A1C4O
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | O1 | sing | 1.43Å | 1.41Å | |
| O5 | S | doub | 1.42Å | 1.40Å | |
| O1 | C2 | sing | 1.43Å | 1.37Å | |
| S | C15 | sing | 1.83Å | 1.67Å | |
| S | C16 | sing | 1.83Å | 1.85Å | |
| S | O4 | doub | 1.42Å | 1.44Å | |
| C2 | C17 | sing | 1.51Å | 1.45Å | |
| C2 | C3 | sing | 1.51Å | 1.47Å | |
| C15 | C14 | sing | 1.55Å | 1.42Å | |
| C14 | C13 | sing | 1.54Å | 1.47Å | |
| F3 | C28 | sing | 1.35Å | 1.35Å | |
| C16 | C13 | sing | 1.54Å | 1.52Å | |
| C13 | N1 | sing | 1.46Å | 1.42Å | |
| C17 | C28 | doub | 1.39Å | 1.37Å | Aromatic |
| C17 | C18 | sing | 1.38Å | 1.38Å | Aromatic |
| C28 | C27 | sing | 1.38Å | 1.38Å | Aromatic |
| C18 | C19 | doub | 1.38Å | 1.37Å | Aromatic |
| C27 | C20 | doub | 1.39Å | 1.39Å | Aromatic |
| C19 | C20 | sing | 1.39Å | 1.39Å | Aromatic |
| C26 | C25 | doub | 1.38Å | 1.38Å | Aromatic |
| C26 | C21 | sing | 1.39Å | 1.39Å | Aromatic |
| F2 | C25 | sing | 1.35Å | 1.34Å | |
| C20 | C21 | sing | 1.48Å | 1.47Å | |
| C25 | C24 | sing | 1.39Å | 1.38Å | Aromatic |
| C21 | C22 | doub | 1.39Å | 1.39Å | Aromatic |
| C3 | N1 | sing | 1.35Å | 1.33Å | |
| C3 | O2 | doub | 1.21Å | 1.21Å | |
| N1 | C4 | sing | 1.46Å | 1.46Å | |
| C24 | F1 | sing | 1.35Å | 1.34Å | |
| C24 | C23 | doub | 1.38Å | 1.38Å | Aromatic |
| C22 | C23 | sing | 1.38Å | 1.37Å | Aromatic |
| C4 | C5 | sing | 1.51Å | 1.49Å | |
| C6 | C5 | doub | 1.39Å | 1.38Å | Aromatic |
| C6 | C7 | sing | 1.38Å | 1.38Å | Aromatic |
| C5 | C12 | sing | 1.39Å | 1.38Å | Aromatic |
| C7 | N2 | doub | 1.32Å | 1.32Å | Aromatic |
| C12 | C8 | doub | 1.38Å | 1.38Å | Aromatic |
| N2 | C8 | sing | 1.32Å | 1.32Å | Aromatic |
| C8 | C9 | sing | 1.51Å | 1.50Å | |
| C9 | C11 | sing | 1.53Å | 1.53Å | |
| C9 | O3 | sing | 1.43Å | 1.43Å | |
| C9 | C10 | sing | 1.53Å | 1.53Å | |
| C4 | H1 | sing | 1.09Å | 1.10Å | |
| C4 | H2 | sing | 1.09Å | 1.10Å | |
| C6 | H3 | sing | 1.08Å | 1.08Å | |
| C7 | H4 | sing | 1.08Å | 1.08Å | |
| C10 | H5 | sing | 1.09Å | 1.10Å | |
| C10 | H6 | sing | 1.09Å | 1.10Å | |
| C10 | H7 | sing | 1.09Å | 1.10Å | |
| C13 | H8 | sing | 1.09Å | 1.10Å | |
| C15 | H9 | sing | 1.09Å | 1.10Å | |
| C22 | H10 | sing | 1.08Å | 1.08Å | |
| C26 | H11 | sing | 1.08Å | 1.08Å | |
