4SL
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C21 | C20 | sing | 1.53Å | 1.53Å | |
| C23 | C20 | sing | 1.53Å | 1.54Å | |
| O30 | C29 | doub | 1.22Å | 1.28Å | |
| C20 | C22 | sing | 1.53Å | 1.54Å | |
| C20 | C11 | sing | 1.53Å | 1.55Å | |
| C29 | O31 | sing | 1.35Å | 1.27Å | |
| C29 | C27 | sing | 1.47Å | 1.38Å | |
| C28 | C27 | sing | 1.51Å | 1.50Å | |
| C11 | C12 | sing | 1.51Å | 1.58Å | |
| C11 | N10 | sing | 1.46Å | 1.47Å | |
| C27 | C26 | doub | 1.33Å | 1.52Å | |
| C25 | N13 | sing | 1.47Å | 1.49Å | |
| C12 | N13 | sing | 1.35Å | 1.36Å | |
| C12 | O24 | doub | 1.21Å | 1.24Å | |
| C18 | N17 | sing | 1.47Å | 1.48Å | |
| N10 | C9 | sing | 1.35Å | 1.34Å | |
| N13 | C14 | sing | 1.46Å | 1.47Å | |
| C26 | C14 | sing | 1.51Å | 1.54Å | |
| O19 | C9 | doub | 1.21Å | 1.22Å | |
| C9 | C8 | sing | 1.51Å | 1.52Å | |
| C14 | C32 | sing | 1.53Å | 1.57Å | |
| N17 | C8 | sing | 1.47Å | 1.45Å | |
| C8 | C7 | sing | 1.53Å | 1.54Å | |
| C32 | C34 | sing | 1.53Å | 1.52Å | |
| C32 | C33 | sing | 1.53Å | 1.55Å | |
| C7 | C15 | sing | 1.53Å | 1.53Å | |
| C7 | C16 | sing | 1.53Å | 1.56Å | |
| C7 | C5 | sing | 1.51Å | 1.39Å | |
| C4 | C5 | doub | 1.38Å | 1.41Å | Aromatic |
| C4 | C3 | sing | 1.38Å | 1.39Å | Aromatic |
| C5 | C6 | sing | 1.38Å | 1.41Å | Aromatic |
| C3 | C2 | doub | 1.38Å | 1.41Å | Aromatic |
| C6 | C1 | doub | 1.38Å | 1.41Å | Aromatic |
| C2 | C1 | sing | 1.38Å | 1.39Å | Aromatic |
| C4 | H1 | sing | 1.08Å | 1.08Å | |
| C14 | H2 | sing | 1.09Å | 1.10Å | |
| C6 | H3 | sing | 1.08Å | 1.08Å | |
| C11 | H4 | sing | 1.09Å | 1.10Å | |
| C8 | H5 | sing | 1.09Å | 1.10Å | |
| C3 | H6 | sing | 1.08Å | 1.08Å | |
| O31 | H7 | sing | 0.97Å | 0.95Å | |
| C28 | H8 | sing | 1.09Å | 1.10Å | |
| C28 | H9 | sing | 1.09Å | 1.10Å | |
| C28 | H10 | sing | 1.09Å | 1.10Å | |
| C26 | H11 | sing | 1.08Å | 1.08Å | |
| C32 | H12 | sing | 1.09Å | 1.10Å | |
| C34 | H13 | sing | 1.09Å | 1.10Å | |
| C34 | H14 | sing | 1.09Å | 1.10Å | |
| C34 | H15 | sing | 1.09Å | 1.10Å | |
| C33 | H16 | sing | 1.09Å | 1.10Å | |
| C33 | H17 | sing | 1.09Å | 1.10Å | |
| C33 | H18 | sing | 1.09Å | 1.10Å | |
| C25 | H19 | sing | 1.09Å | 1.10Å | |
| C25 | H20 | sing | 1.09Å | 1.10Å | |
| C25 | H21 | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H23 | sing | 1.09Å | 1.10Å | |
| C22 | H24 | sing | 1.09Å | 1.10Å | |
| C23 | H25 | sing | 1.09Å | 1.10Å | |
| C23 | H26 | sing | 1.09Å | 1.10Å | |
| C23 | H27 | sing | 1.09Å | 1.10Å | |
