8N1
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CL1 | C20 | sing | 1.74Å | 1.79Å | |
| O5 | C26 | sing | 1.43Å | 1.43Å | |
| C25 | C26 | sing | 1.54Å | 1.52Å | |
| C25 | O4 | sing | 1.43Å | 1.43Å | |
| C25 | C24 | sing | 1.55Å | 1.52Å | |
| C26 | C27 | sing | 1.55Å | 1.53Å | |
| O6 | C29 | sing | 1.43Å | 1.43Å | |
| N1 | C24 | sing | 1.47Å | 1.46Å | |
| N1 | C21 | sing | 1.40Å | 1.36Å | |
| C20 | C19 | doub | 1.38Å | 1.39Å | Aromatic |
| C20 | C21 | sing | 1.39Å | 1.38Å | Aromatic |
| C29 | C27 | sing | 1.53Å | 1.52Å | |
| C24 | O3 | sing | 1.44Å | 1.43Å | |
| C19 | C18 | sing | 1.38Å | 1.39Å | Aromatic |
| C27 | O3 | sing | 1.44Å | 1.43Å | |
| C21 | C22 | doub | 1.39Å | 1.40Å | Aromatic |
| C18 | C17 | doub | 1.39Å | 1.39Å | Aromatic |
| C22 | C17 | sing | 1.39Å | 1.40Å | Aromatic |
| C17 | N4 | sing | 1.40Å | 1.36Å | |
| N4 | C10 | sing | 1.35Å | 1.34Å | |
| O2 | C10 | doub | 1.22Å | 1.22Å | |
| C10 | N3 | sing | 1.35Å | 1.34Å | |
| N3 | C11 | sing | 1.47Å | 1.46Å | |
| C9 | C7 | sing | 1.51Å | 1.32Å | |
| C13 | C11 | sing | 1.53Å | 1.52Å | |
| C11 | C1 | sing | 1.51Å | 1.50Å | |
| C11 | C12 | sing | 1.53Å | 1.53Å | |
| C6 | C1 | doub | 1.38Å | 1.39Å | Aromatic |
| C6 | C5 | sing | 1.40Å | 1.39Å | Aromatic |
| C7 | C8 | doub | 1.32Å | 1.32Å | |
| C7 | C5 | sing | 1.48Å | 1.50Å | |
| C1 | C2 | sing | 1.38Å | 1.39Å | Aromatic |
| C5 | C4 | doub | 1.40Å | 1.39Å | Aromatic |
| C2 | C3 | doub | 1.38Å | 1.39Å | Aromatic |
| C4 | C3 | sing | 1.38Å | 1.39Å | Aromatic |
| C2 | H1 | sing | 1.08Å | 1.08Å | |
| C3 | H2 | sing | 1.08Å | 1.08Å | |
| C4 | H3 | sing | 1.08Å | 1.08Å | |
| C6 | H4 | sing | 1.08Å | 1.08Å | |
| C8 | H5 | sing | 1.08Å | 1.08Å | |
| C8 | H6 | sing | 1.08Å | 1.08Å | |
| C12 | H7 | sing | 1.09Å | 1.10Å | |
| C12 | H8 | sing | 1.09Å | 1.10Å | |
| C12 | H9 | sing | 1.09Å | 1.10Å | |
| C13 | H10 | sing | 1.09Å | 1.10Å | |
| C13 | H11 | sing | 1.09Å | 1.10Å | |
| C13 | H12 | sing | 1.09Å | 1.10Å | |
| C18 | H13 | sing | 1.08Å | 1.08Å | |
| C19 | H14 | sing | 1.08Å | 1.08Å | |
| C22 | H15 | sing | 1.08Å | 1.08Å | |
| C24 | H16 | sing | 1.09Å | 1.10Å | |
| C25 | H17 | sing | 1.09Å | 1.10Å | |
| C26 | H18 | sing | 1.09Å | 1.10Å | |
| C27 | H19 | sing | 1.09Å | 1.10Å | |
| C29 | H20 | sing | 1.09Å | 1.10Å | |
