9M6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C4 | C5 | sing | 1.54Å | 1.52Å | |
| C4 | C3 | sing | 1.54Å | 1.54Å | |
| C5 | C2 | sing | 1.55Å | 1.54Å | |
| C3 | C1 | sing | 1.54Å | 1.55Å | |
| C7 | C8 | doub | 1.38Å | 1.41Å | Aromatic |
| C7 | C6 | sing | 1.38Å | 1.42Å | Aromatic |
| C2 | C1 | sing | 1.55Å | 1.51Å | |
| O1 | C13 | sing | 1.43Å | 1.43Å | |
| C8 | C17 | sing | 1.39Å | 1.42Å | Aromatic |
| C1 | C6 | sing | 1.51Å | 1.56Å | |
| C13 | C14 | sing | 1.53Å | 1.56Å | |
| C10 | C16 | doub | 1.38Å | 1.39Å | Aromatic |
| C10 | C9 | sing | 1.39Å | 1.42Å | Aromatic |
| C6 | C20 | doub | 1.38Å | 1.41Å | Aromatic |
| C16 | C15 | sing | 1.38Å | 1.42Å | Aromatic |
| C17 | C9 | sing | 1.48Å | 1.47Å | |
| C17 | C18 | doub | 1.39Å | 1.41Å | Aromatic |
| C9 | C11 | doub | 1.39Å | 1.42Å | Aromatic |
| O2 | S1 | doub | 1.42Å | 1.50Å | |
| C20 | C18 | sing | 1.38Å | 1.44Å | Aromatic |
| C20 | C19 | sing | 1.51Å | 1.50Å | |
| C14 | S1 | sing | 1.81Å | 1.87Å | |
| C15 | S1 | sing | 1.76Å | 1.82Å | |
| C15 | C12 | doub | 1.38Å | 1.38Å | Aromatic |
| S1 | O3 | doub | 1.42Å | 1.50Å | |
| C11 | C12 | sing | 1.38Å | 1.38Å | Aromatic |
| N1 | C26 | doub | 1.32Å | 1.41Å | Aromatic |
| N1 | C22 | sing | 1.32Å | 1.38Å | Aromatic |
| C19 | C27 | sing | 1.53Å | 1.55Å | |
| C19 | C21 | sing | 1.53Å | 1.49Å | |
| C26 | C25 | sing | 1.38Å | 1.44Å | Aromatic |
| C27 | C22 | sing | 1.51Å | 1.55Å | |
| C27 | C21 | sing | 1.53Å | 1.53Å | |
| C22 | C23 | doub | 1.38Å | 1.46Å | Aromatic |
| C25 | C24 | doub | 1.39Å | 1.41Å | Aromatic |
| C23 | C24 | sing | 1.39Å | 1.44Å | Aromatic |
| C2 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C12 | H3 | sing | 1.08Å | 1.08Å | |
| C13 | H4 | sing | 1.09Å | 1.10Å | |
| C13 | H5 | sing | 1.09Å | 1.10Å | |
| C14 | H6 | sing | 1.09Å | 1.10Å | |
| C14 | H7 | sing | 1.09Å | 1.10Å | |
| C18 | H8 | sing | 1.08Å | 1.08Å | |
| C19 | H9 | sing | 1.09Å | 1.10Å | |
| C5 | H10 | sing | 1.09Å | 1.10Å | |
| C5 | H11 | sing | 1.09Å | 1.10Å | |
| C7 | H12 | sing | 1.08Å | 1.08Å | |
| O1 | H13 | sing | 0.97Å | 0.95Å | |
| C16 | H14 | sing | 1.08Å | 1.08Å | |
| C10 | H15 | sing | 1.08Å | 1.08Å | |
| C11 | H16 | sing | 1.08Å | 1.08Å | |
| C8 | H17 | sing | 1.08Å | 1.08Å | |
| C1 | H18 | sing | 1.09Å | 1.10Å | |
| C3 | H19 | sing | 1.09Å | 1.10Å | |
| C3 | H20 | sing | 1.09Å | 1.10Å | |
| C4 | H21 | sing | 1.09Å | 1.10Å | |
| C4 | H22 | sing | 1.09Å | 1.10Å | |
