QSX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C22 | C23 | doub | 1.36Å | 1.37Å | Aromatic |
| C22 | C21 | sing | 1.40Å | 1.42Å | Aromatic |
| C23 | C24 | sing | 1.39Å | 1.39Å | Aromatic |
| C20 | C21 | doub | 1.40Å | 1.41Å | Aromatic |
| C20 | N3 | sing | 1.31Å | 1.32Å | Aromatic |
| C21 | C26 | sing | 1.42Å | 1.42Å | Aromatic |
| C24 | C25 | doub | 1.36Å | 1.37Å | Aromatic |
| N3 | C19 | doub | 1.32Å | 1.34Å | Aromatic |
| C1 | C2 | sing | 1.56Å | 1.53Å | |
| C1 | N | sing | 1.48Å | 1.47Å | |
| C2 | C3 | sing | 1.57Å | 1.53Å | |
| C2 | N1 | sing | 1.49Å | 1.47Å | |
| C26 | C25 | sing | 1.40Å | 1.42Å | Aromatic |
| C26 | C18 | doub | 1.41Å | 1.43Å | Aromatic |
| C3 | C4 | sing | 1.57Å | 1.53Å | |
| C19 | C18 | sing | 1.38Å | 1.40Å | Aromatic |
| C18 | N2 | sing | 1.40Å | 1.41Å | |
| C | N | sing | 1.47Å | 1.46Å | |
| N | C4 | sing | 1.50Å | 1.48Å | |
| O | C6 | doub | 1.21Å | 1.22Å | |
| N2 | C17 | sing | 1.35Å | 1.36Å | |
| N1 | C6 | sing | 1.35Å | 1.35Å | |
| N1 | C5 | sing | 1.48Å | 1.46Å | |
| C4 | C5 | sing | 1.56Å | 1.53Å | |
| C6 | C7 | sing | 1.51Å | 1.51Å | |
| C7 | C8 | sing | 1.53Å | 1.54Å | |
| C17 | C8 | sing | 1.51Å | 1.54Å | |
| C17 | O2 | doub | 1.21Å | 1.22Å | |
| C8 | C9 | sing | 1.53Å | 1.55Å | |
| C8 | C16 | sing | 1.51Å | 1.55Å | |
| C9 | C10 | sing | 1.53Å | 1.51Å | |
| C15 | C16 | doub | 1.38Å | 1.40Å | Aromatic |
| C15 | C14 | sing | 1.38Å | 1.39Å | Aromatic |
| C16 | C11 | sing | 1.38Å | 1.40Å | Aromatic |
| C10 | O1 | sing | 1.43Å | 1.43Å | |
| CL | C14 | sing | 1.74Å | 1.75Å | |
| C14 | C13 | doub | 1.38Å | 1.37Å | Aromatic |
| C11 | O1 | sing | 1.36Å | 1.37Å | |
| C11 | C12 | doub | 1.39Å | 1.38Å | Aromatic |
| C13 | C12 | sing | 1.38Å | 1.38Å | Aromatic |
| C4 | H1 | sing | 1.09Å | 1.10Å | |
| C5 | H2 | sing | 1.09Å | 1.10Å | |
| C5 | H3 | sing | 1.09Å | 1.10Å | |
| C7 | H4 | sing | 1.09Å | 1.10Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C10 | H6 | sing | 1.09Å | 1.10Å | |
| C10 | H7 | sing | 1.09Å | 1.10Å | |
| C13 | H8 | sing | 1.08Å | 1.08Å | |
| C15 | H9 | sing | 1.08Å | 1.08Å | |
| C20 | H10 | sing | 1.08Å | 1.08Å | |
| C22 | H11 | sing | 1.08Å | 1.08Å | |
| C24 | H12 | sing | 1.08Å | 1.08Å | |
