NH1
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O4 | C23 | sing | 1.36Å | 1.38Å | |
| O4 | H37 | sing | 0.97Å | 0.96Å | |
| C23 | C20 | doub | 1.39Å | 1.40Å | Aromatic |
| C23 | C25 | sing | 1.39Å | 1.40Å | Aromatic |
| C20 | C17 | sing | 1.38Å | 1.40Å | Aromatic |
| C20 | H35 | sing | 1.08Å | 1.08Å | |
| C17 | C29 | doub | 1.38Å | 1.40Å | Aromatic |
| C17 | H34 | sing | 1.08Å | 1.08Å | |
| C29 | C14 | sing | 1.38Å | 1.40Å | Aromatic |
| C29 | C8 | sing | 1.51Å | 1.48Å | |
| C14 | C25 | doub | 1.38Å | 1.40Å | Aromatic |
| C14 | H33 | sing | 1.08Å | 1.08Å | |
| C25 | H36 | sing | 1.08Å | 1.08Å | |
| C8 | C7 | sing | 1.53Å | 1.54Å | |
| C8 | H6 | sing | 1.09Å | 1.09Å | |
| C8 | H7 | sing | 1.09Å | 1.09Å | |
| C7 | C3 | sing | 1.53Å | 1.56Å | |
| C7 | H4 | sing | 1.09Å | 1.09Å | |
| C7 | H5 | sing | 1.09Å | 1.09Å | |
| C3 | O2 | sing | 1.43Å | 1.47Å | |
| C3 | C4 | sing | 1.53Å | 1.56Å | |
| C3 | C22 | sing | 1.53Å | 1.56Å | |
| O2 | C1 | sing | 1.35Å | 1.36Å | |
| C1 | O1 | doub | 1.22Å | 1.24Å | |
| C1 | C6 | sing | 1.47Å | 1.50Å | |
| C6 | S1 | sing | 1.76Å | 1.77Å | |
| C6 | C5 | doub | 1.35Å | 1.35Å | |
| S1 | C21 | sing | 1.76Å | 1.77Å | |
| C21 | C24 | doub | 1.39Å | 1.39Å | Aromatic |
| C21 | C18 | sing | 1.39Å | 1.42Å | Aromatic |
| C24 | C12 | sing | 1.38Å | 1.39Å | Aromatic |
| C24 | H9 | sing | 1.08Å | 1.08Å | |
| C12 | C2 | doub | 1.39Å | 1.40Å | Aromatic |
| C12 | C11 | sing | 1.51Å | 1.46Å | |
| C2 | N1 | sing | 1.40Å | 1.33Å | |
| C2 | C15 | sing | 1.39Å | 1.39Å | Aromatic |
| N1 | H13 | sing | 0.97Å | 0.99Å | |
| N1 | H14 | sing | 0.97Å | 0.98Å | |
| C15 | C18 | doub | 1.38Å | 1.40Å | Aromatic |
| C15 | H8 | sing | 1.08Å | 1.08Å | |
| C18 | C26 | sing | 1.51Å | 1.49Å | |
| C26 | C10 | sing | 1.53Å | 1.54Å | |
| C26 | C27 | sing | 1.53Å | 1.54Å | |
| C26 | C9 | sing | 1.53Å | 1.53Å | |
| C10 | H15 | sing | 1.09Å | 1.09Å | |
| C10 | H16 | sing | 1.09Å | 1.09Å | |
| C10 | H17 | sing | 1.09Å | 1.09Å | |
| C27 | H18 | sing | 1.09Å | 1.09Å | |
| C27 | H19 | sing | 1.09Å | 1.09Å | |
| C27 | H20 | sing | 1.09Å | 1.09Å | |
| C9 | H21 | sing | 1.09Å | 1.09Å | |
| C9 | H22 | sing | 1.09Å | 1.09Å | |
| C9 | H23 | sing | 1.09Å | 1.09Å | |
| C11 | H10 | sing | 1.09Å | 1.09Å | |
| C11 | H11 | sing | 1.09Å | 1.09Å | |
| C11 | H12 | sing | 1.09Å | 1.09Å | |
| C5 | O3 | sing | 1.35Å | 1.34Å | |
| C5 | C4 | sing | 1.51Å | 1.52Å | |
| O3 | H3 | sing | 0.97Å | 0.97Å | |
| C4 | H1 | sing | 1.09Å | 1.09Å | |
