A1H9P
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C26 | C25 | sing | 1.53Å | 1.52Å | |
| C27 | C25 | sing | 1.53Å | 1.52Å | |
| C25 | O3 | sing | 1.43Å | 1.44Å | |
| C25 | C24 | sing | 1.51Å | 1.54Å | |
| C24 | C23 | doub | 1.31Å | 1.54Å | |
| C23 | C22 | sing | 1.51Å | 1.55Å | |
| C22 | C20 | sing | 1.53Å | 1.55Å | |
| O4 | C4 | sing | 1.43Å | 1.43Å | |
| C18 | C13 | sing | 1.53Å | 1.54Å | |
| C19 | C10 | doub | 1.33Å | 1.33Å | |
| C11 | C12 | sing | 1.54Å | 1.53Å | |
| C11 | C9 | sing | 1.53Å | 1.54Å | |
| C12 | C13 | sing | 1.51Å | 1.54Å | |
| C20 | C21 | sing | 1.53Å | 1.53Å | |
| C20 | C17 | sing | 1.53Å | 1.54Å | |
| C13 | C17 | sing | 1.52Å | 1.54Å | |
| C13 | C14 | sing | 1.56Å | 1.55Å | |
| C2 | C1 | sing | 1.54Å | 1.52Å | |
| C2 | C3 | sing | 1.53Å | 1.52Å | |
| O1 | C1 | sing | 1.43Å | 1.41Å | |
| C10 | C5 | sing | 1.48Å | 1.48Å | |
| C10 | C1 | sing | 1.52Å | 1.51Å | |
| C4 | C5 | sing | 1.52Å | 1.51Å | |
| C4 | C3 | sing | 1.53Å | 1.53Å | |
| C5 | C28 | doub | 1.35Å | 1.34Å | |
| C17 | C16 | sing | 1.56Å | 1.54Å | |
| C9 | C6 | sing | 1.52Å | 1.50Å | |
| C3 | O2 | sing | 1.43Å | 1.44Å | |
| C28 | C7 | sing | 1.47Å | 1.43Å | |
| C7 | C6 | doub | 1.33Å | 1.34Å | |
| C6 | C14 | sing | 1.50Å | 1.51Å | |
| C14 | C15 | sing | 1.53Å | 1.54Å | |
| C16 | C15 | sing | 1.55Å | 1.56Å | |
| C14 | H1 | sing | 1.09Å | 1.10Å | |
| C9 | H2 | sing | 1.09Å | 1.10Å | |
| C9 | H3 | sing | 1.09Å | 1.10Å | |
| C11 | H4 | sing | 1.09Å | 1.10Å | |
| C11 | H5 | sing | 1.09Å | 1.10Å | |
| C12 | H6 | sing | 1.09Å | 1.10Å | |
| C12 | H7 | sing | 1.09Å | 1.10Å | |
| C18 | H8 | sing | 1.09Å | 1.10Å | |
| C18 | H9 | sing | 1.09Å | 1.10Å | |
| C18 | H10 | sing | 1.09Å | 1.10Å | |
| C19 | H11 | sing | 1.08Å | 1.08Å | |
| C19 | H12 | sing | 1.08Å | 1.08Å | |
| C21 | H13 | sing | 1.09Å | 1.10Å | |
| C21 | H14 | sing | 1.09Å | 1.10Å | |
| C21 | H15 | sing | 1.09Å | 1.10Å | |
| C23 | H16 | sing | 1.08Å | 1.08Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C7 | H18 | sing | 1.08Å | 1.08Å | |
| C28 | H19 | sing | 1.08Å | 1.08Å | |
| C4 | H20 | sing | 1.09Å | 1.10Å | |
| C3 | H21 | sing | 1.09Å | 1.10Å | |
| C2 | H22 | sing | 1.09Å | 1.10Å | |
| C2 | H23 | sing | 1.09Å | 1.10Å | |
| C1 | H24 | sing | 1.09Å | 1.10Å | |
| C16 | H25 | sing | 1.09Å | 1.10Å | |
| C16 | H26 | sing | 1.09Å | 1.10Å | |
| C20 | H27 | sing | 1.09Å | 1.10Å | |
| C22 | H28 | sing | 1.09Å | 1.10Å | |
| C22 | H29 | sing | 1.09Å | 1.10Å | |
| C24 | H30 | sing | 1.08Å | 1.08Å | |
| C26 | H31 | sing | 1.09Å | 1.10Å | |
| C26 | H32 | sing | 1.09Å | 1.10Å | |
