8LA
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O6 | C29 | sing | 1.43Å | 1.43Å | |
| CL | C20 | sing | 1.74Å | 1.78Å | |
| C29 | C27 | sing | 1.53Å | 1.52Å | |
| O3 | C24 | sing | 1.44Å | 1.43Å | |
| O3 | C27 | sing | 1.44Å | 1.43Å | |
| C24 | C25 | sing | 1.54Å | 1.52Å | |
| C24 | O1 | sing | 1.43Å | 1.44Å | |
| C25 | O4 | sing | 1.43Å | 1.43Å | |
| C25 | C26 | sing | 1.55Å | 1.52Å | |
| C27 | C26 | sing | 1.55Å | 1.53Å | |
| C20 | C19 | doub | 1.38Å | 1.38Å | Aromatic |
| C20 | C21 | sing | 1.39Å | 1.48Å | Aromatic |
| C19 | C18 | sing | 1.38Å | 1.39Å | Aromatic |
| C26 | O5 | sing | 1.43Å | 1.43Å | |
| O1 | C21 | sing | 1.36Å | 1.38Å | |
| C21 | C22 | doub | 1.39Å | 1.39Å | Aromatic |
| C18 | C17 | doub | 1.39Å | 1.40Å | Aromatic |
| C22 | C17 | sing | 1.39Å | 1.40Å | Aromatic |
| C17 | N4 | sing | 1.40Å | 1.37Å | |
| C8 | C7 | sing | 1.51Å | 1.32Å | |
| C9 | C7 | doub | 1.33Å | 1.32Å | |
| C7 | C5 | sing | 1.48Å | 1.50Å | |
| N4 | C10 | sing | 1.35Å | 1.33Å | |
| C5 | C6 | doub | 1.40Å | 1.39Å | Aromatic |
| C5 | C4 | sing | 1.40Å | 1.39Å | Aromatic |
| C10 | O2 | doub | 1.22Å | 1.21Å | |
| C10 | N3 | sing | 1.35Å | 1.34Å | |
| C6 | C1 | sing | 1.38Å | 1.39Å | Aromatic |
| C4 | C3 | doub | 1.38Å | 1.39Å | Aromatic |
| N3 | C11 | sing | 1.46Å | 1.46Å | |
| C1 | C11 | sing | 1.51Å | 1.50Å | |
| C1 | C2 | doub | 1.38Å | 1.39Å | Aromatic |
| C3 | C2 | sing | 1.38Å | 1.40Å | Aromatic |
| C11 | C12 | sing | 1.53Å | 1.53Å | |
| C11 | C13 | sing | 1.53Å | 1.53Å | |
| 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 | |
| C12 | H5 | sing | 1.09Å | 1.10Å | |
| C12 | H6 | sing | 1.09Å | 1.10Å | |
| C12 | H7 | sing | 1.09Å | 1.10Å | |
| C13 | H8 | sing | 1.09Å | 1.10Å | |
| C13 | H9 | sing | 1.09Å | 1.10Å | |
| C13 | H10 | sing | 1.09Å | 1.10Å | |
| C18 | H11 | sing | 1.08Å | 1.08Å | |
| C19 | H12 | sing | 1.08Å | 1.08Å | |
| C22 | H13 | sing | 1.08Å | 1.08Å | |
| C24 | H14 | sing | 1.09Å | 1.10Å | |
| C25 | H15 | sing | 1.09Å | 1.10Å | |
| C26 | H16 | sing | 1.09Å | 1.10Å | |
| C27 | H17 | sing | 1.09Å | 1.10Å | |
| C29 | H18 | sing | 1.09Å | 1.10Å | |
| C29 | H19 | sing | 1.09Å | 1.10Å | |
| C8 | H20 | sing | 1.09Å | 1.10Å | |
| C8 | H21 | sing | 1.09Å | 1.10Å | |