| C21 | H28 | sing | 1.09Å | 1.10Å | |
| C21 | H29 | sing | 1.09Å | 1.10Å | |
| C21 | H30 | sing | 1.09Å | 1.10Å | |
| N10 | H31 | sing | 0.97Å | 1.00Å | |
| N17 | H32 | sing | 1.01Å | 1.00Å | |
| C18 | H34 | sing | 1.09Å | 1.10Å | |
| C18 | H35 | sing | 1.09Å | 1.10Å | |
| C18 | H36 | sing | 1.09Å | 1.10Å | |
| C15 | H37 | sing | 1.09Å | 1.10Å | |
| C15 | H38 | sing | 1.09Å | 1.10Å | |
| C15 | H39 | sing | 1.09Å | 1.10Å | |
| C16 | H40 | sing | 1.09Å | 1.10Å | |
| C16 | H41 | sing | 1.09Å | 1.10Å | |
| C16 | H42 | sing | 1.09Å | 1.10Å | |
| C2 | H43 | sing | 1.08Å | 1.08Å | |
| C1 | H44 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C21 | C20 | C23 | 105.2° | 109.5° |
| C21 | C20 | C22 | 107.8° | 109.5° |
| C21 | C20 | C11 | 112.7° | 109.5° |
| C20 | C21 | H28 | 109.5° | 109.5° |
| C20 | C21 | H29 | 109.5° | 109.5° |
| C20 | C21 | H30 | 109.5° | 109.5° |
| C23 | C20 | C22 | 109.9° | 109.5° |
| C23 | C20 | C11 | 109.5° | 109.5° |
| C20 | C23 | H25 | 109.5° | 109.5° |
| C20 | C23 | H26 | 109.5° | 109.5° |
| C20 | C23 | H27 | 109.5° | 109.5° |
| O30 | C29 | O31 | 128.4° | 120.0° |
| O30 | C29 | C27 | 113.0° | 120.0° |
| C22 | C20 | C11 | 111.6° | 109.5° |
| C20 | C22 | H22 | 109.5° | 109.5° |
| C20 | C22 | H23 | 109.5° | 109.5° |
| C20 | C22 | H24 | 109.4° | 109.5° |
| C20 | C11 | C12 | 115.0° | 109.5° |
| C20 | C11 | N10 | 109.4° | 109.4° |
| C20 | C11 | H4 | 108.2° | 109.4° |
| O31 | C29 | C27 | 118.7° | 120.0° |
| C29 | O31 | H7 | 109.5° | 117.0° |
| C29 | C27 | C28 | 112.0° | 120.0° |
| C29 | C27 | C26 | 122.4° | 120.0° |
| C28 | C27 | C26 | 125.5° | 120.0° |
| C27 | C28 | H8 | 109.5° | 109.5° |
| C27 | C28 | H9 | 109.5° | 109.5° |
| C27 | C28 | H10 | 109.4° | 109.4° |
| C12 | C11 | N10 | 107.2° | 109.5° |
| C11 | C12 | N13 | 118.8° | 120.1° |
| C11 | C12 | O24 | 121.6° | 120.0° |
| C12 | C11 | H4 | 107.9° | 109.5° |
| C11 | N10 | C9 | 123.4° | 120.1° |
| N10 | C11 | H4 | 109.1° | 109.4° |
| C11 | N10 | H31 | 118.3° | 120.0° |
| C27 | C26 | C14 | 127.3° | 120.0° |
| C27 | C26 | H11 | 116.4° | 120.0° |
| C25 | N13 | C12 | 122.9° | 120.0° |
| C25 | N13 | C14 | 118.4° | 120.0° |
| N13 | C25 | H19 | 109.5° | 109.5° |
| N13 | C25 | H20 | 109.5° | 109.5° |
| N13 | C25 | H21 | 109.5° | 109.5° |
| N13 | C12 | O24 | 119.3° | 120.0° |
| C12 | N13 | C14 | 118.7° | 120.0° |
| C18 | N17 | C8 | 109.7° | 111.0° |
| C18 | N17 | H32 | 109.4° | 111.0° |
| N17 | C18 | H34 | 109.5° | 109.5° |
| N17 | C18 | H35 | 109.5° | 109.5° |