| C4 | H2 | sing | 1.09Å | 1.09Å | |
| C22 | C13 | sing | 1.55Å | 1.54Å | |
| C22 | C19 | sing | 1.55Å | 1.55Å | |
| C22 | H32 | sing | 1.09Å | 1.09Å | |
| C13 | C28 | sing | 1.54Å | 1.54Å | |
| C13 | H24 | sing | 1.09Å | 1.09Å | |
| C13 | H25 | sing | 1.09Å | 1.09Å | |
| C28 | C16 | sing | 1.54Å | 1.56Å | |
| C28 | H26 | sing | 1.09Å | 1.09Å | |
| C28 | H27 | sing | 1.09Å | 1.09Å | |
| C16 | C19 | sing | 1.54Å | 1.53Å | |
| C16 | H28 | sing | 1.09Å | 1.09Å | |
| C16 | H29 | sing | 1.09Å | 1.09Å | |
| C19 | H30 | sing | 1.09Å | 1.09Å | |
| C19 | H31 | sing | 1.09Å | 1.09Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C23 | O4 | H37 | 109.0° | 106.8° |
| O4 | C23 | C20 | 119.8° | 120.1° |
| O4 | C23 | C25 | 119.8° | 120.0° |
| C20 | C23 | C25 | 120.4° | 119.9° |
| C23 | C20 | C17 | 119.9° | 120.0° |
| C23 | C20 | H35 | 120.1° | 120.0° |
| C23 | C25 | C14 | 119.5° | 119.9° |
| C23 | C25 | H36 | 120.3° | 120.1° |
| C17 | C20 | H35 | 120.0° | 120.0° |
| C20 | C17 | C29 | 120.0° | 120.1° |
| C20 | C17 | H34 | 119.8° | 120.0° |
| C29 | C17 | H34 | 120.1° | 119.9° |
| C17 | C29 | C14 | 119.6° | 120.1° |
| C17 | C29 | C8 | 120.0° | 120.0° |
| C14 | C29 | C8 | 120.4° | 119.9° |
| C29 | C14 | C25 | 120.5° | 120.0° |
| C29 | C14 | H33 | 119.8° | 120.0° |
| C29 | C8 | C7 | 113.2° | 109.5° |
| C29 | C8 | H6 | 108.7° | 109.5° |
| C29 | C8 | H7 | 108.5° | 109.5° |
| C25 | C14 | H33 | 119.7° | 120.0° |
| C14 | C25 | H36 | 120.1° | 120.0° |
| C7 | C8 | H6 | 109.1° | 109.5° |
| C7 | C8 | H7 | 108.5° | 109.4° |
| C8 | C7 | C3 | 113.6° | 109.5° |
| C8 | C7 | H4 | 108.5° | 109.5° |
| C8 | C7 | H5 | 109.2° | 109.4° |
| H6 | C8 | H7 | 108.7° | 109.4° |
| C3 | C7 | H4 | 108.4° | 109.5° |
| C3 | C7 | H5 | 108.8° | 109.4° |
| C7 | C3 | O2 | 105.8° | 109.5° |
| C7 | C3 | C4 | 114.0° | 109.4° |
| C7 | C3 | C22 | 112.2° | 109.5° |
| H4 | C7 | H5 | 108.2° | 109.4° |
| O2 | C3 | C4 | 108.2° | 109.5° |
| O2 | C3 | C22 | 108.5° | 109.5° |
| C3 | O2 | C1 | 118.9° | 106.4° |
| C4 | C3 | C22 | 107.9° | 109.4° |
| C3 | C4 | C5 | 105.7° | 109.4° |
| C3 | C4 | H1 | 110.1° | 109.5° |
| C3 | C4 | H2 | 110.3° | 109.5° |
| C3 | C22 | C13 | 115.9° | 110.7° |
| C3 | C22 | C19 | 113.3° | 110.8° |
| C3 | C22 | H32 | 107.0° | 110.8° |
| O2 | C1 | O1 | 123.5° | 120.4° |
| O2 | C1 | C6 | 117.3° | 119.1° |
| O1 | C1 | C6 | 119.2° | 120.5° |
| C1 | C6 | S1 | 120.7° | 120.5° |
| C1 | C6 | C5 | 119.7° | 119.0° |
| S1 | C6 | C5 | 119.6° | 120.5° |
| C6 | S1 | C21 | 105.3° | 100.0° |
