QR9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | C1 | sing | 1.51Å | 1.50Å | |
| C23 | C24 | doub | 1.36Å | 1.36Å | Aromatic |
| C23 | C22 | sing | 1.40Å | 1.42Å | Aromatic |
| C24 | C25 | sing | 1.39Å | 1.39Å | Aromatic |
| C21 | C22 | doub | 1.40Å | 1.42Å | Aromatic |
| C21 | N3 | sing | 1.31Å | 1.33Å | Aromatic |
| C5 | C6 | sing | 1.56Å | 1.53Å | |
| C5 | C4 | sing | 1.58Å | 1.53Å | |
| C5 | N | sing | 1.48Å | 1.48Å | |
| C22 | C27 | sing | 1.42Å | 1.42Å | Aromatic |
| N3 | C20 | doub | 1.33Å | 1.34Å | Aromatic |
| C6 | N1 | sing | 1.48Å | 1.46Å | |
| C25 | C26 | doub | 1.36Å | 1.37Å | Aromatic |
| C1 | N | sing | 1.35Å | 1.36Å | |
| C1 | O | doub | 1.21Å | 1.23Å | |
| C4 | C3 | sing | 1.57Å | 1.53Å | |
| C27 | C26 | sing | 1.40Å | 1.42Å | Aromatic |
| C27 | C19 | doub | 1.41Å | 1.43Å | Aromatic |
| C20 | C19 | sing | 1.38Å | 1.40Å | Aromatic |
| N | C2 | sing | 1.48Å | 1.47Å | |
| C19 | N2 | sing | 1.40Å | 1.41Å | |
| N2 | C18 | sing | 1.35Å | 1.36Å | |
| N1 | C3 | sing | 1.49Å | 1.48Å | |
| N1 | C7 | sing | 1.35Å | 1.35Å | |
| C3 | C2 | sing | 1.56Å | 1.53Å | |
| C8 | C7 | sing | 1.51Å | 1.51Å | |
| C8 | C9 | sing | 1.53Å | 1.55Å | |
| C7 | O1 | doub | 1.21Å | 1.22Å | |
| C18 | C9 | sing | 1.51Å | 1.55Å | |
| C18 | O3 | doub | 1.21Å | 1.22Å | |
| C9 | C10 | sing | 1.53Å | 1.55Å | |
| C9 | C17 | sing | 1.51Å | 1.54Å | |
| C10 | C11 | sing | 1.53Å | 1.51Å | |
| C11 | O2 | sing | 1.43Å | 1.44Å | |
| C17 | C16 | doub | 1.38Å | 1.40Å | Aromatic |
| C17 | C12 | sing | 1.38Å | 1.41Å | Aromatic |
| C16 | C15 | sing | 1.38Å | 1.38Å | Aromatic |
| O2 | C12 | sing | 1.36Å | 1.37Å | |
| C12 | C13 | doub | 1.39Å | 1.39Å | Aromatic |
| C15 | CL | sing | 1.74Å | 1.75Å | |
| C15 | C14 | doub | 1.38Å | 1.38Å | Aromatic |
| C13 | C14 | sing | 1.38Å | 1.38Å | Aromatic |
| C4 | H1 | sing | 1.09Å | 1.10Å | |
| C4 | H2 | sing | 1.09Å | 1.10Å | |
| C5 | H3 | sing | 1.09Å | 1.10Å | |
| C6 | H4 | sing | 1.09Å | 1.10Å | |
| C6 | H5 | sing | 1.09Å | 1.10Å | |
| C8 | H6 | sing | 1.09Å | 1.10Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C10 | H8 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.09Å | 1.10Å | |
| C13 | H10 | sing | 1.08Å | 1.08Å | |
| C20 | H11 | sing | 1.08Å | 1.08Å | |