| N17 | C18 | H36 | 109.4° | 109.5° |
| N10 | C9 | O19 | 123.4° | 120.0° |
| N10 | C9 | C8 | 117.9° | 120.0° |
| C9 | N10 | H31 | 118.3° | 119.9° |
| N13 | C14 | C26 | 111.6° | 109.4° |
| N13 | C14 | C32 | 108.2° | 109.5° |
| N13 | C14 | H2 | 108.7° | 109.5° |
| C26 | C14 | C32 | 112.8° | 109.5° |
| C26 | C14 | H2 | 107.8° | 109.5° |
| C14 | C26 | H11 | 116.4° | 120.0° |
| O19 | C9 | C8 | 118.7° | 120.0° |
| C9 | C8 | N17 | 105.4° | 109.5° |
| C9 | C8 | C7 | 110.8° | 109.5° |
| C9 | C8 | H5 | 110.1° | 109.5° |
| C14 | C32 | C34 | 113.9° | 109.5° |
| C14 | C32 | C33 | 114.0° | 109.5° |
| C32 | C14 | H2 | 107.5° | 109.5° |
| C14 | C32 | H12 | 105.6° | 109.5° |
| N17 | C8 | C7 | 109.3° | 109.5° |
| N17 | C8 | H5 | 111.1° | 109.4° |
| C8 | N17 | H32 | 109.4° | 111.0° |
| C8 | C7 | C15 | 106.8° | 109.5° |
| C8 | C7 | C16 | 109.8° | 109.5° |
| C8 | C7 | C5 | 112.0° | 109.5° |
| C7 | C8 | H5 | 109.9° | 109.4° |
| C34 | C32 | C33 | 110.6° | 109.5° |
| C34 | C32 | H12 | 106.1° | 109.4° |
| C32 | C34 | H13 | 109.5° | 109.5° |
| C32 | C34 | H14 | 109.5° | 109.5° |
| C32 | C34 | H15 | 109.5° | 109.5° |
| C33 | C32 | H12 | 105.9° | 109.5° |
| C32 | C33 | H16 | 109.5° | 109.4° |
| C32 | C33 | H17 | 109.4° | 109.5° |
| C32 | C33 | H18 | 109.5° | 109.5° |
| C15 | C7 | C16 | 110.6° | 109.5° |
| C15 | C7 | C5 | 106.8° | 109.4° |
| C7 | C15 | H37 | 109.5° | 109.4° |
| C7 | C15 | H38 | 109.5° | 109.5° |
| C7 | C15 | H39 | 109.4° | 109.5° |
| C16 | C7 | C5 | 110.7° | 109.4° |
| C7 | C16 | H40 | 109.5° | 109.5° |
| C7 | C16 | H41 | 109.5° | 109.5° |
| C7 | C16 | H42 | 109.5° | 109.4° |
| C7 | C5 | C4 | 117.6° | 120.0° |
| C7 | C5 | C6 | 123.6° | 120.0° |
| C5 | C4 | C3 | 121.0° | 120.0° |
| C4 | C5 | C6 | 118.8° | 120.0° |
| C5 | C4 | H1 | 119.5° | 120.0° |
| C4 | C3 | C2 | 119.5° | 120.0° |
| C3 | C4 | H1 | 119.5° | 120.0° |
| C4 | C3 | H6 | 120.2° | 120.0° |
| C5 | C6 | C1 | 120.4° | 120.0° |
| C5 | C6 | H3 | 119.8° | 120.1° |
| C3 | C2 | C1 | 120.4° | 120.0° |
| C2 | C3 | H6 | 120.2° | 120.0° |
| C3 | C2 | H43 | 119.8° | 120.0° |
| C6 | C1 | C2 | 119.8° | 120.0° |
| C1 | C6 | H3 | 119.8° | 120.0° |
| C6 | C1 | H44 | 120.1° | 120.0° |
| C1 | C2 | H43 | 119.8° | 120.1° |
| C2 | C1 | H44 | 120.1° | 119.9° |
| H8 | C28 | H9 | 109.5° | 109.5° |
| H8 | C28 | H10 | 109.5° | 109.5° |
| H9 | C28 | H10 | 109.5° | 109.5° |
| H13 | C34 | H14 | 109.5° | 109.4° |
| H13 | C34 | H15 | 109.4° | 109.5° |
| H14 | C34 | H15 | 109.5° | 109.5° |