| C8 | H22 | sing | 1.09Å | 1.10Å | |
| C9 | H23 | sing | 1.08Å | 1.08Å | |
| C9 | H24 | sing | 1.08Å | 1.08Å | |
| N3 | H25 | sing | 0.97Å | 1.00Å | |
| N4 | H26 | sing | 0.97Å | 1.00Å | |
| O4 | H27 | sing | 0.97Å | 0.95Å | |
| O5 | H28 | sing | 0.97Å | 0.95Å | |
| O6 | H29 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O6 | C29 | C27 | 109.8° | 109.5° |
| O6 | C29 | H18 | 109.4° | 109.5° |
| O6 | C29 | H19 | 109.4° | 109.5° |
| C29 | O6 | H29 | 109.5° | 114.0° |
| CL | C20 | C19 | 120.5° | 119.9° |
| CL | C20 | C21 | 119.0° | 120.0° |
| C29 | C27 | O3 | 108.4° | 110.8° |
| C29 | C27 | C26 | 110.4° | 110.7° |
| C29 | C27 | H17 | 109.8° | 110.6° |
| C27 | C29 | H18 | 109.4° | 109.5° |
| C27 | C29 | H19 | 109.4° | 109.5° |
| C24 | O3 | C27 | 109.6° | 107.0° |
| O3 | C24 | C25 | 104.5° | 107.3° |
| O3 | C24 | O1 | 105.8° | 109.9° |
| O3 | C24 | H14 | 112.6° | 110.0° |
| O3 | C27 | C26 | 107.3° | 103.5° |
| O3 | C27 | H17 | 111.1° | 110.6° |
| C25 | C24 | O1 | 110.0° | 109.9° |
| C24 | C25 | O4 | 111.5° | 110.5° |
| C24 | C25 | C26 | 102.9° | 104.2° |
| C25 | C24 | H14 | 111.1° | 109.9° |
| C24 | C25 | H15 | 109.2° | 110.5° |
| C24 | O1 | C21 | 124.9° | 117.0° |
| O1 | C24 | H14 | 112.5° | 109.9° |
| O4 | C25 | C26 | 113.4° | 110.5° |
| O4 | C25 | H15 | 110.4° | 110.4° |
| C25 | O4 | H27 | 109.5° | 114.0° |
| C25 | C26 | C27 | 103.4° | 102.1° |
| C25 | C26 | O5 | 112.7° | 110.9° |
| C26 | C25 | H15 | 109.2° | 110.6° |
| C25 | C26 | H16 | 109.5° | 110.9° |
| C27 | C26 | O5 | 110.7° | 111.0° |
| C27 | C26 | H16 | 109.4° | 110.9° |
| C26 | C27 | H17 | 109.7° | 110.6° |
| C19 | C20 | C21 | 120.5° | 120.1° |
| C20 | C19 | C18 | 118.9° | 120.1° |
| C20 | C19 | H12 | 120.5° | 119.9° |
| C20 | C21 | O1 | 120.6° | 120.0° |
| C20 | C21 | C22 | 117.7° | 120.0° |
| C19 | C18 | C17 | 121.9° | 120.0° |
| C19 | C18 | H11 | 119.1° | 120.0° |
| C18 | C19 | H12 | 120.5° | 120.0° |
| O5 | C26 | H16 | 110.8° | 110.8° |
| C26 | O5 | H28 | 109.5° | 114.1° |
| O1 | C21 | C22 | 121.6° | 120.0° |
| C21 | C22 | C17 | 120.8° | 119.9° |
| C21 | C22 | H13 | 119.6° | 120.0° |
| C18 | C17 | C22 | 120.2° | 119.9° |
| C18 | C17 | N4 | 115.8° | 120.0° |
| C17 | C18 | H11 | 119.0° | 120.0° |
