L8L
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C41 | C28 | sing | 1.53Å | 1.54Å | |
| C3 | N2 | sing | 1.47Å | 1.48Å | |
| C3 | C4 | sing | 1.53Å | 1.56Å | |
| C28 | C27 | sing | 1.53Å | 1.55Å | |
| C17 | C10 | sing | 1.51Å | 1.51Å | |
| C27 | N23 | sing | 1.46Å | 1.48Å | |
| N2 | C1 | sing | 1.47Å | 1.48Å | |
| C4 | C5 | sing | 1.53Å | 1.56Å | |
| C10 | C9 | doub | 1.34Å | 1.35Å | Aromatic |
| C10 | C11 | sing | 1.46Å | 1.49Å | Aromatic |
| C9 | N8 | sing | 1.37Å | 1.31Å | Aromatic |
| C18 | N23 | sing | 1.36Å | 1.38Å | |
| C18 | C19 | doub | 1.36Å | 1.36Å | |
| N23 | C22 | sing | 1.34Å | 1.36Å | |
| C11 | C13 | doub | 1.39Å | 1.40Å | Aromatic |
| C11 | C12 | sing | 1.41Å | 1.39Å | Aromatic |
| C13 | C14 | sing | 1.39Å | 1.40Å | Aromatic |
| C1 | C6 | sing | 1.53Å | 1.56Å | |
| C5 | C6 | sing | 1.53Å | 1.55Å | |
| C5 | C7 | sing | 1.53Å | 1.57Å | |
| N8 | C12 | sing | 1.38Å | 1.35Å | Aromatic |
| N8 | C7 | sing | 1.47Å | 1.46Å | |
| C12 | C16 | doub | 1.39Å | 1.37Å | Aromatic |
| C14 | C19 | sing | 1.48Å | 1.52Å | |
| C14 | C15 | doub | 1.40Å | 1.40Å | Aromatic |
| C19 | C20 | sing | 1.47Å | 1.46Å | |
| C22 | O29 | doub | 1.22Å | 1.24Å | |
| C22 | C21 | sing | 1.48Å | 1.48Å | |
| C16 | C15 | sing | 1.37Å | 1.40Å | Aromatic |
| C20 | C21 | doub | 1.40Å | 1.35Å | Aromatic |
| C20 | S24 | sing | 1.76Å | 1.73Å | Aromatic |
| C21 | C26 | sing | 1.40Å | 1.46Å | Aromatic |
| C26 | C25 | doub | 1.34Å | 1.34Å | Aromatic |
| S24 | C25 | sing | 1.76Å | 1.72Å | Aromatic |
| C25 | C30 | sing | 1.47Å | 1.48Å | |
| C30 | N31 | sing | 1.35Å | 1.35Å | |
| C30 | O32 | doub | 1.22Å | 1.23Å | |
| N31 | C33 | sing | 1.47Å | 1.47Å | |
| C34 | C33 | sing | 1.53Å | 1.57Å | |
| C34 | C35 | sing | 1.53Å | 1.55Å | |
| C33 | C38 | sing | 1.53Å | 1.56Å | |
| C38 | C37 | sing | 1.53Å | 1.55Å | |
| O40 | S36 | doub | 1.42Å | 1.44Å | |
| C35 | S36 | sing | 1.82Å | 1.80Å | |
| S36 | C37 | sing | 1.82Å | 1.80Å | |
| S36 | O39 | doub | 1.42Å | 1.46Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| C41 | H5 | sing | 1.09Å | 1.10Å | |
| C41 | H6 | sing | 1.09Å | 1.10Å | |
| C41 | H7 | sing | 1.09Å | 1.10Å | |
| C13 | H8 | sing | 1.08Å | 1.08Å | |
| C15 | H9 | sing | 1.08Å | 1.08Å | |
| C16 | H10 | sing | 1.08Å | 1.08Å | |
| C17 | H11 | sing | 1.09Å | 1.10Å | |
| C17 | H12 | sing | 1.09Å | 1.10Å | |
| C17 | H13 | sing | 1.09Å | 1.10Å | |
| C18 | H14 | sing | 1.08Å | 1.08Å | |
| C26 | H15 | sing | 1.08Å | 1.08Å | |
| C27 | H16 | sing | 1.09Å | 1.10Å | |
| C27 | H17 | sing | 1.09Å | 1.10Å | |
| C28 | H18 | sing | 1.09Å | 1.10Å | |
| C28 | H19 | sing | 1.09Å | 1.10Å | |
| N2 | H20 | sing | 1.01Å | 1.00Å | |
| C4 | H22 | sing | 1.09Å | 1.10Å | |
| C4 | H23 | sing | 1.09Å | 1.10Å | |
| C5 | H24 | sing | 1.09Å | 1.10Å | |
| C6 | H25 | sing | 1.09Å | 1.10Å | |
| C6 | H26 | sing | 1.09Å | 1.10Å | |
| C7 | H27 | sing | 1.09Å | 1.10Å | |