| C21 | H12 | sing | 1.08Å | 1.08Å | |
| C24 | H13 | sing | 1.08Å | 1.08Å | |
| C26 | H14 | sing | 1.08Å | 1.08Å | |
| N2 | H15 | sing | 0.97Å | 1.00Å | |
| C25 | H16 | sing | 1.08Å | 1.08Å | |
| C23 | H17 | sing | 1.08Å | 1.08Å | |
| C16 | H18 | sing | 1.08Å | 1.08Å | |
| C14 | H19 | sing | 1.08Å | 1.08Å | |
| C11 | H20 | sing | 1.09Å | 1.10Å | |
| C11 | H21 | sing | 1.09Å | 1.10Å | |
| C3 | H22 | sing | 1.09Å | 1.10Å | |
| C2 | H23 | sing | 1.09Å | 1.10Å | |
| C2 | H24 | sing | 1.09Å | 1.10Å | |
| C | H25 | sing | 1.09Å | 1.10Å | |
| C | H26 | sing | 1.09Å | 1.10Å | |
| C | H27 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C | C1 | N | 117.9° | 120.0° |
| C | C1 | O | 121.7° | 120.0° |
| C1 | C | H25 | 109.5° | 109.5° |
| C1 | C | H26 | 109.5° | 109.5° |
| C1 | C | H27 | 109.5° | 109.5° |
| C24 | C23 | C22 | 120.7° | 119.5° |
| C23 | C24 | C25 | 120.6° | 121.1° |
| C23 | C24 | H13 | 119.7° | 119.5° |
| C24 | C23 | H17 | 119.6° | 120.3° |
| C23 | C22 | C21 | 123.1° | 122.0° |
| C23 | C22 | C27 | 119.1° | 119.3° |
| C22 | C23 | H17 | 119.6° | 120.2° |
| C24 | C25 | C26 | 120.7° | 121.0° |
| C25 | C24 | H13 | 119.7° | 119.4° |
| C24 | C25 | H16 | 119.7° | 119.5° |
| C22 | C21 | N3 | 124.3° | 120.2° |
| C21 | C22 | C27 | 117.8° | 118.7° |
| C22 | C21 | H12 | 117.9° | 119.9° |
| C21 | N3 | C20 | 117.5° | 122.9° |
| N3 | C21 | H12 | 117.9° | 119.9° |
| C6 | C5 | C4 | 97.9° | 99.5° |
| C6 | C5 | N | 109.5° | 104.3° |
| C5 | C6 | N1 | 101.3° | 105.1° |
| C6 | C5 | H3 | 115.0° | 116.2° |
| C5 | C6 | H4 | 111.5° | 110.4° |
| C5 | C6 | H5 | 111.5° | 110.3° |
| C4 | C5 | N | 101.4° | 101.2° |
| C5 | C4 | C3 | 93.2° | 94.0° |
| C5 | C4 | H1 | 113.4° | 112.3° |
| C5 | C4 | H2 | 113.4° | 112.7° |
| C4 | C5 | H3 | 114.9° | 116.5° |
| C5 | N | C1 | 127.7° | 127.0° |
| C5 | N | C2 | 106.9° | 106.2° |
| N | C5 | H3 | 115.9° | 116.6° |
| C22 | C27 | C26 | 118.0° | 119.6° |
| C22 | C27 | C19 | 118.0° | 118.1° |
| N3 | C20 | C19 | 125.3° | 121.6° |
| N3 | C20 | H11 | 117.4° | 119.2° |
| C6 | N1 | C3 | 107.1° | 106.0° |
| C6 | N1 | C7 | 129.2° | 127.0° |
| N1 | C6 | H4 | 111.5° | 110.3° |
| N1 | C6 | H5 | 111.5° | 110.3° |
| C25 | C26 | C27 | 120.9° | 119.5° |
| C25 | C26 | H14 | 119.6° | 120.3° |
