0T9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C22 | C19 | sing | 1.53Å | 1.53Å | |
| C7 | C5 | sing | 1.53Å | 1.55Å | |
| C16 | C14 | sing | 1.53Å | 1.54Å | |
| C12 | C13 | sing | 1.54Å | 1.56Å | |
| C12 | C8 | sing | 1.53Å | 1.60Å | |
| C2 | C6 | sing | 1.53Å | 1.55Å | |
| C2 | C1 | sing | 1.53Å | 1.55Å | |
| C13 | C14 | sing | 1.52Å | 1.52Å | |
| C6 | C5 | sing | 1.53Å | 1.66Å | |
| C19 | C20 | sing | 1.51Å | 1.55Å | |
| C19 | C17 | sing | 1.53Å | 1.56Å | |
| C5 | C8 | sing | 1.52Å | 1.54Å | |
| C5 | C4 | sing | 1.50Å | 1.49Å | |
| C14 | C17 | sing | 1.52Å | 1.67Å | |
| C14 | C15 | sing | 1.55Å | 1.58Å | |
| C8 | C9 | sing | 1.54Å | 1.55Å | |
| O1 | C1 | sing | 1.43Å | 1.51Å | |
| C23 | C20 | sing | 1.51Å | 1.50Å | |
| C23 | C24 | sing | 1.53Å | 1.54Å | |
| C1 | C3 | sing | 1.53Å | 1.62Å | |
| C20 | O3 | doub | 1.21Å | 1.21Å | |
| C28 | C26 | sing | 1.53Å | 1.54Å | |
| C17 | C18 | sing | 1.53Å | 1.43Å | |
| C9 | C15 | sing | 1.52Å | 1.56Å | |
| C9 | C10 | sing | 1.53Å | 1.58Å | |
| C3 | C4 | sing | 1.52Å | 1.43Å | |
| C4 | C11 | doub | 1.30Å | 1.38Å | |
| C15 | C21 | sing | 1.53Å | 1.60Å | |
| C26 | C25 | sing | 1.53Å | 1.44Å | |
| C18 | O2 | doub | 1.21Å | 1.24Å | |
| C18 | C21 | sing | 1.53Å | 1.48Å | |
| C24 | C25 | sing | 1.53Å | 1.46Å | |
| C11 | C10 | sing | 1.50Å | 1.41Å | |
| C25 | C27 | sing | 1.53Å | 1.51Å | |
| C2 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C6 | H3 | sing | 1.09Å | 1.10Å | |
| C6 | H4 | sing | 1.09Å | 1.10Å | |
| C8 | H5 | sing | 1.09Å | 1.10Å | |
| C16 | H6 | sing | 1.09Å | 1.10Å | |
| C16 | H7 | sing | 1.09Å | 1.10Å | |
| C16 | H8 | sing | 1.09Å | 1.10Å | |
| C13 | H9 | sing | 1.09Å | 1.10Å | |
| C13 | H10 | sing | 1.09Å | 1.10Å | |
| C12 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C7 | H13 | sing | 1.09Å | 1.10Å | |
| C7 | H14 | sing | 1.09Å | 1.10Å | |
| C7 | H15 | sing | 1.09Å | 1.10Å | |
| C1 | H16 | sing | 1.09Å | 1.10Å | |
| O1 | H17 | sing | 0.97Å | 0.95Å | |
| C3 | H18 | sing | 1.09Å | 1.10Å | |
| C3 | H19 | sing | 1.09Å | 1.10Å | |
| C11 | H20 | sing | 1.08Å | 1.08Å | |
| C10 | H21 | sing | 1.09Å | 1.10Å | |
| C10 | H22 | sing | 1.09Å | 1.10Å | |
| C9 | H23 | sing | 1.09Å | 1.10Å | |
| C15 | H24 | sing | 1.09Å | 1.10Å | |
| C21 | H25 | sing | 1.09Å | 1.10Å | |
| C21 | H26 | sing | 1.09Å | 1.10Å | |
| C17 | H27 | sing | 1.09Å | 1.10Å | |
| C19 | H28 | sing | 1.09Å | 1.10Å | |
| C22 | H29 | sing | 1.09Å | 1.10Å | |
| C22 | H30 | sing | 1.09Å | 1.10Å | |
| C22 | H31 | sing | 1.09Å | 1.10Å | |
| C23 | H32 | sing | 1.09Å | 1.10Å | |
| C23 | H33 | sing | 1.09Å | 1.10Å | |
| C24 | H34 | sing | 1.09Å | 1.10Å | |
| C24 | H35 | sing | 1.09Å | 1.10Å | |
| C25 | H36 | sing | 1.09Å | 1.10Å | |
| C27 | H37 | sing | 1.09Å | 1.10Å | |
| C27 | H38 | sing | 1.09Å | 1.10Å | |
| C27 | H39 | sing | 1.09Å | 1.10Å | |
| C26 | H40 | sing | 1.09Å | 1.10Å | |
| C26 | H41 | sing | 1.09Å | 1.10Å | |
| C28 | H42 | sing | 1.09Å | 1.10Å | |
| C28 | H43 | sing | 1.09Å | 1.10Å | |