| H16 | C33 | H17 | 109.5° | 109.5° |
| H16 | C33 | H18 | 109.5° | 109.4° |
| H17 | C33 | H18 | 109.4° | 109.5° |
| H19 | C25 | H20 | 109.4° | 109.5° |
| H19 | C25 | H21 | 109.5° | 109.5° |
| H20 | C25 | H21 | 109.5° | 109.4° |
| H22 | C22 | H23 | 109.5° | 109.4° |
| H22 | C22 | H24 | 109.5° | 109.5° |
| H23 | C22 | H24 | 109.5° | 109.5° |
| H25 | C23 | H26 | 109.5° | 109.4° |
| H25 | C23 | H27 | 109.5° | 109.5° |
| H26 | C23 | H27 | 109.4° | 109.4° |
| H28 | C21 | H29 | 109.5° | 109.5° |
| H28 | C21 | H30 | 109.5° | 109.4° |
| H29 | C21 | H30 | 109.4° | 109.5° |
| H34 | C18 | H35 | 109.4° | 109.5° |
| H34 | C18 | H36 | 109.5° | 109.4° |
| H35 | C18 | H36 | 109.5° | 109.5° |
| H37 | C15 | H38 | 109.5° | 109.4° |
| H37 | C15 | H39 | 109.5° | 109.5° |
| H38 | C15 | H39 | 109.5° | 109.5° |
| H40 | C16 | H41 | 109.5° | 109.5° |
| H40 | C16 | H42 | 109.5° | 109.5° |
| H41 | C16 | H42 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C21 | C20 | C23 | C22 | 115.7° | 120.0° |
| C21 | C20 | C23 | C11 | 121.4° | 120.0° |
| C21 | C20 | C22 | C11 | 124.2° | 120.0° |
| C21 | C20 | C11 | C12 | 58.9° | 65.3° |
| C21 | C20 | C11 | N10 | 179.5° | 54.8° |
| C21 | C20 | C11 | H4 | 61.8° | 174.7° |
| C21 | C20 | C22 | H22 | 180.0° | 177.3° |
| C21 | C20 | C22 | H23 | 60.0° | 57.4° |
| C21 | C20 | C22 | H24 | 60.0° | 62.7° |
| C21 | C20 | C23 | H25 | 180.0° | 180.0° |
| C21 | C20 | C23 | H26 | 60.0° | 60.0° |
| C21 | C20 | C23 | H27 | 60.0° | 60.0° |
| C20 | C21 | H28 | H29 | 120.0° | 120.0° |
| C20 | C21 | H28 | H30 | 120.0° | 120.0° |
| C20 | C21 | H29 | H30 | 120.0° | 120.0° |
| C23 | C20 | C22 | C11 | 121.7° | 120.0° |
| C23 | C20 | C11 | C12 | 175.5° | 174.7° |
| C23 | C20 | C11 | N10 | 63.8° | 65.2° |
| C23 | C20 | C11 | H4 | 54.9° | 54.7° |
| C23 | C20 | C22 | H22 | 65.9° | 57.3° |
| C23 | C20 | C22 | H23 | 174.1° | 62.6° |
| C23 | C20 | C22 | H24 | 54.1° | 177.3° |
| C20 | C23 | H25 | H26 | 120.0° | 120.0° |
| C20 | C23 | H25 | H27 | 120.0° | 120.1° |
| C20 | C23 | H26 | H27 | 120.0° | 120.0° |
| C23 | C20 | C21 | H28 | 180.0° | 60.0° |
| C23 | C20 | C21 | H29 | 60.0° | 60.0° |
| C23 | C20 | C21 | H30 | 60.0° | 179.9° |
| O30 | C29 | O31 | C27 | 179.8° | 180.0° |
| O30 | C29 | C27 | C28 | 0.7° | 79.6° |
| O30 | C29 | C27 | C26 | 178.1° | 100.4° |
| O30 | C29 | O31 | H7 | 0.0° | 0.0° |
| C22 | C20 | C11 | C12 | 62.6° | 54.7° |
| C22 | C20 | C11 | N10 | 58.1° | 174.8° |
| C22 | C20 | C11 | H4 | 176.8° | 65.3° |