| C26 | C25 | H16 | 119.6° | 119.5° |
| N | C1 | O | 120.3° | 120.0° |
| C1 | N | C2 | 125.4° | 126.9° |
| C4 | C3 | N1 | 101.9° | 101.1° |
| C4 | C3 | C2 | 98.6° | 99.6° |
| C3 | C4 | H1 | 113.4° | 112.4° |
| C3 | C4 | H2 | 113.4° | 112.3° |
| C4 | C3 | H22 | 115.4° | 116.5° |
| C26 | C27 | C19 | 123.9° | 122.3° |
| C27 | C26 | H14 | 119.5° | 120.2° |
| C27 | C19 | C20 | 117.1° | 118.5° |
| C27 | C19 | N2 | 119.1° | 120.7° |
| C20 | C19 | N2 | 123.5° | 120.8° |
| C19 | C20 | H11 | 117.3° | 119.2° |
| N | C2 | C3 | 102.0° | 105.1° |
| N | C2 | H23 | 111.3° | 110.3° |
| N | C2 | H24 | 111.3° | 110.4° |
| C19 | N2 | C18 | 127.6° | 120.0° |
| C19 | N2 | H15 | 116.2° | 120.0° |
| N2 | C18 | C9 | 116.7° | 120.0° |
| N2 | C18 | O3 | 122.6° | 120.0° |
| C18 | N2 | H15 | 116.2° | 120.0° |
| C3 | N1 | C7 | 123.2° | 127.0° |
| N1 | C3 | C2 | 106.8° | 104.1° |
| N1 | C3 | H22 | 116.4° | 116.1° |
| N1 | C7 | C8 | 117.8° | 120.0° |
| N1 | C7 | O1 | 119.2° | 120.0° |
| C2 | C3 | H22 | 115.5° | 116.9° |
| C3 | C2 | H23 | 111.3° | 110.3° |
| C3 | C2 | H24 | 111.3° | 110.4° |
| C7 | C8 | C9 | 114.6° | 109.5° |
| C8 | C7 | O1 | 123.0° | 120.0° |
| C7 | C8 | H6 | 108.2° | 109.5° |
| C7 | C8 | H7 | 108.2° | 109.4° |
| C8 | C9 | C18 | 113.5° | 109.5° |
| C8 | C9 | C10 | 111.2° | 109.5° |
| C8 | C9 | C17 | 109.3° | 109.4° |
| C9 | C8 | H6 | 108.2° | 109.5° |
| C9 | C8 | H7 | 108.2° | 109.5° |
| C9 | C18 | O3 | 120.7° | 119.9° |
| C18 | C9 | C10 | 103.3° | 109.4° |
| C18 | C9 | C17 | 109.8° | 109.4° |
| C10 | C9 | C17 | 109.6° | 109.6° |
| C9 | C10 | C11 | 111.8° | 108.3° |
| C9 | C10 | H8 | 108.9° | 109.7° |
| C9 | C10 | H9 | 108.9° | 109.7° |
| C9 | C17 | C16 | 120.7° | 118.7° |
| C9 | C17 | C12 | 121.3° | 121.4° |
| C10 | C11 | O2 | 111.8° | 108.4° |
| C11 | C10 | H8 | 108.9° | 109.8° |
| C11 | C10 | H9 | 108.9° | 109.7° |
| C10 | C11 | H20 | 108.9° | 109.6° |
| C10 | C11 | H21 | 108.9° | 109.7° |
| C11 | O2 | C12 | 115.8° | 117.9° |
| O2 | C11 | H20 | 108.9° | 109.7° |
| O2 | C11 | H21 | 108.9° | 109.7° |
| C16 | C17 | C12 | 118.0° | 119.8° |
| C17 | C16 | C15 | 119.6° | 120.3° |
| C17 | C16 | H18 | 120.2° | 119.9° |
| C17 | C12 | O2 | 123.0° | 121.8° |
| C17 | C12 | C13 | 121.6° | 119.7° |
| C16 | C15 | CL | 118.9° | 120.1° |