| C6 | C5 | O3 | 119.4° | 120.4° |
| C6 | C5 | C4 | 121.6° | 119.3° |
| S1 | C21 | C24 | 115.7° | 120.0° |
| S1 | C21 | C18 | 123.9° | 120.0° |
| C24 | C21 | C18 | 120.3° | 120.0° |
| C21 | C24 | C12 | 120.5° | 120.0° |
| C21 | C24 | H9 | 119.9° | 120.0° |
| C21 | C18 | C15 | 118.2° | 120.0° |
| C21 | C18 | C26 | 123.0° | 120.0° |
| C12 | C24 | H9 | 119.6° | 120.1° |
| C24 | C12 | C2 | 120.0° | 120.0° |
| C24 | C12 | C11 | 119.2° | 120.0° |
| C2 | C12 | C11 | 120.6° | 120.0° |
| C12 | C2 | N1 | 120.4° | 120.0° |
| C12 | C2 | C15 | 119.9° | 120.0° |
| C12 | C11 | H10 | 109.1° | 109.5° |
| C12 | C11 | H11 | 108.7° | 109.5° |
| C12 | C11 | H12 | 109.2° | 109.5° |
| N1 | C2 | C15 | 119.7° | 120.0° |
| C2 | N1 | H13 | 120.7° | 120.0° |
| C2 | N1 | H14 | 120.3° | 120.0° |
| C2 | C15 | C18 | 121.1° | 120.0° |
| C2 | C15 | H8 | 119.1° | 120.0° |
| H13 | N1 | H14 | 118.3° | 120.0° |
| C18 | C15 | H8 | 119.8° | 120.0° |
| C15 | C18 | C26 | 118.8° | 120.0° |
| C18 | C26 | C10 | 110.0° | 109.5° |
| C18 | C26 | C27 | 110.9° | 109.5° |
| C18 | C26 | C9 | 111.6° | 109.4° |
| C10 | C26 | C27 | 107.6° | 109.5° |
| C10 | C26 | C9 | 108.7° | 109.5° |
| C26 | C10 | H15 | 108.9° | 109.5° |
| C26 | C10 | H16 | 109.2° | 109.4° |
| C26 | C10 | H17 | 109.5° | 109.5° |
| C27 | C26 | C9 | 107.8° | 109.5° |
| C26 | C27 | H18 | 108.9° | 109.4° |
| C26 | C27 | H19 | 109.7° | 109.4° |
| C26 | C27 | H20 | 109.9° | 109.5° |
| C26 | C9 | H21 | 109.2° | 109.5° |
| C26 | C9 | H22 | 109.8° | 109.4° |
| C26 | C9 | H23 | 109.1° | 109.5° |
| H15 | C10 | H16 | 109.7° | 109.5° |
| H15 | C10 | H17 | 109.5° | 109.5° |
| H16 | C10 | H17 | 110.0° | 109.4° |
| H18 | C27 | H19 | 109.5° | 109.5° |
| H18 | C27 | H20 | 109.2° | 109.5° |
| H19 | C27 | H20 | 109.5° | 109.5° |
| H21 | C9 | H22 | 109.1° | 109.5° |
| H21 | C9 | H23 | 109.5° | 109.5° |
| H22 | C9 | H23 | 110.0° | 109.5° |
| H10 | C11 | H11 | 110.2° | 109.5° |
| H10 | C11 | H12 | 109.7° | 109.4° |
| H11 | C11 | H12 | 109.9° | 109.5° |
| O3 | C5 | C4 | 118.1° | 120.3° |
| C5 | O3 | H3 | 108.2° | 106.8° |
| C5 | C4 | H1 | 109.7° | 109.5° |
| C5 | C4 | H2 | 111.4° | 109.4° |
| H1 | C4 | H2 | 109.6° | 109.5° |
| C13 | C22 | C19 | 106.4° | 102.7° |
| C13 | C22 | H32 | 107.0° | 110.8° |
| C22 | C13 | C28 | 105.6° | 104.2° |
| C22 | C13 | H24 | 110.7° | 110.5° |
| C22 | C13 | H25 | 110.3° | 110.4° |
| C19 | C22 | H32 | 106.9° | 110.9° |
| C22 | C19 | C16 | 105.9° | 104.3° |
| C22 | C19 | H30 | 110.3° | 110.5° |