| C7 | H28 | sing | 1.09Å | 1.10Å | |
| C9 | H29 | sing | 1.08Å | 1.08Å | |
| N31 | H30 | sing | 0.97Å | 1.00Å | |
| C33 | H31 | sing | 1.09Å | 1.10Å | |
| C34 | H32 | sing | 1.09Å | 1.10Å | |
| C34 | H33 | sing | 1.09Å | 1.10Å | |
| C35 | H34 | sing | 1.09Å | 1.10Å | |
| C35 | H35 | sing | 1.09Å | 1.10Å | |
| C37 | H36 | sing | 1.09Å | 1.10Å | |
| C37 | H37 | sing | 1.09Å | 1.10Å | |
| C38 | H38 | sing | 1.09Å | 1.10Å | |
| C38 | H39 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C41 | C28 | C27 | 112.9° | 109.5° |
| C28 | C41 | H5 | 109.5° | 109.4° |
| C28 | C41 | H6 | 109.5° | 109.4° |
| C28 | C41 | H7 | 109.5° | 109.5° |
| C41 | C28 | H18 | 108.6° | 109.5° |
| C41 | C28 | H19 | 108.6° | 109.5° |
| N2 | C3 | C4 | 112.9° | 109.6° |
| C3 | N2 | C1 | 112.5° | 111.2° |
| N2 | C3 | H3 | 108.6° | 109.5° |
| N2 | C3 | H4 | 108.6° | 109.5° |
| C3 | N2 | H20 | 108.8° | 111.0° |
| C3 | C4 | C5 | 112.0° | 109.3° |
| C4 | C3 | H3 | 108.6° | 109.5° |
| C4 | C3 | H4 | 108.6° | 109.5° |
| C3 | C4 | H22 | 108.9° | 109.5° |
| C3 | C4 | H23 | 108.8° | 109.5° |
| C28 | C27 | N23 | 109.6° | 109.5° |
| C28 | C27 | H16 | 109.4° | 109.4° |
| C28 | C27 | H17 | 109.4° | 109.4° |
| C27 | C28 | H18 | 108.6° | 109.5° |
| C27 | C28 | H19 | 108.6° | 109.5° |
| C17 | C10 | C9 | 128.0° | 126.5° |
| C17 | C10 | C11 | 124.6° | 126.5° |
| C10 | C17 | H11 | 109.5° | 109.4° |
| C10 | C17 | H12 | 109.4° | 109.5° |
| C10 | C17 | H13 | 109.5° | 109.5° |
| C27 | N23 | C18 | 119.5° | 118.9° |
| C27 | N23 | C22 | 119.0° | 118.9° |
| N23 | C27 | H16 | 109.4° | 109.5° |
| N23 | C27 | H17 | 109.4° | 109.5° |
| N2 | C1 | C6 | 111.9° | 109.5° |
| N2 | C1 | H1 | 108.9° | 109.4° |
| N2 | C1 | H2 | 108.8° | 109.4° |
| C1 | N2 | H20 | 108.7° | 111.0° |
| C4 | C5 | C6 | 107.3° | 109.2° |
| C4 | C5 | C7 | 113.6° | 109.5° |
| C5 | C4 | H22 | 108.8° | 109.5° |
| C5 | C4 | H23 | 108.9° | 109.5° |
| C4 | C5 | H24 | 108.0° | 109.5° |
| C9 | C10 | C11 | 107.3° | 107.0° |
| C10 | C9 | N8 | 109.8° | 110.0° |
| C10 | C9 | H29 | 125.1° | 125.0° |
| C10 | C11 | C13 | 133.6° | 133.9° |
| C10 | C11 | C12 | 102.2° | 106.1° |
| C9 | N8 | C12 | 110.5° | 109.9° |
| C9 | N8 | C7 | 123.6° | 125.1° |
| N8 | C9 | H29 | 125.1° | 125.1° |
| N23 | C18 | C19 | 123.3° | 121.5° |
| C18 | N23 | C22 | 121.4° | 122.3° |
| N23 | C18 | H14 | 118.4° | 119.3° |
| C18 | C19 | C14 | 120.8° | 120.1° |
| C18 | C19 | C20 | 117.3° | 119.7° |
| C19 | C18 | H14 | 118.3° | 119.3° |
| N23 | C22 | O29 | 125.1° | 119.8° |
| N23 | C22 | C21 | 116.6° | 120.3° |
| C13 | C11 | C12 | 124.1° | 120.0° |
| C11 | C13 | C14 | 114.9° | 119.4° |
| C11 | C13 | H8 | 122.5° | 120.3° |
| C11 | C12 | N8 | 110.0° | 107.1° |
| C11 | C12 | C16 | 121.2° | 119.6° |
| C13 | C14 | C19 | 120.9° | 120.0° |
| C13 | C14 | C15 | 120.5° | 120.1° |
| C14 | C13 | H8 | 122.6° | 120.3° |
| C1 | C6 | C5 | 108.8° | 109.3° |