| C29 | H21 | sing | 1.09Å | 1.10Å | |
| C9 | H22 | sing | 1.09Å | 1.10Å | |
| C9 | H23 | sing | 1.09Å | 1.10Å | |
| C9 | H24 | sing | 1.09Å | 1.10Å | |
| N1 | H25 | sing | 0.97Å | 1.00Å | |
| N3 | H26 | sing | 0.97Å | 1.00Å | |
| N4 | H27 | sing | 0.97Å | 1.00Å | |
| O4 | H28 | sing | 0.97Å | 0.95Å | |
| O5 | H29 | sing | 0.97Å | 0.95Å | |
| O6 | H30 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CL1 | C20 | C19 | 119.9° | 120.0° |
| CL1 | C20 | C21 | 119.7° | 120.0° |
| O5 | C26 | C25 | 110.2° | 110.5° |
| O5 | C26 | C27 | 111.8° | 110.5° |
| O5 | C26 | H18 | 110.8° | 110.6° |
| C26 | O5 | H29 | 109.5° | 114.0° |
| C26 | C25 | O4 | 110.7° | 110.5° |
| C26 | C25 | C24 | 104.6° | 104.0° |
| C25 | C26 | C27 | 104.9° | 104.1° |
| C26 | C25 | H17 | 109.7° | 110.5° |
| C25 | C26 | H18 | 109.5° | 110.5° |
| O4 | C25 | C24 | 111.1° | 110.5° |
| O4 | C25 | H17 | 110.9° | 110.6° |
| C25 | O4 | H28 | 109.5° | 114.0° |
| C25 | C24 | N1 | 104.1° | 110.4° |
| C25 | C24 | O3 | 104.9° | 104.8° |
| C25 | C24 | H16 | 110.1° | 110.3° |
| C24 | C25 | H17 | 109.6° | 110.5° |
| C26 | C27 | C29 | 112.3° | 110.4° |
| C26 | C27 | O3 | 106.7° | 104.8° |
| C27 | C26 | H18 | 109.4° | 110.5° |
| C26 | C27 | H19 | 108.5° | 110.3° |
| O6 | C29 | C27 | 109.5° | 109.5° |
| O6 | C29 | H20 | 109.5° | 109.5° |
| O6 | C29 | H21 | 109.5° | 109.5° |
| C29 | O6 | H30 | 109.5° | 114.0° |
| C24 | N1 | C21 | 123.1° | 120.0° |
| N1 | C24 | O3 | 114.8° | 110.4° |
| N1 | C24 | H16 | 111.0° | 110.3° |
| C24 | N1 | H25 | 106.0° | 120.0° |
| N1 | C21 | C20 | 117.6° | 120.0° |
| N1 | C21 | C22 | 122.4° | 120.0° |
| C21 | N1 | H25 | 106.0° | 120.0° |
| C19 | C20 | C21 | 120.4° | 120.0° |
| C20 | C19 | C18 | 119.7° | 120.1° |
| C20 | C19 | H14 | 120.1° | 119.9° |
| C20 | C21 | C22 | 120.0° | 119.9° |
| C29 | C27 | O3 | 111.0° | 110.4° |
| C29 | C27 | H19 | 108.6° | 110.5° |
| C27 | C29 | H20 | 109.5° | 109.5° |
| C27 | C29 | H21 | 109.5° | 109.5° |
| C24 | O3 | C27 | 107.7° | 105.3° |
| O3 | C24 | H16 | 111.5° | 110.4° |
| C19 | C18 | C17 | 120.8° | 120.1° |
| C19 | C18 | H13 | 119.6° | 120.0° |
| C18 | C19 | H14 | 120.1° | 119.9° |
| O3 | C27 | H19 | 109.8° | 110.4° |
| C21 | C22 | C17 | 119.8° | 119.9° |
| C21 | C22 | H15 | 120.1° | 120.1° |
| C18 | C17 | C22 | 119.4° | 120.0° |