| C20 | C22 | H22 | H23 | 120.0° | 120.0° |
| C20 | C22 | H22 | H24 | 120.0° | 120.1° |
| C20 | C22 | H23 | H24 | 120.0° | 120.1° |
| C22 | C20 | C23 | H25 | 64.3° | 60.0° |
| C22 | C20 | C23 | H26 | 55.7° | 180.0° |
| C22 | C20 | C23 | H27 | 175.7° | 60.0° |
| C22 | C20 | C21 | H28 | 62.8° | 60.0° |
| C22 | C20 | C21 | H29 | 177.2° | 180.0° |
| C22 | C20 | C21 | H30 | 57.2° | 60.0° |
| C20 | C11 | C12 | N10 | 121.9° | 120.0° |
| C20 | C11 | C12 | H4 | 120.8° | 120.0° |
| C20 | C11 | N10 | H4 | 118.2° | 119.9° |
| C20 | C11 | C12 | N13 | 103.2° | 97.2° |
| C20 | C11 | C12 | O24 | 82.1° | 82.8° |
| C20 | C11 | N10 | C9 | 118.5° | 85.0° |
| C11 | C20 | C22 | H22 | 55.7° | 62.8° |
| C11 | C20 | C22 | H23 | 64.3° | 177.3° |
| C11 | C20 | C22 | H24 | 175.8° | 57.3° |
| C11 | C20 | C23 | H25 | 58.6° | 60.0° |
| C11 | C20 | C23 | H26 | 178.6° | 60.0° |
| C11 | C20 | C23 | H27 | 61.4° | 180.0° |
| C11 | C20 | C21 | H28 | 60.7° | 179.9° |
| C11 | C20 | C21 | H29 | 59.3° | 60.0° |
| C11 | C20 | C21 | H30 | 179.2° | 60.0° |
| C20 | C11 | N10 | H31 | 61.5° | 95.0° |
| O31 | C29 | C27 | C28 | 179.1° | 100.4° |
| O31 | C29 | C27 | C26 | 2.1° | 79.6° |
| C29 | C27 | C28 | C26 | 178.8° | 180.0° |
| C29 | C27 | C26 | C14 | 1.5° | 5.0° |
| C27 | C29 | O31 | H7 | 179.9° | 180.0° |
| C29 | C27 | C28 | H8 | 180.0° | 90.0° |
| C29 | C27 | C28 | H9 | 60.0° | 150.0° |
| C29 | C27 | C28 | H10 | 60.0° | 30.0° |
| C29 | C27 | C26 | H11 | 178.5° | 175.1° |
| C28 | C27 | C26 | C14 | 179.9° | 175.0° |
| C27 | C28 | H8 | H9 | 120.0° | 120.0° |
| C27 | C28 | H8 | H10 | 120.0° | 120.0° |
| C27 | C28 | H9 | H10 | 120.0° | 120.0° |
| C28 | C27 | C26 | H11 | 0.1° | 4.9° |
| C12 | C11 | N10 | H4 | 116.5° | 120.0° |
| C11 | C12 | N13 | C25 | 3.0° | 4.4° |
| C11 | C12 | N13 | O24 | 174.8° | 180.0° |
| C12 | C11 | N10 | C9 | 116.2° | 155.0° |
| C11 | C12 | N13 | C14 | 178.8° | 175.7° |
| C12 | C11 | N10 | H31 | 63.9° | 25.0° |
| N10 | C11 | C12 | N13 | 134.9° | 142.8° |
| N10 | C11 | C12 | O24 | 39.7° | 37.2° |
| C11 | N10 | C9 | H31 | 180.0° | 180.0° |
| C11 | N10 | C9 | O19 | 2.4° | 0.0° |
| C11 | N10 | C9 | C8 | 177.2° | 180.0° |
| C27 | C26 | C14 | N13 | 89.9° | 117.5° |
| C27 | C26 | C14 | H11 | 180.0° | 179.9° |
| C27 | C26 | C14 | C32 | 147.9° | 122.5° |
| C27 | C26 | C14 | H2 | 29.4° | 2.5° |
| C26 | C27 | C28 | H8 | 1.2° | 90.0° |
| C26 | C27 | C28 | H9 | 118.8° | 30.0° |
| C26 | C27 | C28 | H10 | 121.3° | 149.9° |
| C25 | N13 | C12 | C14 | 178.2° | 180.0° |