| C27 | H23 | sing | 1.09Å | 1.10Å | |
| C21 | H24 | sing | 1.09Å | 1.10Å | |
| C21 | H25 | sing | 1.09Å | 1.10Å | |
| C23 | H26 | sing | 1.08Å | 1.08Å | |
| C24 | H27 | sing | 1.08Å | 1.08Å | |
| C25 | H28 | sing | 1.08Å | 1.08Å | |
| C26 | H29 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C5 | C4 | C3 | 103.5° | 106.6° |
| C4 | C5 | C2 | 105.4° | 104.2° |
| C4 | C5 | H10 | 110.5° | 110.5° |
| C4 | C5 | H11 | 110.5° | 110.7° |
| C5 | C4 | H21 | 110.9° | 110.0° |
| C5 | C4 | H22 | 110.9° | 110.0° |
| C4 | C3 | C1 | 102.3° | 106.6° |
| C4 | C3 | H19 | 111.2° | 110.1° |
| C4 | C3 | H20 | 111.2° | 110.1° |
| C3 | C4 | H21 | 111.0° | 110.1° |
| C3 | C4 | H22 | 110.9° | 110.0° |
| C5 | C2 | C1 | 106.5° | 102.7° |
| C5 | C2 | H1 | 110.2° | 110.7° |
| C5 | C2 | H2 | 110.2° | 110.9° |
| C2 | C5 | H10 | 110.5° | 110.5° |
| C2 | C5 | H11 | 110.5° | 110.5° |
| C3 | C1 | C2 | 99.0° | 104.2° |
| C3 | C1 | C6 | 122.2° | 110.5° |
| C3 | C1 | H18 | 108.1° | 110.6° |
| C1 | C3 | H19 | 111.2° | 110.0° |
| C1 | C3 | H20 | 111.2° | 110.0° |
| C8 | C7 | C6 | 120.4° | 120.1° |
| C7 | C8 | C17 | 121.9° | 119.9° |
| C8 | C7 | H12 | 119.8° | 119.9° |
| C7 | C8 | H17 | 119.1° | 120.1° |
| C7 | C6 | C1 | 119.5° | 119.9° |
| C7 | C6 | C20 | 118.8° | 120.2° |
| C6 | C7 | H12 | 119.8° | 119.9° |
| C2 | C1 | C6 | 110.3° | 110.5° |
| C1 | C2 | H1 | 110.2° | 110.8° |
| C1 | C2 | H2 | 110.2° | 110.7° |
| C2 | C1 | H18 | 108.5° | 110.5° |
| O1 | C13 | C14 | 103.0° | 109.5° |
| O1 | C13 | H4 | 111.0° | 109.5° |
| O1 | C13 | H5 | 111.1° | 109.4° |
| C13 | O1 | H13 | 109.5° | 114.0° |
| C8 | C17 | C9 | 120.3° | 120.1° |
| C8 | C17 | C18 | 117.6° | 119.8° |
| C17 | C8 | H17 | 119.0° | 120.1° |
| C1 | C6 | C20 | 121.8° | 119.9° |
| C6 | C1 | H18 | 108.0° | 110.4° |
| C13 | C14 | S1 | 111.7° | 109.4° |
| C14 | C13 | H4 | 111.1° | 109.5° |
| C14 | C13 | H5 | 111.1° | 109.5° |
| C13 | C14 | H6 | 108.9° | 109.5° |
| C13 | C14 | H7 | 108.9° | 109.5° |
| C16 | C10 | C9 | 122.5° | 119.9° |
| C10 | C16 | C15 | 115.1° | 120.1° |
| C10 | C16 | H14 | 122.4° | 120.0° |
| C16 | C10 | H15 | 118.8° | 120.1° |
| C10 | C9 | C17 | 123.1° | 120.1° |
| C10 | C9 | C11 | 119.6° | 119.8° |
| C9 | C10 | H15 | 118.7° | 120.1° |
| C6 | C20 | C18 | 120.3° | 120.2° |
| C6 | C20 | C19 | 118.5° | 119.9° |
| C16 | C15 | S1 | 120.5° | 119.9° |
| C16 | C15 | C12 | 123.8° | 120.2° |
| C15 | C16 | H14 | 122.4° | 119.9° |