| C18 | C17 | N4 | 115.4° | 120.0° |
| C17 | C18 | H13 | 119.6° | 120.0° |
| C22 | C17 | N4 | 125.2° | 120.0° |
| C17 | C22 | H15 | 120.1° | 120.1° |
| C17 | N4 | C10 | 130.2° | 120.0° |
| C17 | N4 | H27 | 114.9° | 120.0° |
| N4 | C10 | O2 | 122.8° | 120.0° |
| N4 | C10 | N3 | 114.0° | 120.0° |
| C10 | N4 | H27 | 114.9° | 120.0° |
| O2 | C10 | N3 | 123.1° | 120.0° |
| C10 | N3 | C11 | 127.6° | 120.0° |
| C10 | N3 | H26 | 116.2° | 120.0° |
| N3 | C11 | C13 | 112.9° | 109.5° |
| N3 | C11 | C1 | 110.5° | 109.5° |
| N3 | C11 | C12 | 109.5° | 109.5° |
| C11 | N3 | H26 | 116.2° | 120.0° |
| C9 | C7 | C8 | 119.8° | 120.0° |
| C9 | C7 | C5 | 119.9° | 120.0° |
| C7 | C9 | H22 | 109.5° | 109.5° |
| C7 | C9 | H23 | 109.5° | 109.5° |
| C7 | C9 | H24 | 109.5° | 109.5° |
| C13 | C11 | C1 | 109.3° | 109.5° |
| C13 | C11 | C12 | 108.5° | 109.4° |
| C11 | C13 | H10 | 109.5° | 109.4° |
| C11 | C13 | H11 | 109.5° | 109.5° |
| C11 | C13 | H12 | 109.4° | 109.5° |
| C1 | C11 | C12 | 105.9° | 109.5° |
| C11 | C1 | C6 | 119.8° | 120.0° |
| C11 | C1 | C2 | 119.8° | 119.9° |
| C11 | C12 | H7 | 109.5° | 109.5° |
| C11 | C12 | H8 | 109.4° | 109.5° |
| C11 | C12 | H9 | 109.5° | 109.5° |
| C1 | C6 | C5 | 120.0° | 119.9° |
| C6 | C1 | C2 | 120.3° | 120.1° |
| C1 | C6 | H4 | 120.0° | 120.1° |
| C6 | C5 | C7 | 119.8° | 120.2° |
| C6 | C5 | C4 | 119.8° | 119.7° |
| C5 | C6 | H4 | 120.0° | 120.1° |
| C8 | C7 | C5 | 120.3° | 120.0° |
| C7 | C8 | H5 | 120.0° | 120.0° |
| C7 | C8 | H6 | 120.0° | 120.1° |
| C7 | C5 | C4 | 120.4° | 120.1° |
| C1 | C2 | C3 | 119.8° | 120.2° |
| C1 | C2 | H1 | 120.1° | 119.8° |
| C5 | C4 | C3 | 120.2° | 119.8° |
| C5 | C4 | H3 | 119.9° | 120.1° |
| C2 | C3 | C4 | 119.9° | 120.2° |
| C3 | C2 | H1 | 120.1° | 119.9° |
| C2 | C3 | H2 | 120.1° | 119.9° |
| C4 | C3 | H2 | 120.1° | 120.0° |
| C3 | C4 | H3 | 119.9° | 120.1° |
| H5 | C8 | H6 | 120.0° | 119.9° |
| H7 | C12 | H8 | 109.5° | 109.5° |
| H7 | C12 | H9 | 109.4° | 109.5° |
| H8 | C12 | H9 | 109.5° | 109.4° |
| H10 | C13 | H11 | 109.5° | 109.5° |
| H10 | C13 | H12 | 109.5° | 109.5° |
| H11 | C13 | H12 | 109.5° | 109.5° |
| H20 | C29 | H21 | 109.5° | 109.4° |
| H22 | C9 | H23 | 109.5° | 109.4° |
| H22 | C9 | H24 | 109.5° | 109.5° |