| C6 | C1 | H1 | 108.9° | 109.4° |
| C6 | C1 | H2 | 108.9° | 109.5° |
| C1 | C6 | H25 | 109.6° | 109.5° |
| C1 | C6 | H26 | 109.6° | 109.5° |
| C6 | C5 | C7 | 111.9° | 109.5° |
| C6 | C5 | H24 | 108.0° | 109.5° |
| C5 | C6 | H25 | 109.7° | 109.5° |
| C5 | C6 | H26 | 109.6° | 109.5° |
| C5 | C7 | N8 | 110.7° | 109.5° |
| C7 | C5 | H24 | 107.8° | 109.6° |
| C5 | C7 | H27 | 109.2° | 109.5° |
| C5 | C7 | H28 | 109.2° | 109.5° |
| C12 | N8 | C7 | 125.9° | 125.0° |
| N8 | C12 | C16 | 128.8° | 133.3° |
| N8 | C7 | H27 | 109.2° | 109.5° |
| N8 | C7 | H28 | 109.2° | 109.4° |
| C12 | C16 | C15 | 115.9° | 120.2° |
| C12 | C16 | H10 | 122.1° | 119.9° |
| C19 | C14 | C15 | 118.2° | 119.9° |
| C14 | C19 | C20 | 122.0° | 120.2° |
| C14 | C15 | C16 | 123.4° | 120.7° |
| C14 | C15 | H9 | 118.3° | 119.7° |
| C19 | C20 | C21 | 119.4° | 118.9° |
| C19 | C20 | S24 | 127.0° | 131.5° |
| O29 | C22 | C21 | 117.9° | 119.9° |
| C22 | C21 | C20 | 121.6° | 117.4° |
| C22 | C21 | C26 | 127.1° | 129.8° |
| C16 | C15 | H9 | 118.3° | 119.6° |
| C15 | C16 | H10 | 122.1° | 119.9° |
| C21 | C20 | S24 | 113.6° | 109.6° |
| C20 | C21 | C26 | 110.9° | 112.8° |
| C20 | S24 | C25 | 90.0° | 91.5° |
| C21 | C26 | C25 | 111.5° | 115.6° |
| C21 | C26 | H15 | 124.2° | 122.2° |
| C26 | C25 | S24 | 113.8° | 110.5° |
| C26 | C25 | C30 | 125.2° | 124.8° |
| C25 | C26 | H15 | 124.3° | 122.2° |
| S24 | C25 | C30 | 120.7° | 124.8° |
| C25 | C30 | N31 | 117.4° | 120.0° |
| C25 | C30 | O32 | 118.2° | 120.0° |
| N31 | C30 | O32 | 124.1° | 120.0° |
| C30 | N31 | C33 | 125.7° | 120.0° |
| C30 | N31 | H30 | 117.2° | 120.0° |
| N31 | C33 | C34 | 102.9° | 109.3° |
| N31 | C33 | C38 | 105.9° | 109.2° |
| C33 | N31 | H30 | 117.2° | 120.0° |
| N31 | C33 | H31 | 113.7° | 109.2° |
| C33 | C34 | C35 | 114.7° | 110.0° |
| C34 | C33 | C38 | 109.4° | 110.7° |
| C34 | C33 | H31 | 112.1° | 109.2° |
| C33 | C34 | H32 | 108.1° | 109.3° |
| C33 | C34 | H33 | 108.1° | 109.4° |
| C34 | C35 | S36 | 109.2° | 109.0° |
| C35 | C34 | H32 | 108.2° | 109.4° |
| C35 | C34 | H33 | 108.2° | 109.4° |
| C34 | C35 | H34 | 109.5° | 109.5° |
| C34 | C35 | H35 | 109.5° | 109.5° |
| C33 | C38 | C37 | 109.3° | 110.0° |
| C38 | C33 | H31 | 112.2° | 109.2° |
| C33 | C38 | H38 | 109.5° | 109.3° |
| C33 | C38 | H39 | 109.5° | 109.4° |
| C38 | C37 | S36 | 109.0° | 109.0° |
| C38 | C37 | H36 | 109.6° | 109.6° |
| C38 | C37 | H37 | 109.6° | 109.6° |
| C37 | C38 | H38 | 109.5° | 109.4° |
| C37 | C38 | H39 | 109.5° | 109.4° |
| O40 | S36 | C35 | 107.1° | 108.7° |
| O40 | S36 | C37 | 108.9° | 108.7° |
| O40 | S36 | O39 | 121.1° | 119.4° |
| C35 | S36 | C37 | 100.4° | 101.3° |
| C35 | S36 | O39 | 109.9° | 108.6° |
| S36 | C35 | H34 | 109.5° | 109.6° |
| S36 | C35 | H35 | 109.5° | 109.5° |
| C37 | S36 | O39 | 107.4° | 108.6° |
| S36 | C37 | H36 | 109.6° | 109.6° |
| S36 | C37 | H37 | 109.6° | 109.5° |