| C1 | H12 | sing | 1.09Å | 1.10Å | |
| C1 | H13 | sing | 1.09Å | 1.10Å | |
| C1 | H14 | sing | 1.09Å | 1.10Å | |
| C2 | H15 | sing | 1.09Å | 1.10Å | |
| C11 | H16 | sing | 1.09Å | 1.10Å | |
| C11 | H17 | sing | 1.09Å | 1.10Å | |
| C11 | H18 | sing | 1.09Å | 1.10Å | |
| O3 | H19 | sing | 0.97Å | 0.95Å | |
| C12 | H20 | sing | 1.08Å | 1.08Å | |
| C14 | H21 | sing | 1.09Å | 1.10Å | |
| C16 | H22 | sing | 1.09Å | 1.10Å | |
| C16 | H23 | sing | 1.09Å | 1.10Å | |
| C18 | H24 | sing | 1.08Å | 1.08Å | |
| C19 | H25 | sing | 1.08Å | 1.08Å | |
| C23 | H26 | sing | 1.08Å | 1.08Å | |
| C27 | H27 | sing | 1.08Å | 1.08Å | |
| C15 | H28 | sing | 1.09Å | 1.10Å | |
| C14 | H29 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | O1 | C2 | 120.9° | 114.0° |
| O1 | C1 | H12 | 109.5° | 109.5° |
| O1 | C1 | H13 | 109.5° | 109.5° |
| O1 | C1 | H14 | 109.5° | 109.5° |
| O5 | S | C15 | 115.6° | 109.3° |
| O5 | S | C16 | 112.4° | 109.3° |
| O5 | S | O4 | 121.8° | 120.0° |
| O1 | C2 | C17 | 116.7° | 109.5° |
| O1 | C2 | C3 | 113.6° | 109.5° |
| O1 | C2 | H15 | 105.6° | 109.5° |
| C15 | S | C16 | 101.5° | 97.1° |
| C15 | S | O4 | 98.5° | 109.3° |
| S | C15 | C14 | 106.6° | 102.6° |
| S | C15 | H9 | 110.2° | 110.7° |
| S | C15 | H28 | 110.2° | 111.0° |
| C16 | S | O4 | 104.3° | 109.4° |
| S | C16 | C13 | 101.0° | 105.1° |
| S | C16 | H22 | 111.5° | 110.3° |
| S | C16 | H23 | 111.6° | 110.3° |
| C17 | C2 | C3 | 110.6° | 109.5° |
| C2 | C17 | C28 | 122.2° | 119.9° |
| C2 | C17 | C18 | 116.3° | 119.9° |
| C17 | C2 | H15 | 104.7° | 109.5° |
| C2 | C3 | N1 | 125.6° | 120.0° |
| C2 | C3 | O2 | 119.0° | 120.0° |
| C3 | C2 | H15 | 104.4° | 109.4° |
| C15 | C14 | C13 | 118.3° | 106.6° |
| C14 | C15 | H9 | 110.2° | 110.8° |
| C15 | C14 | H21 | 107.2° | 110.0° |
| C14 | C15 | H28 | 110.2° | 110.8° |
| C15 | C14 | H29 | 107.3° | 110.0° |
| C14 | C13 | C16 | 112.5° | 108.6° |
| C14 | C13 | N1 | 106.9° | 109.7° |
| C14 | C13 | H8 | 108.0° | 109.6° |
| C13 | C14 | H21 | 107.2° | 110.1° |
| C13 | C14 | H29 | 107.2° | 110.0° |
| F3 | C28 | C17 | 119.3° | 119.9° |
| F3 | C28 | C27 | 121.1° | 120.0° |
| C16 | C13 | N1 | 113.3° | 109.6° |
| C16 | C13 | H8 | 107.4° | 109.6° |
| C13 | C16 | H22 | 111.5° | 110.3° |