| H23 | C9 | H24 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CL1 | C20 | C21 | N1 | 0.2° | 0.0° |
| CL1 | C20 | C19 | C21 | 179.9° | 179.9° |
| CL1 | C20 | C19 | C18 | 179.6° | 180.0° |
| CL1 | C20 | C21 | C22 | 179.8° | 179.8° |
| CL1 | C20 | C19 | H14 | 0.4° | 0.0° |
| O5 | C26 | C25 | C27 | 120.5° | 118.7° |
| O5 | C26 | C25 | H18 | 122.2° | 122.7° |
| O5 | C26 | C25 | O4 | 108.1° | 122.7° |
| O5 | C26 | C25 | C24 | 132.1° | 118.7° |
| O5 | C26 | C27 | H18 | 123.1° | 122.7° |
| O5 | C26 | C27 | C29 | 11.0° | 24.2° |
| O5 | C26 | C27 | O3 | 110.8° | 94.7° |
| O5 | C26 | C25 | H17 | 14.6° | 0.1° |
| O5 | C26 | C27 | H19 | 131.0° | 146.5° |
| C26 | C25 | O4 | C24 | 115.8° | 114.6° |
| C26 | C25 | O4 | H17 | 122.0° | 122.7° |
| C26 | C25 | C24 | H17 | 117.5° | 118.6° |
| C25 | C26 | C27 | H18 | 117.4° | 118.6° |
| C26 | C25 | C24 | N1 | 148.9° | 142.9° |
| C25 | C26 | C27 | C29 | 130.4° | 142.8° |
| C26 | C25 | C24 | O3 | 28.0° | 24.0° |
| C25 | C26 | C27 | O3 | 8.6° | 24.0° |
| C26 | C25 | C24 | H16 | 92.0° | 94.9° |
| C25 | C26 | C27 | H19 | 109.6° | 94.8° |
| C26 | C25 | O4 | H28 | 180.0° | 180.0° |
| C25 | C26 | O5 | H29 | 180.0° | 61.4° |
| O4 | C25 | C24 | H17 | 122.9° | 122.7° |
| O4 | C25 | C26 | C27 | 131.4° | 118.6° |
| O4 | C25 | C24 | N1 | 91.5° | 98.5° |
| O4 | C25 | C24 | O3 | 147.5° | 142.6° |
| O4 | C25 | C24 | H16 | 27.5° | 23.7° |
| O4 | C25 | C26 | H18 | 14.1° | 0.0° |
| C24 | C25 | C26 | C27 | 11.6° | 0.0° |
| C25 | C24 | N1 | O3 | 114.1° | 115.4° |
| C25 | C24 | N1 | H16 | 118.4° | 122.2° |
| C25 | C24 | N1 | C21 | 160.9° | 148.1° |
| C25 | C24 | O3 | H16 | 119.1° | 118.8° |
| C25 | C24 | O3 | C27 | 34.7° | 40.5° |
| C24 | C25 | C26 | H18 | 105.7° | 118.6° |
| C25 | C24 | N1 | H25 | 77.3° | 31.9° |
| C24 | C25 | O4 | H28 | 64.2° | 65.4° |
| C26 | C27 | C29 | O6 | 56.2° | 175.0° |
| C26 | C27 | C29 | O3 | 119.3° | 115.4° |
| C26 | C27 | C29 | H19 | 120.0° | 122.3° |
| C26 | C27 | O3 | C24 | 27.3° | 40.5° |
| C26 | C27 | O3 | H19 | 117.4° | 118.8° |
| C27 | C26 | C25 | H17 | 105.9° | 118.6° |
| C26 | C27 | C29 | H20 | 176.2° | 54.9° |
| C26 | C27 | C29 | H21 | 63.8° | 65.0° |
| C27 | C26 | O5 | H29 | 63.7° | 176.1° |
| O6 | C29 | C27 | H20 | 120.0° | 120.1° |
| O6 | C29 | C27 | H21 | 120.0° | 120.0° |
| O6 | C29 | C27 | O3 | 175.5° | 69.6° |