| H1 | C1 | H2 | 109.5° | 109.5° |
| H3 | C3 | H4 | 109.4° | 109.4° |
| H5 | C41 | H6 | 109.4° | 109.5° |
| H5 | C41 | H7 | 109.4° | 109.5° |
| H6 | C41 | H7 | 109.5° | 109.5° |
| H11 | C17 | H12 | 109.5° | 109.5° |
| H11 | C17 | H13 | 109.5° | 109.5° |
| H12 | C17 | H13 | 109.5° | 109.5° |
| H16 | C27 | H17 | 109.5° | 109.5° |
| H18 | C28 | H19 | 109.5° | 109.4° |
| H22 | C4 | H23 | 109.5° | 109.5° |
| H25 | C6 | H26 | 109.4° | 109.5° |
| H27 | C7 | H28 | 109.5° | 109.4° |
| H32 | C34 | H33 | 109.5° | 109.3° |
| H34 | C35 | H35 | 109.5° | 109.6° |
| H36 | C37 | H37 | 109.5° | 109.6° |
| H38 | C38 | H39 | 109.5° | 109.3° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C41 | C28 | C27 | H18 | 120.5° | 120.0° |
| C41 | C28 | C27 | H19 | 120.5° | 120.0° |
| C41 | C28 | C27 | N23 | 67.8° | 180.0° |
| C28 | C41 | H5 | H6 | 120.0° | 119.9° |
| C28 | C41 | H5 | H7 | 120.0° | 120.0° |
| C28 | C41 | H6 | H7 | 120.0° | 120.0° |
| C41 | C28 | C27 | H16 | 172.2° | 60.0° |
| C41 | C28 | C27 | H17 | 52.2° | 60.0° |
| C41 | C28 | H18 | H19 | 118.4° | 120.0° |
| N2 | C3 | C4 | H3 | 120.5° | 120.0° |
| N2 | C3 | C4 | H4 | 120.6° | 120.1° |
| C3 | N2 | C1 | H20 | 120.5° | 124.2° |
| N2 | C3 | C4 | C5 | 51.9° | 59.2° |
| C3 | N2 | C1 | C6 | 56.2° | 61.7° |
| C3 | N2 | C1 | H1 | 64.2° | 58.3° |
| C3 | N2 | C1 | H2 | 176.5° | 178.3° |
| N2 | C3 | H3 | H4 | 118.4° | 119.9° |
| N2 | C3 | C4 | H22 | 68.5° | 60.8° |
| N2 | C3 | C4 | H23 | 172.3° | 179.1° |
| C4 | C3 | N2 | C1 | 50.9° | 61.7° |
| C3 | C4 | C5 | H22 | 120.4° | 120.0° |
| C3 | C4 | C5 | H23 | 120.4° | 119.9° |
| C3 | C4 | C5 | C6 | 55.9° | 57.7° |
| C3 | C4 | C5 | C7 | 179.9° | 177.5° |
| C4 | C3 | H3 | H4 | 118.4° | 120.0° |
| C4 | C3 | N2 | H20 | 171.3° | 174.1° |
| C3 | C4 | H22 | H23 | 118.8° | 120.1° |
| C3 | C4 | C5 | H24 | 60.3° | 62.2° |
| C28 | C27 | N23 | H16 | 120.0° | 120.0° |
| C28 | C27 | N23 | H17 | 120.0° | 120.0° |
| C28 | C27 | N23 | C18 | 115.9° | 90.0° |
| C28 | C27 | N23 | C22 | 68.4° | 90.0° |
| C27 | C28 | C41 | H5 | 180.0° | 60.0° |
| C27 | C28 | C41 | H6 | 60.0° | 60.0° |
| C27 | C28 | C41 | H7 | 60.0° | 180.0° |
| C28 | C27 | H16 | H17 | 119.9° | 119.9° |
| C27 | C28 | H18 | H19 | 118.4° | 120.0° |
| C17 | C10 | C9 | C11 | 177.0° | 179.6° |
| C17 | C10 | C9 | N8 | 174.6° | 180.0° |
| C17 | C10 | C11 | C13 | 5.2° | 0.3° |
| C17 | C10 | C11 | C12 | 177.0° | 180.0° |
| C10 | C17 | H11 | H12 | 120.0° | 120.0° |
| C10 | C17 | H11 | H13 | 120.0° | 119.9° |
| C10 | C17 | H12 | H13 | 120.0° | 120.0° |
| C17 | C10 | C9 | H29 | 5.4° | 0.2° |
| C27 | N23 | C18 | C22 | 175.6° | 179.9° |
| C27 | N23 | C18 | C19 | 179.1° | 180.0° |
| C27 | N23 | C22 | O29 | 5.7° | 0.0° |
| C27 | N23 | C22 | C21 | 178.3° | 179.9° |
| C27 | N23 | C18 | H14 | 0.9° | 0.2° |
| N23 | C27 | H16 | H17 | 119.9° | 120.1° |
| N23 | C27 | C28 | H18 | 52.7° | 60.0° |
