A1IL8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O4 | S2 | doub | 1.42Å | 1.57Å | |
| CL2 | C29 | sing | 1.74Å | 1.73Å | |
| S2 | O5 | sing | 1.52Å | 1.46Å | |
| S2 | C30 | sing | 1.76Å | 1.80Å | |
| C29 | C30 | doub | 1.38Å | 1.39Å | Aromatic |
| C29 | C28 | sing | 1.38Å | 1.38Å | Aromatic |
| C30 | C1 | sing | 1.38Å | 1.39Å | Aromatic |
| O2 | C21 | doub | 1.21Å | 1.21Å | |
| C28 | C3 | doub | 1.40Å | 1.39Å | Aromatic |
| C23 | C22 | sing | 1.53Å | 1.51Å | |
| C21 | C20 | sing | 1.51Å | 1.50Å | |
| C21 | O1 | sing | 1.34Å | 1.34Å | |
| C1 | CL1 | sing | 1.74Å | 1.73Å | |
| C1 | C2 | doub | 1.38Å | 1.37Å | Aromatic |
| C25 | C22 | sing | 1.53Å | 1.51Å | |
| C3 | C2 | sing | 1.40Å | 1.39Å | Aromatic |
| C3 | C4 | sing | 1.48Å | 1.50Å | |
| C27 | C26 | doub | 1.38Å | 1.38Å | Aromatic |
| C27 | C5 | sing | 1.39Å | 1.39Å | Aromatic |
| C22 | O1 | sing | 1.45Å | 1.48Å | |
| C22 | C24 | sing | 1.53Å | 1.51Å | |
| C20 | C19 | sing | 1.53Å | 1.53Å | |
| N1 | C4 | sing | 1.35Å | 1.36Å | |
| N1 | C5 | sing | 1.40Å | 1.42Å | |
| C26 | C8 | sing | 1.39Å | 1.39Å | Aromatic |
| C4 | O3 | doub | 1.22Å | 1.23Å | |
| C5 | C6 | doub | 1.39Å | 1.39Å | Aromatic |
| N5 | C19 | sing | 1.47Å | 1.46Å | |
| N5 | C9 | doub | 1.29Å | 1.29Å | |
| C19 | C18 | sing | 1.51Å | 1.49Å | |
| N4 | C18 | doub | 1.30Å | 1.33Å | Aromatic |
| N4 | N3 | sing | 1.29Å | 1.40Å | Aromatic |
| C8 | C9 | sing | 1.48Å | 1.49Å | |
| C8 | C7 | doub | 1.40Å | 1.39Å | Aromatic |
| C6 | C7 | sing | 1.38Å | 1.38Å | Aromatic |
| C18 | N2 | sing | 1.36Å | 1.37Å | Aromatic |
| C9 | C10 | sing | 1.48Å | 1.43Å | |
| N3 | C16 | doub | 1.31Å | 1.31Å | Aromatic |
| N2 | C16 | sing | 1.35Å | 1.38Å | Aromatic |
| N2 | C11 | sing | 1.40Å | 1.41Å | |
| C16 | C17 | sing | 1.51Å | 1.48Å | |
| C10 | C11 | doub | 1.38Å | 1.44Å | Aromatic |
| C10 | C14 | sing | 1.45Å | 1.47Å | Aromatic |
| C11 | S1 | sing | 1.71Å | 1.73Å | Aromatic |
| C15 | C14 | sing | 1.51Å | 1.49Å | |
| C14 | C12 | doub | 1.32Å | 1.35Å | Aromatic |
| S1 | C12 | sing | 1.75Å | 1.72Å | Aromatic |
| C12 | C13 | sing | 1.51Å | 1.50Å | |
| C2 | H1 | sing | 1.08Å | 1.08Å | |
| N1 | H2 | sing | 0.97Å | 1.00Å | |
| C6 | H3 | sing | 1.08Å | 1.08Å | |
| C7 | H4 | sing | 1.08Å | 1.08Å | |
| C13 | H5 | sing | 1.09Å | 1.10Å | |