| C16 | C15 | C14 | 122.0° | 119.9° |
| C15 | C16 | H18 | 120.2° | 119.8° |
| O2 | C12 | C13 | 115.3° | 118.5° |
| C12 | C13 | C14 | 119.5° | 120.2° |
| C12 | C13 | H10 | 120.3° | 119.9° |
| CL | C15 | C14 | 119.1° | 120.0° |
| C15 | C14 | C13 | 119.3° | 120.0° |
| C15 | C14 | H19 | 120.4° | 120.0° |
| C14 | C13 | H10 | 120.3° | 119.9° |
| C13 | C14 | H19 | 120.3° | 120.0° |
| H1 | C4 | H2 | 109.5° | 112.0° |
| H4 | C6 | H5 | 109.5° | 110.4° |
| H6 | C8 | H7 | 109.5° | 109.5° |
| H8 | C10 | H9 | 109.5° | 109.7° |
| H20 | C11 | H21 | 109.5° | 109.7° |
| H23 | C2 | H24 | 109.4° | 110.2° |
| H25 | C | H26 | 109.5° | 109.4° |
| H25 | C | H27 | 109.5° | 109.4° |
| H26 | C | H27 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C | C1 | N | C5 | 43.6° | 180.0° |
| C | C1 | N | O | 177.5° | 180.0° |
| C | C1 | N | C2 | 134.2° | 0.1° |
| C1 | C | H25 | H26 | 120.0° | 120.0° |
| C1 | C | H25 | H27 | 120.0° | 120.0° |
| C1 | C | H26 | H27 | 120.0° | 120.0° |
| C24 | C23 | C22 | H17 | 180.0° | 179.9° |
| C23 | C24 | C25 | H13 | 180.0° | 180.0° |
| C24 | C23 | C22 | C21 | 179.6° | 179.9° |
| C24 | C23 | C22 | C27 | 0.6° | 0.1° |
| C23 | C24 | C25 | C26 | 0.5° | 0.1° |
| C23 | C24 | C25 | H16 | 179.5° | 179.9° |
| C22 | C23 | C24 | C25 | 0.2° | 0.1° |
| C23 | C22 | C21 | C27 | 179.8° | 180.0° |
| C23 | C22 | C21 | N3 | 180.0° | 180.0° |
| C23 | C22 | C27 | C26 | 1.1° | 0.0° |
| C23 | C22 | C27 | C19 | 178.1° | 180.0° |
| C23 | C22 | C21 | H12 | 0.1° | 0.0° |
| C22 | C23 | C24 | H13 | 179.8° | 179.9° |
| C24 | C25 | C26 | H16 | 180.0° | 180.0° |
| C24 | C25 | C26 | C27 | 0.0° | 0.0° |
| C24 | C25 | C26 | H14 | 180.0° | 180.0° |
| C25 | C24 | C23 | H17 | 179.8° | 180.0° |
| C22 | C21 | N3 | H12 | 180.0° | 180.0° |
| C22 | C21 | N3 | C20 | 1.0° | 0.0° |
| C21 | C22 | C27 | C26 | 179.1° | 180.0° |
| C21 | C22 | C27 | C19 | 1.6° | 0.1° |
| C21 | C22 | C23 | H17 | 0.4° | 0.0° |
| N3 | C21 | C22 | C27 | 0.2° | 0.0° |
| C21 | N3 | C20 | C19 | 0.1° | 0.0° |
| C21 | N3 | C20 | H11 | 179.9° | 179.9° |
| C6 | C5 | C4 | N | 111.8° | 106.8° |
| C6 | C5 | C4 | H3 | 122.4° | 125.8° |
| C6 | C5 | N | H3 | 132.1° | 129.7° |
| C5 | C6 | N1 | H4 | 118.7° | 118.9° |
| C5 | C6 | N1 | H5 | 118.6° | 118.9° |