| N2 | H13 | sing | 0.97Å | 1.00Å | |
| C25 | H14 | sing | 1.08Å | 1.08Å | |
| C23 | H15 | sing | 1.08Å | 1.08Å | |
| C19 | H16 | sing | 1.08Å | 1.08Å | |
| C12 | H17 | sing | 1.08Å | 1.08Å | |
| C9 | H18 | sing | 1.09Å | 1.10Å | |
| C9 | H19 | sing | 1.09Å | 1.10Å | |
| C2 | H20 | sing | 1.09Å | 1.10Å | |
| C1 | H21 | sing | 1.09Å | 1.10Å | |
| C1 | H22 | sing | 1.09Å | 1.10Å | |
| C3 | H23 | sing | 1.09Å | 1.10Å | |
| C3 | H24 | sing | 1.09Å | 1.10Å | |
| C | H26 | sing | 1.09Å | 1.10Å | |
| C | H27 | sing | 1.09Å | 1.10Å | |
| C | H28 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C23 | C22 | C21 | 120.6° | 119.5° |
| C22 | C23 | C24 | 120.6° | 121.1° |
| C23 | C22 | H11 | 119.7° | 120.3° |
| C22 | C23 | H15 | 119.7° | 119.5° |
| C22 | C21 | C20 | 123.1° | 122.0° |
| C22 | C21 | C26 | 119.1° | 119.3° |
| C21 | C22 | H11 | 119.7° | 120.2° |
| C23 | C24 | C25 | 120.7° | 121.0° |
| C23 | C24 | H12 | 119.7° | 119.5° |
| C24 | C23 | H15 | 119.7° | 119.4° |
| C21 | C20 | N3 | 124.2° | 120.2° |
| C20 | C21 | C26 | 117.8° | 118.7° |
| C21 | C20 | H10 | 117.9° | 119.9° |
| C20 | N3 | C19 | 117.6° | 122.9° |
| N3 | C20 | H10 | 117.9° | 119.9° |
| C21 | C26 | C25 | 118.1° | 119.6° |
| C21 | C26 | C18 | 118.1° | 118.3° |
| C24 | C25 | C26 | 120.9° | 119.5° |
| C25 | C24 | H12 | 119.7° | 119.5° |
| C24 | C25 | H14 | 119.5° | 120.3° |
| N3 | C19 | C18 | 125.2° | 121.6° |
| N3 | C19 | H16 | 117.4° | 119.2° |
| C2 | C1 | N | 102.2° | 105.1° |
| C1 | C2 | C3 | 99.6° | 99.7° |
| C1 | C2 | N1 | 109.0° | 104.1° |
| C1 | C2 | H20 | 114.6° | 116.9° |
| C2 | C1 | H21 | 111.3° | 110.4° |
| C2 | C1 | H22 | 111.2° | 110.3° |
| C1 | N | C | 112.5° | 111.0° |
| C1 | N | C4 | 106.2° | 105.9° |
| N | C1 | H21 | 111.3° | 110.3° |
| N | C1 | H22 | 111.3° | 110.3° |
| C3 | C2 | N1 | 101.5° | 101.1° |
| C2 | C3 | C4 | 92.6° | 94.3° |
| C3 | C2 | H20 | 114.6° | 116.4° |
| C2 | C3 | H23 | 113.5° | 112.3° |
| C2 | C3 | H24 | 113.5° | 112.4° |
| C2 | N1 | C6 | 125.9° | 127.0° |
| C2 | N1 | C5 | 106.7° | 106.1° |
| N1 | C2 | H20 | 115.6° | 116.2° |
| C25 | C26 | C18 | 123.7° | 122.1° |
| C26 | C25 | H14 | 119.5° | 120.3° |
| C26 | C18 | C19 | 117.1° | 118.4° |