| C13 | H6 | sing | 1.09Å | 1.10Å | |
| C13 | H7 | sing | 1.09Å | 1.10Å | |
| C15 | H8 | sing | 1.09Å | 1.10Å | |
| C15 | H9 | sing | 1.09Å | 1.10Å | |
| C15 | H10 | sing | 1.09Å | 1.10Å | |
| C17 | H11 | sing | 1.09Å | 1.10Å | |
| C17 | H12 | sing | 1.09Å | 1.10Å | |
| C17 | H13 | sing | 1.09Å | 1.10Å | |
| C19 | H14 | sing | 1.09Å | 1.10Å | |
| C20 | H15 | sing | 1.09Å | 1.10Å | |
| C20 | H16 | sing | 1.09Å | 1.10Å | |
| C23 | H17 | sing | 1.09Å | 1.10Å | |
| C23 | H18 | sing | 1.09Å | 1.10Å | |
| C23 | H19 | sing | 1.09Å | 1.10Å | |
| C24 | H20 | sing | 1.09Å | 1.10Å | |
| C24 | H21 | sing | 1.09Å | 1.10Å | |
| C24 | H22 | sing | 1.09Å | 1.10Å | |
| C25 | H23 | sing | 1.09Å | 1.10Å | |
| C25 | H24 | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C27 | H27 | sing | 1.08Å | 1.08Å | |
| C28 | H28 | sing | 1.08Å | 1.08Å | |
| O5 | H30 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O4 | S2 | O5 | 106.9° | 103.0° |
| O4 | S2 | C30 | 100.9° | 103.0° |
| CL2 | C29 | C30 | 120.3° | 119.9° |
| CL2 | C29 | C28 | 119.3° | 119.9° |
| O5 | S2 | C30 | 105.9° | 103.0° |
| S2 | O5 | H30 | 109.5° | 114.0° |
| S2 | C30 | C29 | 120.7° | 119.9° |
| S2 | C30 | C1 | 119.8° | 119.9° |
| C30 | C29 | C28 | 120.3° | 120.1° |
| C29 | C30 | C1 | 119.5° | 120.3° |
| C29 | C28 | C3 | 119.9° | 119.8° |
| C29 | C28 | H28 | 120.1° | 120.1° |
| C30 | C1 | CL1 | 120.3° | 119.9° |
| C30 | C1 | C2 | 120.3° | 120.2° |
| O2 | C21 | C20 | 122.8° | 120.0° |
| O2 | C21 | O1 | 127.2° | 120.0° |
| C28 | C3 | C2 | 119.8° | 119.7° |
| C28 | C3 | C4 | 122.5° | 120.1° |
| C3 | C28 | H28 | 120.1° | 120.1° |
| C23 | C22 | C25 | 111.7° | 109.5° |
| C23 | C22 | O1 | 109.2° | 109.5° |
| C23 | C22 | C24 | 111.0° | 109.5° |
| C22 | C23 | H17 | 109.5° | 109.5° |
| C22 | C23 | H18 | 109.5° | 109.5° |
| C22 | C23 | H19 | 109.5° | 109.5° |
| C20 | C21 | O1 | 110.0° | 120.0° |
| C21 | C20 | C19 | 111.5° | 109.5° |
| C21 | C20 | H15 | 109.0° | 109.4° |
| C21 | C20 | H16 | 109.0° | 109.4° |
| C21 | O1 | C22 | 123.1° | 117.0° |
| CL1 | C1 | C2 | 119.4° | 120.0° |
| C1 | C2 | C3 | 120.1° | 119.9° |
| C1 | C2 | H1 | 120.0° | 120.1° |
| C25 | C22 | O1 | 108.7° | 109.5° |
| C25 | C22 | C24 | 111.0° | 109.5° |
| C22 | C25 | H23 | 109.5° | 109.5° |
| C22 | C25 | H24 | 109.5° | 109.5° |