| C22 | C17 | N4 | 124.0° | 120.0° |
| C17 | C22 | H13 | 119.6° | 120.0° |
| C17 | N4 | C10 | 129.3° | 120.0° |
| C17 | N4 | H26 | 115.3° | 120.0° |
| C8 | C7 | C9 | 120.2° | 120.0° |
| C8 | C7 | C5 | 119.6° | 120.0° |
| C7 | C8 | H20 | 109.5° | 109.5° |
| C7 | C8 | H21 | 109.5° | 109.5° |
| C7 | C8 | H22 | 109.4° | 109.4° |
| C9 | C7 | C5 | 120.2° | 120.0° |
| C7 | C9 | H23 | 120.0° | 120.0° |
| C7 | C9 | H24 | 120.0° | 119.9° |
| C7 | C5 | C6 | 118.3° | 120.1° |
| C7 | C5 | C4 | 121.5° | 120.1° |
| N4 | C10 | O2 | 122.4° | 120.0° |
| N4 | C10 | N3 | 115.3° | 120.0° |
| C10 | N4 | H26 | 115.4° | 120.0° |
| C6 | C5 | C4 | 120.2° | 119.7° |
| C5 | C6 | C1 | 120.6° | 119.8° |
| C5 | C6 | H4 | 119.7° | 120.1° |
| C5 | C4 | C3 | 119.3° | 119.9° |
| C5 | C4 | H3 | 120.3° | 120.0° |
| O2 | C10 | N3 | 122.3° | 120.0° |
| C10 | N3 | C11 | 126.6° | 120.0° |
| C10 | N3 | H25 | 116.7° | 120.0° |
| C6 | C1 | C11 | 118.3° | 119.9° |
| C6 | C1 | C2 | 119.5° | 120.2° |
| C1 | C6 | H4 | 119.7° | 120.1° |
| C4 | C3 | C2 | 120.2° | 120.2° |
| C4 | C3 | H2 | 119.9° | 120.0° |
| C3 | C4 | H3 | 120.4° | 120.1° |
| N3 | C11 | C1 | 108.7° | 109.5° |
| N3 | C11 | C12 | 113.1° | 109.5° |
| N3 | C11 | C13 | 108.8° | 109.5° |
| C11 | N3 | H25 | 116.7° | 120.0° |
| C11 | C1 | C2 | 122.2° | 119.9° |
| C1 | C11 | C12 | 109.9° | 109.5° |
| C1 | C11 | C13 | 108.5° | 109.4° |
| C1 | C2 | C3 | 120.2° | 120.3° |
| C1 | C2 | H1 | 119.9° | 119.9° |
| C3 | C2 | H1 | 119.9° | 119.9° |
| C2 | C3 | H2 | 119.9° | 119.9° |
| C12 | C11 | C13 | 107.6° | 109.5° |
| C11 | C12 | H5 | 109.5° | 109.5° |
| C11 | C12 | H6 | 109.4° | 109.5° |
| C11 | C12 | H7 | 109.5° | 109.4° |
| C11 | C13 | H8 | 109.5° | 109.4° |
| C11 | C13 | H9 | 109.5° | 109.4° |
| C11 | C13 | H10 | 109.5° | 109.5° |
| H5 | C12 | H6 | 109.5° | 109.5° |
| H5 | C12 | H7 | 109.5° | 109.4° |
| H6 | C12 | H7 | 109.5° | 109.5° |
| H8 | C13 | H9 | 109.5° | 109.5° |
| H8 | C13 | H10 | 109.5° | 109.5° |
| H9 | C13 | H10 | 109.4° | 109.5° |
| H18 | C29 | H19 | 109.5° | 109.4° |
| H20 | C8 | H21 | 109.5° | 109.5° |
| H20 | C8 | H22 | 109.4° | 109.5° |
| H21 | C8 | H22 | 109.5° | 109.5° |