| C26 | C18 | N2 | 118.5° | 120.9° |
| C3 | C4 | N | 102.1° | 101.0° |
| C3 | C4 | C5 | 100.9° | 99.6° |
| C3 | C4 | H1 | 115.2° | 116.4° |
| C4 | C3 | H23 | 113.5° | 112.2° |
| C4 | C3 | H24 | 113.5° | 112.4° |
| C19 | C18 | N2 | 123.9° | 120.7° |
| C18 | C19 | H16 | 117.4° | 119.2° |
| C18 | N2 | C17 | 125.7° | 120.1° |
| C18 | N2 | H13 | 117.2° | 119.9° |
| C | N | C4 | 113.5° | 111.0° |
| N | C | H26 | 109.5° | 109.5° |
| N | C | H27 | 109.5° | 109.5° |
| N | C | H28 | 109.5° | 109.5° |
| N | C4 | C5 | 105.2° | 104.1° |
| N | C4 | H1 | 116.1° | 116.9° |
| O | C6 | N1 | 121.8° | 120.0° |
| O | C6 | C7 | 121.7° | 120.0° |
| N2 | C17 | C8 | 118.6° | 120.0° |
| N2 | C17 | O2 | 121.6° | 120.0° |
| C17 | N2 | H13 | 117.2° | 120.0° |
| C6 | N1 | C5 | 127.3° | 126.9° |
| N1 | C6 | C7 | 116.4° | 120.0° |
| N1 | C5 | C4 | 102.3° | 105.1° |
| N1 | C5 | H2 | 111.2° | 110.3° |
| N1 | C5 | H3 | 111.2° | 110.3° |
| C5 | C4 | H1 | 115.3° | 116.3° |
| C4 | C5 | H2 | 111.2° | 110.3° |
| C4 | C5 | H3 | 111.2° | 110.3° |
| C6 | C7 | C8 | 116.3° | 109.5° |
| C6 | C7 | H4 | 107.7° | 109.4° |
| C6 | C7 | H5 | 107.7° | 109.5° |
| C7 | C8 | C17 | 120.4° | 109.5° |
| C7 | C8 | C9 | 105.7° | 109.5° |
| C7 | C8 | C16 | 111.0° | 109.4° |
| C8 | C7 | H4 | 107.7° | 109.5° |
| C8 | C7 | H5 | 107.7° | 109.5° |
| C8 | C17 | O2 | 119.5° | 120.0° |
| C17 | C8 | C9 | 96.3° | 109.4° |
| C17 | C8 | C16 | 111.1° | 109.4° |
| C9 | C8 | C16 | 111.1° | 109.6° |
| C8 | C9 | C10 | 112.0° | 108.3° |
| C8 | C9 | H18 | 108.9° | 109.7° |
| C8 | C9 | H19 | 108.9° | 109.8° |
| C8 | C16 | C15 | 121.9° | 118.8° |
| C8 | C16 | C11 | 120.2° | 121.4° |
| C9 | C10 | O1 | 110.9° | 108.4° |
| C9 | C10 | H6 | 109.1° | 109.7° |
| C9 | C10 | H7 | 109.1° | 109.7° |
| C10 | C9 | H18 | 108.8° | 109.7° |
| C10 | C9 | H19 | 108.8° | 109.7° |
| C16 | C15 | C14 | 119.5° | 120.3° |
| C15 | C16 | C11 | 117.8° | 119.8° |
| C16 | C15 | H9 | 120.2° | 119.8° |
| C15 | C14 | CL | 119.1° | 120.0° |
| C15 | C14 | C13 | 122.0° | 120.0° |
| C14 | C15 | H9 | 120.3° | 119.9° |
| C16 | C11 | O1 | 123.2° | 121.8° |
| C16 | C11 | C12 | 121.8° | 119.7° |
| C10 | O1 | C11 | 115.3° | 117.9° |
| O1 | C10 | H6 | 109.1° | 109.7° |