| C26 | H33 | sing | 1.09Å | 1.10Å | |
| C15 | H34 | sing | 1.09Å | 1.10Å | |
| C15 | H35 | sing | 1.09Å | 1.10Å | |
| C27 | H36 | sing | 1.09Å | 1.10Å | |
| C27 | H37 | sing | 1.09Å | 1.10Å | |
| C27 | H38 | sing | 1.09Å | 1.10Å | |
| O4 | H39 | sing | 0.97Å | 0.95Å | |
| O2 | H40 | sing | 0.97Å | 0.95Å | |
| O1 | H41 | sing | 0.97Å | 0.95Å | |
| O3 | H42 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C26 | C25 | C27 | 110.4° | 109.5° |
| C26 | C25 | O3 | 107.9° | 109.5° |
| C26 | C25 | C24 | 111.9° | 109.5° |
| C25 | C26 | H31 | 109.5° | 109.5° |
| C25 | C26 | H32 | 109.5° | 109.5° |
| C25 | C26 | H33 | 109.5° | 109.5° |
| C27 | C25 | O3 | 106.2° | 109.5° |
| C27 | C25 | C24 | 111.3° | 109.5° |
| C25 | C27 | H36 | 109.5° | 109.4° |
| C25 | C27 | H37 | 109.5° | 109.5° |
| C25 | C27 | H38 | 109.5° | 109.5° |
| O3 | C25 | C24 | 109.0° | 109.4° |
| C25 | O3 | H42 | 109.5° | 113.9° |
| C25 | C24 | C23 | 115.7° | 120.0° |
| C25 | C24 | H30 | 122.1° | 120.0° |
| C24 | C23 | C22 | 115.2° | 120.0° |
| C24 | C23 | H16 | 122.4° | 120.0° |
| C23 | C24 | H30 | 122.1° | 120.0° |
| C23 | C22 | C20 | 113.9° | 109.5° |
| C22 | C23 | H16 | 122.4° | 120.0° |
| C23 | C22 | H28 | 108.4° | 109.4° |
| C23 | C22 | H29 | 108.3° | 109.4° |
| C22 | C20 | C21 | 110.1° | 109.5° |
| C22 | C20 | C17 | 114.3° | 109.5° |
| C22 | C20 | H27 | 106.8° | 109.5° |
| C20 | C22 | H28 | 108.3° | 109.5° |
| C20 | C22 | H29 | 108.4° | 109.5° |
| O4 | C4 | C5 | 110.0° | 109.7° |
| O4 | C4 | C3 | 110.1° | 109.7° |
| O4 | C4 | H20 | 108.2° | 109.7° |
| C4 | O4 | H39 | 109.5° | 114.0° |
| C18 | C13 | C12 | 110.6° | 109.3° |
| C18 | C13 | C17 | 112.6° | 109.3° |
| C18 | C13 | C14 | 109.4° | 108.4° |
| C13 | C18 | H8 | 109.5° | 109.4° |
| C13 | C18 | H9 | 109.5° | 109.5° |
| C13 | C18 | H10 | 109.5° | 109.5° |
| C19 | C10 | C5 | 123.0° | 121.7° |
| C19 | C10 | C1 | 120.8° | 121.6° |
| C10 | C19 | H11 | 120.0° | 119.9° |
| C10 | C19 | H12 | 120.0° | 120.0° |
| C12 | C11 | C9 | 111.3° | 111.8° |
| C11 | C12 | C13 | 112.6° | 108.1° |
| C12 | C11 | H4 | 109.0° | 109.1° |
| C12 | C11 | H5 | 109.0° | 109.0° |
| C11 | C12 | H6 | 108.7° | 109.8° |
| C11 | C12 | H7 | 108.7° | 109.9° |
| C11 | C9 | C6 | 109.9° | 110.7° |
| C11 | C9 | H2 | 109.4° | 109.2° |
| C11 | C9 | H3 | 109.4° | 109.3° |
| C9 | C11 | H4 | 109.0° | 109.2° |
| C9 | C11 | H5 | 109.0° | 108.8° |
| C12 | C13 | C17 | 117.8° | 118.3° |
| C12 | C13 | C14 | 106.8° | 107.7° |
| C13 | C12 | H6 | 108.6° | 109.4° |
| C13 | C12 | H7 | 108.7° | 109.8° |