| C22 | C25 | H25 | 109.5° | 109.5° |
| C2 | C3 | C4 | 117.6° | 120.2° |
| C3 | C2 | H1 | 119.9° | 120.0° |
| C3 | C4 | N1 | 116.3° | 120.0° |
| C3 | C4 | O3 | 120.2° | 120.0° |
| C26 | C27 | C5 | 120.3° | 120.0° |
| C27 | C26 | C8 | 121.1° | 120.0° |
| C27 | C26 | H26 | 119.4° | 120.0° |
| C26 | C27 | H27 | 119.8° | 120.0° |
| C27 | C5 | N1 | 118.8° | 119.9° |
| C27 | C5 | C6 | 118.9° | 120.1° |
| C5 | C27 | H27 | 119.9° | 120.0° |
| O1 | C22 | C24 | 104.9° | 109.4° |
| C22 | C24 | H20 | 109.5° | 109.5° |
| C22 | C24 | H21 | 109.5° | 109.4° |
| C22 | C24 | H22 | 109.5° | 109.5° |
| C20 | C19 | N5 | 107.9° | 109.5° |
| C20 | C19 | C18 | 110.3° | 109.5° |
| C20 | C19 | H14 | 108.2° | 109.6° |
| C19 | C20 | H15 | 109.0° | 109.5° |
| C19 | C20 | H16 | 108.9° | 109.5° |
| C4 | N1 | C5 | 128.7° | 120.0° |
| N1 | C4 | O3 | 123.5° | 120.0° |
| C4 | N1 | H2 | 115.7° | 120.0° |
| N1 | C5 | C6 | 122.2° | 119.9° |
| C5 | N1 | H2 | 115.7° | 120.0° |
| C26 | C8 | C9 | 120.4° | 120.1° |
| C26 | C8 | C7 | 118.2° | 119.9° |
| C8 | C26 | H26 | 119.5° | 120.0° |
| C5 | C6 | C7 | 120.3° | 120.0° |
| C5 | C6 | H3 | 119.9° | 120.0° |
| C19 | N5 | C9 | 125.3° | 122.4° |
| N5 | C19 | C18 | 112.5° | 109.1° |
| N5 | C19 | H14 | 109.1° | 109.6° |
| N5 | C9 | C8 | 113.9° | 116.9° |
| N5 | C9 | C10 | 121.6° | 126.0° |
| C19 | C18 | N4 | 126.9° | 127.8° |
| C19 | C18 | N2 | 124.3° | 125.1° |
| C18 | C19 | H14 | 108.7° | 109.6° |
| C18 | N4 | N3 | 107.4° | 109.7° |
| N4 | C18 | N2 | 108.8° | 107.1° |
| N4 | N3 | C16 | 108.2° | 109.9° |
| C9 | C8 | C7 | 121.4° | 120.0° |
| C8 | C9 | C10 | 124.1° | 117.1° |
| C8 | C7 | C6 | 121.1° | 119.9° |
| C8 | C7 | H4 | 119.5° | 120.0° |
| C7 | C6 | H3 | 119.8° | 120.0° |
| C6 | C7 | H4 | 119.4° | 120.0° |
| C18 | N2 | C16 | 106.3° | 106.5° |
| C18 | N2 | C11 | 122.1° | 124.6° |
| C9 | C10 | C11 | 125.7° | 124.8° |
| C9 | C10 | C14 | 125.8° | 123.5° |
| N3 | C16 | N2 | 109.1° | 106.8° |
| N3 | C16 | C17 | 125.0° | 126.6° |
| C16 | N2 | C11 | 131.1° | 129.0° |
| N2 | C16 | C17 | 125.6° | 126.6° |
| N2 | C11 | C10 | 127.0° | 124.0° |
| N2 | C11 | S1 | 121.5° | 125.0° |
| C16 | C17 | H11 | 109.5° | 109.5° |
| C16 | C17 | H12 | 109.5° | 109.5° |
| C16 | C17 | H13 | 109.5° | 109.5° |
| C11 | C10 | C14 | 107.9° | 111.7° |