| O1 | C10 | H7 | 109.1° | 109.7° |
| CL | C14 | C13 | 118.8° | 120.0° |
| C14 | C13 | C12 | 119.3° | 119.9° |
| C14 | C13 | H8 | 120.3° | 120.1° |
| O1 | C11 | C12 | 114.7° | 118.5° |
| C11 | C12 | C13 | 119.6° | 120.2° |
| C11 | C12 | H17 | 120.2° | 119.9° |
| C12 | C13 | H8 | 120.4° | 120.0° |
| C13 | C12 | H17 | 120.2° | 119.9° |
| H2 | C5 | H3 | 109.5° | 110.3° |
| H4 | C7 | H5 | 109.5° | 109.5° |
| H6 | C10 | H7 | 109.5° | 109.7° |
| H18 | C9 | H19 | 109.5° | 109.7° |
| H21 | C1 | H22 | 109.5° | 110.3° |
| H23 | C3 | H24 | 109.5° | 112.1° |
| H26 | C | H27 | 109.5° | 109.5° |
| H26 | C | H28 | 109.4° | 109.5° |
| H27 | C | H28 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C23 | C22 | C21 | H11 | 180.0° | 179.9° |
| C22 | C23 | C24 | H15 | 180.0° | 180.0° |
| C23 | C22 | C21 | C20 | 179.4° | 180.0° |
| C23 | C22 | C21 | C26 | 0.9° | 0.0° |
| C22 | C23 | C24 | C25 | 0.4° | 0.0° |
| C22 | C23 | C24 | H12 | 179.6° | 180.0° |
| C21 | C22 | C23 | C24 | 0.2° | 0.0° |
| C22 | C21 | C20 | C26 | 179.8° | 180.0° |
| C22 | C21 | C20 | N3 | 179.8° | 180.0° |
| C22 | C21 | C26 | C25 | 0.9° | 0.0° |
| C22 | C21 | C26 | C18 | 178.5° | 180.0° |
| C22 | C21 | C20 | H10 | 0.2° | 0.0° |
| C21 | C22 | C23 | H15 | 179.8° | 180.0° |
| C23 | C24 | C25 | H12 | 180.0° | 180.0° |
| C23 | C24 | C25 | C26 | 0.4° | 0.0° |
| C24 | C23 | C22 | H11 | 179.8° | 180.0° |
| C23 | C24 | C25 | H14 | 179.6° | 180.0° |
| C21 | C20 | N3 | H10 | 180.0° | 180.0° |
| C21 | C20 | N3 | C19 | 0.9° | 0.0° |
| C20 | C21 | C26 | C25 | 179.3° | 180.0° |
| C20 | C21 | C26 | C18 | 1.2° | 0.0° |
| C20 | C21 | C22 | H11 | 0.6° | 0.1° |
| N3 | C20 | C21 | C26 | 0.5° | 0.0° |
| C20 | N3 | C19 | C18 | 0.5° | 0.0° |
| C20 | N3 | C19 | H16 | 179.5° | 180.0° |
| C21 | C26 | C25 | C24 | 0.3° | 0.0° |
| C21 | C26 | C25 | C18 | 179.4° | 180.0° |
| C21 | C26 | C18 | C19 | 2.4° | 0.0° |
| C21 | C26 | C18 | N2 | 169.7° | 180.0° |
| C26 | C21 | C20 | H10 | 179.5° | 180.0° |
| C26 | C21 | C22 | H11 | 179.1° | 180.0° |
| C21 | C26 | C25 | H14 | 179.7° | 180.0° |
| C24 | C25 | C26 | H14 | 180.0° | 180.0° |
| C24 | C25 | C26 | C18 | 179.1° | 180.0° |
| C25 | C24 | C23 | H15 | 179.6° | 180.0° |