| C13 | C16 | H23 | 111.5° | 110.4° |
| C13 | N1 | C3 | 118.1° | 120.0° |
| C13 | N1 | C4 | 117.9° | 120.0° |
| N1 | C13 | H8 | 108.6° | 109.7° |
| C28 | C17 | C18 | 121.0° | 120.2° |
| C17 | C28 | C27 | 119.6° | 120.1° |
| C17 | C18 | C19 | 119.8° | 120.1° |
| C17 | C18 | H24 | 120.1° | 119.9° |
| C28 | C27 | C20 | 119.7° | 119.8° |
| C28 | C27 | H27 | 120.1° | 120.1° |
| C18 | C19 | C20 | 119.6° | 119.9° |
| C19 | C18 | H24 | 120.1° | 119.9° |
| C18 | C19 | H25 | 120.2° | 120.0° |
| C27 | C20 | C19 | 120.2° | 119.8° |
| C27 | C20 | C21 | 119.9° | 120.1° |
| C20 | C27 | H27 | 120.2° | 120.1° |
| C19 | C20 | C21 | 119.8° | 120.1° |
| C20 | C19 | H25 | 120.2° | 120.1° |
| C25 | C26 | C21 | 119.0° | 119.9° |
| C26 | C25 | F2 | 120.3° | 120.0° |
| C26 | C25 | C24 | 120.5° | 120.1° |
| C25 | C26 | H11 | 120.5° | 120.1° |
| C26 | C21 | C20 | 121.8° | 120.1° |
| C26 | C21 | C22 | 120.3° | 119.9° |
| C21 | C26 | H11 | 120.5° | 120.1° |
| F2 | C25 | C24 | 119.2° | 119.9° |
| C20 | C21 | C22 | 117.9° | 120.1° |
| C25 | C24 | F1 | 119.2° | 119.9° |
| C25 | C24 | C23 | 120.6° | 120.1° |
| C21 | C22 | C23 | 120.3° | 119.9° |
| C21 | C22 | H10 | 119.8° | 120.1° |
| N1 | C3 | O2 | 115.1° | 120.0° |
| C3 | N1 | C4 | 124.0° | 120.0° |
| N1 | C4 | C5 | 112.5° | 109.5° |
| N1 | C4 | H1 | 108.7° | 109.5° |
| N1 | C4 | H2 | 108.7° | 109.4° |
| F1 | C24 | C23 | 120.1° | 120.0° |
| C24 | C23 | C22 | 119.2° | 120.2° |
| C24 | C23 | H26 | 120.4° | 119.9° |
| C23 | C22 | H10 | 119.8° | 120.0° |
| C22 | C23 | H26 | 120.3° | 119.9° |
| C4 | C5 | C6 | 121.8° | 120.8° |
| C4 | C5 | C12 | 119.6° | 120.8° |
| C5 | C4 | H1 | 108.7° | 109.4° |
| C5 | C4 | H2 | 108.7° | 109.5° |
| C5 | C6 | C7 | 119.1° | 119.2° |
| C6 | C5 | C12 | 118.6° | 118.4° |
| C5 | C6 | H3 | 120.4° | 120.4° |
| C6 | C7 | N2 | 120.9° | 120.8° |
| C7 | C6 | H3 | 120.5° | 120.4° |
| C6 | C7 | H4 | 119.5° | 119.6° |
| C5 | C12 | C8 | 119.1° | 119.1° |
| C5 | C12 | H20 | 120.4° | 120.4° |
| C7 | N2 | C8 | 121.4° | 121.7° |
| N2 | C7 | H4 | 119.5° | 119.7° |
| C12 | C8 | N2 | 120.8° | 120.8° |
| C12 | C8 | C9 | 119.9° | 119.6° |
| C8 | C12 | H20 | 120.4° | 120.5° |
| N2 | C8 | C9 | 119.4° | 119.6° |
| C8 | C9 | C11 | 109.6° | 109.5° |