| H23 | C9 | H24 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O6 | C29 | C27 | H18 | 120.0° | 120.0° |
| O6 | C29 | C27 | H19 | 120.1° | 120.0° |
| O6 | C29 | C27 | O3 | 54.5° | 70.9° |
| O6 | C29 | C27 | C26 | 171.8° | 175.0° |
| O6 | C29 | C27 | H17 | 67.0° | 52.1° |
| O6 | C29 | H18 | H19 | 119.8° | 120.0° |
| CL | C20 | C19 | C21 | 179.5° | 180.0° |
| CL | C20 | C19 | C18 | 179.1° | 180.0° |
| CL | C20 | C21 | O1 | 0.2° | 0.1° |
| CL | C20 | C21 | C22 | 178.6° | 179.7° |
| CL | C20 | C19 | H12 | 0.9° | 0.0° |
| C29 | C27 | O3 | C24 | 128.2° | 158.6° |
| C29 | C27 | O3 | C26 | 119.3° | 118.6° |
| C29 | C27 | O3 | H17 | 120.8° | 122.9° |
| C29 | C27 | C26 | C25 | 104.4° | 155.7° |
| C29 | C27 | C26 | H17 | 121.2° | 122.9° |
| C29 | C27 | C26 | O5 | 134.7° | 86.1° |
| C29 | C27 | C26 | H16 | 12.3° | 37.5° |
| C27 | C29 | H18 | H19 | 119.9° | 120.0° |
| C27 | C29 | O6 | H29 | 180.0° | 180.0° |
| O3 | C24 | C25 | O1 | 113.1° | 119.4° |
| O3 | C24 | C25 | H14 | 121.7° | 119.6° |
| O3 | C24 | O1 | H14 | 123.3° | 121.2° |
| O3 | C24 | C25 | O4 | 157.2° | 120.7° |
| O3 | C24 | C25 | C26 | 35.4° | 2.0° |
| C24 | O3 | C27 | C26 | 8.9° | 40.0° |
| O3 | C24 | O1 | C21 | 151.9° | 72.2° |
| O3 | C24 | C25 | H15 | 80.5° | 116.8° |
| C24 | O3 | C27 | H17 | 111.0° | 78.4° |
| C27 | O3 | C24 | C25 | 27.9° | 26.5° |
| C27 | O3 | C24 | O1 | 88.2° | 92.9° |
| O3 | C27 | C26 | C25 | 13.6° | 37.0° |
| O3 | C27 | C26 | H17 | 120.8° | 118.4° |
| O3 | C27 | C26 | O5 | 107.3° | 155.2° |
| C27 | O3 | C24 | H14 | 148.6° | 146.0° |
| O3 | C27 | C26 | H16 | 130.3° | 81.2° |
| O3 | C27 | C29 | H18 | 65.5° | 169.1° |
| O3 | C27 | C29 | H19 | 174.5° | 49.2° |
| C25 | C24 | O1 | H14 | 124.5° | 121.0° |
| C24 | C25 | O4 | C26 | 115.6° | 114.8° |
| C24 | C25 | O4 | H15 | 121.6° | 122.6° |
| C24 | C25 | C26 | H15 | 115.9° | 118.8° |
| C24 | C25 | C26 | C27 | 29.3° | 20.9° |
| C24 | C25 | C26 | O5 | 90.2° | 139.1° |
| C25 | C24 | O1 | C21 | 95.8° | 170.0° |
| C24 | C25 | C26 | H16 | 145.9° | 97.4° |
| C24 | C25 | O4 | H27 | 180.0° | 61.4° |
| O1 | C24 | C25 | O4 | 44.1° | 1.3° |
| O1 | C24 | C25 | C26 | 77.7° | 117.4° |
| C24 | O1 | C21 | C20 | 60.8° | 180.0° |
| C24 | O1 | C21 | C22 | 120.8° | 0.2° |
| O1 | C24 | C25 | H15 | 166.4° | 123.8° |