| O6 | C29 | C27 | H19 | 63.8° | 52.7° |
| O6 | C29 | H20 | H21 | 120.0° | 120.0° |
| C24 | N1 | C21 | H25 | 121.9° | 179.9° |
| C24 | N1 | C21 | C20 | 179.0° | 180.0° |
| N1 | C24 | O3 | H16 | 127.3° | 122.3° |
| N1 | C24 | O3 | C27 | 148.3° | 159.5° |
| C24 | N1 | C21 | C22 | 1.4° | 0.2° |
| N1 | C24 | C25 | H17 | 31.4° | 24.3° |
| N1 | C21 | C20 | C19 | 179.7° | 179.9° |
| N1 | C21 | C20 | C22 | 179.6° | 179.8° |
| C21 | N1 | C24 | O3 | 85.0° | 96.4° |
| N1 | C21 | C22 | C17 | 179.6° | 179.7° |
| N1 | C21 | C22 | H15 | 0.4° | 0.2° |
| C21 | N1 | C24 | H16 | 42.5° | 25.9° |
| C20 | C19 | C18 | H14 | 180.0° | 180.0° |
| C19 | C20 | C21 | C22 | 0.1° | 0.3° |
| C20 | C19 | C18 | C17 | 0.4° | 0.1° |
| C20 | C19 | C18 | H13 | 179.6° | 180.0° |
| C21 | C20 | C19 | C18 | 0.3° | 0.1° |
| C20 | C21 | C22 | C17 | 0.0° | 0.5° |
| C21 | C20 | C19 | H14 | 179.7° | 180.0° |
| C20 | C21 | C22 | H15 | 180.0° | 180.0° |
| C20 | C21 | N1 | H25 | 59.1° | 0.0° |
| C29 | C27 | O3 | C24 | 149.9° | 159.4° |
| C29 | C27 | O3 | H19 | 120.0° | 122.4° |
| C29 | C27 | C26 | H18 | 112.2° | 98.5° |
| C27 | C29 | H20 | H21 | 120.0° | 120.0° |
| C27 | C29 | O6 | H30 | 180.0° | 180.0° |
| O3 | C24 | C25 | H17 | 89.5° | 94.6° |
| C24 | O3 | C27 | H19 | 90.2° | 78.2° |
| O3 | C24 | N1 | H25 | 36.8° | 83.5° |
| C19 | C18 | C17 | H13 | 180.0° | 180.0° |
| C19 | C18 | C17 | C22 | 0.3° | 0.3° |
| C19 | C18 | C17 | N4 | 179.8° | 180.0° |
| C27 | O3 | C24 | H16 | 84.5° | 78.3° |
| O3 | C27 | C26 | H18 | 126.1° | 142.6° |
| O3 | C27 | C29 | H20 | 64.5° | 170.3° |
| O3 | C27 | C29 | H21 | 55.5° | 50.4° |
| C21 | C22 | C17 | C18 | 0.1° | 0.5° |
| C21 | C22 | C17 | H15 | 180.0° | 179.5° |
| C21 | C22 | C17 | N4 | 180.0° | 179.8° |
| C22 | C21 | N1 | H25 | 120.5° | 179.8° |
| C18 | C17 | C22 | N4 | 179.9° | 179.7° |
| C18 | C17 | N4 | C10 | 179.9° | 33.3° |
| C17 | C18 | C19 | H14 | 179.6° | 180.0° |
| C18 | C17 | C22 | H15 | 179.9° | 180.0° |
| C18 | C17 | N4 | H27 | 0.1° | 146.7° |
| C22 | C17 | N4 | C10 | 0.0° | 147.0° |
| C22 | C17 | C18 | H13 | 179.7° | 179.7° |
| C22 | C17 | N4 | H27 | 180.0° | 33.1° |
| C17 | N4 | C10 | H27 | 180.0° | 180.0° |
| C17 | N4 | C10 | O2 | 0.2° | 5.2° |
| C17 | N4 | C10 | N3 | 180.0° | 174.8° |
| N4 | C17 | C18 | H13 | 0.2° | 0.0° |