| N23 | C27 | C28 | H19 | 171.7° | 60.0° |
| N2 | C1 | C6 | H1 | 120.4° | 120.0° |
| N2 | C1 | C6 | H2 | 120.3° | 120.0° |
| N2 | C1 | C6 | C5 | 61.4° | 59.1° |
| N2 | C1 | H1 | H2 | 118.9° | 120.0° |
| C1 | N2 | C3 | H3 | 171.4° | 178.2° |
| C1 | N2 | C3 | H4 | 69.6° | 58.3° |
| N2 | C1 | C6 | H25 | 178.6° | 179.1° |
| N2 | C1 | C6 | H26 | 58.5° | 60.8° |
| C4 | C5 | C6 | C1 | 59.8° | 57.6° |
| C4 | C5 | C6 | C7 | 125.3° | 119.9° |
| C4 | C5 | C6 | H24 | 116.2° | 119.9° |
| C4 | C5 | C7 | H24 | 119.7° | 120.2° |
| C4 | C5 | C7 | N8 | 57.1° | 175.0° |
| C5 | C4 | C3 | H3 | 172.5° | 179.2° |
| C5 | C4 | C3 | H4 | 68.6° | 60.9° |
| C5 | C4 | H22 | H23 | 118.9° | 120.1° |
| C4 | C5 | C6 | H25 | 179.7° | 177.6° |
| C4 | C5 | C6 | H26 | 60.1° | 62.2° |
| C4 | C5 | C7 | H27 | 177.3° | 65.0° |
| C4 | C5 | C7 | H28 | 63.1° | 55.0° |
| C10 | C9 | N8 | H29 | 180.0° | 179.8° |
| C9 | C10 | C11 | C13 | 177.6° | 179.9° |
| C9 | C10 | C11 | C12 | 0.2° | 0.4° |
| C10 | C9 | N8 | C12 | 3.8° | 0.2° |
| C10 | C9 | N8 | C7 | 175.2° | 179.7° |
| C9 | C10 | C17 | H11 | 88.2° | 90.0° |
| C9 | C10 | C17 | H12 | 151.8° | 150.0° |
| C9 | C10 | C17 | H13 | 31.8° | 29.9° |
| C11 | C10 | C9 | N8 | 2.4° | 0.4° |
| C10 | C11 | C13 | C12 | 177.4° | 179.7° |
| C10 | C11 | C13 | C14 | 176.7° | 179.6° |
| C10 | C11 | C12 | N8 | 2.0° | 0.3° |
| C10 | C11 | C12 | C16 | 177.0° | 179.7° |
| C10 | C11 | C13 | H8 | 3.3° | 0.3° |
| C11 | C10 | C17 | H11 | 88.4° | 90.5° |
| C11 | C10 | C17 | H12 | 31.6° | 29.5° |
| C11 | C10 | C17 | H13 | 151.6° | 149.6° |
| C11 | C10 | C9 | H29 | 177.6° | 179.8° |
| C9 | N8 | C12 | C11 | 3.7° | 0.0° |
| C9 | N8 | C7 | C5 | 115.6° | 94.9° |
| C9 | N8 | C12 | C7 | 179.0° | 180.0° |
| C9 | N8 | C12 | C16 | 175.3° | 180.0° |
| C9 | N8 | C7 | H27 | 124.2° | 145.0° |
| C9 | N8 | C7 | H28 | 4.6° | 25.1° |
| N23 | C18 | C19 | H14 | 180.0° | 179.8° |
| N23 | C18 | C19 | C14 | 178.7° | 179.9° |
| N23 | C18 | C19 | C20 | 2.4° | 0.1° |
| C18 | N23 | C22 | O29 | 178.7° | 179.9° |
| C18 | N23 | C22 | C21 | 6.1° | 0.0° |
| C18 | N23 | C27 | H16 | 124.1° | 29.9° |
| C18 | N23 | C27 | H17 | 4.2° | 150.0° |
| C19 | C18 | N23 | C22 | 3.5° | 0.1° |
| C18 | C19 | C14 | C13 | 53.0° | 65.0° |
| C18 | C19 | C14 | C20 | 178.9° | 180.0° |
| C18 | C19 | C14 | C15 | 119.5° | 115.1° |
| C18 | C19 | C20 | C21 | 5.2° | 0.1° |
| C18 | C19 | C20 | S24 | 177.0° | 180.0° |
| N23 | C22 | O29 | C21 | 172.5° | 180.0° |
| N23 | C22 | C21 | C20 | 3.1° | 0.0° |
| N23 | C22 | C21 | C26 | 169.6° | 180.0° |
| C22 | N23 | C18 | H14 | 176.5° | 179.7° |
| C22 | N23 | C27 | H16 | 51.6° | 150.0° |
| C22 | N23 | C27 | H17 | 171.6° | 29.9° |
| C11 | C13 | C14 | H8 | 180.0° | 179.9° |
| C13 | C11 | C12 | N8 | 179.9° | 180.0° |
| C13 | C11 | C12 | C16 | 1.0° | 0.0° |
| C11 | C13 | C14 | C19 | 172.1° | 180.0° |
| C11 | C13 | C14 | C15 | 0.2° | 0.1° |