| C6 | C5 | N | C1 | 103.2° | 113.3° |
| C6 | C5 | C4 | C3 | 59.1° | 52.2° |
| C6 | C5 | N | C2 | 74.9° | 66.6° |
| C5 | C6 | N1 | C3 | 13.9° | 2.0° |
| C5 | C6 | N1 | C7 | 158.7° | 178.2° |
| C6 | C5 | C4 | H1 | 176.3° | 168.3° |
| C6 | C5 | C4 | H2 | 58.1° | 64.1° |
| C5 | C6 | H4 | H5 | 123.8° | 122.2° |
| C4 | C5 | N | H3 | 125.1° | 127.4° |
| C4 | C5 | C6 | N1 | 46.5° | 32.9° |
| C4 | C5 | N | C1 | 154.0° | 143.7° |
| C5 | C4 | C3 | H1 | 117.2° | 116.1° |
| C5 | C4 | C3 | H2 | 117.2° | 116.6° |
| C4 | C5 | N | C2 | 27.8° | 36.4° |
| C5 | C4 | C3 | N1 | 51.0° | 54.7° |
| C5 | C4 | C3 | C2 | 58.3° | 51.8° |
| C5 | C4 | H1 | H2 | 127.6° | 128.0° |
| C4 | C5 | C6 | H4 | 72.1° | 151.8° |
| C4 | C5 | C6 | H5 | 165.1° | 86.0° |
| C5 | C4 | C3 | H22 | 178.2° | 178.4° |
| N | C5 | C6 | N1 | 58.6° | 71.3° |
| C5 | N | C1 | C2 | 177.8° | 179.9° |
| C5 | N | C1 | O | 138.9° | 0.0° |
| N | C5 | C4 | C3 | 52.7° | 54.6° |
| C5 | N | C2 | C3 | 9.6° | 2.2° |
| N | C5 | C4 | H1 | 64.5° | 61.5° |
| N | C5 | C4 | H2 | 169.9° | 170.8° |
| N | C5 | C6 | H4 | 177.3° | 47.6° |
| N | C5 | C6 | H5 | 60.0° | 169.8° |
| C5 | N | C2 | H23 | 128.4° | 121.1° |
| C5 | N | C2 | H24 | 109.2° | 116.8° |
| C22 | C27 | C26 | C25 | 0.8° | 0.0° |
| C22 | C27 | C26 | C19 | 179.2° | 180.0° |
| C22 | C27 | C19 | C20 | 2.6° | 0.1° |
| C22 | C27 | C19 | N2 | 171.7° | 179.9° |
| C27 | C22 | C21 | H12 | 179.8° | 179.9° |
| C22 | C27 | C26 | H14 | 179.2° | 180.0° |
| C27 | C22 | C23 | H17 | 179.4° | 180.0° |
| N3 | C20 | C19 | C27 | 1.9° | 0.0° |
| N3 | C20 | C19 | H11 | 180.0° | 179.9° |
| N3 | C20 | C19 | N2 | 172.1° | 180.0° |
| C20 | N3 | C21 | H12 | 179.0° | 180.0° |
| C6 | N1 | C3 | C4 | 24.1° | 36.5° |
| C6 | N1 | C3 | C7 | 173.1° | 179.8° |
| C6 | N1 | C3 | C2 | 78.8° | 66.5° |
| C6 | N1 | C7 | C8 | 35.7° | 0.3° |
| C6 | N1 | C7 | O1 | 143.7° | 179.7° |
| N1 | C6 | C5 | H3 | 168.8° | 158.8° |
| N1 | C6 | H4 | H5 | 123.8° | 122.1° |
| C6 | N1 | C3 | H22 | 150.5° | 163.6° |
| C25 | C26 | C27 | H14 | 180.0° | 180.0° |
| C25 | C26 | C27 | C19 | 178.4° | 180.0° |
| C26 | C25 | C24 | H13 | 179.5° | 180.0° |
| C1 | N | C2 | C3 | 168.6° | 178.0° |
| C1 | N | C5 | H3 | 28.9° | 16.4° |
| C1 | N | C2 | H23 | 49.8° | 59.0° |