| C22 | C19 | H31 | 110.2° | 110.5° |
| C28 | C13 | H24 | 110.6° | 110.5° |
| C28 | C13 | H25 | 110.0° | 110.5° |
| C13 | C28 | C16 | 107.8° | 106.6° |
| C13 | C28 | H26 | 109.6° | 110.0° |
| C13 | C28 | H27 | 110.3° | 110.0° |
| H24 | C13 | H25 | 109.6° | 110.6° |
| C16 | C28 | H26 | 109.5° | 110.0° |
| C16 | C28 | H27 | 110.0° | 110.0° |
| C28 | C16 | C19 | 106.8° | 106.6° |
| C28 | C16 | H28 | 109.8° | 110.0° |
| C28 | C16 | H29 | 110.6° | 110.0° |
| H26 | C28 | H27 | 109.6° | 110.1° |
| C19 | C16 | H28 | 109.4° | 110.1° |
| C19 | C16 | H29 | 110.6° | 110.1° |
| C16 | C19 | H30 | 110.3° | 110.5° |
| C16 | C19 | H31 | 110.4° | 110.4° |
| H28 | C16 | H29 | 109.5° | 110.1° |
| H30 | C19 | H31 | 109.7° | 110.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O4 | C23 | C20 | C25 | 177.9° | 180.0° |
| O4 | C23 | C20 | C17 | 178.0° | 180.0° |
| O4 | C23 | C20 | H35 | 0.1° | 0.1° |
| O4 | C23 | C25 | C14 | 177.9° | 179.7° |
| O4 | C23 | C25 | H36 | 1.2° | 0.0° |
| H37 | O4 | C23 | C20 | 174.0° | 90.0° |
| H37 | O4 | C23 | C25 | 3.9° | 90.0° |
| C23 | C20 | C17 | H35 | 178.0° | 179.9° |
| C23 | C20 | C17 | C29 | 0.1° | 0.0° |
| C23 | C20 | C17 | H34 | 177.1° | 179.9° |
| C20 | C23 | C25 | C14 | 0.0° | 0.2° |
| C20 | C23 | C25 | H36 | 176.7° | 180.0° |
| C25 | C23 | C20 | C17 | 0.0° | 0.0° |
| C25 | C23 | C20 | H35 | 178.0° | 180.0° |
| C23 | C25 | C14 | C29 | 0.1° | 0.5° |
| C23 | C25 | C14 | H36 | 176.7° | 179.8° |
| C23 | C25 | C14 | H33 | 178.3° | 180.0° |
| C20 | C17 | C29 | H34 | 177.2° | 179.9° |
| C20 | C17 | C29 | C14 | 0.2° | 0.3° |
| C20 | C17 | C29 | C8 | 179.8° | 180.0° |
| H35 | C20 | C17 | C29 | 177.9° | 179.9° |
| H35 | C20 | C17 | H34 | 4.9° | 0.0° |
| C17 | C29 | C14 | C8 | 179.6° | 179.7° |
| C17 | C29 | C14 | C25 | 0.2° | 0.6° |
| C17 | C29 | C14 | H33 | 178.2° | 179.9° |
| C17 | C29 | C8 | C7 | 98.4° | 90.1° |
| C17 | C29 | C8 | H6 | 140.2° | 30.0° |
| C17 | C29 | C8 | H7 | 22.1° | 149.9° |
| H34 | C17 | C29 | C14 | 177.0° | 179.8° |
| H34 | C17 | C29 | C8 | 2.6° | 0.1° |
| C29 | C14 | C25 | H33 | 178.4° | 179.5° |
| C29 | C14 | C25 | H36 | 176.6° | 179.7° |
| C14 | C29 | C8 | C7 | 81.2° | 90.2° |
| C14 | C29 | C8 | H6 | 40.3° | 149.7° |
| C14 | C29 | C8 | H7 | 158.3° | 29.7° |
| C8 | C29 | C14 | C25 | 179.8° | 179.8° |
| C8 | C29 | C14 | H33 | 1.4° | 0.2° |
| C29 | C8 | C7 | H6 | 121.2° | 120.0° |
| C29 | C8 | C7 | H7 | 120.5° | 120.0° |
| C29 | C8 | H6 | H7 | 118.0° | 120.0° |
