1 | N1 | 134.3° | 45.0° |
| C2 | C4 | C5 | H1 | 178.7° | 179.8° |
| C4 | C2 | C1 | H4 | 17.6° | 165.0° |
| C8 | S1 | C3 | C1 | 175.5° | 180.0° |
| C8 | S1 | C3 | C10 | 0.7° | 0.2° |
| S1 | C8 | C9 | C14 | 176.0° | 180.0° |
| S1 | C8 | C9 | C10 | 0.1° | 0.1° |
| C3 | S1 | C8 | C9 | 0.3° | 0.2° |
| S1 | C3 | C1 | C2 | 58.3° | 80.3° |
| S1 | C3 | C1 | C10 | 175.6° | 179.7° |
| S1 | C3 | C10 | C9 | 0.9° | 0.2° |
| S1 | C3 | C1 | N1 | 175.8° | 39.7° |
| S1 | C3 | C1 | H4 | 57.5° | 159.7° |
| S1 | C3 | C10 | H11 | 179.1° | 179.8° |
| N4 | C6 | C7 | C2 | 177.1° | 179.7° |
| N4 | C6 | C7 | F1 | 0.1° | 0.0° |
| C6 | N4 | H2 | H3 | 120.0° | 180.0° |
| C6 | C7 | C2 | F1 | 177.1° | 179.7° |
| C6 | C7 | C2 | C1 | 178.7° | 179.7° |
| C7 | C6 | N4 | H2 | 178.0° | 180.0° |
| C7 | C6 | N4 | H3 | 61.9° | 0.0° |
| C12 | C13 | C14 | H13 | 180.0° | 180.0° |
| C12 | C13 | C14 | C9 | 2.1° | 0.1° |
| C12 | C13 | C14 | H12 | 177.9° | 180.0° |
| C8 | C9 | C14 | C13 | 4.8° | 0.0° |
| C8 | C9 | C10 | C3 | 0.6° | 0.1° |
| C8 | C9 | C14 | C10 | 175.3° | 179.9° |
| C8 | C9 | C10 | H11 | 179.4° | 179.9° |
| C8 | C9 | C14 | H12 | 175.2° | 180.0° |
| C7 | C2 | C1 | C3 | 78.3° | 104.8° |
| C7 | C2 | C1 | N1 | 48.9° | 135.2° |
| C7 | C2 | C1 | H4 | 165.6° | 15.3° |
| C1 | C2 | C7 | F1 | 4.3° | 0.0° |
| C2 | C1 | C3 | N1 | 125.9° | 120.0° |
| C2 | C1 | C3 | H4 | 115.8° | 120.1° |
| C2 | C1 | C3 | C10 | 126.1° | 100.0° |
| C2 | C1 | N1 | H4 | 116.3° | 120.0° |
| C2 | C1 | N1 | S2 | 121.4° | 95.1° |
| C2 | C1 | N1 | H5 | 0.2° | 85.0° |
| C13 | C14 | C9 | H12 | 180.0° | 179.9° |
| C13 | C14 | C9 | C10 | 179.8° | 179.9° |
| C14 | C13 | C12 | H14 | 179.6° | 180.0° |
| C1 | C3 | C10 | C9 | 175.2° | 180.0° |
| C3 | C1 | N1 | H4 | 118.2° | 120.0° |
| C3 | C1 | N1 | S2 | 113.1° | 145.0° |
| C3 | C1 | N1 | H5 | 125.7° | 35.0° |
| C1 | C3 | C10 | H11 | 4.8° | 0.0° |
| C3 | C10 | C9 | C14 | 176.1° | 179.8° |
| C3 | C10 | C9 | H11 | 180.0° | 180.0° |
| C10 | C3 | C1 | N1 | 0.2° | 140.0° |
| C10 | C3 | C1 | H4 | 118.1° | 20.0° |
| C14 | C9 | C10 | H11 | 3.8° | 0.2° |
| C9 | C14 | C13 | H13 | 177.9° | 179.9° |