| C9 | C17 | C18 | 122.1° | 120.1° |
| C17 | C9 | C11 | 117.2° | 120.1° |
| C17 | C18 | C20 | 121.1° | 119.8° |
| C17 | C18 | H8 | 119.5° | 120.1° |
| C9 | C11 | C12 | 118.5° | 119.8° |
| C9 | C11 | H16 | 120.8° | 120.0° |
| O2 | S1 | C14 | 103.5° | 110.5° |
| O2 | S1 | C15 | 102.5° | 104.2° |
| O2 | S1 | O3 | 129.4° | 121.1° |
| C18 | C20 | C19 | 121.0° | 119.9° |
| C20 | C18 | H8 | 119.5° | 120.1° |
| C20 | C19 | C27 | 115.1° | 117.6° |
| C20 | C19 | C21 | 124.8° | 117.5° |
| C20 | C19 | H9 | 115.0° | 115.5° |
| C14 | S1 | C15 | 107.8° | 104.4° |
| C14 | S1 | O3 | 106.1° | 110.6° |
| S1 | C14 | H6 | 108.9° | 109.5° |
| S1 | C14 | H7 | 108.9° | 109.5° |
| S1 | C15 | C12 | 115.6° | 119.9° |
| C15 | S1 | O3 | 106.1° | 104.3° |
| C15 | C12 | C11 | 120.4° | 120.2° |
| C15 | C12 | H3 | 119.8° | 120.0° |
| C11 | C12 | H3 | 119.8° | 119.9° |
| C12 | C11 | H16 | 120.7° | 120.1° |
| C26 | N1 | C22 | 120.1° | 121.7° |
| N1 | C26 | C25 | 126.2° | 120.8° |
| N1 | C26 | H29 | 116.9° | 119.7° |
| N1 | C22 | C27 | 119.5° | 119.6° |
| N1 | C22 | C23 | 115.3° | 120.8° |
| C27 | C19 | C21 | 60.2° | 60.0° |
| C19 | C27 | C22 | 127.6° | 117.5° |
| C19 | C27 | C21 | 57.6° | 60.0° |
| C27 | C19 | H9 | 114.1° | 117.5° |
| C19 | C27 | H23 | 114.3° | 117.5° |
| C19 | C21 | C27 | 62.1° | 60.0° |
| C21 | C19 | H9 | 115.3° | 117.5° |
| C19 | C21 | H24 | 119.6° | 117.5° |
| C19 | C21 | H25 | 119.7° | 117.5° |
| C26 | C25 | C24 | 114.9° | 119.1° |
| C26 | C25 | H28 | 122.6° | 120.5° |
| C25 | C26 | H29 | 116.9° | 119.5° |
| C22 | C27 | C21 | 115.1° | 117.5° |
| C27 | C22 | C23 | 125.1° | 119.6° |
| C22 | C27 | H23 | 114.3° | 115.6° |
| C21 | C27 | H23 | 114.8° | 117.5° |
| C27 | C21 | H24 | 119.6° | 117.5° |
| C27 | C21 | H25 | 119.7° | 117.5° |
| C22 | C23 | C24 | 124.7° | 119.2° |
| C22 | C23 | H26 | 117.6° | 120.4° |
| C25 | C24 | C23 | 118.8° | 118.4° |
| C25 | C24 | H27 | 120.6° | 120.8° |
| C24 | C25 | H28 | 122.6° | 120.4° |
| C24 | C23 | H26 | 117.6° | 120.4° |
| C23 | C24 | H27 | 120.6° | 120.8° |
| H1 | C2 | H2 | 109.4° | 110.7° |
| H4 | C13 | H5 | 109.5° | 109.5° |
| H6 | C14 | H7 | 109.5° | 109.5° |
| H10 | C5 | H11 | 109.5° | 110.4° |
| H19 | C3 | H20 | 109.5° | 110.0° |
| H21 | C4 | H22 | 109.4° | 110.0° |
| H24 | C21 | H25 | 109.5° | 115.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C5 | C4 | C3 | H21 | 119.1° | 119.3° |
| C5 | C4 | C3 | H22 | 119.1° | 119.3° |