| C10 | C11 | S1 | 111.3° | 111.0° |
| C10 | C14 | C15 | 125.0° | 123.0° |
| C10 | C14 | C12 | 114.7° | 114.0° |
| C11 | S1 | C12 | 92.4° | 92.6° |
| C15 | C14 | C12 | 120.3° | 123.1° |
| C14 | C15 | H8 | 109.5° | 109.5° |
| C14 | C15 | H9 | 109.4° | 109.5° |
| C14 | C15 | H10 | 109.5° | 109.5° |
| C14 | C12 | S1 | 111.9° | 110.7° |
| C14 | C12 | C13 | 129.7° | 124.7° |
| S1 | C12 | C13 | 118.3° | 124.7° |
| C12 | C13 | H5 | 109.5° | 109.4° |
| C12 | C13 | H6 | 109.5° | 109.5° |
| C12 | C13 | H7 | 109.5° | 109.5° |
| H5 | C13 | H6 | 109.5° | 109.5° |
| H5 | C13 | H7 | 109.5° | 109.5° |
| H6 | C13 | H7 | 109.5° | 109.4° |
| H8 | C15 | H9 | 109.5° | 109.4° |
| H8 | C15 | H10 | 109.5° | 109.5° |
| H9 | C15 | H10 | 109.5° | 109.5° |
| H11 | C17 | H12 | 109.4° | 109.4° |
| H11 | C17 | H13 | 109.5° | 109.5° |
| H12 | C17 | H13 | 109.5° | 109.4° |
| H15 | C20 | H16 | 109.4° | 109.5° |
| H17 | C23 | H18 | 109.4° | 109.5° |
| H17 | C23 | H19 | 109.5° | 109.5° |
| H18 | C23 | H19 | 109.5° | 109.4° |
| H20 | C24 | H21 | 109.5° | 109.5° |
| H20 | C24 | H22 | 109.4° | 109.5° |
| H21 | C24 | H22 | 109.5° | 109.5° |
| H23 | C25 | H24 | 109.5° | 109.4° |
| H23 | C25 | H25 | 109.5° | 109.5° |
| H24 | C25 | H25 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O4 | S2 | O5 | C30 | 107.0° | 106.9° |
| O4 | S2 | C30 | C29 | 26.3° | 103.1° |
| O4 | S2 | C30 | C1 | 153.4° | 77.6° |
| O4 | S2 | O5 | H30 | 0.0° | 73.1° |
| CL2 | C29 | C30 | S2 | 0.1° | 0.6° |
| CL2 | C29 | C30 | C28 | 180.0° | 179.3° |
| CL2 | C29 | C30 | C1 | 179.9° | 180.0° |
| CL2 | C29 | C28 | C3 | 179.6° | 179.8° |
| CL2 | C29 | C28 | H28 | 0.4° | 0.3° |
| O5 | S2 | C30 | C29 | 85.0° | 150.0° |
| O5 | S2 | C30 | C1 | 95.3° | 29.3° |
| S2 | C30 | C29 | C1 | 179.7° | 179.3° |
| S2 | C30 | C29 | C28 | 179.9° | 180.0° |
| S2 | C30 | C1 | CL1 | 0.3° | 0.2° |
| S2 | C30 | C1 | C2 | 179.6° | 179.8° |
| C30 | S2 | O5 | H30 | 107.0° | 180.0° |
| C30 | C29 | C28 | C3 | 0.4° | 0.5° |
| C29 | C30 | C1 | CL1 | 179.9° | 179.6° |
| C29 | C30 | C1 | C2 | 0.7° | 0.4° |
| C30 | C29 | C28 | H28 | 179.6° | 179.6° |
| C28 | C29 | C30 | C1 | 0.2° | 0.7° |
| C29 | C28 | C3 | H28 | 180.0° | 179.9° |
| C29 | C28 | C3 | C2 | 1.2° | 0.0° |
| C29 | C28 | C3 | C4 | 179.3° | 179.7° |