| N3 | C19 | C18 | C26 | 2.2° | 0.0° |
| N3 | C19 | C18 | H16 | 180.0° | 180.0° |
| N3 | C19 | C18 | N2 | 169.5° | 180.0° |
| C19 | N3 | C20 | H10 | 179.1° | 180.0° |
| C2 | C1 | N | H21 | 118.8° | 119.0° |
| C2 | C1 | N | H22 | 118.8° | 118.9° |
| C1 | C2 | C3 | N1 | 111.8° | 106.5° |
| C1 | C2 | C3 | H20 | 122.9° | 126.6° |
| C1 | C2 | N1 | H20 | 130.9° | 130.0° |
| C1 | C2 | C3 | C4 | 57.5° | 52.2° |
| C2 | C1 | N | C | 132.6° | 118.7° |
| C2 | C1 | N | C4 | 7.8° | 1.9° |
| C1 | C2 | N1 | C6 | 105.6° | 113.1° |
| C1 | C2 | N1 | C5 | 70.2° | 67.1° |
| C2 | C1 | H21 | H22 | 123.4° | 122.1° |
| C1 | C2 | C3 | H23 | 59.6° | 168.3° |
| C1 | C2 | C3 | H24 | 174.5° | 64.2° |
| N | C1 | C2 | C3 | 42.1° | 32.9° |
| N | C1 | C2 | N1 | 63.6° | 71.2° |
| C1 | N | C4 | C3 | 29.3° | 36.2° |
| C1 | N | C | C4 | 120.6° | 117.5° |
| C1 | N | C4 | C5 | 75.7° | 66.8° |
| C1 | N | C4 | H1 | 155.6° | 163.5° |
| N | C1 | C2 | H20 | 165.0° | 159.2° |
| N | C1 | H21 | H22 | 123.4° | 122.2° |
| C1 | N | C | H26 | 180.0° | 60.1° |
| C1 | N | C | H27 | 60.0° | 179.9° |
| C1 | N | C | H28 | 60.0° | 59.8° |
| C3 | C2 | N1 | H20 | 124.7° | 127.0° |
| C2 | C3 | C4 | H23 | 117.1° | 116.2° |
| C2 | C3 | C4 | H24 | 117.1° | 116.3° |
| C2 | C3 | C4 | N | 53.0° | 54.5° |
| C3 | C2 | N1 | C6 | 150.0° | 143.8° |
| C3 | C2 | N1 | C5 | 34.2° | 35.9° |
| C2 | C3 | C4 | C5 | 55.3° | 52.0° |
| C2 | C3 | C4 | H1 | 179.8° | 177.8° |
| C3 | C2 | C1 | H21 | 160.9° | 151.8° |
| C3 | C2 | C1 | H22 | 76.7° | 86.0° |
| C2 | C3 | H23 | H24 | 128.0° | 127.6° |
| N1 | C2 | C3 | C4 | 54.3° | 54.4° |
| C2 | N1 | C6 | O | 70.4° | 0.3° |
| C2 | N1 | C6 | C5 | 175.0° | 179.7° |
| C2 | N1 | C5 | C4 | 1.8° | 1.7° |
| C2 | N1 | C6 | C7 | 107.3° | 179.7° |
| C2 | N1 | C5 | H2 | 117.1° | 120.6° |
| C2 | N1 | C5 | H3 | 120.6° | 117.2° |
| N1 | C2 | C1 | H21 | 55.2° | 47.7° |
| N1 | C2 | C1 | H22 | 177.6° | 169.9° |
| N1 | C2 | C3 | H23 | 171.4° | 61.8° |
| N1 | C2 | C3 | H24 | 62.8° | 170.7° |
| C25 | C26 | C18 | C19 | 178.2° | 180.0° |
| C25 | C26 | C18 | N2 | 9.7° | 0.0° |
| C26 | C25 | C24 | H12 | 179.7° | 180.0° |
| C26 | C18 | C19 | N2 | 171.7° | 180.0° |
| C26 | C18 | N2 | C17 | 96.2° | 152.0° |