| C4 | C5 | C2 | H10 | 119.4° | 118.7° |
| C4 | C5 | C2 | H11 | 119.4° | 118.9° |
| C5 | C4 | C3 | C1 | 39.1° | 0.1° |
| C4 | C5 | C2 | C1 | 15.6° | 37.9° |
| C4 | C5 | C2 | H1 | 103.9° | 80.4° |
| C4 | C5 | C2 | H2 | 135.2° | 156.3° |
| C4 | C5 | H10 | H11 | 121.9° | 122.8° |
| C5 | C4 | C3 | H19 | 158.0° | 119.3° |
| C5 | C4 | C3 | H20 | 79.7° | 119.3° |
| C5 | C4 | H21 | H22 | 122.7° | 121.4° |
| C3 | C4 | C5 | C2 | 14.8° | 23.6° |
| C4 | C3 | C1 | H19 | 118.8° | 119.4° |
| C4 | C3 | C1 | H20 | 118.8° | 119.3° |
| C4 | C3 | C1 | C2 | 47.8° | 23.6° |
| C4 | C3 | C1 | C6 | 168.8° | 142.3° |
| C3 | C4 | C5 | H10 | 104.6° | 95.1° |
| C3 | C4 | C5 | H11 | 134.1° | 142.3° |
| C4 | C3 | C1 | H18 | 65.2° | 95.1° |
| C4 | C3 | H19 | H20 | 123.4° | 121.4° |
| C3 | C4 | H21 | H22 | 122.7° | 121.4° |
| C5 | C2 | C1 | C3 | 38.9° | 37.9° |
| C5 | C2 | C1 | H1 | 119.5° | 118.2° |
| C5 | C2 | C1 | H2 | 119.6° | 118.5° |
| C5 | C2 | C1 | C6 | 168.2° | 156.6° |
| C5 | C2 | H1 | H2 | 121.4° | 123.4° |
| C2 | C5 | H10 | H11 | 121.9° | 122.5° |
| C5 | C2 | C1 | H18 | 73.7° | 80.9° |
| C2 | C5 | C4 | H21 | 104.3° | 142.9° |
| C2 | C5 | C4 | H22 | 133.8° | 95.7° |
| C3 | C1 | C6 | C7 | 53.6° | 54.8° |
| C3 | C1 | C2 | C6 | 129.3° | 118.7° |
| C3 | C1 | C2 | H18 | 112.6° | 118.8° |
| C3 | C1 | C6 | H18 | 126.1° | 122.7° |
| C3 | C1 | C6 | C20 | 127.4° | 125.2° |
| C3 | C1 | C2 | H1 | 80.6° | 80.3° |
| C3 | C1 | C2 | H2 | 158.5° | 156.4° |
| C1 | C3 | H19 | H20 | 123.3° | 121.4° |
| C1 | C3 | C4 | H21 | 79.9° | 119.3° |
| C1 | C3 | C4 | H22 | 158.2° | 119.3° |
| C8 | C7 | C6 | H12 | 180.0° | 179.4° |
| C7 | C8 | C17 | H17 | 180.0° | 179.6° |
| C8 | C7 | C6 | C1 | 179.6° | 179.7° |
| C8 | C7 | C6 | C20 | 0.5° | 0.3° |
| C7 | C8 | C17 | C9 | 179.8° | 179.8° |
| C7 | C8 | C17 | C18 | 0.8° | 0.5° |
| C7 | C6 | C1 | C2 | 61.9° | 60.0° |
| C6 | C7 | C8 | C17 | 0.2° | 0.5° |
| C7 | C6 | C1 | C20 | 179.0° | 180.0° |
| C7 | C6 | C20 | C18 | 0.7° | 0.0° |
| C7 | C6 | C20 | C19 | 175.1° | 180.0° |
| C6 | C7 | C8 | H17 | 179.7° | 179.9° |
| C7 | C6 | C1 | H18 | 179.7° | 177.4° |
| C2 | C1 | C6 | H18 | 118.4° | 122.6° |
| C2 | C1 | C6 | C20 | 117.2° | 120.0° |
| C1 | C2 | H1 | H2 | 121.4° | 123.3° |
| C1 | C2 | C5 | H10 | 135.0° | 80.8° |
| C1 | C2 | C5 | H11 | 103.8° | 156.8° |
| C2 | C1 | C3 | H19 | 166.7° | 95.7° |
| C2 | C1 | C3 | H20 | 71.0° | 143.0° |