| N4 | C17 | C22 | H15 | 0.0° | 0.3° |
| N4 | C10 | O2 | N3 | 179.9° | 180.0° |
| N4 | C10 | N3 | C11 | 179.9° | 180.0° |
| N4 | C10 | N3 | H26 | 0.1° | 0.0° |
| O2 | C10 | N3 | C11 | 0.2° | 0.0° |
| O2 | C10 | N3 | H26 | 179.8° | 180.0° |
| O2 | C10 | N4 | H27 | 179.8° | 174.8° |
| C10 | N3 | C11 | H26 | 180.0° | 179.9° |
| C10 | N3 | C11 | C13 | 52.2° | 61.2° |
| C10 | N3 | C11 | C1 | 70.5° | 178.8° |
| C10 | N3 | C11 | C12 | 173.2° | 58.8° |
| N3 | C10 | N4 | H27 | 0.0° | 5.2° |
| N3 | C11 | C13 | C1 | 123.4° | 120.0° |
| N3 | C11 | C13 | C12 | 121.7° | 120.0° |
| N3 | C11 | C1 | C12 | 118.5° | 120.0° |
| N3 | C11 | C1 | C6 | 30.9° | 155.1° |
| N3 | C11 | C1 | C2 | 150.6° | 24.7° |
| N3 | C11 | C12 | H7 | 180.0° | 180.0° |
| N3 | C11 | C12 | H8 | 60.0° | 60.0° |
| N3 | C11 | C12 | H9 | 60.0° | 60.0° |
| N3 | C11 | C13 | H10 | 180.0° | 60.0° |
| N3 | C11 | C13 | H11 | 60.0° | 59.9° |
| N3 | C11 | C13 | H12 | 60.0° | 180.0° |
| C9 | C7 | C5 | C6 | 6.4° | 114.9° |
| C9 | C7 | C8 | C5 | 179.6° | 180.0° |
| C9 | C7 | C5 | C4 | 173.4° | 65.0° |
| C9 | C7 | C8 | H5 | 179.6° | 0.0° |
| C9 | C7 | C8 | H6 | 0.3° | 180.0° |
| C7 | C9 | H22 | H23 | 120.0° | 120.0° |
| C7 | C9 | H22 | H24 | 120.0° | 120.0° |
| C7 | C9 | H23 | H24 | 120.0° | 120.0° |
| C13 | C11 | C1 | C12 | 116.7° | 120.0° |
| C13 | C11 | C1 | C6 | 155.7° | 35.0° |
| C13 | C11 | C1 | C2 | 25.7° | 144.7° |
| C13 | C11 | C12 | H7 | 56.3° | 60.0° |
| C13 | C11 | C12 | H8 | 63.7° | 60.0° |
| C13 | C11 | C12 | H9 | 176.3° | 180.0° |
| C11 | C13 | H10 | H11 | 120.0° | 120.0° |
| C11 | C13 | H10 | H12 | 120.0° | 120.0° |
| C11 | C13 | H11 | H12 | 120.0° | 120.1° |
| C13 | C11 | N3 | H26 | 127.8° | 118.9° |
| C11 | C1 | C6 | C2 | 178.5° | 179.7° |
| C11 | C1 | C6 | C5 | 179.4° | 179.7° |
| C11 | C1 | C2 | C3 | 179.5° | 179.7° |
| C11 | C1 | C2 | H1 | 0.4° | 0.3° |
| C11 | C1 | C6 | H4 | 0.6° | 0.3° |
| C1 | C11 | C12 | H7 | 60.9° | 60.0° |
| C1 | C11 | C12 | H8 | 179.1° | 180.0° |
| C1 | C11 | C12 | H9 | 59.1° | 60.0° |
| C1 | C11 | C13 | H10 | 56.6° | 60.0° |
| C1 | C11 | C13 | H11 | 63.4° | 180.0° |
| C1 | C11 | C13 | H12 | 176.6° | 59.9° |
| C1 | C11 | N3 | H26 | 109.5° | 1.2° |
| C12 | C11 | C1 | C6 | 87.6° | 84.9° |
| C12 | C11 | C1 | C2 | 90.9° | 95.3° |