| C8 | C9 | O3 | 109.5° | 109.5° |
| C8 | C9 | C10 | 110.3° | 109.5° |
| C11 | C9 | O3 | 108.8° | 109.5° |
| C11 | C9 | C10 | 109.1° | 109.5° |
| C9 | C11 | H16 | 109.5° | 109.4° |
| C9 | C11 | H17 | 109.4° | 109.4° |
| C9 | C11 | H18 | 109.5° | 109.5° |
| O3 | C9 | C10 | 109.6° | 109.5° |
| C9 | O3 | H19 | 109.5° | 114.0° |
| C9 | C10 | H5 | 109.5° | 109.4° |
| C9 | C10 | H6 | 109.5° | 109.5° |
| C9 | C10 | H7 | 109.5° | 109.5° |
| H1 | C4 | H2 | 109.4° | 109.5° |
| H5 | C10 | H6 | 109.5° | 109.5° |
| H5 | C10 | H7 | 109.5° | 109.5° |
| H6 | C10 | H7 | 109.5° | 109.5° |
| H9 | C15 | H28 | 109.5° | 110.7° |
| H12 | C1 | H13 | 109.5° | 109.5° |
| H12 | C1 | H14 | 109.4° | 109.4° |
| H13 | C1 | H14 | 109.4° | 109.4° |
| H16 | C11 | H17 | 109.5° | 109.5° |
| H16 | C11 | H18 | 109.4° | 109.5° |
| H17 | C11 | H18 | 109.5° | 109.5° |
| H21 | C14 | H29 | 109.4° | 110.0° |
| H22 | C16 | H23 | 109.5° | 110.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | O1 | C2 | C17 | 94.6° | 90.0° |
| C1 | O1 | C2 | C3 | 135.0° | 150.0° |
| O1 | C1 | H12 | H13 | 120.0° | 120.1° |
| O1 | C1 | H12 | H14 | 120.0° | 120.0° |
| O1 | C1 | H13 | H14 | 120.0° | 120.0° |
| C1 | O1 | C2 | H15 | 21.2° | 30.1° |
| O5 | S | C15 | C16 | 121.9° | 113.4° |
| O5 | S | C15 | O4 | 131.5° | 133.2° |
| O5 | S | C16 | O4 | 133.9° | 133.2° |
| O5 | S | C15 | C14 | 117.3° | 136.6° |
| O5 | S | C16 | C13 | 121.3° | 111.2° |
| O5 | S | C15 | H9 | 2.2° | 105.1° |
| O5 | S | C16 | H22 | 120.1° | 7.6° |
| O5 | S | C16 | H23 | 2.7° | 129.8° |
| O5 | S | C15 | H28 | 123.1° | 18.3° |
| O1 | C2 | C17 | C3 | 131.8° | 120.0° |
| O1 | C2 | C17 | H15 | 116.3° | 120.1° |
| O1 | C2 | C3 | H15 | 114.5° | 120.0° |
| O1 | C2 | C17 | C28 | 153.6° | 159.9° |
| O1 | C2 | C17 | C18 | 34.2° | 19.9° |
| O1 | C2 | C3 | N1 | 59.0° | 151.8° |
| O1 | C2 | C3 | O2 | 114.9° | 28.1° |
| C2 | O1 | C1 | H12 | 180.0° | 60.0° |
| C2 | O1 | C1 | H13 | 60.0° | 180.0° |
| C2 | O1 | C1 | H14 | 60.0° | 60.0° |
| C15 | S | C16 | O4 | 102.0° | 113.4° |
| S | C15 | C14 | H9 | 119.5° | 118.2° |
| S | C15 | C14 | H28 | 119.5° | 118.5° |
| S | C15 | C14 | C13 | 5.2° | 42.5° |
| C15 | S | C16 | C13 | 2.8° | 2.2° |
| S | C15 | H9 | H28 | 121.3° | 123.6° |