| C12 | C11 | C13 | C14 | 0.7° | 0.1° |
| C11 | C12 | N8 | C16 | 179.0° | 180.0° |
| C11 | C12 | N8 | C7 | 175.3° | 180.0° |
| C11 | C12 | C16 | C15 | 0.4° | 0.0° |
| C12 | C11 | C13 | H8 | 179.3° | 180.0° |
| C11 | C12 | C16 | H10 | 179.6° | 180.0° |
| C13 | C14 | C19 | C15 | 172.5° | 179.9° |
| C13 | C14 | C19 | C20 | 125.9° | 114.9° |
| C13 | C14 | C15 | C16 | 0.8° | 0.1° |
| C13 | C14 | C15 | H9 | 179.2° | 179.9° |
| C1 | C6 | C5 | H25 | 119.9° | 120.0° |
| C1 | C6 | C5 | H26 | 119.9° | 119.9° |
| C1 | C6 | C5 | C7 | 174.9° | 177.5° |
| C6 | C1 | H1 | H2 | 118.9° | 120.0° |
| C6 | C1 | N2 | H20 | 176.7° | 174.2° |
| C1 | C6 | C5 | H24 | 56.4° | 62.3° |
| C1 | C6 | H25 | H26 | 120.3° | 120.1° |
| C6 | C5 | C7 | H24 | 118.6° | 120.2° |
| C6 | C5 | C7 | N8 | 178.8° | 65.3° |
| C5 | C6 | C1 | H1 | 58.9° | 60.8° |
| C5 | C6 | C1 | H2 | 178.2° | 179.1° |
| C6 | C5 | C4 | H22 | 64.5° | 62.3° |
| C6 | C5 | C4 | H23 | 176.3° | 177.6° |
| C5 | C6 | H25 | H26 | 120.3° | 120.1° |
| C6 | C5 | C7 | H27 | 61.1° | 54.7° |
| C6 | C5 | C7 | H28 | 58.6° | 174.7° |
| C5 | C7 | N8 | C12 | 63.3° | 85.0° |
| C5 | C7 | N8 | H27 | 120.2° | 120.1° |
| C5 | C7 | N8 | H28 | 120.2° | 120.0° |
| C7 | C5 | C4 | H22 | 59.7° | 57.6° |
| C7 | C5 | C4 | H23 | 59.5° | 62.5° |
| C7 | C5 | C6 | H25 | 55.0° | 62.5° |
| C7 | C5 | C6 | H26 | 65.2° | 57.6° |
| C5 | C7 | H27 | H28 | 119.4° | 120.0° |
| N8 | C12 | C16 | C15 | 179.2° | 180.0° |
| N8 | C12 | C16 | H10 | 0.7° | 0.0° |
| C12 | N8 | C7 | H27 | 56.8° | 35.1° |
| C12 | N8 | C7 | H28 | 176.5° | 155.0° |
| C12 | N8 | C9 | H29 | 176.2° | 179.9° |
| C7 | N8 | C12 | C16 | 5.7° | 0.0° |
| N8 | C7 | C5 | H24 | 62.6° | 54.8° |
| N8 | C7 | H27 | H28 | 119.5° | 119.9° |
| C7 | N8 | C9 | H29 | 4.7° | 0.1° |
| C12 | C16 | C15 | C14 | 0.5° | 0.1° |
| C12 | C16 | C15 | H10 | 180.0° | 180.0° |
| C12 | C16 | C15 | H9 | 179.4° | 180.0° |
| C19 | C14 | C15 | C16 | 171.7° | 180.0° |
| C14 | C19 | C20 | C21 | 175.8° | 180.0° |
| C14 | C19 | C20 | S24 | 2.0° | 0.0° |
| C19 | C14 | C13 | H8 | 7.9° | 0.1° |
| C19 | C14 | C15 | H9 | 8.3° | 0.1° |
| C14 | C19 | C18 | H14 | 1.3° | 0.3° |
| C15 | C14 | C19 | C20 | 61.6° | 64.9° |
| C14 | C15 | C16 | H9 | 180.0° | 179.9° |
| C15 | C14 | C13 | H8 | 179.8° | 180.0° |
| C14 | C15 | C16 | H10 | 179.5° | 179.9° |
| C19 | C20 | C21 | C22 | 2.5° | 0.0° |
| C19 | C20 | C21 | S24 | 178.1° | 179.9° |
| C19 | C20 | C21 | C26 | 176.3° | 180.0° |
| C19 | C20 | S24 | C25 | 178.1° | 179.9° |
| C20 | C19 | C18 | H14 | 177.6° | 179.7° |
| O29 | C22 | C21 | C20 | 176.2° | 180.0° |
| O29 | C22 | C21 | C26 | 3.6° | 0.1° |
| C22 | C21 | C20 | C26 | 173.7° | 180.0° |
| C22 | C21 | C20 | S24 | 179.4° | 179.9° |
| C22 | C21 | C26 | C25 | 178.1° | 180.0° |
| C22 | C21 | C26 | H15 | 2.0° | 0.1° |
| C20 | C21 | C26 | C25 | 4.8° | 0.0° |
| C21 | C20 | S24 | C25 | 4.0° | 0.0° |
| C20 | C21 | C26 | H15 | 175.3° | 180.0° |