| C26 | C18 | N2 | H13 | 83.8° | 27.9° |
| C18 | C26 | C25 | H14 | 0.9° | 0.0° |
| C26 | C18 | C19 | H16 | 177.8° | 180.0° |
| C3 | C4 | N | C | 94.8° | 84.4° |
| C3 | C4 | N | C5 | 105.0° | 102.9° |
| C3 | C4 | N | H1 | 126.2° | 127.3° |
| C3 | C4 | C5 | N1 | 37.0° | 33.0° |
| C3 | C4 | C5 | H1 | 124.8° | 125.9° |
| C3 | C4 | C5 | H2 | 81.8° | 85.9° |
| C3 | C4 | C5 | H3 | 155.9° | 151.9° |
| C4 | C3 | C2 | H20 | 179.7° | 178.8° |
| C4 | C3 | H23 | H24 | 127.9° | 127.6° |
| C19 | C18 | N2 | C17 | 75.4° | 28.0° |
| C19 | C18 | N2 | H13 | 104.6° | 152.0° |
| C18 | N2 | C17 | H13 | 180.0° | 180.0° |
| C18 | N2 | C17 | C8 | 165.7° | 175.4° |
| C18 | N2 | C17 | O2 | 7.8° | 4.6° |
| N2 | C18 | C19 | H16 | 10.5° | 0.0° |
| C | N | C4 | C5 | 160.2° | 172.6° |
| C | N | C4 | H1 | 31.4° | 42.9° |
| C | N | C1 | H21 | 108.6° | 122.4° |
| C | N | C1 | H22 | 13.8° | 0.2° |
| N | C | H26 | H27 | 120.0° | 120.0° |
| N | C | H26 | H28 | 120.0° | 120.0° |
| N | C | H27 | H28 | 120.0° | 120.0° |
| N | C4 | C5 | N1 | 68.9° | 71.0° |
| N | C4 | C5 | H1 | 129.2° | 130.1° |
| N | C4 | C5 | H2 | 172.3° | 170.0° |
| N | C4 | C5 | H3 | 49.9° | 47.9° |
| C4 | N | C1 | H21 | 126.6° | 117.1° |
| C4 | N | C1 | H22 | 111.0° | 120.8° |
| N | C4 | C3 | H23 | 64.0° | 170.8° |
| N | C4 | C3 | H24 | 170.1° | 61.8° |
| C4 | N | C | H26 | 59.4° | 57.4° |
| C4 | N | C | H27 | 179.4° | 62.6° |
| C4 | N | C | H28 | 60.6° | 177.4° |
| O | C6 | N1 | C7 | 177.8° | 180.0° |
| O | C6 | N1 | C5 | 114.6° | 180.0° |
| O | C6 | C7 | C8 | 32.4° | 4.1° |
| O | C6 | C7 | H4 | 88.5° | 124.1° |
| O | C6 | C7 | H5 | 153.4° | 115.9° |
| N2 | C17 | C8 | C7 | 13.6° | 53.9° |
| N2 | C17 | C8 | O2 | 173.6° | 180.0° |
| N2 | C17 | C8 | C9 | 98.7° | 173.8° |
| N2 | C17 | C8 | C16 | 145.8° | 66.0° |
| C6 | N1 | C5 | C4 | 174.0° | 178.0° |
| N1 | C6 | C7 | C8 | 149.8° | 175.9° |
| C6 | N1 | C5 | H2 | 67.2° | 59.1° |
| C6 | N1 | C5 | H3 | 55.1° | 63.1° |
| N1 | C6 | C7 | H4 | 89.2° | 56.0° |
| N1 | C6 | C7 | H5 | 28.8° | 64.1° |
| C6 | N1 | C2 | H20 | 25.3° | 16.8° |
| N1 | C5 | C4 | H2 | 118.8° | 118.9° |
| N1 | C5 | C4 | H3 | 118.8° | 118.9° |
| C5 | N1 | C6 | C7 | 67.6° | 0.0° |