| C28 | H44 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C22 | C19 | C20 | 106.4° | 109.5° |
| C22 | C19 | C17 | 111.4° | 109.5° |
| C22 | C19 | H28 | 109.5° | 109.4° |
| C19 | C22 | H29 | 109.5° | 109.4° |
| C19 | C22 | H30 | 109.5° | 109.4° |
| C19 | C22 | H31 | 109.5° | 109.5° |
| C7 | C5 | C6 | 108.6° | 107.6° |
| C7 | C5 | C8 | 110.1° | 108.2° |
| C7 | C5 | C4 | 106.4° | 108.2° |
| C5 | C7 | H13 | 109.5° | 109.5° |
| C5 | C7 | H14 | 109.5° | 109.5° |
| C5 | C7 | H15 | 109.5° | 109.5° |
| C16 | C14 | C13 | 110.2° | 109.9° |
| C16 | C14 | C17 | 109.5° | 109.9° |
| C16 | C14 | C15 | 117.1° | 109.9° |
| C14 | C16 | H6 | 109.5° | 109.4° |
| C14 | C16 | H7 | 109.4° | 109.4° |
| C14 | C16 | H8 | 109.5° | 109.4° |
| C13 | C12 | C8 | 110.9° | 111.9° |
| C12 | C13 | C14 | 113.4° | 107.1° |
| C12 | C13 | H9 | 108.5° | 109.9° |
| C12 | C13 | H10 | 108.5° | 110.0° |
| C13 | C12 | H11 | 109.1° | 109.0° |
| C13 | C12 | H12 | 109.1° | 109.0° |
| C12 | C8 | C5 | 112.6° | 109.8° |
| C12 | C8 | C9 | 111.5° | 111.9° |
| C12 | C8 | H5 | 107.0° | 107.9° |
| C8 | C12 | H11 | 109.1° | 109.0° |
| C8 | C12 | H12 | 109.1° | 109.0° |
| C6 | C2 | C1 | 108.9° | 109.7° |
| C2 | C6 | C5 | 105.8° | 109.4° |
| C6 | C2 | H1 | 109.6° | 109.4° |
| C6 | C2 | H2 | 109.6° | 109.5° |
| C2 | C6 | H3 | 110.4° | 109.5° |
| C2 | C6 | H4 | 110.4° | 109.5° |
| C2 | C1 | O1 | 107.6° | 109.5° |
| C2 | C1 | C3 | 109.6° | 109.4° |
| C1 | C2 | H1 | 109.6° | 109.4° |
| C1 | C2 | H2 | 109.6° | 109.4° |
| C2 | C1 | H16 | 108.9° | 109.5° |
| C13 | C14 | C17 | 118.7° | 117.1° |
| C13 | C14 | C15 | 103.7° | 106.9° |
| C14 | C13 | H9 | 108.5° | 110.0° |
| C14 | C13 | H10 | 108.5° | 109.9° |
| C6 | C5 | C8 | 108.5° | 110.0° |
| C6 | C5 | C4 | 111.2° | 109.4° |
| C5 | C6 | H3 | 110.4° | 109.4° |
| C5 | C6 | H4 | 110.4° | 109.5° |
| C20 | C19 | C17 | 111.0° | 109.5° |
| C19 | C20 | C23 | 118.3° | 120.0° |
| C19 | C20 | O3 | 122.5° | 120.0° |
| C20 | C19 | H28 | 109.4° | 109.4° |
| C19 | C17 | C14 | 117.3° | 110.2° |
| C19 | C17 | C18 | 109.9° | 110.2° |
| C19 | C17 | H27 | 109.7° | 110.3° |
| C17 | C19 | H28 | 109.2° | 109.5° |
| C8 | C5 | C4 | 112.0° | 113.3° |
| C5 | C8 | C9 | 110.2° | 110.5° |
| C5 | C8 | H5 | 107.7° | 108.3° |
| C5 | C4 | C3 | 120.4° | 117.9° |
| C5 | C4 | C11 | 121.9° | 123.9° |
| C17 | C14 | C15 | 97.2° | 102.8° |
| C14 | C17 | C18 | 99.6° | 105.5° |
| C14 | C17 | H27 | 108.5° | 110.3° |
| C14 | C15 | C9 | 113.4° | 107.1° |
| C14 | C15 | C21 | 99.3° | 101.2° |
| C14 | C15 | H24 | 109.2° | 110.5° |
| C8 | C9 | C15 | 105.8° | 107.5° |
| C8 | C9 | C10 | 107.7° | 108.1° |
| C9 | C8 | H5 | 107.6° | 108.3° |
| C8 | C9 | H23 | 111.4° | 110.3° |
| O1 | C1 | C3 | 112.9° | 109.5° |
| O1 | C1 | H16 | 109.5° | 109.5° |
| C1 | O1 | H17 | 109.5° | 114.0° |
| C20 | C23 | C24 | 101.0° | 109.5° |
| C23 | C20 | O3 | 118.4° | 120.0° |
| C20 | C23 | H32 | 111.5° | 109.4° |
| C20 | C23 | H33 | 111.6° | 109.5° |
| C23 | C24 | C25 | 110.4° | 109.5° |