| C1 | N | C2 | H24 | 72.6° | 63.0° |
| N | C1 | C | H25 | 177.4° | 90.0° |
| N | C1 | C | H26 | 57.4° | 150.0° |
| N | C1 | C | H27 | 62.6° | 30.0° |
| O | C1 | N | C2 | 43.2° | 179.9° |
| O | C1 | C | H25 | 0.0° | 90.0° |
| O | C1 | C | H26 | 120.0° | 30.0° |
| O | C1 | C | H27 | 120.0° | 150.0° |
| C4 | C3 | C2 | N | 43.4° | 32.8° |
| C4 | C3 | N1 | C2 | 102.9° | 103.0° |
| C4 | C3 | N1 | H22 | 126.4° | 127.1° |
| C4 | C3 | N1 | C7 | 162.8° | 143.7° |
| C4 | C3 | C2 | H22 | 123.5° | 126.4° |
| C3 | C4 | H1 | H2 | 127.7° | 127.5° |
| C3 | C4 | C5 | H3 | 178.5° | 177.9° |
| C4 | C3 | C2 | H23 | 162.2° | 86.1° |
| C4 | C3 | C2 | H24 | 75.4° | 151.8° |
| C26 | C27 | C19 | C20 | 178.3° | 180.0° |
| C26 | C27 | C19 | N2 | 7.5° | 0.0° |
| C27 | C26 | C25 | H16 | 180.0° | 180.0° |
| C27 | C19 | C20 | N2 | 174.0° | 180.0° |
| C27 | C19 | N2 | C18 | 100.8° | 151.8° |
| C27 | C19 | C20 | H11 | 178.1° | 180.0° |
| C19 | C27 | C26 | H14 | 1.6° | 0.0° |
| C27 | C19 | N2 | H15 | 79.2° | 28.2° |
| C20 | C19 | N2 | C18 | 73.0° | 28.2° |
| C20 | C19 | N2 | H15 | 107.0° | 151.8° |
| N | C2 | C3 | N1 | 61.9° | 71.3° |
| N | C2 | C3 | H23 | 118.8° | 118.9° |
| N | C2 | C3 | H24 | 118.8° | 119.0° |
| C2 | N | C5 | H3 | 153.0° | 163.8° |
| N | C2 | C3 | H22 | 166.9° | 159.2° |
| N | C2 | H23 | H24 | 123.5° | 122.1° |
| C19 | N2 | C18 | H15 | 180.0° | 180.0° |
| C19 | N2 | C18 | C9 | 178.7° | 175.2° |
| C19 | N2 | C18 | O3 | 3.2° | 4.8° |
| N2 | C19 | C20 | H11 | 7.9° | 0.0° |
| N2 | C18 | C9 | C8 | 37.8° | 54.3° |
| N2 | C18 | C9 | O3 | 178.1° | 180.0° |
| N2 | C18 | C9 | C10 | 82.7° | 174.2° |
| N2 | C18 | C9 | C17 | 160.5° | 65.6° |
| N1 | C3 | C2 | H22 | 131.2° | 129.5° |
| C3 | N1 | C7 | C8 | 152.9° | 180.0° |
| C3 | N1 | C7 | O1 | 27.7° | 0.0° |
| N1 | C3 | C4 | H1 | 168.2° | 170.8° |
| N1 | C3 | C4 | H2 | 66.2° | 61.9° |
| C3 | N1 | C6 | H4 | 104.8° | 117.0° |
| C3 | N1 | C6 | H5 | 132.5° | 120.9° |
| N1 | C3 | C2 | H23 | 56.9° | 169.8° |
| N1 | C3 | C2 | H24 | 179.3° | 47.7° |
| C7 | N1 | C3 | C2 | 94.3° | 113.3° |
| N1 | C7 | C8 | O1 | 179.4° | 180.0° |
| N1 | C7 | C8 | C9 | 157.9° | 178.9° |
| C7 | N1 | C6 | H4 | 82.7° | 62.8° |
| C7 | N1 | C6 | H5 | 40.0° | 59.3° |
| N1 | C7 | C8 | H6 | 81.4° | 58.8° |