| N1 | C5 | C4 | H1 | 161.9° | 158.9° |
| N1 | C5 | H2 | H3 | 123.4° | 122.2° |
| C5 | N1 | C2 | H20 | 158.9° | 162.9° |
| C4 | C5 | H2 | H3 | 123.3° | 122.1° |
| C5 | C4 | C3 | H23 | 172.4° | 64.2° |
| C5 | C4 | C3 | H24 | 61.8° | 168.3° |
| C6 | C7 | C8 | H4 | 121.0° | 120.0° |
| C6 | C7 | C8 | H5 | 121.0° | 120.0° |
| C6 | C7 | C8 | C17 | 61.3° | 56.8° |
| C6 | C7 | C8 | C9 | 168.6° | 63.2° |
| C6 | C7 | C8 | C16 | 70.9° | 176.7° |
| C6 | C7 | H4 | H5 | 116.9° | 120.0° |
| C7 | C8 | C17 | C9 | 112.3° | 120.0° |
| C7 | C8 | C17 | C16 | 132.2° | 119.9° |
| C7 | C8 | C17 | O2 | 172.8° | 126.1° |
| C7 | C8 | C9 | C16 | 120.5° | 120.0° |
| C7 | C8 | C9 | C10 | 84.7° | 168.3° |
| C7 | C8 | C16 | C15 | 76.5° | 42.2° |
| C7 | C8 | C16 | C11 | 109.1° | 137.9° |
| C8 | C7 | H4 | H5 | 116.9° | 120.0° |
| C7 | C8 | C9 | H18 | 154.9° | 72.0° |
| C7 | C8 | C9 | H19 | 35.6° | 48.6° |
| C17 | C8 | C9 | C16 | 115.5° | 120.0° |
| C17 | C8 | C9 | C10 | 151.2° | 71.7° |
| C17 | C8 | C16 | C15 | 60.4° | 77.8° |
| C17 | C8 | C16 | C11 | 114.1° | 102.2° |
| C17 | C8 | C7 | H4 | 59.7° | 176.7° |
| C17 | C8 | C7 | H5 | 177.7° | 63.2° |
| C8 | C17 | N2 | H13 | 14.3° | 4.6° |
| C17 | C8 | C9 | H18 | 30.8° | 48.0° |
| C17 | C8 | C9 | H19 | 88.4° | 168.5° |
| O2 | C17 | C8 | C9 | 74.9° | 6.2° |
| O2 | C17 | C8 | C16 | 40.5° | 114.0° |
| O2 | C17 | N2 | H13 | 172.2° | 175.5° |
| C8 | C9 | C10 | H18 | 120.4° | 119.7° |
| C8 | C9 | C10 | H19 | 120.4° | 119.8° |
| C9 | C8 | C16 | C15 | 166.3° | 162.2° |
| C9 | C8 | C16 | C11 | 8.2° | 17.8° |
| C8 | C9 | C10 | O1 | 59.4° | 64.7° |
| C9 | C8 | C7 | H4 | 47.6° | 56.8° |
| C9 | C8 | C7 | H5 | 70.5° | 176.8° |
| C8 | C9 | C10 | H6 | 179.6° | 175.5° |
| C8 | C9 | C10 | H7 | 60.8° | 55.0° |
| C8 | C9 | H18 | H19 | 118.9° | 120.6° |
| C16 | C8 | C9 | C10 | 35.7° | 48.3° |
| C8 | C16 | C15 | C11 | 174.6° | 180.0° |
| C8 | C16 | C15 | C14 | 172.9° | 179.9° |
| C8 | C16 | C11 | O1 | 2.0° | 0.4° |
| C8 | C16 | C11 | C12 | 175.7° | 179.7° |
| C16 | C8 | C7 | H4 | 168.1° | 63.4° |
| C16 | C8 | C7 | H5 | 50.0° | 56.7° |
| C8 | C16 | C15 | H9 | 7.1° | 0.1° |
| C16 | C8 | C9 | H18 | 84.6° | 168.0° |
| C16 | C8 | C9 | H19 | 156.1° | 71.5° |