| C24 | C23 | H32 | 111.5° | 109.5° |
| C24 | C23 | H33 | 111.5° | 109.5° |
| C23 | C24 | H34 | 109.2° | 109.5° |
| C23 | C24 | H35 | 109.2° | 109.5° |
| C1 | C3 | C4 | 108.7° | 108.4° |
| C3 | C1 | H16 | 108.2° | 109.5° |
| C1 | C3 | H18 | 109.7° | 109.7° |
| C1 | C3 | H19 | 109.7° | 109.7° |
| C28 | C26 | C25 | 103.1° | 109.5° |
| C28 | C26 | H40 | 111.0° | 109.5° |
| C28 | C26 | H41 | 111.0° | 109.5° |
| C26 | C28 | H42 | 109.5° | 109.4° |
| C26 | C28 | H43 | 109.5° | 109.4° |
| C26 | C28 | H44 | 109.5° | 109.5° |
| C17 | C18 | O2 | 122.0° | 126.4° |
| C17 | C18 | C21 | 113.2° | 107.1° |
| C18 | C17 | H27 | 111.5° | 110.2° |
| C15 | C9 | C10 | 109.6° | 109.5° |
| C9 | C15 | C21 | 115.9° | 115.7° |
| C15 | C9 | H23 | 111.2° | 110.2° |
| C9 | C15 | H24 | 109.5° | 110.7° |
| C9 | C10 | C11 | 113.7° | 109.2° |
| C9 | C10 | H21 | 108.4° | 109.5° |
| C9 | C10 | H22 | 108.4° | 109.5° |
| C10 | C9 | H23 | 110.9° | 111.0° |
| C3 | C4 | C11 | 117.1° | 118.2° |
| C4 | C3 | H18 | 109.7° | 109.6° |
| C4 | C3 | H19 | 109.7° | 109.7° |
| C4 | C11 | C10 | 124.4° | 123.0° |
| C4 | C11 | H20 | 117.8° | 118.5° |
| C15 | C21 | C18 | 103.5° | 103.1° |
| C21 | C15 | H24 | 109.1° | 111.0° |
| C15 | C21 | H25 | 110.9° | 110.7° |
| C15 | C21 | H26 | 110.9° | 110.7° |
| C26 | C25 | C24 | 102.7° | 109.5° |
| C26 | C25 | C27 | 105.9° | 109.5° |
| C26 | C25 | H36 | 112.7° | 109.5° |
| C25 | C26 | H40 | 111.0° | 109.5° |
| C25 | C26 | H41 | 111.0° | 109.5° |
| O2 | C18 | C21 | 124.6° | 126.5° |
| C18 | C21 | H25 | 111.0° | 110.7° |
| C18 | C21 | H26 | 110.9° | 110.8° |
| C24 | C25 | C27 | 111.3° | 109.5° |
| C25 | C24 | H34 | 109.2° | 109.4° |
| C25 | C24 | H35 | 109.2° | 109.5° |
| C24 | C25 | H36 | 112.3° | 109.5° |
| C10 | C11 | H20 | 117.8° | 118.5° |
| C11 | C10 | H21 | 108.4° | 109.6° |
| C11 | C10 | H22 | 108.4° | 109.5° |
| C27 | C25 | H36 | 111.5° | 109.4° |
| C25 | C27 | H37 | 109.5° | 109.5° |
| C25 | C27 | H38 | 109.5° | 109.5° |
| C25 | C27 | H39 | 109.5° | 109.5° |
| H1 | C2 | H2 | 109.5° | 109.4° |
| H3 | C6 | H4 | 109.5° | 109.5° |
| H6 | C16 | H7 | 109.4° | 109.5° |
| H6 | C16 | H8 | 109.5° | 109.6° |
| H7 | C16 | H8 | 109.5° | 109.5° |
| H9 | C13 | H10 | 109.5° | 109.9° |
| H11 | C12 | H12 | 109.5° | 108.9° |
| H13 | C7 | H14 | 109.5° | 109.5° |
| H13 | C7 | H15 | 109.4° | 109.5° |
| H14 | C7 | H15 | 109.4° | 109.4° |
| H18 | C3 | H19 | 109.5° | 109.7° |
| H21 | C10 | H22 | 109.5° | 109.5° |
| H25 | C21 | H26 | 109.5° | 110.6° |
| H29 | C22 | H30 | 109.4° | 109.5° |
| H29 | C22 | H31 | 109.5° | 109.5° |
| H30 | C22 | H31 | 109.5° | 109.5° |
| H32 | C23 | H33 | 109.5° | 109.5° |
| H34 | C24 | H35 | 109.5° | 109.5° |
| H37 | C27 | H38 | 109.5° | 109.4° |
| H37 | C27 | H39 | 109.4° | 109.5° |
| H38 | C27 | H39 | 109.5° | 109.5° |
| H40 | C26 | H41 | 109.5° | 109.5° |
| H42 | C28 | H43 | 109.4° | 109.5° |
| H42 | C28 | H44 | 109.5° | 109.5° |
| H43 | C28 | H44 | 109.5° | 109.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C22 | C19 | C20 | C17 | 121.4° | 120.0° |