| S | C15 | C14 | H21 | 116.0° | 76.8° |
| C15 | S | C16 | H22 | 115.8° | 121.0° |
| C15 | S | C16 | H23 | 121.5° | 116.8° |
| S | C15 | C14 | H29 | 126.5° | 161.8° |
| C16 | S | C15 | C14 | 4.6° | 23.2° |
| S | C16 | C13 | C14 | 0.2° | 28.0° |
| S | C16 | C13 | H22 | 118.6° | 118.9° |
| S | C16 | C13 | H23 | 118.6° | 118.9° |
| S | C16 | C13 | N1 | 121.6° | 147.8° |
| S | C16 | C13 | H8 | 118.4° | 91.8° |
| C16 | S | C15 | H9 | 124.1° | 141.5° |
| S | C16 | H22 | H23 | 124.0° | 122.1° |
| C16 | S | C15 | H28 | 115.0° | 95.1° |
| O4 | S | C15 | C14 | 111.2° | 90.2° |
| O4 | S | C16 | C13 | 104.8° | 115.6° |
| O4 | S | C15 | H9 | 129.3° | 28.0° |
| O4 | S | C16 | H22 | 13.8° | 125.6° |
| O4 | S | C16 | H23 | 136.6° | 3.4° |
| O4 | S | C15 | H28 | 8.4° | 151.4° |
| C17 | C2 | C3 | H15 | 112.1° | 120.0° |
| C2 | C17 | C28 | F3 | 6.3° | 0.2° |
| C2 | C17 | C28 | C18 | 171.8° | 179.7° |
| C2 | C17 | C28 | C27 | 175.2° | 179.7° |
| C2 | C17 | C18 | C19 | 175.7° | 179.7° |
| C17 | C2 | C3 | N1 | 167.6° | 31.8° |
| C17 | C2 | C3 | O2 | 18.5° | 148.1° |
| C2 | C17 | C18 | H24 | 4.3° | 0.3° |
| C2 | C3 | N1 | C13 | 3.4° | 43.6° |
| C3 | C2 | C17 | C28 | 74.6° | 80.1° |
| C3 | C2 | C17 | C18 | 97.6° | 100.1° |
| C2 | C3 | N1 | O2 | 174.1° | 180.0° |
| C2 | C3 | N1 | C4 | 176.3° | 136.2° |
| C15 | C14 | C13 | H21 | 121.3° | 119.3° |
| C15 | C14 | C13 | H29 | 121.3° | 119.3° |
| C15 | C14 | C13 | C16 | 3.3° | 47.2° |
| C15 | C14 | C13 | N1 | 121.7° | 167.0° |
| C15 | C14 | C13 | H8 | 121.6° | 72.5° |
| C14 | C15 | H9 | H28 | 121.4° | 123.3° |
| C15 | C14 | H21 | H29 | 116.0° | 121.4° |
| C14 | C13 | C16 | N1 | 121.4° | 119.8° |
| C14 | C13 | C16 | H8 | 118.6° | 119.8° |
| C14 | C13 | N1 | H8 | 116.3° | 120.4° |
| C14 | C13 | N1 | C3 | 118.5° | 10.5° |
| C14 | C13 | N1 | C4 | 61.8° | 169.7° |
| C13 | C14 | C15 | H9 | 124.8° | 160.7° |
| C13 | C14 | H21 | H29 | 116.0° | 121.4° |
| C14 | C13 | C16 | H22 | 118.4° | 146.8° |
| C14 | C13 | C16 | H23 | 118.9° | 90.9° |
| C13 | C14 | C15 | H28 | 114.3° | 76.0° |
| F3 | C28 | C17 | C27 | 178.5° | 179.9° |
| F3 | C28 | C17 | C18 | 178.2° | 180.0° |
| F3 | C28 | C27 | C20 | 179.5° | 180.0° |
| F3 | C28 | C27 | H27 | 0.5° | 0.1° |
| C16 | C13 | N1 | H8 | 119.2° | 120.4° |