| O4 | C25 | C26 | H15 | 123.5° | 122.5° |
| O4 | C25 | C26 | C27 | 149.9° | 97.9° |
| O4 | C25 | C26 | O5 | 30.3° | 20.4° |
| O4 | C25 | C24 | H14 | 81.1° | 119.7° |
| O4 | C25 | C26 | H16 | 93.6° | 143.9° |
| C25 | C26 | C27 | O5 | 120.9° | 118.2° |
| C25 | C26 | C27 | H16 | 116.6° | 118.2° |
| C25 | C26 | O5 | H16 | 123.1° | 123.6° |
| C26 | C25 | C24 | H14 | 157.0° | 121.6° |
| C25 | C26 | C27 | H17 | 134.4° | 81.5° |
| C26 | C25 | O4 | H27 | 64.4° | 176.2° |
| C25 | C26 | O5 | H28 | 180.0° | 61.4° |
| C27 | C26 | O5 | H16 | 121.6° | 123.7° |
| C27 | C26 | C25 | H15 | 86.6° | 139.6° |
| C26 | C27 | C29 | H18 | 51.8° | 55.0° |
| C26 | C27 | C29 | H19 | 68.1° | 65.0° |
| C27 | C26 | O5 | H28 | 64.8° | 174.2° |
| C20 | C19 | C18 | H12 | 180.0° | 180.0° |
| C19 | C20 | C21 | O1 | 179.3° | 179.9° |
| C19 | C20 | C21 | C22 | 0.9° | 0.2° |
| C20 | C19 | C18 | C17 | 0.1° | 0.0° |
| C20 | C19 | C18 | H11 | 179.9° | 180.0° |
| C21 | C20 | C19 | C18 | 0.4° | 0.0° |
| C20 | C21 | O1 | C22 | 178.4° | 179.8° |
| C20 | C21 | C22 | C17 | 1.1° | 0.5° |
| C21 | C20 | C19 | H12 | 179.6° | 180.0° |
| C20 | C21 | C22 | H13 | 179.0° | 180.0° |
| C19 | C18 | C17 | H11 | 180.0° | 179.9° |
| C19 | C18 | C17 | C22 | 0.2° | 0.3° |
| C19 | C18 | C17 | N4 | 179.9° | 180.0° |
| O5 | C26 | C25 | H15 | 153.9° | 102.1° |
| O5 | C26 | C27 | H17 | 13.5° | 36.8° |
| O1 | C21 | C22 | C17 | 179.5° | 179.6° |
| O1 | C21 | C22 | H13 | 0.5° | 0.2° |
| C21 | O1 | C24 | H14 | 28.7° | 49.0° |
| C21 | C22 | C17 | C18 | 0.8° | 0.6° |
| C21 | C22 | C17 | H13 | 180.0° | 179.4° |
| C21 | C22 | C17 | N4 | 179.6° | 179.7° |
| C18 | C17 | C22 | N4 | 179.6° | 179.7° |
| C18 | C17 | N4 | C10 | 179.4° | 33.3° |
| C17 | C18 | C19 | H12 | 179.9° | 180.0° |
| C18 | C17 | C22 | H13 | 179.3° | 180.0° |
| C18 | C17 | N4 | H26 | 0.6° | 146.7° |
| C22 | C17 | N4 | C10 | 1.0° | 147.0° |
| C22 | C17 | C18 | H11 | 179.8° | 179.7° |
| C22 | C17 | N4 | H26 | 179.0° | 33.0° |
| C17 | N4 | C10 | H26 | 180.0° | 180.0° |
| C17 | N4 | C10 | O2 | 0.5° | 5.2° |
| C17 | N4 | C10 | N3 | 179.6° | 174.8° |
| N4 | C17 | C18 | H11 | 0.1° | 0.0° |
| N4 | C17 | C22 | H13 | 0.3° | 0.3° |
| C8 | C7 | C9 | C5 | 179.1° | 179.9° |