| N1 | C7 | C8 | H7 | 37.1° | 61.1° |
| C7 | N1 | C3 | H22 | 36.4° | 16.6° |
| C2 | C3 | C4 | H1 | 58.9° | 64.3° |
| C2 | C3 | C4 | H2 | 175.5° | 168.4° |
| C3 | C2 | H23 | H24 | 123.5° | 122.1° |
| C7 | C8 | C9 | H6 | 120.8° | 120.0° |
| C7 | C8 | C9 | H7 | 120.8° | 120.0° |
| C7 | C8 | C9 | C18 | 173.8° | 56.9° |
| C7 | C8 | C9 | C10 | 57.9° | 63.1° |
| C7 | C8 | C9 | C17 | 63.2° | 176.8° |
| C7 | C8 | H6 | H7 | 117.7° | 119.9° |
| C9 | C8 | C7 | O1 | 21.5° | 1.1° |
| C8 | C9 | C18 | C10 | 120.5° | 119.9° |
| C8 | C9 | C18 | C17 | 122.7° | 119.9° |
| C8 | C9 | C18 | O3 | 144.1° | 125.7° |
| C8 | C9 | C10 | C17 | 121.0° | 120.1° |
| C8 | C9 | C10 | C11 | 162.0° | 168.3° |
| C8 | C9 | C17 | C16 | 42.3° | 42.1° |
| C8 | C9 | C17 | C12 | 137.8° | 138.1° |
| C9 | C8 | H6 | H7 | 117.6° | 120.0° |
| C8 | C9 | C10 | H8 | 77.7° | 71.9° |
| C8 | C9 | C10 | H9 | 41.6° | 48.6° |
| O1 | C7 | C8 | H6 | 99.3° | 121.2° |
| O1 | C7 | C8 | H7 | 142.3° | 118.9° |
| C18 | C9 | C10 | C17 | 117.0° | 120.0° |
| C18 | C9 | C10 | C11 | 76.0° | 71.8° |
| C18 | C9 | C17 | C16 | 82.7° | 77.8° |
| C18 | C9 | C17 | C12 | 97.1° | 102.0° |
| C18 | C9 | C8 | H6 | 65.4° | 176.9° |
| C18 | C9 | C8 | H7 | 53.1° | 63.1° |
| C18 | C9 | C10 | H8 | 44.3° | 48.0° |
| C18 | C9 | C10 | H9 | 163.6° | 168.6° |
| C9 | C18 | N2 | H15 | 1.2° | 4.9° |
| O3 | C18 | C9 | C10 | 95.5° | 5.7° |
| O3 | C18 | C9 | C17 | 21.4° | 114.4° |
| O3 | C18 | N2 | H15 | 176.8° | 175.2° |
| C9 | C10 | C11 | H8 | 120.4° | 119.7° |
| C9 | C10 | C11 | H9 | 120.3° | 119.7° |
| C9 | C10 | C11 | O2 | 59.3° | 64.6° |
| C10 | C9 | C17 | C16 | 164.4° | 162.2° |
| C10 | C9 | C17 | C12 | 15.7° | 18.1° |
| C10 | C9 | C8 | H6 | 178.7° | 57.0° |
| C10 | C9 | C8 | H7 | 62.8° | 177.0° |
| C9 | C10 | H8 | H9 | 118.9° | 120.5° |
| C9 | C10 | C11 | H20 | 61.0° | 55.1° |
| C9 | C10 | C11 | H21 | 179.7° | 175.6° |
| C17 | C9 | C10 | C11 | 41.0° | 48.2° |
| C9 | C17 | C16 | C12 | 179.9° | 179.7° |
| C9 | C17 | C16 | C15 | 178.7° | 179.6° |
| C9 | C17 | C12 | O2 | 5.9° | 0.8° |
| C9 | C17 | C12 | C13 | 177.6° | 179.5° |
| C17 | C9 | C8 | H6 | 57.5° | 63.2° |
| C17 | C9 | C8 | H7 | 176.0° | 56.8° |
| C17 | C9 | C10 | H8 | 161.3° | 168.0° |
| C17 | C9 | C10 | H9 | 79.4° | 71.4° |