| C30 | C1 | CL1 | C2 | 179.3° | 180.0° |
| C30 | C1 | C2 | C3 | 1.5° | 0.0° |
| C30 | C1 | C2 | H1 | 178.5° | 179.9° |
| O2 | C21 | C20 | O1 | 180.0° | 179.9° |
| O2 | C21 | O1 | C22 | 0.4° | 0.0° |
| O2 | C21 | C20 | C19 | 125.0° | 0.0° |
| O2 | C21 | C20 | H15 | 114.6° | 120.0° |
| O2 | C21 | C20 | H16 | 4.7° | 120.0° |
| C28 | C3 | C2 | C1 | 1.8° | 0.3° |
| C28 | C3 | C2 | C4 | 178.2° | 179.7° |
| C28 | C3 | C4 | N1 | 10.4° | 0.2° |
| C28 | C3 | C4 | O3 | 170.7° | 179.7° |
| C28 | C3 | C2 | H1 | 178.2° | 179.8° |
| C23 | C22 | O1 | C21 | 61.0° | 60.0° |
| C23 | C22 | C25 | O1 | 120.6° | 120.0° |
| C23 | C22 | C25 | C24 | 124.5° | 120.0° |
| C23 | C22 | O1 | C24 | 119.1° | 120.0° |
| C22 | C23 | H17 | H18 | 120.0° | 120.0° |
| C22 | C23 | H17 | H19 | 120.0° | 120.0° |
| C22 | C23 | H18 | H19 | 120.0° | 120.0° |
| C23 | C22 | C24 | H20 | 180.0° | 180.0° |
| C23 | C22 | C24 | H21 | 60.0° | 60.0° |
| C23 | C22 | C24 | H22 | 60.0° | 60.0° |
| C23 | C22 | C25 | H23 | 180.0° | 59.9° |
| C23 | C22 | C25 | H24 | 60.0° | 60.0° |
| C23 | C22 | C25 | H25 | 60.0° | 180.0° |
| C20 | C21 | O1 | C22 | 179.6° | 180.0° |
| C21 | C20 | C19 | H15 | 120.3° | 120.0° |
| C21 | C20 | C19 | H16 | 120.3° | 119.9° |
| C21 | C20 | C19 | N5 | 54.1° | 65.3° |
| C21 | C20 | C19 | C18 | 177.3° | 175.1° |
| C21 | C20 | C19 | H14 | 63.8° | 54.9° |
| C21 | C20 | H15 | H16 | 119.1° | 120.0° |
| C21 | O1 | C22 | C25 | 61.2° | 180.0° |
| C21 | O1 | C22 | C24 | 179.9° | 60.0° |
| O1 | C21 | C20 | C19 | 55.0° | 179.9° |
| O1 | C21 | C20 | H15 | 65.4° | 60.0° |
| O1 | C21 | C20 | H16 | 175.3° | 60.0° |
| CL1 | C1 | C2 | C3 | 179.3° | 180.0° |
| CL1 | C1 | C2 | H1 | 0.8° | 0.1° |
| C1 | C2 | C3 | H1 | 180.0° | 179.9° |
| C1 | C2 | C3 | C4 | 179.9° | 180.0° |
| C25 | C22 | O1 | C24 | 118.8° | 120.0° |
| C25 | C22 | C23 | H17 | 180.0° | 180.0° |
| C25 | C22 | C23 | H18 | 60.0° | 60.0° |
| C25 | C22 | C23 | H19 | 60.0° | 59.9° |
| C25 | C22 | C24 | H20 | 55.2° | 59.9° |
| C25 | C22 | C24 | H21 | 64.9° | 60.0° |
| C25 | C22 | C24 | H22 | 175.1° | 180.0° |
| C22 | C25 | H23 | H24 | 120.0° | 120.0° |
| C22 | C25 | H23 | H25 | 120.0° | 120.1° |
| C22 | C25 | H24 | H25 | 120.0° | 120.1° |
| C2 | C3 | C4 | N1 | 171.4° | 180.0° |
| C2 | C3 | C4 | O3 | 7.4° | 0.0° |