| C22 | C19 | C20 | H28 | 118.1° | 119.9° |
| C22 | C19 | C17 | H28 | 121.0° | 120.0° |
| C22 | C19 | C17 | C14 | 56.3° | 66.0° |
| C22 | C19 | C20 | C23 | 108.8° | 90.0° |
| C22 | C19 | C20 | O3 | 82.1° | 90.1° |
| C22 | C19 | C17 | C18 | 169.1° | 177.9° |
| C22 | C19 | C17 | H27 | 68.0° | 56.0° |
| C19 | C22 | H29 | H30 | 120.0° | 120.0° |
| C19 | C22 | H29 | H31 | 120.0° | 120.0° |
| C19 | C22 | H30 | H31 | 120.0° | 120.0° |
| C7 | C5 | C8 | C12 | 54.3° | 40.8° |
| C7 | C5 | C6 | C2 | 64.4° | 63.1° |
| C7 | C5 | C6 | C8 | 119.7° | 117.6° |
| C7 | C5 | C6 | C4 | 116.7° | 117.3° |
| C7 | C5 | C8 | C4 | 118.2° | 119.9° |
| C7 | C5 | C8 | C9 | 71.0° | 83.1° |
| C7 | C5 | C4 | C3 | 68.2° | 65.9° |
| C7 | C5 | C4 | C11 | 102.5° | 114.3° |
| C7 | C5 | C6 | H3 | 176.2° | 176.9° |
| C7 | C5 | C6 | H4 | 55.0° | 56.9° |
| C7 | C5 | C8 | H5 | 172.0° | 158.4° |
| C5 | C7 | H13 | H14 | 120.0° | 120.0° |
| C5 | C7 | H13 | H15 | 120.0° | 120.1° |
| C5 | C7 | H14 | H15 | 120.0° | 120.0° |
| C16 | C14 | C13 | C12 | 67.0° | 54.1° |
| C16 | C14 | C13 | C17 | 127.5° | 126.2° |
| C16 | C14 | C13 | C15 | 126.2° | 119.2° |
| C16 | C14 | C17 | C19 | 43.1° | 31.1° |
| C16 | C14 | C17 | C15 | 122.2° | 117.0° |
| C16 | C14 | C17 | C18 | 75.4° | 87.9° |
| C16 | C14 | C15 | C9 | 55.6° | 48.5° |
| C16 | C14 | C15 | C21 | 68.0° | 73.1° |
| C14 | C16 | H6 | H7 | 120.0° | 119.9° |
| C14 | C16 | H6 | H8 | 120.0° | 120.0° |
| C14 | C16 | H7 | H8 | 120.0° | 120.0° |
| C16 | C14 | C13 | H9 | 172.4° | 65.3° |
| C16 | C14 | C13 | H10 | 53.6° | 173.6° |
| C16 | C14 | C15 | H24 | 178.0° | 169.2° |
| C16 | C14 | C17 | H27 | 167.9° | 153.1° |
| C13 | C12 | C8 | H11 | 120.2° | 120.6° |
| C13 | C12 | C8 | H12 | 120.2° | 120.7° |
| C12 | C13 | C14 | H9 | 120.6° | 119.4° |
| C12 | C13 | C14 | H10 | 120.6° | 119.4° |
| C13 | C12 | C8 | C5 | 176.7° | 176.6° |
| C12 | C13 | C14 | C17 | 165.5° | 179.6° |
| C12 | C13 | C14 | C15 | 59.2° | 65.1° |
| C13 | C12 | C8 | C9 | 52.2° | 53.5° |
| C13 | C12 | C8 | H5 | 65.2° | 65.5° |
| C12 | C13 | H9 | H10 | 118.2° | 121.2° |
| C13 | C12 | H11 | H12 | 119.4° | 118.9° |
| C8 | C12 | C13 | C14 | 55.4° | 57.4° |
| C12 | C8 | C5 | C6 | 64.5° | 76.4° |
| C12 | C8 | C5 | C9 | 125.2° | 123.9° |
| C12 | C8 | C5 | H5 | 117.7° | 117.6° |
| C12 | C8 | C5 | C4 | 172.4° | 160.8° |
| C12 | C8 | C9 | H5 | 117.0° | 118.8° |
| C12 | C8 | C9 | C15 | 55.4° | 56.3° |
| C12 | C8 | C9 | C10 | 172.6° | 174.5° |
| C8 | C12 | C13 | H9 | 65.1° | 176.8° |
| C8 | C12 | C13 | H10 | 176.0° | 62.1° |
| C8 | C12 | H11 | H12 | 119.4° | 118.8° |
| C12 | C8 | C9 | H23 | 65.6° | 63.9° |
| C6 | C2 | C1 | H1 | 119.9° | 120.1° |
| C6 | C2 | C1 | H2 | 119.9° | 120.1° |
| C2 | C6 | C5 | H3 | 119.4° | 120.0° |
| C2 | C6 | C5 | H4 | 119.4° | 120.0° |
| C2 | C6 | C5 | C8 | 175.9° | 179.3° |
| C2 | C6 | C5 | C4 | 52.3° | 54.2° |
| C6 | C2 | C1 | O1 | 170.9° | 176.3° |
| C6 | C2 | C1 | C3 | 65.9° | 63.7° |
| C6 | C2 | H1 | H2 | 120.3° | 119.9° |