| O1 | C13 | C14 | H4 | 118.9° | 120.0° |
| O1 | C13 | C14 | H5 | 119.0° | 120.0° |
| O1 | C13 | C14 | S1 | 87.1° | 180.0° |
| O1 | C13 | H4 | H5 | 123.0° | 120.0° |
| O1 | C13 | C14 | H6 | 33.3° | 60.0° |
| O1 | C13 | C14 | H7 | 152.6° | 60.0° |
| C8 | C17 | C9 | C10 | 7.6° | 179.7° |
| C8 | C17 | C9 | C18 | 178.9° | 179.7° |
| C8 | C17 | C9 | C11 | 169.3° | 0.3° |
| C8 | C17 | C18 | C20 | 0.7° | 0.3° |
| C8 | C17 | C18 | H8 | 179.3° | 179.7° |
| C17 | C8 | C7 | H12 | 179.8° | 179.9° |
| C1 | C6 | C20 | C18 | 179.7° | 180.0° |
| C1 | C6 | C20 | C19 | 5.8° | 0.0° |
| C6 | C1 | C2 | H1 | 48.6° | 38.4° |
| C6 | C1 | C2 | H2 | 72.3° | 84.9° |
| C1 | C6 | C7 | H12 | 0.4° | 0.3° |
| C6 | C1 | C3 | H19 | 72.4° | 23.0° |
| C6 | C1 | C3 | H20 | 49.9° | 98.4° |
| C13 | C14 | S1 | O2 | 30.5° | 68.4° |
| C13 | C14 | S1 | H6 | 120.3° | 120.0° |
| C13 | C14 | S1 | H7 | 120.4° | 120.0° |
| C13 | C14 | S1 | C15 | 77.7° | 180.0° |
| C13 | C14 | S1 | O3 | 169.1° | 68.4° |
| C14 | C13 | H4 | H5 | 123.0° | 120.0° |
| C13 | C14 | H6 | H7 | 119.0° | 120.0° |
| C14 | C13 | O1 | H13 | 180.0° | 180.0° |
| C16 | C10 | C9 | H15 | 180.0° | 179.9° |
| C10 | C16 | C15 | H14 | 180.0° | 180.0° |
| C16 | C10 | C9 | C17 | 179.4° | 179.7° |
| C16 | C10 | C9 | C11 | 2.6° | 0.2° |
| C10 | C16 | C15 | S1 | 178.5° | 180.0° |
| C10 | C16 | C15 | C12 | 2.5° | 0.0° |
| C9 | C10 | C16 | C15 | 0.1° | 0.0° |
| C10 | C9 | C17 | C11 | 176.9° | 179.5° |
| C10 | C9 | C17 | C18 | 171.3° | 0.5° |
| C10 | C9 | C11 | C12 | 2.4° | 0.5° |
| C9 | C10 | C16 | H14 | 179.8° | 180.0° |
| C10 | C9 | C11 | H16 | 177.6° | 179.9° |
| C6 | C20 | C18 | C17 | 0.0° | 0.0° |
| C6 | C20 | C18 | C19 | 174.3° | 179.9° |
| C6 | C20 | C19 | C27 | 126.1° | 120.0° |
| C6 | C20 | C19 | C21 | 163.9° | 171.4° |
| C6 | C20 | C18 | H8 | 180.0° | 180.0° |
| C6 | C20 | C19 | H9 | 9.8° | 25.8° |
| C20 | C6 | C7 | H12 | 179.5° | 179.7° |
| C20 | C6 | C1 | H18 | 1.3° | 2.6° |
| C16 | C15 | S1 | O2 | 31.2° | 26.1° |
| C16 | C15 | S1 | C14 | 77.7° | 90.0° |
| C16 | C15 | S1 | C12 | 176.4° | 180.0° |
| C16 | C15 | S1 | O3 | 169.0° | 153.9° |
| C16 | C15 | C12 | C11 | 2.6° | 0.3° |
| C16 | C15 | C12 | H3 | 177.4° | 180.0° |
| C15 | C16 | C10 | H15 | 179.9° | 179.9° |
| C9 | C17 | C18 | C20 | 179.6° | 180.0° |
| C17 | C9 | C11 | C12 | 179.4° | 180.0° |
| C9 | C17 | C18 | H8 | 0.4° | 0.0° |
| C17 | C9 | C10 | H15 | 0.7° | 0.2° |
| C17 | C9 | C11 | H16 | 0.6° | 0.6° |