| C25 | N13 | C12 | O24 | 177.8° | 175.6° |
| C25 | N13 | C14 | C26 | 25.9° | 60.0° |
| C25 | N13 | C14 | C32 | 98.8° | 60.0° |
| C25 | N13 | C14 | H2 | 144.8° | 179.9° |
| N13 | C25 | H19 | H20 | 120.0° | 120.1° |
| N13 | C25 | H19 | H21 | 120.0° | 120.0° |
| N13 | C25 | H20 | H21 | 120.0° | 119.9° |
| C12 | N13 | C14 | C26 | 152.3° | 120.0° |
| C12 | N13 | C14 | C32 | 82.9° | 120.0° |
| C12 | N13 | C14 | H2 | 33.5° | 0.1° |
| N13 | C12 | C11 | H4 | 17.6° | 22.8° |
| C12 | N13 | C25 | H19 | 180.0° | 84.5° |
| C12 | N13 | C25 | H20 | 60.0° | 155.4° |
| C12 | N13 | C25 | H21 | 60.0° | 35.5° |
| O24 | C12 | N13 | C14 | 4.1° | 4.4° |
| O24 | C12 | C11 | H4 | 157.0° | 157.2° |
| C18 | N17 | C8 | C9 | 88.2° | 85.6° |
| C18 | N17 | C8 | H32 | 120.0° | 124.0° |
| C18 | N17 | C8 | C7 | 152.6° | 154.4° |
| C18 | N17 | C8 | H5 | 31.1° | 34.4° |
| N17 | C18 | H34 | H35 | 120.0° | 120.1° |
| N17 | C18 | H34 | H36 | 120.0° | 120.0° |
| N17 | C18 | H35 | H36 | 120.0° | 120.0° |
| N10 | C9 | O19 | C8 | 179.6° | 179.9° |
| N10 | C9 | C8 | N17 | 145.0° | 152.4° |
| N10 | C9 | C8 | C7 | 96.8° | 87.6° |
| C9 | N10 | C11 | H4 | 0.4° | 35.0° |
| N10 | C9 | C8 | H5 | 25.0° | 32.4° |
| N13 | C14 | C26 | C32 | 122.2° | 120.0° |
| N13 | C14 | C26 | H2 | 119.3° | 120.0° |
| N13 | C14 | C32 | H2 | 117.2° | 120.0° |
| N13 | C14 | C32 | C34 | 19.7° | 180.0° |
| N13 | C14 | C32 | C33 | 147.9° | 60.0° |
| N13 | C14 | C26 | H11 | 90.1° | 62.6° |
| N13 | C14 | C32 | H12 | 96.3° | 60.0° |
| C14 | N13 | C25 | H19 | 1.8° | 95.5° |
| C14 | N13 | C25 | H20 | 121.8° | 24.6° |
| C14 | N13 | C25 | H21 | 118.2° | 144.5° |
| C26 | C14 | C32 | H2 | 118.7° | 120.0° |
| C26 | C14 | C32 | C34 | 104.4° | 60.0° |
| C26 | C14 | C32 | C33 | 23.9° | 180.0° |
| C26 | C14 | C32 | H12 | 139.6° | 59.9° |
| O19 | C9 | C8 | N17 | 35.4° | 27.6° |
| O19 | C9 | C8 | C7 | 82.8° | 92.4° |
| O19 | C9 | C8 | H5 | 155.4° | 147.6° |
| O19 | C9 | N10 | H31 | 177.6° | 180.0° |
| C9 | C8 | N17 | C7 | 119.1° | 120.0° |
| C9 | C8 | N17 | H5 | 119.3° | 120.0° |
| C9 | C8 | C7 | H5 | 122.0° | 120.0° |
| C9 | C8 | C7 | C15 | 63.4° | 53.1° |
| C9 | C8 | C7 | C16 | 56.5° | 66.9° |
| C9 | C8 | C7 | C5 | 180.0° | 173.1° |
| C8 | C9 | N10 | H31 | 2.8° | 0.0° |
| C9 | C8 | N17 | H32 | 151.8° | 150.4° |
| C14 | C32 | C34 | C33 | 129.9° | 120.0° |
| C14 | C32 | C34 | H12 | 115.7° | 120.0° |
| C14 | C32 | C33 | H12 | 115.6° | 120.1° |
| C32 | C14 | C26 | H11 | 32.1° | 57.4° |