| C2 | C6 | H3 | H4 | 121.7° | 120.0° |
| C6 | C2 | C1 | H16 | 52.2° | 56.2° |
| C1 | C2 | C6 | C5 | 62.2° | 62.8° |
| C2 | C1 | O1 | C3 | 121.1° | 120.0° |
| C2 | C1 | O1 | H16 | 118.3° | 120.0° |
| C2 | C1 | C3 | H16 | 118.6° | 120.0° |
| C2 | C1 | C3 | C4 | 55.5° | 55.2° |
| C1 | C2 | H1 | H2 | 120.2° | 119.8° |
| C1 | C2 | C6 | H3 | 57.2° | 57.2° |
| C1 | C2 | C6 | H4 | 178.4° | 177.2° |
| C2 | C1 | O1 | H17 | 180.0° | 179.9° |
| C2 | C1 | C3 | H18 | 64.3° | 174.9° |
| C2 | C1 | C3 | H19 | 175.4° | 64.6° |
| C13 | C14 | C17 | C19 | 84.7° | 95.1° |
| C13 | C14 | C17 | C15 | 110.0° | 116.8° |
| C13 | C14 | C17 | C18 | 156.8° | 145.9° |
| C13 | C14 | C15 | C9 | 66.1° | 70.7° |
| C13 | C14 | C15 | C21 | 170.3° | 167.7° |
| C13 | C14 | C16 | H6 | 180.0° | 63.9° |
| C13 | C14 | C16 | H7 | 60.0° | 56.1° |
| C13 | C14 | C16 | H8 | 60.0° | 176.0° |
| C14 | C13 | H9 | H10 | 118.2° | 121.2° |
| C14 | C13 | C12 | H11 | 64.8° | 177.9° |
| C14 | C13 | C12 | H12 | 175.7° | 63.3° |
| C13 | C14 | C15 | H24 | 56.3° | 50.0° |
| C13 | C14 | C17 | H27 | 40.1° | 26.9° |
| C6 | C5 | C8 | C4 | 123.1° | 122.9° |
| C6 | C5 | C8 | C9 | 170.3° | 159.7° |
| C6 | C5 | C4 | C3 | 49.9° | 51.0° |
| C6 | C5 | C4 | C11 | 139.5° | 128.8° |
| C5 | C6 | C2 | H1 | 57.7° | 57.2° |
| C5 | C6 | C2 | H2 | 177.9° | 177.1° |
| C5 | C6 | H3 | H4 | 121.7° | 120.0° |
| C6 | C5 | C8 | H5 | 53.2° | 41.2° |
| C6 | C5 | C7 | H13 | 180.0° | 58.8° |
| C6 | C5 | C7 | H14 | 60.0° | 61.2° |
| C6 | C5 | C7 | H15 | 60.0° | 178.8° |
| C20 | C19 | C17 | H28 | 120.6° | 120.0° |
| C20 | C19 | C17 | C14 | 174.6° | 174.0° |
| C19 | C20 | C23 | O3 | 169.6° | 179.9° |
| C19 | C20 | C23 | C24 | 132.4° | 180.0° |
| C20 | C19 | C17 | C18 | 72.6° | 57.9° |
| C20 | C19 | C17 | H27 | 50.4° | 64.0° |
| C20 | C19 | C22 | H29 | 180.0° | 62.2° |
| C20 | C19 | C22 | H30 | 60.0° | 177.8° |
| C20 | C19 | C22 | H31 | 60.0° | 57.8° |
| C19 | C20 | C23 | H32 | 109.0° | 60.0° |
| C19 | C20 | C23 | H33 | 13.8° | 60.0° |
| C19 | C17 | C14 | C18 | 118.5° | 119.0° |
| C19 | C17 | C14 | H27 | 124.9° | 122.0° |
| C19 | C17 | C14 | C15 | 165.3° | 148.1° |
| C17 | C19 | C20 | C23 | 129.8° | 150.0° |
| C17 | C19 | C20 | O3 | 39.3° | 29.9° |
| C19 | C17 | C18 | H27 | 121.8° | 122.0° |
| C19 | C17 | C18 | O2 | 23.8° | 57.6° |
| C19 | C17 | C18 | C21 | 150.8° | 122.3° |
| C17 | C19 | C22 | H29 | 58.9° | 57.8° |
| C17 | C19 | C22 | H30 | 178.9° | 62.2° |
| C17 | C19 | C22 | H31 | 61.1° | 177.7° |
| C5 | C8 | C9 | H5 | 117.1° | 118.5° |
| C5 | C8 | C9 | C15 | 178.7° | 179.0° |
| C5 | C8 | C9 | C10 | 61.6° | 62.8° |
| C8 | C5 | C4 | C3 | 171.5° | 174.2° |
| C8 | C5 | C4 | C11 | 17.9° | 5.6° |
| C8 | C5 | C6 | H3 | 56.5° | 59.4° |
| C8 | C5 | C6 | H4 | 64.6° | 60.7° |
| C5 | C8 | C12 | H11 | 56.6° | 62.7° |
| C5 | C8 | C12 | H12 | 63.1° | 55.9° |
| C8 | C5 | C7 | H13 | 61.4° | 60.0° |
| C8 | C5 | C7 | H14 | 58.7° | 180.0° |
| C8 | C5 | C7 | H15 | 178.7° | 60.0° |
| C5 | C8 | C9 | H23 | 60.3° | 58.8° |