| C29 | C8 | C7 | C3 | 168.0° | 179.9° |
| C29 | C8 | C7 | H4 | 71.3° | 59.9° |
| C29 | C8 | C7 | H5 | 46.4° | 60.0° |
| H33 | C14 | C25 | H36 | 5.0° | 0.2° |
| C7 | C8 | H6 | H7 | 118.2° | 119.9° |
| C8 | C7 | C3 | H4 | 120.7° | 120.1° |
| C8 | C7 | C3 | H5 | 121.9° | 119.9° |
| C8 | C7 | H4 | H5 | 118.4° | 119.9° |
| C8 | C7 | C3 | O2 | 178.8° | 59.9° |
| C8 | C7 | C3 | C4 | 62.4° | 60.1° |
| C8 | C7 | C3 | C22 | 60.7° | 180.0° |
| H6 | C8 | C7 | C3 | 46.9° | 59.9° |
| H6 | C8 | C7 | H4 | 167.5° | 180.0° |
| H6 | C8 | C7 | H5 | 74.7° | 60.0° |
| H7 | C8 | C7 | C3 | 71.4° | 60.1° |
| H7 | C8 | C7 | H4 | 49.2° | 60.1° |
| H7 | C8 | C7 | H5 | 167.0° | 180.0° |
| C3 | C7 | H4 | H5 | 117.8° | 119.9° |
| C7 | C3 | O2 | C4 | 122.6° | 120.0° |
| C7 | C3 | O2 | C22 | 120.6° | 120.1° |
| C7 | C3 | C4 | C22 | 125.4° | 120.0° |
| C7 | C3 | O2 | C1 | 69.2° | 170.5° |
| C7 | C3 | C4 | C5 | 59.5° | 173.4° |
| C7 | C3 | C4 | H1 | 177.9° | 53.4° |
| C7 | C3 | C4 | H2 | 61.1° | 66.7° |
| C7 | C3 | C22 | C13 | 47.2° | 58.3° |
| C7 | C3 | C22 | C19 | 170.5° | 55.0° |
| C7 | C3 | C22 | H32 | 72.0° | 178.5° |
| H4 | C7 | C3 | O2 | 60.5° | 180.0° |
| H4 | C7 | C3 | C4 | 58.3° | 60.0° |
| H4 | C7 | C3 | C22 | 178.6° | 59.9° |
| H5 | C7 | C3 | O2 | 56.9° | 60.1° |
| H5 | C7 | C3 | C4 | 175.7° | 179.9° |
| H5 | C7 | C3 | C22 | 61.2° | 60.0° |
| O2 | C3 | C4 | C22 | 117.2° | 120.0° |
| C3 | O2 | C1 | O1 | 158.7° | 129.1° |
| C3 | O2 | C1 | C6 | 20.4° | 51.3° |
| O2 | C3 | C4 | C5 | 57.9° | 53.3° |
| O2 | C3 | C4 | H1 | 60.5° | 66.6° |
| O2 | C3 | C4 | H2 | 178.5° | 173.3° |
| O2 | C3 | C22 | C13 | 69.2° | 61.8° |
| O2 | C3 | C22 | C19 | 54.1° | 175.1° |
| O2 | C3 | C22 | H32 | 171.6° | 61.4° |
| C4 | C3 | O2 | C1 | 53.4° | 69.6° |
| C3 | C4 | C5 | C6 | 37.6° | 18.4° |
| C3 | C4 | C5 | O3 | 153.4° | 161.6° |
| C3 | C4 | C5 | H1 | 118.7° | 120.0° |
| C3 | C4 | C5 | H2 | 119.9° | 119.9° |
| C3 | C4 | H1 | H2 | 121.5° | 120.1° |
| C4 | C3 | C22 | C13 | 173.7° | 178.2° |
| C4 | C3 | C22 | C19 | 63.0° | 64.9° |
| C4 | C3 | C22 | H32 | 54.5° | 58.5° |
| C22 | C3 | O2 | C1 | 170.2° | 50.3° |
| C22 | C3 | C4 | C5 | 175.1° | 66.6° |
| C22 | C3 | C4 | H1 | 56.7° | 173.4° |
| C22 | C3 | C4 | H2 | 64.3° | 53.3° |
| C3 | C22 | C13 | C19 | 126.9° | 118.3° |
| C3 | C22 | C13 | H32 | 119.2° | 123.2° |
| C3 | C22 | C19 | H32 | 117.5° | 123.4° |
| C3 | C22 | C13 | C28 | 152.2° | 156.3° |
| C3 | C22 | C13 | H24 | 32.5° | 37.6° |
| C3 | C22 | C13 | H25 | 89.0° | 85.1° |