| C14 | C32 | C34 | H13 | 180.0° | 60.0° |
| C14 | C32 | C34 | H14 | 60.0° | 179.9° |
| C14 | C32 | C34 | H15 | 60.0° | 60.0° |
| C14 | C32 | C33 | H16 | 180.0° | 60.0° |
| C14 | C32 | C33 | H17 | 60.0° | 180.0° |
| C14 | C32 | C33 | H18 | 60.0° | 59.9° |
| N17 | C8 | C7 | H5 | 122.3° | 119.9° |
| N17 | C8 | C7 | C15 | 179.2° | 173.2° |
| N17 | C8 | C7 | C16 | 59.3° | 53.1° |
| N17 | C8 | C7 | C5 | 64.2° | 66.9° |
| C8 | N17 | C18 | H34 | 180.0° | 65.4° |
| C8 | N17 | C18 | H35 | 60.0° | 174.5° |
| C8 | N17 | C18 | H36 | 60.0° | 54.5° |
| C8 | C7 | C15 | C16 | 119.4° | 120.0° |
| C8 | C7 | C15 | C5 | 120.0° | 120.0° |
| C8 | C7 | C16 | C5 | 124.2° | 120.0° |
| C8 | C7 | C5 | C4 | 54.3° | 180.0° |
| C8 | C7 | C5 | C6 | 125.0° | 0.0° |
| C7 | C8 | N17 | H32 | 32.6° | 30.4° |
| C8 | C7 | C15 | H37 | 180.0° | 60.0° |
| C8 | C7 | C15 | H38 | 60.0° | 60.0° |
| C8 | C7 | C15 | H39 | 60.0° | 180.0° |
| C8 | C7 | C16 | H40 | 180.0° | 175.5° |
| C8 | C7 | C16 | H41 | 60.0° | 64.4° |
| C8 | C7 | C16 | H42 | 60.0° | 55.5° |
| C34 | C32 | C33 | H12 | 114.5° | 119.9° |
| C34 | C32 | C14 | H2 | 136.9° | 60.0° |
| C32 | C34 | H13 | H14 | 120.0° | 119.9° |
| C32 | C34 | H13 | H15 | 120.0° | 120.0° |
| C32 | C34 | H14 | H15 | 120.0° | 120.0° |
| C34 | C32 | C33 | H16 | 50.2° | 180.0° |
| C34 | C32 | C33 | H17 | 69.9° | 60.0° |
| C34 | C32 | C33 | H18 | 170.2° | 60.1° |
| C33 | C32 | C14 | H2 | 94.9° | 60.0° |
| C33 | C32 | C34 | H13 | 50.1° | 60.0° |
| C33 | C32 | C34 | H14 | 170.1° | 59.9° |
| C33 | C32 | C34 | H15 | 69.9° | 180.0° |
| C32 | C33 | H16 | H17 | 120.0° | 120.1° |
| C32 | C33 | H16 | H18 | 120.0° | 120.0° |
| C32 | C33 | H17 | H18 | 120.0° | 120.1° |
| C15 | C7 | C16 | C5 | 118.2° | 120.0° |
| C15 | C7 | C5 | C4 | 62.3° | 60.0° |
| C15 | C7 | C5 | C6 | 118.3° | 120.0° |
| C15 | C7 | C8 | H5 | 58.5° | 66.9° |
| C7 | C15 | H37 | H38 | 120.0° | 120.0° |
| C7 | C15 | H37 | H39 | 120.0° | 120.0° |
| C7 | C15 | H38 | H39 | 120.0° | 120.1° |
| C15 | C7 | C16 | H40 | 62.4° | 55.5° |
| C15 | C7 | C16 | H41 | 177.6° | 175.5° |
| C15 | C7 | C16 | H42 | 57.6° | 64.5° |
| C16 | C7 | C5 | C4 | 177.3° | 60.0° |
| C16 | C7 | C5 | C6 | 2.1° | 120.0° |
| C16 | C7 | C8 | H5 | 178.4° | 173.1° |
| C16 | C7 | C15 | H37 | 60.6° | 60.0° |
| C16 | C7 | C15 | H38 | 59.4° | 180.0° |
| C16 | C7 | C15 | H39 | 179.4° | 60.0° |
| C7 | C16 | H40 | H41 | 120.0° | 120.0° |
| C7 | C16 | H40 | H42 | 120.0° | 120.0° |
| C7 | C16 | H41 | H42 | 120.0° | 120.0° |