| C4 | C5 | C8 | C9 | 47.2° | 36.8° |
| C5 | C4 | C3 | C1 | 50.0° | 51.4° |
| C5 | C4 | C3 | C11 | 171.1° | 179.8° |
| C5 | C4 | C11 | C10 | 4.0° | 0.3° |
| C4 | C5 | C6 | H3 | 67.1° | 65.8° |
| C4 | C5 | C6 | H4 | 171.7° | 174.2° |
| C4 | C5 | C8 | H5 | 69.9° | 81.6° |
| C4 | C5 | C7 | H13 | 60.2° | 176.9° |
| C4 | C5 | C7 | H14 | 179.7° | 56.9° |
| C4 | C5 | C7 | H15 | 59.8° | 63.1° |
| C5 | C4 | C3 | H18 | 69.9° | 171.2° |
| C5 | C4 | C3 | H19 | 169.9° | 68.3° |
| C5 | C4 | C11 | H20 | 176.0° | 179.6° |
| C14 | C17 | C18 | H27 | 114.3° | 119.0° |
| C17 | C14 | C15 | C9 | 171.9° | 165.5° |
| C17 | C14 | C15 | C21 | 48.4° | 43.8° |
| C14 | C17 | C18 | O2 | 147.6° | 176.6° |
| C14 | C17 | C18 | C21 | 27.0° | 3.4° |
| C17 | C14 | C16 | H6 | 47.6° | 66.3° |
| C17 | C14 | C16 | H7 | 72.4° | 173.7° |
| C17 | C14 | C16 | H8 | 167.6° | 53.8° |
| C17 | C14 | C13 | H9 | 45.0° | 61.0° |
| C17 | C14 | C13 | H10 | 73.9° | 60.2° |
| C17 | C14 | C15 | H24 | 65.7° | 73.8° |
| C14 | C17 | C19 | H28 | 64.8° | 54.0° |
| C14 | C15 | C9 | C8 | 65.3° | 64.1° |
| C15 | C14 | C17 | C18 | 46.8° | 29.1° |
| C14 | C15 | C9 | C21 | 113.9° | 112.0° |
| C14 | C15 | C9 | H24 | 122.3° | 120.5° |
| C14 | C15 | C9 | C10 | 178.8° | 178.6° |
| C14 | C15 | C21 | H24 | 114.2° | 117.3° |
| C14 | C15 | C21 | C18 | 34.6° | 41.5° |
| C15 | C14 | C16 | H6 | 61.8° | 178.7° |
| C15 | C14 | C16 | H7 | 178.3° | 61.3° |
| C15 | C14 | C16 | H8 | 58.3° | 58.7° |
| C15 | C14 | C13 | H9 | 61.4° | 175.5° |
| C15 | C14 | C13 | H10 | 179.8° | 54.3° |
| C14 | C15 | C9 | H23 | 55.8° | 56.1° |
| C14 | C15 | C21 | H25 | 84.4° | 76.9° |
| C14 | C15 | C21 | H26 | 153.7° | 160.0° |
| C15 | C14 | C17 | H27 | 69.9° | 89.9° |
| C8 | C9 | C15 | C10 | 115.9° | 117.3° |
| C8 | C9 | C15 | H23 | 121.1° | 120.2° |
| C8 | C9 | C10 | H23 | 122.1° | 121.1° |
| C8 | C9 | C15 | C21 | 179.1° | 176.1° |
| C8 | C9 | C10 | C11 | 47.4° | 56.1° |
| C9 | C8 | C12 | H11 | 68.0° | 174.2° |
| C9 | C8 | C12 | H12 | 172.4° | 67.1° |
| C8 | C9 | C10 | H21 | 73.2° | 176.0° |
| C8 | C9 | C10 | H22 | 168.1° | 63.9° |
| C8 | C9 | C15 | H24 | 57.0° | 56.4° |
| O1 | C1 | C3 | H16 | 121.4° | 120.0° |
| O1 | C1 | C3 | C4 | 175.5° | 175.2° |
| O1 | C1 | C2 | H1 | 69.2° | 63.7° |
| O1 | C1 | C2 | H2 | 51.0° | 56.1° |
| O1 | C1 | C3 | H18 | 55.6° | 65.1° |
| O1 | C1 | C3 | H19 | 64.6° | 55.4° |
| C20 | C23 | C24 | H32 | 118.6° | 120.0° |
| C20 | C23 | C24 | H33 | 118.6° | 120.0° |
| C20 | C23 | C24 | C25 | 142.6° | 180.0° |
| C23 | C20 | C19 | H28 | 9.3° | 29.9° |
| C20 | C23 | H32 | H33 | 123.9° | 120.0° |
| C20 | C23 | C24 | H34 | 97.2° | 60.0° |
| C20 | C23 | C24 | H35 | 22.5° | 60.0° |
| C24 | C23 | C20 | O3 | 37.2° | 0.1° |
| C23 | C24 | C25 | C26 | 43.4° | 175.0° |
| C23 | C24 | C25 | H34 | 120.1° | 120.0° |
| C23 | C24 | C25 | H35 | 120.1° | 120.0° |
| C23 | C24 | C25 | C27 | 156.2° | 65.0° |
| C24 | C23 | H32 | H33 | 123.9° | 120.0° |
| C23 | C24 | H34 | H35 | 119.6° | 120.0° |