| C2 | C3 | C28 | H28 | 178.8° | 179.9° |
| C3 | C4 | N1 | O3 | 178.8° | 180.0° |
| C3 | C4 | N1 | C5 | 176.6° | 175.1° |
| C4 | C3 | C2 | H1 | 0.1° | 0.1° |
| C3 | C4 | N1 | H2 | 3.4° | 4.9° |
| C4 | C3 | C28 | H28 | 0.7° | 0.2° |
| C26 | C27 | C5 | H27 | 180.0° | 179.5° |
| C26 | C27 | C5 | N1 | 178.3° | 179.7° |
| C27 | C26 | C8 | H26 | 180.0° | 179.7° |
| C26 | C27 | C5 | C6 | 2.4° | 0.5° |
| C27 | C26 | C8 | C9 | 179.9° | 179.8° |
| C27 | C26 | C8 | C7 | 1.1° | 0.3° |
| C27 | C5 | N1 | C4 | 167.4° | 33.9° |
| C27 | C5 | N1 | C6 | 175.8° | 179.8° |
| C5 | C27 | C26 | C8 | 1.3° | 0.5° |
| C27 | C5 | C6 | C7 | 3.3° | 0.2° |
| C27 | C5 | N1 | H2 | 12.6° | 146.1° |
| C27 | C5 | C6 | H3 | 176.7° | 179.8° |
| C5 | C27 | C26 | H26 | 178.7° | 179.8° |
| O1 | C22 | C23 | H17 | 59.7° | 60.0° |
| O1 | C22 | C23 | H18 | 179.7° | 180.0° |
| O1 | C22 | C23 | H19 | 60.3° | 60.1° |
| O1 | C22 | C24 | H20 | 62.1° | 60.0° |
| O1 | C22 | C24 | H21 | 177.9° | 180.0° |
| O1 | C22 | C24 | H22 | 57.9° | 60.0° |
| O1 | C22 | C25 | H23 | 59.4° | 60.0° |
| O1 | C22 | C25 | H24 | 60.7° | 180.0° |
| O1 | C22 | C25 | H25 | 179.4° | 60.0° |
| C24 | C22 | C23 | H17 | 55.6° | 60.0° |
| C24 | C22 | C23 | H18 | 64.4° | 60.1° |
| C24 | C22 | C23 | H19 | 175.6° | 180.0° |
| C22 | C24 | H20 | H21 | 120.0° | 119.9° |
| C22 | C24 | H20 | H22 | 120.0° | 120.0° |
| C22 | C24 | H21 | H22 | 120.0° | 120.0° |
| C24 | C22 | C25 | H23 | 55.5° | 180.0° |
| C24 | C22 | C25 | H24 | 175.6° | 60.1° |
| C24 | C22 | C25 | H25 | 64.5° | 60.0° |
| C20 | C19 | N5 | C18 | 121.9° | 119.9° |
| C20 | C19 | N5 | H14 | 117.4° | 120.2° |
| C20 | C19 | N5 | C9 | 171.2° | 57.4° |
| C20 | C19 | C18 | H14 | 118.5° | 120.2° |
| C20 | C19 | C18 | N4 | 3.6° | 119.9° |
| C20 | C19 | C18 | N2 | 174.5° | 60.4° |
| C19 | C20 | H15 | H16 | 119.0° | 120.0° |
| C4 | N1 | C5 | H2 | 180.0° | 180.0° |
| C4 | N1 | C5 | C6 | 8.4° | 146.3° |
| C5 | N1 | C4 | O3 | 2.3° | 4.9° |
| N1 | C5 | C6 | C7 | 179.0° | 180.0° |
| N1 | C5 | C6 | H3 | 1.0° | 0.0° |
| N1 | C5 | C27 | H27 | 1.7° | 0.2° |
| C26 | C8 | C9 | N5 | 16.3° | 33.4° |
| C26 | C8 | C9 | C7 | 178.7° | 180.0° |
| C26 | C8 | C7 | C6 | 2.0° | 0.0° |
| C26 | C8 | C9 | C10 | 171.5° | 146.6° |
| C26 | C8 | C7 | H4 | 178.0° | 179.9° |