| C16 | C13 | N1 | C3 | 117.0° | 108.6° |
| C16 | C13 | N1 | C4 | 62.7° | 71.2° |
| C16 | C13 | C14 | H21 | 118.0° | 72.1° |
| C13 | C16 | H22 | H23 | 123.9° | 122.2° |
| C16 | C13 | C14 | H29 | 124.6° | 166.5° |
| C13 | N1 | C3 | C4 | 179.7° | 179.8° |
| C13 | N1 | C3 | O2 | 177.5° | 136.5° |
| C13 | N1 | C4 | C5 | 119.3° | 90.0° |
| C13 | N1 | C4 | H1 | 1.1° | 150.1° |
| C13 | N1 | C4 | H2 | 120.2° | 30.0° |
| N1 | C13 | C14 | H21 | 117.0° | 47.7° |
| N1 | C13 | C16 | H22 | 3.0° | 93.4° |
| N1 | C13 | C16 | H23 | 119.7° | 28.9° |
| N1 | C13 | C14 | H29 | 0.5° | 73.7° |
| C28 | C17 | C18 | C19 | 3.4° | 0.0° |
| C17 | C28 | C27 | C20 | 1.1° | 0.1° |
| C28 | C17 | C2 | H15 | 37.3° | 39.8° |
| C28 | C17 | C18 | H24 | 176.7° | 180.0° |
| C17 | C28 | C27 | H27 | 178.9° | 180.0° |
| C18 | C17 | C28 | C27 | 3.3° | 0.1° |
| C17 | C18 | C19 | H24 | 180.0° | 180.0° |
| C17 | C18 | C19 | C20 | 1.1° | 0.0° |
| C18 | C17 | C2 | H15 | 150.5° | 139.9° |
| C17 | C18 | C19 | H25 | 178.8° | 180.0° |
| C28 | C27 | C20 | H27 | 180.0° | 179.9° |
| C28 | C27 | C20 | C19 | 1.1° | 0.1° |
| C28 | C27 | C20 | C21 | 178.2° | 180.0° |
| C18 | C19 | C20 | C27 | 1.1° | 0.1° |
| C18 | C19 | C20 | H25 | 180.0° | 180.0° |
| C18 | C19 | C20 | C21 | 178.1° | 180.0° |
| C27 | C20 | C19 | C21 | 177.1° | 179.9° |
| C27 | C20 | C21 | C26 | 27.8° | 179.8° |
| C27 | C20 | C21 | C22 | 148.0° | 0.1° |
| C27 | C20 | C19 | H25 | 179.0° | 179.9° |
| C19 | C20 | C21 | C26 | 155.1° | 0.3° |
| C19 | C20 | C21 | C22 | 29.0° | 180.0° |
| C20 | C19 | C18 | H24 | 178.9° | 180.0° |
| C19 | C20 | C27 | H27 | 178.9° | 180.0° |
| C25 | C26 | C21 | H11 | 180.0° | 179.9° |
| C26 | C25 | F2 | C24 | 179.8° | 180.0° |
| C25 | C26 | C21 | C20 | 178.1° | 179.9° |
| C25 | C26 | C21 | C22 | 2.3° | 0.2° |
| C26 | C25 | C24 | F1 | 179.7° | 180.0° |
| C26 | C25 | C24 | C23 | 0.1° | 0.3° |
| C21 | C26 | C25 | F2 | 178.9° | 180.0° |
| C26 | C21 | C20 | C22 | 175.9° | 179.7° |
| C21 | C26 | C25 | C24 | 1.0° | 0.0° |
| C26 | C21 | C22 | C23 | 2.6° | 0.2° |
| C26 | C21 | C22 | H10 | 177.4° | 179.7° |
| F2 | C25 | C24 | F1 | 0.1° | 0.1° |
| F2 | C25 | C24 | C23 | 180.0° | 179.7° |
| F2 | C25 | C26 | H11 | 1.2° | 0.1° |