| C23 | C24 | C25 | H36 | 77.9° | 55.0° |
| C1 | C3 | C4 | H18 | 119.9° | 119.7° |
| C1 | C3 | C4 | H19 | 119.9° | 119.8° |
| C1 | C3 | C4 | C11 | 139.0° | 128.4° |
| C3 | C1 | C2 | H1 | 54.0° | 56.3° |
| C3 | C1 | C2 | H2 | 174.2° | 176.2° |
| C3 | C1 | O1 | H17 | 58.9° | 60.0° |
| C1 | C3 | H18 | H19 | 120.3° | 120.6° |
| O3 | C20 | C19 | H28 | 159.8° | 150.0° |
| O3 | C20 | C23 | H32 | 81.5° | 120.1° |
| O3 | C20 | C23 | H33 | 155.8° | 120.0° |
| C28 | C26 | C25 | H40 | 119.0° | 120.0° |
| C28 | C26 | C25 | H41 | 119.0° | 120.0° |
| C28 | C26 | C25 | C24 | 135.7° | 175.0° |
| C28 | C26 | C25 | C27 | 107.5° | 65.0° |
| C28 | C26 | C25 | H36 | 14.7° | 55.0° |
| C28 | C26 | H40 | H41 | 122.9° | 120.0° |
| C26 | C28 | H42 | H43 | 120.0° | 119.9° |
| C26 | C28 | H42 | H44 | 120.0° | 120.0° |
| C26 | C28 | H43 | H44 | 120.0° | 120.0° |
| C17 | C18 | C21 | C15 | 3.8° | 24.1° |
| C17 | C18 | O2 | C21 | 174.0° | 179.9° |
| C17 | C18 | C21 | H25 | 115.2° | 94.3° |
| C17 | C18 | C21 | H26 | 122.8° | 142.6° |
| C18 | C17 | C19 | H28 | 48.1° | 62.1° |
| C15 | C9 | C10 | H23 | 123.2° | 122.0° |
| C9 | C15 | C21 | H24 | 124.1° | 127.3° |
| C9 | C15 | C21 | C18 | 156.4° | 156.9° |
| C15 | C9 | C10 | C11 | 162.1° | 172.9° |
| C15 | C9 | C8 | H5 | 61.6° | 62.5° |
| C15 | C9 | C10 | H21 | 41.5° | 67.1° |
| C15 | C9 | C10 | H22 | 77.2° | 53.0° |
| C9 | C15 | C21 | H25 | 37.3° | 38.5° |
| C9 | C15 | C21 | H26 | 84.6° | 84.5° |
| C9 | C10 | C11 | C4 | 19.5° | 26.4° |
| C10 | C9 | C15 | C21 | 65.0° | 66.6° |
| C9 | C10 | C11 | H21 | 120.6° | 119.9° |
| C9 | C10 | C11 | H22 | 120.6° | 120.0° |
| C10 | C9 | C8 | H5 | 55.5° | 55.7° |
| C9 | C10 | C11 | H20 | 160.5° | 153.6° |
| C9 | C10 | H21 | H22 | 118.1° | 120.1° |
| C10 | C9 | C15 | H24 | 58.9° | 60.9° |
| C3 | C4 | C11 | C10 | 174.9° | 179.5° |
| C4 | C3 | C1 | H16 | 63.1° | 64.8° |
| C4 | C3 | H18 | H19 | 120.4° | 120.5° |
| C3 | C4 | C11 | H20 | 5.1° | 0.6° |
| C4 | C11 | C10 | H20 | 180.0° | 179.9° |
| C11 | C4 | C3 | H18 | 101.2° | 8.7° |
| C11 | C4 | C3 | H19 | 19.1° | 111.8° |
| C4 | C11 | C10 | H21 | 101.1° | 146.3° |
| C4 | C11 | C10 | H22 | 140.1° | 93.6° |
| C15 | C21 | C18 | O2 | 178.2° | 156.0° |
| C15 | C21 | C18 | H25 | 119.0° | 118.4° |
| C15 | C21 | C18 | H26 | 119.0° | 118.5° |
| C21 | C15 | C9 | H23 | 58.0° | 55.9° |
| C15 | C21 | H25 | H26 | 122.8° | 123.1° |
| C26 | C25 | C24 | C27 | 112.9° | 120.0° |
| C26 | C25 | C24 | H36 | 121.3° | 120.0° |
| C26 | C25 | C27 | H36 | 122.9° | 120.0° |
| C26 | C25 | C24 | H34 | 163.5° | 65.0° |
| C26 | C25 | C24 | H35 | 76.8° | 55.0° |
| C26 | C25 | C27 | H37 | 180.0° | 180.0° |
| C26 | C25 | C27 | H38 | 60.0° | 60.0° |
| C26 | C25 | C27 | H39 | 60.0° | 60.0° |
| C25 | C26 | H40 | H41 | 123.0° | 120.0° |
| C25 | C26 | C28 | H42 | 180.0° | 180.0° |
| C25 | C26 | C28 | H43 | 60.0° | 60.0° |
| C25 | C26 | C28 | H44 | 60.0° | 60.0° |
| O2 | C18 | C21 | H25 | 59.2° | 85.6° |
| O2 | C18 | C21 | H26 | 62.7° | 37.5° |
| O2 | C18 | C17 | H27 | 98.0° | 64.4° |