| C7 | C5 | C4 | C6 | 179.4° | 179.9° |
| C7 | C5 | C4 | C3 | 179.0° | 180.0° |
| C7 | C5 | C6 | C1 | 179.3° | 180.0° |
| C7 | C5 | C4 | H1 | 1.0° | 0.3° |
| C7 | C5 | C6 | H3 | 0.7° | 0.0° |
| C5 | C7 | C8 | H5 | 58.1° | 53.1° |
| C5 | C7 | C15 | H37 | 60.0° | 180.0° |
| C5 | C7 | C15 | H38 | 179.9° | 60.0° |
| C5 | C7 | C15 | H39 | 60.0° | 60.0° |
| C5 | C7 | C16 | H40 | 55.8° | 64.5° |
| C5 | C7 | C16 | H41 | 64.3° | 55.6° |
| C5 | C7 | C16 | H42 | 175.8° | 175.5° |
| C5 | C4 | C3 | H1 | 180.0° | 179.7° |
| C5 | C4 | C3 | C2 | 1.6° | 0.1° |
| C4 | C5 | C6 | C1 | 0.0° | 0.1° |
| C4 | C5 | C6 | H3 | 180.0° | 179.9° |
| C5 | C4 | C3 | H6 | 178.4° | 180.0° |
| C3 | C4 | C5 | C6 | 0.4° | 0.1° |
| C4 | C3 | C2 | H6 | 180.0° | 180.0° |
| C4 | C3 | C2 | C1 | 2.5° | 0.1° |
| C4 | C3 | C2 | H43 | 177.5° | 180.0° |
| C5 | C6 | C1 | H3 | 180.0° | 180.0° |
| C5 | C6 | C1 | C2 | 0.9° | 0.1° |
| C6 | C5 | C4 | H1 | 179.6° | 179.7° |
| C5 | C6 | C1 | H44 | 179.1° | 180.0° |
| C3 | C2 | C1 | C6 | 2.1° | 0.1° |
| C3 | C2 | C1 | H43 | 180.0° | 179.9° |
| C2 | C3 | C4 | H1 | 178.4° | 179.7° |
| C3 | C2 | C1 | H44 | 177.9° | 180.0° |
| C6 | C1 | C2 | H44 | 180.0° | 179.9° |
| C6 | C1 | C2 | H43 | 177.9° | 180.0° |
| C2 | C1 | C6 | H3 | 179.1° | 179.9° |
| C1 | C2 | C3 | H6 | 177.5° | 180.0° |
| H1 | C4 | C3 | H6 | 1.6° | 0.3° |
| H2 | C14 | C26 | H11 | 150.6° | 177.4° |
| H2 | C14 | C32 | H12 | 20.9° | 179.9° |
| H3 | C6 | C1 | H44 | 0.9° | 0.0° |
| H4 | C11 | N10 | H31 | 179.6° | 145.0° |
| H5 | C8 | N17 | H32 | 88.9° | 89.6° |
| H6 | C3 | C2 | H43 | 2.5° | 0.0° |
| H8 | C28 | H9 | H10 | 120.0° | 120.0° |
| H12 | C32 | C34 | H13 | 64.3° | 180.0° |
| H12 | C32 | C34 | H14 | 55.7° | 60.1° |
| H12 | C32 | C34 | H15 | 175.7° | 60.0° |
| H12 | C32 | C33 | H16 | 64.4° | 60.1° |
| H12 | C32 | C33 | H17 | 175.6° | 59.9° |
| H12 | C32 | C33 | H18 | 55.6° | 180.0° |
| H13 | C34 | H14 | H15 | 120.0° | 120.1° |
| H16 | C33 | H17 | H18 | 120.0° | 119.9° |
| H19 | C25 | H20 | H21 | 120.0° | 120.0° |
| H22 | C22 | H23 | H24 | 120.0° | 120.0° |
| H25 | C23 | H26 | H27 | 120.0° | 120.0° |
| H28 | C21 | H29 | H30 | 120.0° | 119.9° |
| H32 | N17 | C18 | H34 | 59.9° | 170.6° |
| H32 | N17 | C18 | H35 | 60.0° | 50.5° |
| H32 | N17 | C18 | H36 | 180.0° | 69.5° |
| H34 | C18 | H35 | H36 | 120.0° | 120.0° |
| H37 | C15 | H38 | H39 | 120.0° | 120.0° |
| H40 | C16 | H41 | H42 | 120.0° | 120.0° |
| H43 | C2 | C1 | H44 | 2.1° | 0.1° |