| S24 | C20 | C21 | C26 | 5.7° | 0.0° |
| C20 | S24 | C25 | C26 | 1.1° | 0.0° |
| C20 | S24 | C25 | C30 | 172.8° | 180.0° |
| C21 | C26 | C25 | H15 | 180.0° | 180.0° |
| C21 | C26 | C25 | S24 | 1.8° | 0.0° |
| C21 | C26 | C25 | C30 | 175.3° | 180.0° |
| C26 | C25 | S24 | C30 | 173.9° | 180.0° |
| C26 | C25 | C30 | N31 | 16.5° | 180.0° |
| C26 | C25 | C30 | O32 | 168.9° | 0.1° |
| S24 | C25 | C30 | N31 | 156.6° | 0.0° |
| S24 | C25 | C30 | O32 | 18.0° | 179.9° |
| S24 | C25 | C26 | H15 | 178.2° | 180.0° |
| C25 | C30 | N31 | O32 | 174.2° | 180.0° |
| C25 | C30 | N31 | C33 | 177.3° | 180.0° |
| C30 | C25 | C26 | H15 | 4.7° | 0.0° |
| C25 | C30 | N31 | H30 | 2.7° | 0.0° |
| C30 | N31 | C33 | H30 | 180.0° | 179.9° |
| C30 | N31 | C33 | C34 | 103.5° | 83.8° |
| C30 | N31 | C33 | C38 | 141.7° | 155.0° |
| C30 | N31 | C33 | H31 | 17.9° | 35.6° |
| O32 | C30 | N31 | C33 | 3.1° | 0.0° |
| O32 | C30 | N31 | H30 | 176.9° | 180.0° |
| N31 | C33 | C34 | C38 | 112.3° | 120.3° |
| N31 | C33 | C34 | H31 | 122.5° | 119.4° |
| N31 | C33 | C34 | C35 | 174.1° | 169.7° |
| N31 | C33 | C38 | H31 | 124.6° | 119.4° |
| N31 | C33 | C38 | C37 | 175.4° | 169.7° |
| N31 | C33 | C34 | H32 | 65.2° | 49.5° |
| N31 | C33 | C34 | H33 | 53.3° | 70.1° |
| N31 | C33 | C38 | H38 | 55.4° | 70.2° |
| N31 | C33 | C38 | H39 | 64.6° | 49.5° |
| C33 | C34 | C35 | H32 | 120.8° | 120.1° |
| C33 | C34 | C35 | H33 | 120.8° | 120.2° |
| C34 | C33 | C38 | H31 | 125.1° | 120.2° |
| C34 | C33 | C38 | C37 | 65.1° | 70.0° |
| C33 | C34 | C35 | S36 | 59.3° | 63.7° |
| C34 | C33 | N31 | H30 | 76.5° | 96.1° |
| C33 | C34 | H32 | H33 | 117.6° | 119.7° |
| C33 | C34 | C35 | H34 | 60.6° | 56.3° |
| C33 | C34 | C35 | H35 | 179.3° | 176.5° |
| C34 | C33 | C38 | H38 | 54.8° | 50.2° |
| C34 | C33 | C38 | H39 | 174.9° | 169.9° |
| C35 | C34 | C33 | C38 | 61.8° | 70.0° |
| C34 | C35 | S36 | O40 | 58.8° | 60.0° |
| C34 | C35 | S36 | H34 | 119.9° | 119.9° |
| C34 | C35 | S36 | H35 | 120.0° | 119.8° |
| C34 | C35 | S36 | C37 | 54.9° | 54.3° |
| C34 | C35 | S36 | O39 | 167.8° | 168.6° |
| C35 | C34 | C33 | H31 | 63.4° | 50.3° |
| C35 | C34 | H32 | H33 | 117.6° | 119.8° |
| C34 | C35 | H34 | H35 | 120.1° | 120.2° |
| C33 | C38 | C37 | H38 | 120.0° | 120.1° |
| C33 | C38 | C37 | H39 | 120.0° | 120.2° |
| C33 | C38 | C37 | S36 | 68.9° | 63.6° |
| C38 | C33 | N31 | H30 | 38.4° | 25.1° |
| C38 | C33 | C34 | H32 | 177.4° | 169.9° |
| C38 | C33 | C34 | H33 | 59.0° | 50.2° |
| C33 | C38 | C37 | H36 | 171.2° | 56.3° |
| C33 | C38 | C37 | H37 | 51.0° | 176.5° |
| C33 | C38 | H38 | H39 | 120.1° | 119.7° |
| C38 | C37 | S36 | O40 | 51.2° | 60.0° |
| C38 | C37 | S36 | C35 | 61.0° | 54.4° |
| C38 | C37 | S36 | H36 | 119.9° | 119.9° |
| C38 | C37 | S36 | H37 | 119.9° | 119.9° |
| C38 | C37 | S36 | O39 | 175.9° | 168.6° |
| C37 | C38 | C33 | H31 | 60.0° | 50.3° |