| C10 | C9 | C14 | H12 | 0.2° | 0.2° |
| C1 | N1 | S2 | H5 | 121.2° | 179.9° |
| C1 | N1 | S2 | O3 | 47.0° | 51.0° |
| C1 | N1 | S2 | C23 | 85.8° | 65.0° |
| C1 | N1 | S2 | O2 | 164.7° | 178.9° |
| N1 | S2 | O3 | C23 | 126.6° | 111.7° |
| N1 | S2 | O3 | O2 | 118.6° | 116.8° |
| N1 | S2 | C23 | C25 | 75.4° | 111.4° |
| N1 | S2 | C23 | O2 | 114.4° | 111.6° |
| N1 | S2 | C23 | C24 | 140.7° | 180.0° |
| S2 | N1 | C1 | H4 | 5.1° | 25.0° |
| N1 | S2 | C23 | H6 | 81.3° | 34.3° |
| O3 | S2 | C23 | C25 | 52.4° | 137.0° |
| O3 | S2 | C23 | O2 | 117.9° | 136.8° |
| O3 | S2 | C23 | C24 | 12.9° | 68.4° |
| O3 | S2 | N1 | H5 | 74.2° | 128.9° |
| O3 | S2 | C23 | H6 | 150.9° | 77.3° |
| C23 | C25 | C24 | H9 | 108.9° | 107.5° |
| C23 | C25 | C24 | H10 | 108.9° | 107.5° |
| C25 | C23 | S2 | C24 | 65.3° | 68.6° |
| C25 | C23 | S2 | H6 | 156.7° | 145.7° |
| C25 | C23 | S2 | O2 | 170.3° | 0.2° |
| C25 | C23 | C24 | H6 | 112.3° | 107.5° |
| C23 | C25 | C24 | H7 | 109.4° | 107.5° |
| C23 | C25 | C24 | H8 | 109.4° | 107.5° |
| C23 | C25 | H9 | H10 | 145.9° | 145.6° |
| C25 | C24 | H7 | H8 | 144.9° | 145.7° |
| C24 | C25 | H9 | H10 | 145.9° | 145.7° |
| S2 | C23 | C24 | H6 | 134.7° | 145.0° |
| C23 | S2 | N1 | H5 | 153.1° | 115.0° |
| S2 | C23 | C24 | H7 | 137.5° | 0.0° |
| S2 | C23 | C24 | H8 | 3.7° | 145.0° |
| S2 | C23 | C25 | H9 | 159.8° | 145.0° |
| S2 | C23 | C25 | H10 | 17.6° | 0.0° |
| O2 | S2 | C23 | C24 | 105.0° | 68.4° |
| O2 | S2 | N1 | H5 | 43.5° | 1.0° |
| O2 | S2 | C23 | H6 | 33.0° | 145.9° |
| C23 | C24 | H7 | H8 | 144.9° | 145.7° |
| H4 | C1 | N1 | H5 | 116.1° | 155.0° |
| H6 | C23 | C24 | H7 | 2.9° | 145.0° |
| H6 | C23 | C24 | H8 | 138.3° | 0.1° |
| H6 | C23 | C25 | H9 | 4.4° | 0.1° |
| H6 | C23 | C25 | H10 | 137.8° | 145.0° |
| H7 | C24 | C25 | H9 | 0.5° | 145.1° |
| H7 | C24 | C25 | H10 | 141.7° | 0.0° |
| H8 | C24 | C25 | H9 | 141.7° | 0.0° |
| H8 | C24 | C25 | H10 | 0.5° | 145.0° |
| H12 | C14 | C13 | H13 | 2.1° | 0.0° |
| H13 | C13 | C12 | H14 | 0.4° | 0.0° |
| H16 | C16 | C17 | H17 | 0.8° | 0.0° |
| H18 | C21 | H19 | H20 | 119.9° | 119.9° |
| H21 | C22 | H22 | H23 | 120.0° | 120.0° |