| C3 | C22 | C19 | C16 | 156.2° | 156.2° |
| C3 | C22 | C19 | H30 | 84.5° | 37.5° |
| C3 | C22 | C19 | H31 | 36.8° | 85.2° |
| O2 | C1 | O1 | C6 | 179.0° | 179.6° |
| O2 | C1 | C6 | S1 | 174.7° | 163.3° |
| O2 | C1 | C6 | C5 | 5.4° | 16.9° |
| O1 | C1 | C6 | S1 | 4.3° | 16.3° |
| O1 | C1 | C6 | C5 | 175.5° | 163.5° |
| C1 | C6 | S1 | C5 | 179.9° | 179.8° |
| C1 | C6 | S1 | C21 | 99.6° | 67.2° |
| C1 | C6 | C5 | O3 | 175.0° | 180.0° |
| C1 | C6 | C5 | C4 | 6.0° | 0.0° |
| C6 | S1 | C21 | C24 | 34.8° | 6.4° |
| C6 | S1 | C21 | C18 | 144.7° | 173.7° |
| S1 | C6 | C5 | O3 | 4.9° | 0.2° |
| S1 | C6 | C5 | C4 | 173.8° | 179.8° |
| C5 | C6 | S1 | C21 | 80.2° | 113.0° |
| C6 | C5 | O3 | C4 | 169.3° | 180.0° |
| C6 | C5 | O3 | H3 | 9.5° | 5.0° |
| C6 | C5 | C4 | H1 | 81.1° | 101.6° |
| C6 | C5 | C4 | H2 | 157.4° | 138.3° |
| S1 | C21 | C24 | C18 | 179.5° | 179.9° |
| S1 | C21 | C24 | C12 | 178.6° | 179.9° |
| S1 | C21 | C24 | H9 | 0.4° | 0.1° |
| S1 | C21 | C18 | C15 | 178.3° | 180.0° |
| S1 | C21 | C18 | C26 | 2.5° | 0.1° |
| C21 | C24 | C12 | H9 | 178.2° | 180.0° |
| C21 | C24 | C12 | C2 | 1.4° | 0.2° |
| C21 | C24 | C12 | C11 | 176.8° | 180.0° |
| C24 | C21 | C18 | C15 | 2.2° | 0.1° |
| C24 | C21 | C18 | C26 | 177.0° | 180.0° |
| C18 | C21 | C24 | C12 | 1.9° | 0.0° |
| C18 | C21 | C24 | H9 | 179.9° | 180.0° |
| C21 | C18 | C15 | C2 | 2.2° | 0.3° |
| C21 | C18 | C15 | C26 | 179.3° | 179.9° |
| C21 | C18 | C15 | H8 | 179.3° | 179.9° |
| C21 | C18 | C26 | C10 | 61.5° | 179.9° |
| C21 | C18 | C26 | C27 | 179.6° | 59.9° |
| C21 | C18 | C26 | C9 | 59.3° | 60.1° |
| C24 | C12 | C2 | C11 | 175.3° | 179.8° |
| C24 | C12 | C2 | N1 | 178.8° | 180.0° |
| C24 | C12 | C2 | C15 | 1.3° | 0.4° |
| C24 | C12 | C11 | H10 | 4.2° | 89.9° |
| C24 | C12 | C11 | H11 | 124.4° | 150.1° |
| C24 | C12 | C11 | H12 | 115.7° | 30.1° |
| H9 | C24 | C12 | C2 | 179.6° | 179.8° |
| H9 | C24 | C12 | C11 | 5.1° | 0.0° |
| C12 | C2 | N1 | C15 | 177.5° | 179.6° |
| C12 | C2 | N1 | H13 | 179.9° | 179.5° |
| C12 | C2 | N1 | H14 | 9.9° | 0.5° |
| C12 | C2 | C15 | C18 | 1.8° | 0.5° |
| C12 | C2 | C15 | H8 | 179.7° | 179.7° |
| C2 | C12 | C11 | H10 | 179.5° | 90.3° |
| C2 | C12 | C11 | H11 | 60.3° | 29.7° |
| C2 | C12 | C11 | H12 | 59.6° | 149.8° |
| C11 | C12 | C2 | N1 | 5.9° | 0.2° |
| C11 | C12 | C2 | C15 | 176.6° | 179.8° |
| C12 | C11 | H10 | H11 | 119.3° | 120.0° |
| C12 | C11 | H10 | H12 | 119.6° | 120.0° |
| C12 | C11 | H11 | H12 | 119.5° | 120.0° |