| C8 | C7 | C5 | C6 | 4.2° | 115.0° |
| C8 | C7 | C5 | C4 | 176.5° | 64.5° |
| C7 | C8 | H20 | H21 | 120.0° | 120.0° |
| C7 | C8 | H20 | H22 | 120.0° | 120.0° |
| C7 | C8 | H21 | H22 | 120.0° | 120.0° |
| C8 | C7 | C9 | H23 | 179.0° | 0.1° |
| C8 | C7 | C9 | H24 | 0.9° | 180.0° |
| C9 | C7 | C5 | C6 | 174.8° | 65.0° |
| C9 | C7 | C5 | C4 | 4.4° | 115.6° |
| C9 | C7 | C8 | H20 | 180.0° | 90.0° |
| C9 | C7 | C8 | H21 | 60.0° | 30.0° |
| C9 | C7 | C8 | H22 | 60.0° | 150.0° |
| C7 | C9 | H23 | H24 | 180.0° | 179.9° |
| C7 | C5 | C6 | C4 | 179.3° | 179.5° |
| C7 | C5 | C6 | C1 | 180.0° | 180.0° |
| C7 | C5 | C4 | C3 | 179.5° | 179.7° |
| C7 | C5 | C4 | H3 | 0.5° | 0.3° |
| C7 | C5 | C6 | H4 | 0.0° | 0.6° |
| C5 | C7 | C8 | H20 | 0.9° | 90.0° |
| C5 | C7 | C8 | H21 | 120.9° | 150.0° |
| C5 | C7 | C8 | H22 | 119.1° | 30.0° |
| C5 | C7 | C9 | H23 | 0.0° | 180.0° |
| C5 | C7 | C9 | H24 | 180.0° | 0.1° |
| N4 | C10 | O2 | N3 | 179.1° | 180.0° |
| N4 | C10 | N3 | C11 | 179.5° | 180.0° |
| N4 | C10 | N3 | H25 | 0.4° | 0.0° |
| C5 | C6 | C1 | H4 | 180.0° | 179.4° |
| C6 | C5 | C4 | C3 | 0.3° | 0.3° |
| C5 | C6 | C1 | C11 | 179.9° | 179.7° |
| C5 | C6 | C1 | C2 | 0.9° | 0.5° |
| C6 | C5 | C4 | H3 | 179.7° | 179.7° |
| C4 | C5 | C6 | C1 | 0.7° | 0.6° |
| C5 | C4 | C3 | H3 | 180.0° | 180.0° |
| C5 | C4 | C3 | C2 | 0.1° | 0.1° |
| C5 | C4 | C3 | H2 | 179.9° | 180.0° |
| C4 | C5 | C6 | H4 | 179.3° | 180.0° |
| O2 | C10 | N3 | C11 | 0.4° | 0.0° |
| O2 | C10 | N3 | H25 | 179.6° | 180.0° |
| O2 | C10 | N4 | H26 | 179.5° | 174.8° |
| C10 | N3 | C11 | H25 | 180.0° | 180.0° |
| C10 | N3 | C11 | C1 | 74.9° | 178.8° |
| C10 | N3 | C11 | C12 | 47.6° | 58.8° |
| C10 | N3 | C11 | C13 | 167.1° | 61.2° |
| N3 | C10 | N4 | H26 | 0.4° | 5.1° |
| C6 | C1 | C11 | N3 | 34.1° | 24.9° |
| C6 | C1 | C11 | C2 | 179.2° | 179.7° |
| C6 | C1 | C2 | C3 | 0.7° | 0.2° |
| C6 | C1 | C11 | C12 | 158.5° | 95.1° |
| C6 | C1 | C11 | C13 | 84.1° | 144.9° |
| C6 | C1 | C2 | H1 | 179.3° | 179.7° |
| C4 | C3 | C2 | C1 | 0.3° | 0.1° |
| C4 | C3 | C2 | H2 | 180.0° | 179.9° |
| C4 | C3 | C2 | H1 | 179.7° | 180.0° |
| N3 | C11 | C1 | C12 | 124.3° | 120.0° |
| N3 | C11 | C1 | C13 | 118.2° | 120.0° |