| C18 | C21 | C15 | H24 | 79.6° | 75.8° |
| C18 | C21 | H25 | H26 | 122.8° | 123.2° |
| C21 | C18 | C17 | H27 | 87.4° | 115.7° |
| C24 | C25 | C27 | H36 | 126.3° | 120.0° |
| C25 | C24 | C23 | H32 | 24.0° | 60.0° |
| C25 | C24 | C23 | H33 | 98.7° | 60.0° |
| C25 | C24 | H34 | H35 | 119.6° | 120.0° |
| C24 | C25 | C27 | H37 | 69.2° | 59.9° |
| C24 | C25 | C27 | H38 | 50.8° | 60.0° |
| C24 | C25 | C27 | H39 | 170.9° | 180.0° |
| C24 | C25 | C26 | H40 | 16.7° | 65.0° |
| C24 | C25 | C26 | H41 | 105.4° | 55.0° |
| C11 | C10 | H21 | H22 | 118.1° | 120.1° |
| C11 | C10 | C9 | H23 | 74.7° | 65.1° |
| C27 | C25 | C24 | H34 | 83.6° | 55.0° |
| C27 | C25 | C24 | H35 | 36.1° | 175.0° |
| C25 | C27 | H37 | H38 | 120.0° | 120.0° |
| C25 | C27 | H37 | H39 | 120.0° | 120.1° |
| C25 | C27 | H38 | H39 | 120.0° | 120.0° |
| C27 | C25 | C26 | H40 | 133.5° | 55.0° |
| C27 | C25 | C26 | H41 | 11.4° | 175.0° |
| H1 | C2 | C6 | H3 | 177.1° | 177.2° |
| H1 | C2 | C6 | H4 | 61.8° | 62.8° |
| H1 | C2 | C1 | H16 | 172.1° | 176.3° |
| H2 | C2 | C6 | H3 | 62.7° | 62.9° |
| H2 | C2 | C6 | H4 | 58.5° | 57.1° |
| H2 | C2 | C1 | H16 | 67.7° | 63.9° |
| H5 | C8 | C12 | H11 | 174.6° | 55.1° |
| H5 | C8 | C12 | H12 | 55.0° | 173.8° |
| H5 | C8 | C9 | H23 | 177.4° | 177.3° |
| H6 | C16 | H7 | H8 | 120.0° | 120.1° |
| H9 | C13 | C12 | H11 | 174.7° | 62.7° |
| H9 | C13 | C12 | H12 | 55.1° | 56.1° |
| H10 | C13 | C12 | H11 | 55.8° | 58.5° |
| H10 | C13 | C12 | H12 | 63.7° | 177.3° |
| H13 | C7 | H14 | H15 | 120.0° | 119.9° |
| H16 | C1 | O1 | H17 | 61.7° | 60.0° |
| H16 | C1 | C3 | H18 | 177.1° | 54.9° |
| H16 | C1 | C3 | H19 | 56.8° | 175.4° |
| H20 | C11 | C10 | H21 | 78.9° | 33.6° |
| H20 | C11 | C10 | H22 | 39.9° | 86.5° |
| H21 | C10 | C9 | H23 | 164.7° | 54.9° |
| H22 | C10 | C9 | H23 | 45.9° | 175.0° |
| H23 | C9 | C15 | H24 | 178.1° | 176.6° |
| H24 | C15 | C21 | H25 | 161.4° | 165.8° |
| H24 | C15 | C21 | H26 | 39.5° | 42.7° |
| H27 | C17 | C19 | H28 | 171.0° | 176.0° |
| H28 | C19 | C22 | H29 | 61.9° | 177.8° |
| H28 | C19 | C22 | H30 | 58.0° | 57.8° |
| H28 | C19 | C22 | H31 | 178.1° | 62.2° |
| H29 | C22 | H30 | H31 | 120.0° | 120.0° |
| H32 | C23 | C24 | H34 | 144.2° | 180.0° |
| H32 | C23 | C24 | H35 | 96.1° | 60.0° |
| H33 | C23 | C24 | H34 | 21.4° | 60.0° |
| H33 | C23 | C24 | H35 | 141.2° | 180.0° |
| H34 | C24 | C25 | H36 | 42.2° | 175.0° |
| H35 | C24 | C25 | H36 | 162.0° | 65.0° |
| H36 | C25 | C27 | H37 | 57.1° | 60.1° |
| H36 | C25 | C27 | H38 | 177.1° | 180.0° |
| H36 | C25 | C27 | H39 | 62.9° | 60.0° |
| H36 | C25 | C26 | H40 | 104.3° | 175.0° |
| H36 | C25 | C26 | H41 | 133.6° | 65.0° |
| H37 | C27 | H38 | H39 | 119.9° | 120.0° |
| H40 | C26 | C28 | H42 | 61.0° | 60.0° |
| H40 | C26 | C28 | H43 | 59.0° | 180.0° |
| H40 | C26 | C28 | H44 | 179.0° | 60.0° |
| H41 | C26 | C28 | H42 | 61.0° | 60.0° |
| H41 | C26 | C28 | H43 | 179.0° | 59.9° |
| H41 | C26 | C28 | H44 | 59.0° | 180.0° |
| H42 | C28 | H43 | H44 | 120.0° | 120.0° |