| C2 | N1 | H13 | H14 | 170.3° | 180.0° |
| N1 | C2 | C15 | C18 | 179.3° | 180.0° |
| N1 | C2 | C15 | H8 | 2.2° | 0.2° |
| C15 | C2 | N1 | H13 | 2.4° | 0.0° |
| C15 | C2 | N1 | H14 | 167.6° | 180.0° |
| C2 | C15 | C18 | H8 | 178.5° | 179.8° |
| C2 | C15 | C18 | C26 | 177.1° | 179.8° |
| C15 | C18 | C26 | C10 | 117.8° | 0.0° |
| C15 | C18 | C26 | C27 | 1.1° | 120.0° |
| C15 | C18 | C26 | C9 | 121.4° | 120.0° |
| H8 | C15 | C18 | C26 | 1.4° | 0.0° |
| C18 | C26 | C10 | C27 | 120.9° | 120.1° |
| C18 | C26 | C10 | C9 | 122.5° | 120.0° |
| C18 | C26 | C27 | C9 | 122.5° | 120.0° |
| C18 | C26 | C10 | H15 | 166.2° | 180.0° |
| C18 | C26 | C10 | H16 | 74.0° | 59.9° |
| C18 | C26 | C10 | H17 | 46.5° | 60.0° |
| C18 | C26 | C27 | H18 | 177.5° | 60.0° |
| C18 | C26 | C27 | H19 | 62.6° | 60.0° |
| C18 | C26 | C27 | H20 | 57.9° | 180.0° |
| C18 | C26 | C9 | H21 | 164.3° | 60.0° |
| C18 | C26 | C9 | H22 | 44.7° | 180.0° |
| C18 | C26 | C9 | H23 | 75.9° | 60.0° |
| C10 | C26 | C27 | C9 | 117.1° | 120.0° |
| C26 | C10 | H15 | H16 | 119.5° | 120.0° |
| C26 | C10 | H15 | H17 | 119.7° | 120.0° |
| C26 | C10 | H16 | H17 | 120.3° | 119.9° |
| C10 | C26 | C27 | H18 | 62.1° | 60.0° |
| C10 | C26 | C27 | H19 | 57.8° | 180.0° |
| C10 | C26 | C27 | H20 | 178.3° | 60.0° |
| C10 | C26 | C9 | H21 | 74.1° | 60.0° |
| C10 | C26 | C9 | H22 | 166.3° | 60.0° |
| C10 | C26 | C9 | H23 | 45.6° | 179.9° |
| C27 | C26 | C10 | H15 | 45.3° | 60.0° |
| C27 | C26 | C10 | H16 | 165.1° | 180.0° |
| C27 | C26 | C10 | H17 | 74.4° | 60.1° |
| C26 | C27 | H18 | H19 | 120.0° | 119.9° |
| C26 | C27 | H18 | H20 | 120.0° | 120.0° |
| C26 | C27 | H19 | H20 | 120.7° | 120.0° |
| C27 | C26 | C9 | H21 | 42.3° | 180.0° |
| C27 | C26 | C9 | H22 | 77.3° | 60.0° |
| C27 | C26 | C9 | H23 | 162.1° | 60.0° |
| C9 | C26 | C10 | H15 | 71.3° | 60.0° |
| C9 | C26 | C10 | H16 | 48.5° | 60.0° |
| C9 | C26 | C10 | H17 | 169.0° | 180.0° |
| C9 | C26 | C27 | H18 | 55.0° | 180.0° |
| C9 | C26 | C27 | H19 | 174.9° | 60.0° |
| C9 | C26 | C27 | H20 | 64.6° | 60.0° |
| C26 | C9 | H21 | H22 | 120.1° | 120.0° |
| C26 | C9 | H21 | H23 | 119.5° | 120.0° |
| C26 | C9 | H22 | H23 | 120.1° | 120.0° |
| H15 | C10 | H16 | H17 | 120.4° | 120.0° |
| H18 | C27 | H19 | H20 | 119.8° | 120.0° |
| H21 | C9 | H22 | H23 | 120.2° | 120.0° |
| H10 | C11 | H11 | H12 | 121.0° | 119.9° |
| O3 | C5 | C4 | H1 | 87.9° | 78.4° |
| O3 | C5 | C4 | H2 | 33.5° | 41.6° |
| C4 | C5 | O3 | H3 | 178.8° | 175.0° |