| C9 | C10 | O1 | H6 | 120.2° | 119.7° |
| C9 | C10 | O1 | H7 | 120.2° | 119.7° |
| C9 | C10 | O1 | C11 | 53.6° | 49.1° |
| C9 | C10 | H6 | H7 | 119.3° | 120.5° |
| C10 | C9 | H18 | H19 | 118.8° | 120.5° |
| C16 | C15 | C14 | H9 | 180.0° | 180.0° |
| C16 | C15 | C14 | CL | 173.2° | 180.0° |
| C16 | C15 | C14 | C13 | 2.7° | 0.0° |
| C15 | C16 | C11 | O1 | 172.7° | 179.6° |
| C15 | C16 | C11 | C12 | 1.0° | 0.2° |
| C14 | C15 | C16 | C11 | 1.6° | 0.1° |
| C15 | C14 | CL | C13 | 176.1° | 180.0° |
| C15 | C14 | C13 | C12 | 1.0° | 0.0° |
| C15 | C14 | C13 | H8 | 179.0° | 180.0° |
| C16 | C11 | O1 | C10 | 25.2° | 17.1° |
| C16 | C11 | O1 | C12 | 174.1° | 179.9° |
| C16 | C11 | C12 | C13 | 2.7° | 0.2° |
| C11 | C16 | C15 | H9 | 178.3° | 179.9° |
| C16 | C11 | C12 | H17 | 177.3° | 179.9° |
| C10 | O1 | C11 | C12 | 160.7° | 163.1° |
| O1 | C10 | H6 | H7 | 119.4° | 120.6° |
| O1 | C10 | C9 | H18 | 61.0° | 175.6° |
| O1 | C10 | C9 | H19 | 179.8° | 55.0° |
| CL | C14 | C13 | C12 | 174.9° | 180.0° |
| CL | C14 | C13 | H8 | 5.1° | 0.0° |
| CL | C14 | C15 | H9 | 6.8° | 0.0° |
| C14 | C13 | C12 | C11 | 1.6° | 0.1° |
| C14 | C13 | C12 | H8 | 180.0° | 180.0° |
| C13 | C14 | C15 | H9 | 177.3° | 180.0° |
| C14 | C13 | C12 | H17 | 178.4° | 180.0° |
| O1 | C11 | C12 | C13 | 171.5° | 179.6° |
| C11 | O1 | C10 | H6 | 173.8° | 168.8° |
| C11 | O1 | C10 | H7 | 66.6° | 70.6° |
| O1 | C11 | C12 | H17 | 8.5° | 0.3° |
| C11 | C12 | C13 | H17 | 180.0° | 179.9° |
| C11 | C12 | C13 | H8 | 178.4° | 179.9° |
| H1 | C4 | C5 | H2 | 43.0° | 40.0° |
| H1 | C4 | C5 | H3 | 79.3° | 82.2° |
| H1 | C4 | C3 | H23 | 62.8° | 61.6° |
| H1 | C4 | C3 | H24 | 63.0° | 65.8° |
| H6 | C10 | C9 | H18 | 59.2° | 55.8° |
| H6 | C10 | C9 | H19 | 60.0° | 64.7° |
| H7 | C10 | C9 | H18 | 178.8° | 64.7° |
| H7 | C10 | C9 | H19 | 59.6° | 174.8° |
| H8 | C13 | C12 | H17 | 1.7° | 0.0° |
| H11 | C22 | C23 | H15 | 0.2° | 0.0° |
| H12 | C24 | C25 | H14 | 0.3° | 0.0° |
| H12 | C24 | C23 | H15 | 0.4° | 0.0° |
| H20 | C2 | C1 | H21 | 76.2° | 81.8° |
| H20 | C2 | C1 | H22 | 46.1° | 40.3° |
| H20 | C2 | C3 | H23 | 63.2° | 65.0° |
| H20 | C2 | C3 | H24 | 62.6° | 62.5° |
| H26 | C | H27 | H28 | 120.0° | 120.0° |