| N3 | C11 | C1 | C2 | 146.7° | 155.3° |
| N3 | C11 | C12 | C13 | 120.3° | 120.0° |
| N3 | C11 | C12 | H5 | 180.0° | 180.0° |
| N3 | C11 | C12 | H6 | 60.0° | 60.0° |
| N3 | C11 | C12 | H7 | 60.0° | 60.0° |
| N3 | C11 | C13 | H8 | 180.0° | 60.0° |
| N3 | C11 | C13 | H9 | 60.0° | 60.0° |
| N3 | C11 | C13 | H10 | 60.0° | 180.0° |
| C11 | C1 | C2 | C3 | 179.9° | 180.0° |
| C1 | C11 | C12 | C13 | 118.0° | 119.9° |
| C11 | C1 | C2 | H1 | 0.1° | 0.0° |
| C11 | C1 | C6 | H4 | 0.1° | 0.3° |
| C1 | C11 | C12 | H5 | 58.2° | 59.9° |
| C1 | C11 | C12 | H6 | 61.8° | 180.0° |
| C1 | C11 | C12 | H7 | 178.2° | 60.0° |
| C1 | C11 | C13 | H8 | 61.9° | 60.0° |
| C1 | C11 | C13 | H9 | 178.1° | 180.0° |
| C1 | C11 | C13 | H10 | 58.2° | 60.0° |
| C1 | C11 | N3 | H25 | 105.1° | 1.2° |
| C1 | C2 | C3 | H1 | 180.0° | 180.0° |
| C2 | C1 | C11 | C12 | 22.3° | 84.6° |
| C2 | C1 | C11 | C13 | 95.1° | 35.3° |
| C1 | C2 | C3 | H2 | 179.7° | 180.0° |
| C2 | C1 | C6 | H4 | 179.1° | 180.0° |
| C2 | C3 | C4 | H3 | 179.9° | 180.0° |
| C11 | C12 | H5 | H6 | 120.0° | 120.1° |
| C11 | C12 | H5 | H7 | 120.0° | 119.9° |
| C11 | C12 | H6 | H7 | 120.0° | 120.0° |
| C12 | C11 | C13 | H8 | 57.1° | 180.0° |
| C12 | C11 | C13 | H9 | 63.0° | 60.0° |
| C12 | C11 | C13 | H10 | 177.1° | 59.9° |
| C12 | C11 | N3 | H25 | 132.4° | 121.2° |
| C13 | C11 | C12 | H5 | 59.7° | 60.0° |
| C13 | C11 | C12 | H6 | 179.7° | 60.1° |
| C13 | C11 | C12 | H7 | 60.3° | 179.9° |
| C11 | C13 | H8 | H9 | 120.0° | 119.9° |
| C11 | C13 | H8 | H10 | 120.0° | 120.0° |
| C11 | C13 | H9 | H10 | 120.0° | 119.9° |
| C13 | C11 | N3 | H25 | 12.8° | 118.8° |
| H1 | C2 | C3 | H2 | 0.3° | 0.0° |
| H2 | C3 | C4 | H3 | 0.1° | 0.0° |
| H5 | C12 | H6 | H7 | 120.0° | 120.0° |
| H8 | C13 | H9 | H10 | 120.0° | 120.1° |
| H11 | C18 | C19 | H12 | 0.1° | 0.0° |
| H14 | C24 | C25 | H15 | 41.1° | 2.8° |
| H15 | C25 | C26 | H16 | 30.0° | 21.4° |
| H15 | C25 | O4 | H27 | 58.4° | 61.2° |
| H16 | C26 | C27 | H17 | 108.9° | 160.4° |
| H16 | C26 | O5 | H28 | 56.8° | 62.2° |
| H17 | C27 | C29 | H18 | 172.9° | 67.9° |
| H17 | C27 | C29 | H19 | 53.0° | 172.1° |
| H18 | C29 | O6 | H29 | 59.9° | 60.0° |
| H19 | C29 | O6 | H29 | 59.9° | 60.0° |
| H20 | C8 | H21 | H22 | 120.0° | 120.0° |