| C5 | C4 | H1 | H2 | 122.5° | 120.0° |
| C13 | C22 | C19 | H32 | 114.1° | 118.4° |
| C22 | C13 | C28 | H24 | 119.8° | 118.7° |
| C22 | C13 | C28 | H25 | 119.0° | 118.6° |
| C22 | C13 | H24 | H25 | 121.9° | 122.6° |
| C22 | C13 | C28 | C16 | 13.4° | 23.6° |
| C22 | C13 | C28 | H26 | 105.7° | 142.9° |
| C22 | C13 | C28 | H27 | 133.5° | 95.7° |
| C13 | C22 | C19 | C16 | 27.8° | 38.0° |
| C13 | C22 | C19 | H30 | 147.1° | 80.7° |
| C13 | C22 | C19 | H31 | 91.6° | 156.6° |
| C19 | C22 | C13 | C28 | 25.3° | 38.0° |
| C19 | C22 | C13 | H24 | 94.4° | 80.7° |
| C19 | C22 | C13 | H25 | 144.1° | 156.6° |
| C22 | C19 | C16 | C28 | 19.2° | 23.7° |
| C22 | C19 | C16 | H30 | 119.3° | 118.7° |
| C22 | C19 | C16 | H31 | 119.3° | 118.6° |
| C22 | C19 | C16 | H28 | 99.7° | 142.9° |
| C22 | C19 | C16 | H29 | 139.6° | 95.6° |
| C22 | C19 | H30 | H31 | 121.6° | 122.6° |
| H32 | C22 | C13 | C28 | 88.6° | 80.5° |
| H32 | C22 | C13 | H24 | 151.7° | 160.8° |
| H32 | C22 | C13 | H25 | 30.2° | 38.2° |
| H32 | C22 | C19 | C16 | 86.3° | 80.4° |
| H32 | C22 | C19 | H30 | 33.1° | 160.9° |
| H32 | C22 | C19 | H31 | 154.3° | 38.2° |
| C28 | C13 | H24 | H25 | 121.5° | 122.6° |
| C13 | C28 | C16 | H26 | 119.1° | 119.3° |
| C13 | C28 | C16 | H27 | 120.3° | 119.3° |
| C13 | C28 | H26 | H27 | 121.2° | 121.4° |
| C13 | C28 | C16 | C19 | 3.6° | 0.0° |
| C13 | C28 | C16 | H28 | 114.9° | 119.3° |
| C13 | C28 | C16 | H29 | 124.1° | 119.3° |
| H24 | C13 | C28 | C16 | 106.4° | 95.1° |
| H24 | C13 | C28 | H26 | 134.5° | 24.2° |
| H24 | C13 | C28 | H27 | 13.8° | 145.6° |
| H25 | C13 | C28 | C16 | 132.4° | 142.2° |
| H25 | C13 | C28 | H26 | 13.3° | 98.5° |
| H25 | C13 | C28 | H27 | 107.5° | 23.0° |
| C16 | C28 | H26 | H27 | 120.8° | 121.4° |
| C28 | C16 | C19 | H28 | 118.9° | 119.2° |
| C28 | C16 | C19 | H29 | 120.4° | 119.2° |
| C28 | C16 | H28 | H29 | 121.6° | 121.4° |
| C28 | C16 | C19 | H30 | 138.5° | 95.1° |
| C28 | C16 | C19 | H31 | 100.1° | 142.3° |
| H26 | C28 | C16 | C19 | 122.8° | 119.3° |
| H26 | C28 | C16 | H28 | 4.2° | 0.0° |
| H26 | C28 | C16 | H29 | 116.8° | 121.5° |
| H27 | C28 | C16 | C19 | 116.7° | 119.3° |
| H27 | C28 | C16 | H28 | 124.7° | 121.5° |
| H27 | C28 | C16 | H29 | 3.8° | 0.0° |
| C19 | C16 | H28 | H29 | 121.4° | 121.5° |
| C16 | C19 | H30 | H31 | 121.8° | 122.5° |
| H28 | C16 | C19 | H30 | 19.7° | 24.1° |
| H28 | C16 | C19 | H31 | 141.0° | 98.5° |
| H29 | C16 | C19 | H30 | 101.1° | 145.7° |
| H29 | C16 | C19 | H31 | 20.3° | 23.1° |