| C11 | C12 | H7 | H8 | 120.0° | 120.0° |
| C11 | C12 | H7 | H9 | 120.0° | 120.0° |
| C11 | C12 | H8 | H9 | 120.0° | 120.0° |
| C12 | C11 | C13 | H10 | 58.4° | 180.0° |
| C12 | C11 | C13 | H11 | 178.4° | 60.1° |
| C12 | C11 | C13 | H12 | 61.7° | 60.0° |
| C12 | C11 | N3 | H26 | 6.8° | 121.2° |
| C1 | C6 | C5 | H4 | 180.0° | 179.9° |
| C1 | C6 | C5 | C7 | 179.8° | 179.9° |
| C1 | C6 | C5 | C4 | 0.4° | 0.0° |
| C6 | C1 | C2 | C3 | 1.0° | 0.0° |
| C6 | C1 | C2 | H1 | 179.0° | 180.0° |
| C6 | C5 | C7 | C8 | 174.0° | 65.0° |
| C6 | C5 | C7 | C4 | 179.8° | 179.9° |
| C5 | C6 | C1 | C2 | 0.8° | 0.0° |
| C6 | C5 | C4 | C3 | 0.1° | 0.0° |
| C6 | C5 | C4 | H3 | 179.9° | 179.9° |
| C8 | C7 | C5 | C4 | 6.2° | 115.0° |
| C7 | C8 | H5 | H6 | 180.0° | 180.0° |
| C8 | C7 | C9 | H22 | 180.0° | 90.0° |
| C8 | C7 | C9 | H23 | 60.0° | 150.0° |
| C8 | C7 | C9 | H24 | 60.0° | 30.0° |
| C7 | C5 | C4 | C3 | 179.9° | 180.0° |
| C7 | C5 | C4 | H3 | 0.1° | 0.0° |
| C7 | C5 | C6 | H4 | 0.2° | 0.0° |
| C5 | C7 | C8 | H5 | 0.0° | 180.0° |
| C5 | C7 | C8 | H6 | 180.0° | 0.0° |
| C5 | C7 | C9 | H22 | 0.4° | 90.0° |
| C5 | C7 | C9 | H23 | 120.4° | 30.0° |
| C5 | C7 | C9 | H24 | 119.6° | 150.0° |
| C1 | C2 | C3 | H1 | 180.0° | 180.0° |
| C1 | C2 | C3 | C4 | 0.7° | 0.1° |
| C1 | C2 | C3 | H2 | 179.3° | 180.0° |
| C2 | C1 | C6 | H4 | 179.2° | 179.9° |
| C5 | C4 | C3 | C2 | 0.3° | 0.1° |
| C5 | C4 | C3 | H3 | 180.0° | 180.0° |
| C5 | C4 | C3 | H2 | 179.7° | 180.0° |
| C4 | C5 | C6 | H4 | 179.7° | 179.9° |
| C2 | C3 | C4 | H2 | 180.0° | 179.9° |
| C2 | C3 | C4 | H3 | 179.7° | 179.9° |
| C4 | C3 | C2 | H1 | 179.3° | 180.0° |
| H1 | C2 | C3 | H2 | 0.7° | 0.1° |
| H2 | C3 | C4 | H3 | 0.3° | 0.0° |
| H7 | C12 | H8 | H9 | 120.0° | 120.0° |
| H10 | C13 | H11 | H12 | 120.0° | 120.0° |
| H13 | C18 | C19 | H14 | 0.4° | 0.0° |
| H16 | C24 | C25 | H17 | 150.4° | 146.5° |
| H16 | C24 | N1 | H25 | 164.3° | 154.2° |
| H17 | C25 | C26 | H18 | 136.8° | 122.8° |
| H17 | C25 | O4 | H28 | 58.0° | 57.3° |
| H18 | C26 | C27 | H19 | 7.8° | 23.8° |
| H18 | C26 | O5 | H29 | 58.6° | 61.3° |
| H19 | C27 | C29 | H20 | 56.2° | 67.4° |
| H19 | C27 | C29 | H21 | 176.2° | 172.7° |
| H20 | C29 | O6 | H30 | 60.0° | 60.0° |
| H21 | C29 | O6 | H30 | 60.0° | 60.0° |
| H22 | C9 | H23 | H24 | 120.0° | 119.9° |