| C20 | C21 | C22 | C23 | 178.5° | 179.9° |
| C20 | C21 | C22 | H10 | 1.5° | 0.0° |
| C20 | C21 | C26 | H11 | 1.9° | 0.0° |
| C21 | C20 | C19 | H25 | 1.9° | 0.0° |
| C21 | C20 | C27 | H27 | 1.9° | 0.1° |
| C25 | C24 | F1 | C23 | 179.9° | 179.7° |
| C25 | C24 | C23 | C22 | 0.1° | 0.3° |
| C24 | C25 | C26 | H11 | 179.0° | 180.0° |
| C25 | C24 | C23 | H26 | 179.9° | 179.8° |
| C21 | C22 | C23 | C24 | 1.5° | 0.0° |
| C21 | C22 | C23 | H10 | 180.0° | 180.0° |
| C22 | C21 | C26 | H11 | 177.7° | 179.7° |
| C21 | C22 | C23 | H26 | 178.5° | 179.9° |
| C3 | N1 | C4 | C5 | 61.0° | 90.2° |
| C3 | N1 | C4 | H1 | 178.6° | 29.7° |
| C3 | N1 | C4 | H2 | 59.5° | 149.8° |
| C3 | N1 | C13 | H8 | 2.3° | 131.0° |
| N1 | C3 | C2 | H15 | 55.5° | 88.2° |
| O2 | C3 | N1 | C4 | 2.2° | 43.7° |
| O2 | C3 | C2 | H15 | 130.6° | 91.9° |
| N1 | C4 | C5 | H1 | 120.5° | 120.0° |
| N1 | C4 | C5 | H2 | 120.5° | 120.0° |
| N1 | C4 | C5 | C6 | 16.0° | 89.7° |
| N1 | C4 | C5 | C12 | 164.5° | 90.0° |
| N1 | C4 | H1 | H2 | 118.6° | 120.0° |
| C4 | N1 | C13 | H8 | 178.0° | 49.3° |
| F1 | C24 | C23 | C22 | 180.0° | 180.0° |
| F1 | C24 | C23 | H26 | 0.0° | 0.1° |
| C24 | C23 | C22 | H26 | 180.0° | 179.9° |
| C24 | C23 | C22 | H10 | 178.5° | 180.0° |
| C4 | C5 | C6 | C12 | 179.5° | 179.8° |
| C4 | C5 | C6 | C7 | 180.0° | 180.0° |
| C4 | C5 | C12 | C8 | 179.9° | 179.7° |
| C5 | C4 | H1 | H2 | 118.6° | 120.0° |
| C4 | C5 | C6 | H3 | 0.1° | 0.0° |
| C4 | C5 | C12 | H20 | 0.0° | 0.0° |
| C5 | C6 | C7 | H3 | 180.0° | 180.0° |
| C5 | C6 | C7 | N2 | 0.2° | 0.0° |
| C6 | C5 | C12 | C8 | 0.4° | 0.5° |
| C6 | C5 | C4 | H1 | 104.5° | 150.3° |
| C6 | C5 | C4 | H2 | 136.5° | 30.2° |
| C5 | C6 | C7 | H4 | 179.8° | 180.0° |
| C6 | C5 | C12 | H20 | 179.5° | 179.7° |
| C7 | C6 | C5 | C12 | 0.6° | 0.2° |
| C6 | C7 | N2 | H4 | 180.0° | 180.0° |
| C6 | C7 | N2 | C8 | 0.3° | 0.1° |
| C5 | C12 | C8 | H20 | 180.0° | 179.8° |
| C5 | C12 | C8 | N2 | 0.1° | 0.5° |
| C5 | C12 | C8 | C9 | 180.0° | 179.7° |
| C12 | C5 | C4 | H1 | 75.0° | 30.0° |
| C12 | C5 | C4 | H2 | 44.1° | 150.0° |
| C12 | C5 | C6 | H3 | 179.4° | 179.8° |
| C7 | N2 | C8 | C12 | 0.4° | 0.2° |
| C7 | N2 | C8 | C9 | 179.7° | 180.0° |
| N2 | C7 | C6 | H3 | 179.8° | 179.9° |
| C12 | C8 | N2 | C9 | 179.9° | 179.8° |