| C9 | C17 | C8 | H17 | 0.2° | 0.2° |
| C18 | C17 | C9 | C11 | 11.8° | 180.0° |
| C17 | C18 | C20 | H8 | 180.0° | 180.0° |
| C17 | C18 | C20 | C19 | 174.4° | 180.0° |
| C18 | C17 | C8 | H17 | 179.1° | 180.0° |
| C9 | C11 | C12 | C15 | 0.0° | 0.5° |
| C9 | C11 | C12 | H16 | 180.0° | 179.4° |
| C9 | C11 | C12 | H3 | 180.0° | 179.7° |
| C11 | C9 | C10 | H15 | 177.5° | 179.6° |
| O2 | S1 | C14 | C15 | 108.1° | 111.6° |
| O2 | S1 | C14 | O3 | 138.6° | 136.8° |
| O2 | S1 | C15 | O3 | 137.9° | 127.9° |
| O2 | S1 | C15 | C12 | 152.4° | 153.9° |
| O2 | S1 | C14 | H6 | 150.8° | 51.6° |
| O2 | S1 | C14 | H7 | 89.9° | 171.6° |
| C18 | C20 | C19 | C27 | 48.4° | 60.0° |
| C18 | C20 | C19 | C21 | 21.6° | 8.7° |
| C18 | C20 | C19 | H9 | 175.8° | 154.3° |
| C20 | C19 | C27 | C21 | 117.3° | 107.5° |
| C20 | C19 | C27 | H9 | 136.3° | 145.0° |
| C20 | C19 | C21 | H9 | 154.1° | 144.9° |
| C20 | C19 | C27 | C22 | 18.9° | 0.0° |
| C19 | C20 | C18 | H8 | 5.6° | 0.0° |
| C20 | C19 | C27 | H23 | 137.8° | 145.0° |
| C20 | C19 | C21 | H24 | 8.6° | 0.1° |
| C20 | C19 | C21 | H25 | 148.5° | 144.9° |
| C14 | S1 | C15 | O3 | 113.3° | 116.1° |
| C14 | S1 | C15 | C12 | 98.7° | 90.0° |
| S1 | C14 | C13 | H4 | 154.0° | 60.0° |
| S1 | C14 | C13 | H5 | 31.9° | 60.0° |
| S1 | C14 | H6 | H7 | 118.9° | 120.0° |
| S1 | C15 | C12 | C11 | 178.9° | 179.7° |
| S1 | C15 | C12 | H3 | 1.1° | 0.0° |
| C15 | S1 | C14 | H6 | 42.7° | 60.0° |
| C15 | S1 | C14 | H7 | 162.0° | 60.0° |
| S1 | C15 | C16 | H14 | 1.5° | 0.0° |
| C12 | C15 | S1 | O3 | 14.6° | 26.1° |
| C15 | C12 | C11 | H3 | 180.0° | 179.8° |
| C12 | C15 | C16 | H14 | 177.6° | 180.0° |
| C15 | C12 | C11 | H16 | 180.0° | 180.0° |
| O3 | S1 | C14 | H6 | 70.6° | 171.6° |
| O3 | S1 | C14 | H7 | 48.7° | 51.6° |
| N1 | C26 | C25 | H29 | 180.0° | 180.0° |
| C26 | N1 | C22 | C27 | 177.1° | 180.0° |
| C26 | N1 | C22 | C23 | 0.5° | 0.1° |
| N1 | C26 | C25 | C24 | 1.3° | 0.0° |
| N1 | C26 | C25 | H28 | 178.7° | 180.0° |
| N1 | C22 | C27 | C19 | 67.4° | 95.1° |
| C22 | N1 | C26 | C25 | 0.4° | 0.0° |
| N1 | C22 | C27 | C23 | 176.2° | 179.9° |
| N1 | C22 | C27 | C21 | 134.8° | 163.7° |
| N1 | C22 | C23 | C24 | 0.6° | 0.1° |
| N1 | C22 | C27 | H23 | 89.3° | 50.7° |
| N1 | C22 | C23 | H26 | 179.3° | 180.0° |
| C22 | N1 | C26 | H29 | 179.6° | 180.0° |
| C27 | C19 | C21 | H9 | 104.5° | 107.5° |
| C19 | C27 | C22 | C21 | 67.3° | 68.6° |