| C8 | C26 | C27 | H27 | 178.7° | 179.9° |
| O3 | C4 | N1 | H2 | 177.7° | 175.1° |
| C5 | C6 | C7 | C8 | 3.2° | 0.0° |
| C5 | C6 | C7 | H3 | 180.0° | 180.0° |
| C6 | C5 | N1 | H2 | 171.6° | 33.7° |
| C5 | C6 | C7 | H4 | 176.8° | 180.0° |
| C6 | C5 | C27 | H27 | 177.6° | 180.0° |
| N5 | C19 | C18 | H14 | 121.0° | 119.9° |
| N5 | C19 | C18 | N4 | 124.0° | 120.2° |
| C19 | N5 | C9 | C8 | 176.8° | 175.2° |
| N5 | C19 | C18 | N2 | 54.0° | 59.5° |
| C19 | N5 | C9 | C10 | 10.8° | 4.7° |
| N5 | C19 | C20 | H15 | 174.5° | 54.7° |
| N5 | C19 | C20 | H16 | 66.2° | 174.7° |
| C9 | N5 | C19 | C18 | 66.9° | 62.4° |
| N5 | C9 | C8 | C10 | 172.2° | 180.0° |
| N5 | C9 | C8 | C7 | 165.0° | 146.7° |
| N5 | C9 | C10 | C11 | 36.4° | 37.9° |
| N5 | C9 | C10 | C14 | 133.2° | 144.0° |
| C9 | N5 | C19 | H14 | 53.8° | 177.6° |
| C19 | C18 | N4 | N2 | 178.3° | 179.7° |
| C19 | C18 | N4 | N3 | 180.0° | 179.2° |
| C19 | C18 | N2 | C16 | 177.9° | 179.1° |
| C19 | C18 | N2 | C11 | 4.5° | 1.4° |
| C18 | C19 | C20 | H15 | 62.3° | 64.9° |
| C18 | C19 | C20 | H16 | 57.0° | 55.1° |
| C18 | N4 | N3 | C16 | 1.2° | 0.3° |
| N4 | C18 | N2 | C16 | 3.8° | 0.6° |
| N4 | C18 | N2 | C11 | 177.1° | 178.9° |
| N4 | C18 | C19 | H14 | 115.0° | 0.3° |
| N3 | N4 | C18 | N2 | 1.7° | 0.6° |
| N4 | N3 | C16 | N2 | 3.6° | 0.1° |
| N4 | N3 | C16 | C17 | 178.2° | 179.8° |
| C9 | C8 | C7 | C6 | 179.2° | 179.9° |
| C8 | C9 | C10 | C11 | 135.2° | 142.1° |
| C8 | C9 | C10 | C14 | 55.1° | 36.0° |
| C9 | C8 | C7 | H4 | 0.8° | 0.0° |
| C9 | C8 | C26 | H26 | 0.1° | 0.1° |
| C8 | C7 | C6 | H4 | 180.0° | 179.9° |
| C7 | C8 | C9 | C10 | 7.2° | 33.4° |
| C8 | C7 | C6 | H3 | 176.9° | 180.0° |
| C7 | C8 | C26 | H26 | 178.9° | 180.0° |
| C18 | N2 | C16 | N3 | 4.6° | 0.4° |
| C18 | N2 | C16 | C11 | 172.5° | 179.5° |
| C18 | N2 | C16 | C17 | 179.1° | 179.5° |
| C18 | N2 | C11 | C10 | 29.6° | 33.6° |
| C18 | N2 | C11 | S1 | 144.5° | 146.4° |
| N2 | C18 | C19 | H14 | 66.9° | 179.4° |
| C9 | C10 | C11 | N2 | 10.7° | 4.2° |
| C9 | C10 | C11 | C14 | 171.2° | 178.3° |
| C9 | C10 | C11 | S1 | 174.7° | 175.8° |
| C9 | C10 | C14 | C15 | 3.0° | 3.5° |
| C9 | C10 | C14 | C12 | 177.2° | 176.5° |
| N3 | C16 | N2 | C17 | 174.5° | 179.9° |
| N3 | C16 | N2 | C11 | 177.1° | 179.1° |
| N3 | C16 | C17 | H11 | 0.0° | 89.9° |