| C12 | C8 | C9 | C11 | 142.4° | 174.8° |
| C12 | C8 | C9 | O3 | 23.2° | 54.7° |
| C12 | C8 | C9 | C10 | 97.5° | 65.2° |
| N2 | C8 | C9 | C11 | 37.7° | 5.0° |
| N2 | C8 | C9 | O3 | 156.9° | 125.0° |
| N2 | C8 | C9 | C10 | 82.4° | 115.0° |
| C8 | N2 | C7 | H4 | 179.7° | 180.0° |
| N2 | C8 | C12 | H20 | 180.0° | 179.7° |
| C8 | C9 | C11 | O3 | 119.7° | 120.0° |
| C8 | C9 | C11 | C10 | 120.8° | 120.0° |
| C8 | C9 | O3 | C10 | 121.1° | 120.0° |
| C8 | C9 | C10 | H5 | 180.0° | 60.0° |
| C8 | C9 | C10 | H6 | 60.0° | 180.0° |
| C8 | C9 | C10 | H7 | 60.0° | 60.0° |
| C8 | C9 | C11 | H16 | 180.0° | 60.0° |
| C8 | C9 | C11 | H17 | 60.0° | 180.0° |
| C8 | C9 | C11 | H18 | 60.0° | 60.0° |
| C8 | C9 | O3 | H19 | 180.0° | 60.0° |
| C9 | C8 | C12 | H20 | 0.1° | 0.0° |
| C11 | C9 | O3 | C10 | 119.2° | 120.0° |
| C11 | C9 | C10 | H5 | 59.6° | 60.0° |
| C11 | C9 | C10 | H6 | 179.6° | 60.0° |
| C11 | C9 | C10 | H7 | 60.4° | 180.0° |
| C9 | C11 | H16 | H17 | 120.0° | 120.0° |
| C9 | C11 | H16 | H18 | 120.0° | 120.0° |
| C9 | C11 | H17 | H18 | 120.0° | 120.0° |
| C11 | C9 | O3 | H19 | 60.3° | 180.0° |
| O3 | C9 | C10 | H5 | 59.4° | 180.0° |
| O3 | C9 | C10 | H6 | 60.6° | 60.0° |
| O3 | C9 | C10 | H7 | 179.4° | 60.0° |
| O3 | C9 | C11 | H16 | 60.3° | 60.0° |
| O3 | C9 | C11 | H17 | 179.7° | 60.0° |
| O3 | C9 | C11 | H18 | 59.7° | 180.0° |
| C9 | C10 | H5 | H6 | 120.0° | 120.0° |
| C9 | C10 | H5 | H7 | 120.0° | 120.0° |
| C9 | C10 | H6 | H7 | 120.0° | 120.0° |
| C10 | C9 | C11 | H16 | 59.2° | 180.0° |
| C10 | C9 | C11 | H17 | 60.8° | 60.0° |
| C10 | C9 | C11 | H18 | 179.2° | 60.0° |
| C10 | C9 | O3 | H19 | 58.9° | 60.0° |
| H3 | C6 | C7 | H4 | 0.3° | 0.1° |
| H5 | C10 | H6 | H7 | 120.0° | 120.0° |
| H8 | C13 | C14 | H21 | 0.3° | 168.2° |
| H8 | C13 | C16 | H22 | 123.0° | 27.1° |
| H8 | C13 | C16 | H23 | 0.2° | 149.3° |
| H8 | C13 | C14 | H29 | 117.2° | 46.8° |
| H9 | C15 | C14 | H21 | 3.5° | 41.4° |
| H9 | C15 | C14 | H29 | 114.0° | 80.0° |
| H10 | C22 | C23 | H26 | 1.4° | 0.1° |
| H12 | C1 | H13 | H14 | 120.0° | 119.9° |
| H16 | C11 | H17 | H18 | 120.0° | 120.1° |
| H21 | C14 | C15 | H28 | 124.4° | 164.6° |
| H24 | C18 | C19 | H25 | 1.1° | 0.0° |
| H28 | C15 | C14 | H29 | 7.0° | 43.2° |