| C19 | C27 | C22 | H23 | 156.7° | 145.7° |
| C19 | C27 | C21 | H23 | 104.1° | 107.5° |
| C19 | C27 | C22 | C23 | 108.7° | 85.0° |
| C27 | C19 | C21 | H24 | 110.0° | 107.5° |
| C27 | C19 | C21 | H25 | 110.1° | 107.5° |
| C19 | C21 | H24 | H25 | 143.6° | 145.7° |
| C26 | C25 | C24 | H28 | 180.0° | 180.0° |
| C26 | C25 | C24 | C23 | 1.2° | 0.0° |
| C26 | C25 | C24 | H27 | 178.8° | 180.0° |
| C22 | C27 | C21 | H23 | 135.8° | 145.0° |
| C27 | C22 | C23 | C24 | 177.0° | 180.0° |
| C22 | C27 | C19 | H9 | 155.2° | 145.1° |
| C22 | C27 | C21 | H24 | 10.1° | 0.0° |
| C22 | C27 | C21 | H25 | 129.8° | 145.0° |
| C27 | C22 | C23 | H26 | 3.0° | 0.1° |
| C21 | C27 | C22 | C23 | 41.4° | 16.4° |
| C27 | C21 | H24 | H25 | 143.6° | 145.7° |
| C22 | C23 | C24 | C25 | 0.3° | 0.0° |
| C22 | C23 | C24 | H26 | 180.0° | 179.9° |
| C23 | C22 | C27 | H23 | 94.6° | 129.2° |
| C22 | C23 | C24 | H27 | 179.7° | 179.9° |
| C25 | C24 | C23 | H27 | 180.0° | 180.0° |
| C25 | C24 | C23 | H26 | 179.8° | 179.9° |
| C24 | C25 | C26 | H29 | 178.7° | 180.0° |
| C23 | C24 | C25 | H28 | 178.8° | 180.0° |
| H1 | C2 | C5 | H10 | 15.5° | 160.9° |
| H1 | C2 | C5 | H11 | 136.7° | 38.5° |
| H1 | C2 | C1 | H18 | 166.8° | 160.9° |
| H2 | C2 | C5 | H10 | 105.5° | 37.6° |
| H2 | C2 | C5 | H11 | 15.8° | 84.8° |
| H2 | C2 | C1 | H18 | 45.8° | 37.6° |
| H3 | C12 | C11 | H16 | 0.0° | 0.3° |
| H4 | C13 | C14 | H6 | 85.7° | 59.9° |
| H4 | C13 | C14 | H7 | 33.6° | 180.0° |
| H4 | C13 | O1 | H13 | 61.0° | 60.0° |
| H5 | C13 | C14 | H6 | 152.2° | 180.0° |
| H5 | C13 | C14 | H7 | 88.4° | 60.0° |
| H5 | C13 | O1 | H13 | 61.1° | 60.0° |
| H9 | C19 | C27 | H23 | 1.5° | 0.0° |
| H9 | C19 | C21 | H24 | 145.5° | 145.0° |
| H9 | C19 | C21 | H25 | 5.6° | 0.0° |
| H10 | C5 | C4 | H21 | 136.3° | 24.3° |
| H10 | C5 | C4 | H22 | 14.5° | 145.6° |
| H11 | C5 | C4 | H21 | 15.1° | 98.3° |
| H11 | C5 | C4 | H22 | 106.8° | 23.0° |
| H12 | C7 | C8 | H17 | 0.3° | 0.5° |
| H14 | C16 | C10 | H15 | 0.2° | 0.1° |
| H18 | C1 | C3 | H19 | 53.7° | 145.5° |
| H18 | C1 | C3 | H20 | 176.0° | 24.2° |
| H19 | C3 | C4 | H21 | 38.9° | 121.4° |
| H19 | C3 | C4 | H22 | 82.9° | 0.0° |
| H20 | C3 | C4 | H21 | 161.3° | 0.0° |
| H20 | C3 | C4 | H22 | 39.4° | 121.4° |
| H23 | C27 | C21 | H24 | 145.8° | 145.0° |
| H23 | C27 | C21 | H25 | 5.9° | 0.0° |
| H26 | C23 | C24 | H27 | 0.3° | 0.1° |
| H27 | C24 | C25 | H28 | 1.2° | 0.0° |
| H28 | C25 | C26 | H29 | 1.3° | 0.0° |