| N3 | C16 | C17 | H12 | 120.0° | 30.0° |
| N3 | C16 | C17 | H13 | 120.0° | 150.0° |
| C16 | N2 | C11 | C10 | 158.9° | 146.9° |
| C16 | N2 | C11 | S1 | 27.0° | 33.0° |
| N2 | C16 | C17 | H11 | 173.6° | 90.0° |
| N2 | C16 | C17 | H12 | 53.6° | 150.1° |
| N2 | C16 | C17 | H13 | 66.4° | 30.1° |
| C11 | N2 | C16 | C17 | 8.4° | 1.0° |
| N2 | C11 | C10 | S1 | 174.7° | 180.0° |
| N2 | C11 | C10 | C14 | 160.5° | 177.5° |
| N2 | C11 | S1 | C12 | 164.1° | 178.0° |
| C16 | C17 | H11 | H12 | 120.0° | 120.0° |
| C16 | C17 | H11 | H13 | 120.0° | 120.1° |
| C16 | C17 | H12 | H13 | 120.0° | 120.0° |
| C11 | C10 | C14 | C15 | 168.2° | 178.2° |
| C11 | C10 | C14 | C12 | 11.6° | 1.8° |
| C10 | C11 | S1 | C12 | 10.9° | 2.0° |
| C14 | C10 | C11 | S1 | 14.2° | 2.5° |
| C10 | C14 | C15 | C12 | 179.8° | 180.0° |
| C10 | C14 | C12 | S1 | 3.8° | 0.3° |
| C10 | C14 | C12 | C13 | 177.8° | 179.8° |
| C10 | C14 | C15 | H8 | 89.9° | 89.8° |
| C10 | C14 | C15 | H9 | 150.1° | 150.2° |
| C10 | C14 | C15 | H10 | 30.1° | 30.1° |
| C11 | S1 | C12 | C14 | 4.0° | 1.0° |
| C11 | S1 | C12 | C13 | 174.5° | 179.0° |
| C15 | C14 | C12 | S1 | 176.0° | 179.7° |
| C15 | C14 | C12 | C13 | 2.4° | 0.2° |
| C14 | C15 | H8 | H9 | 120.0° | 120.0° |
| C14 | C15 | H8 | H10 | 120.0° | 120.0° |
| C14 | C15 | H9 | H10 | 120.0° | 120.0° |
| C14 | C12 | S1 | C13 | 178.6° | 179.9° |
| C14 | C12 | C13 | H5 | 178.3° | 90.0° |
| C14 | C12 | C13 | H6 | 61.7° | 150.0° |
| C14 | C12 | C13 | H7 | 58.3° | 30.0° |
| C12 | C14 | C15 | H8 | 89.9° | 90.2° |
| C12 | C14 | C15 | H9 | 30.1° | 29.8° |
| C12 | C14 | C15 | H10 | 150.1° | 149.9° |
| S1 | C12 | C13 | H5 | 0.0° | 90.1° |
| S1 | C12 | C13 | H6 | 120.0° | 29.9° |
| S1 | C12 | C13 | H7 | 120.0° | 150.0° |
| C12 | C13 | H5 | H6 | 120.0° | 120.0° |
| C12 | C13 | H5 | H7 | 120.0° | 120.0° |
| C12 | C13 | H6 | H7 | 120.0° | 120.0° |
| H3 | C6 | C7 | H4 | 3.2° | 0.1° |
| H5 | C13 | H6 | H7 | 120.0° | 120.0° |
| H8 | C15 | H9 | H10 | 120.0° | 120.0° |
| H11 | C17 | H12 | H13 | 120.0° | 120.0° |
| H14 | C19 | C20 | H15 | 56.5° | 174.8° |
| H14 | C19 | C20 | H16 | 175.9° | 65.1° |
| H17 | C23 | H18 | H19 | 120.0° | 120.0° |
| H20 | C24 | H21 | H22 | 119.9° | 120.1° |
| H23 | C25 | H24 | H25 | 120.0° | 120.0° |
| H26 | C26 | C27 | H27 | 1.4° | 0.2° |