| C9 | C17 | C16 | H18 | 1.3° | 0.4° |
| C10 | C11 | O2 | H20 | 120.4° | 119.7° |
| C10 | C11 | O2 | H21 | 120.4° | 119.8° |
| C10 | C11 | O2 | C12 | 48.9° | 49.1° |
| C11 | C10 | H8 | H9 | 118.9° | 120.5° |
| C10 | C11 | H20 | H21 | 118.9° | 120.5° |
| C11 | O2 | C12 | C17 | 22.5° | 17.4° |
| C11 | O2 | C12 | C13 | 160.8° | 162.9° |
| O2 | C11 | C10 | H8 | 179.7° | 175.6° |
| O2 | C11 | C10 | H9 | 61.0° | 55.1° |
| O2 | C11 | H20 | H21 | 118.9° | 120.6° |
| C17 | C16 | C15 | H18 | 180.0° | 179.9° |
| C16 | C17 | C12 | O2 | 174.2° | 179.5° |
| C16 | C17 | C12 | C13 | 2.2° | 0.3° |
| C17 | C16 | C15 | CL | 179.8° | 180.0° |
| C17 | C16 | C15 | C14 | 0.8° | 0.1° |
| C12 | C17 | C16 | C15 | 1.1° | 0.1° |
| C17 | C12 | O2 | C13 | 176.7° | 179.7° |
| C17 | C12 | C13 | C14 | 1.4° | 0.2° |
| C17 | C12 | C13 | H10 | 178.6° | 179.7° |
| C12 | C17 | C16 | H18 | 178.9° | 179.8° |
| C16 | C15 | CL | C14 | 179.5° | 179.8° |
| C16 | C15 | C14 | C13 | 1.7° | 0.2° |
| C16 | C15 | C14 | H19 | 178.3° | 179.7° |
| O2 | C12 | C13 | C14 | 175.3° | 179.6° |
| O2 | C12 | C13 | H10 | 4.6° | 0.6° |
| C12 | O2 | C11 | H20 | 71.4° | 70.6° |
| C12 | O2 | C11 | H21 | 169.3° | 168.9° |
| C12 | C13 | C14 | C15 | 0.6° | 0.1° |
| C12 | C13 | C14 | H10 | 180.0° | 179.9° |
| C12 | C13 | C14 | H19 | 179.4° | 179.9° |
| CL | C15 | C14 | C13 | 178.9° | 179.9° |
| CL | C15 | C16 | H18 | 0.2° | 0.1° |
| CL | C15 | C14 | H19 | 1.1° | 0.1° |
| C15 | C14 | C13 | H19 | 180.0° | 180.0° |
| C15 | C14 | C13 | H10 | 179.4° | 180.0° |
| C14 | C15 | C16 | H18 | 179.2° | 179.9° |
| H1 | C4 | C5 | H3 | 61.3° | 65.9° |
| H1 | C4 | C3 | H22 | 64.6° | 62.3° |
| H2 | C4 | C5 | H3 | 64.3° | 61.7° |
| H2 | C4 | C3 | H22 | 60.9° | 65.0° |
| H3 | C5 | C6 | H4 | 50.2° | 82.3° |
| H3 | C5 | C6 | H5 | 72.6° | 40.0° |
| H8 | C10 | C11 | H20 | 59.4° | 64.6° |
| H8 | C10 | C11 | H21 | 59.9° | 55.8° |
| H9 | C10 | C11 | H20 | 178.7° | 174.8° |
| H9 | C10 | C11 | H21 | 59.4° | 64.7° |
| H10 | C13 | C14 | H19 | 0.6° | 0.0° |
| H13 | C24 | C25 | H16 | 0.5° | 0.0° |
| H13 | C24 | C23 | H17 | 0.2° | 0.0° |
| H14 | C26 | C25 | H16 | 0.0° | 0.0° |
| H22 | C3 | C2 | H23 | 74.3° | 40.3° |
| H22 | C3 | C2 | H24 | 48.1° | 81.8° |
| H25 | C | H26 | H27 | 120.0° | 119.9° |