| C38 | C37 | H36 | H37 | 120.2° | 120.3° |
| C37 | C38 | H38 | H39 | 120.1° | 119.8° |
| O40 | S36 | C35 | C37 | 113.7° | 114.3° |
| O40 | S36 | C35 | O39 | 133.4° | 131.4° |
| O40 | S36 | C37 | O39 | 132.9° | 131.4° |
| O40 | S36 | C35 | H34 | 178.7° | 179.9° |
| O40 | S36 | C35 | H35 | 61.2° | 59.8° |
| O40 | S36 | C37 | H36 | 68.7° | 179.9° |
| O40 | S36 | C37 | H37 | 171.1° | 59.9° |
| C35 | S36 | C37 | O39 | 114.9° | 114.3° |
| S36 | C35 | C34 | H32 | 179.9° | 176.2° |
| S36 | C35 | C34 | H33 | 61.4° | 56.5° |
| S36 | C35 | H34 | H35 | 120.1° | 120.3° |
| C35 | S36 | C37 | H36 | 179.1° | 65.6° |
| C35 | S36 | C37 | H37 | 58.9° | 174.2° |
| C37 | S36 | C35 | H34 | 65.1° | 65.5° |
| C37 | S36 | C35 | H35 | 174.8° | 174.2° |
| S36 | C37 | H36 | H37 | 120.2° | 120.2° |
| S36 | C37 | C38 | H38 | 51.1° | 56.4° |
| S36 | C37 | C38 | H39 | 171.2° | 176.2° |
| O39 | S36 | C35 | H34 | 47.9° | 48.8° |
| O39 | S36 | C35 | H35 | 72.2° | 71.5° |
| O39 | S36 | C37 | H36 | 64.2° | 48.7° |
| O39 | S36 | C37 | H37 | 56.0° | 71.5° |
| H1 | C1 | N2 | H20 | 56.3° | 65.9° |
| H1 | C1 | C6 | H25 | 61.0° | 59.2° |
| H1 | C1 | C6 | H26 | 178.9° | 179.3° |
| H2 | C1 | N2 | H20 | 63.0° | 54.1° |
| H2 | C1 | C6 | H25 | 58.3° | 60.9° |
| H2 | C1 | C6 | H26 | 61.8° | 59.2° |
| H3 | C3 | N2 | H20 | 68.1° | 54.1° |
| H3 | C3 | C4 | H22 | 52.1° | 59.3° |
| H3 | C3 | C4 | H23 | 67.2° | 60.8° |
| H4 | C3 | N2 | H20 | 50.8° | 65.8° |
| H4 | C3 | C4 | H22 | 171.0° | 179.2° |
| H4 | C3 | C4 | H23 | 51.7° | 59.0° |
| H5 | C41 | H6 | H7 | 119.9° | 120.1° |
| H5 | C41 | C28 | H18 | 59.5° | 60.0° |
| H5 | C41 | C28 | H19 | 59.5° | 180.0° |
| H6 | C41 | C28 | H18 | 60.5° | 180.0° |
| H6 | C41 | C28 | H19 | 179.5° | 60.0° |
| H7 | C41 | C28 | H18 | 179.5° | 59.9° |
| H7 | C41 | C28 | H19 | 60.5° | 60.0° |
| H9 | C15 | C16 | H10 | 0.5° | 0.0° |
| H11 | C17 | H12 | H13 | 120.0° | 120.0° |
| H16 | C27 | C28 | H18 | 67.3° | 180.0° |
| H16 | C27 | C28 | H19 | 51.7° | 60.0° |
| H17 | C27 | C28 | H18 | 172.7° | 60.0° |
| H17 | C27 | C28 | H19 | 68.3° | 180.0° |
| H22 | C4 | C5 | H24 | 179.3° | 177.8° |
| H23 | C4 | C5 | H24 | 60.1° | 57.7° |
| H24 | C5 | C6 | H25 | 63.5° | 57.7° |
| H24 | C5 | C6 | H26 | 176.3° | 177.8° |
| H24 | C5 | C7 | H27 | 57.6° | 174.9° |
| H24 | C5 | C7 | H28 | 177.2° | 65.1° |
| H30 | N31 | C33 | H31 | 162.1° | 144.5° |
| H31 | C33 | C34 | H32 | 57.4° | 69.9° |
| H31 | C33 | C34 | H33 | 175.8° | 170.5° |
| H31 | C33 | C38 | H38 | 179.9° | 170.4° |
| H31 | C33 | C38 | H39 | 60.0° | 69.9° |
| H32 | C34 | C35 | H34 | 60.1° | 63.9° |
| H32 | C34 | C35 | H35 | 60.0° | 56.4° |
| H33 | C34 | C35 | H34 | 178.6° | 176.4° |
| H33 | C34 | C35 | H35 | 58.5° | 63.3° |
| H36 | C37 | C38 | H38 | 68.8° | 176.3° |
| H36 | C37 | C38 | H39 | 51.2° | 63.9° |
| H37 | C37 | C38 | H38 | 171.0° | 63.4° |
| H37 | C37 | C38 | H39 | 68.9° | 56.3° |