| C21 | C20 | C17 | 111.5° | 109.5° |
| C20 | C21 | H13 | 109.5° | 109.5° |
| C20 | C21 | H14 | 109.5° | 109.5° |
| C20 | C21 | H15 | 109.5° | 109.5° |
| C21 | C20 | H27 | 107.0° | 109.5° |
| C20 | C17 | C13 | 121.2° | 110.0° |
| C20 | C17 | C16 | 113.2° | 110.3° |
| C20 | C17 | H17 | 105.9° | 110.3° |
| C17 | C20 | H27 | 106.8° | 109.5° |
| C17 | C13 | C14 | 98.6° | 103.3° |
| C13 | C17 | C16 | 103.5° | 104.6° |
| C13 | C17 | H17 | 105.9° | 111.2° |
| C13 | C14 | C6 | 112.5° | 106.0° |
| C13 | C14 | C15 | 103.7° | 101.2° |
| C13 | C14 | H1 | 105.8° | 111.0° |
| C1 | C2 | C3 | 105.1° | 109.9° |
| C2 | C1 | O1 | 109.6° | 109.6° |
| C2 | C1 | C10 | 111.3° | 108.3° |
| C1 | C2 | H22 | 110.6° | 109.4° |
| C1 | C2 | H23 | 110.5° | 109.4° |
| C2 | C1 | H24 | 107.8° | 109.8° |
| C2 | C3 | C4 | 110.1° | 109.8° |
| C2 | C3 | O2 | 110.3° | 109.4° |
| C2 | C3 | H21 | 108.2° | 109.4° |
| C3 | C2 | H22 | 110.5° | 109.6° |
| C3 | C2 | H23 | 110.6° | 109.2° |
| O1 | C1 | C10 | 110.8° | 109.7° |
| O1 | C1 | H24 | 109.3° | 109.7° |
| C1 | O1 | H41 | 109.5° | 114.0° |
| C5 | C10 | C1 | 115.9° | 116.8° |
| C10 | C5 | C4 | 111.6° | 116.8° |
| C10 | C5 | C28 | 124.8° | 121.6° |
| C10 | C1 | H24 | 108.0° | 109.7° |
| C5 | C4 | C3 | 114.1° | 108.3° |
| C4 | C5 | C28 | 123.1° | 121.6° |
| C5 | C4 | H20 | 107.2° | 109.7° |
| C4 | C3 | O2 | 110.6° | 109.4° |
| C3 | C4 | H20 | 107.0° | 109.7° |
| C4 | C3 | H21 | 108.2° | 109.4° |
| C5 | C28 | C7 | 127.0° | 120.0° |
| C5 | C28 | H19 | 116.5° | 120.1° |
| C17 | C16 | C15 | 104.7° | 106.4° |
| C16 | C17 | H17 | 106.0° | 110.3° |
| C17 | C16 | H25 | 110.7° | 110.0° |
| C17 | C16 | H26 | 110.6° | 110.1° |
| C9 | C6 | C7 | 125.4° | 122.4° |
| C9 | C6 | C14 | 110.4° | 115.2° |
| C6 | C9 | H2 | 109.4° | 109.2° |
| C6 | C9 | H3 | 109.4° | 109.2° |
| O2 | C3 | H21 | 109.4° | 109.4° |
| C3 | O2 | H40 | 109.5° | 114.0° |
| C28 | C7 | C6 | 126.3° | 120.0° |
| C28 | C7 | H18 | 116.8° | 120.0° |
| C7 | C28 | H19 | 116.5° | 120.0° |
| C7 | C6 | C14 | 123.9° | 122.4° |
| C6 | C7 | H18 | 116.8° | 120.0° |
| C6 | C14 | C15 | 121.6° | 116.6° |
| C6 | C14 | H1 | 106.3° | 110.7° |
| C14 | C15 | C16 | 104.6° | 102.8° |
| C15 | C14 | H1 | 105.9° | 110.8° |
| C14 | C15 | H34 | 110.6° | 110.8° |
| C14 | C15 | H35 | 110.7° | 110.8° |
| C15 | C16 | H25 | 110.6° | 110.1° |
| C15 | C16 | H26 | 110.7° | 110.1° |
| C16 | C15 | H34 | 110.7° | 110.7° |
| C16 | C15 | H35 | 110.7° | 110.8° |
| H2 | C9 | H3 | 109.5° | 109.2° |
| H4 | C11 | H5 | 109.4° | 108.9° |
| H6 | C12 | H7 | 109.5° | 109.9° |
| H8 | C18 | H9 | 109.5° | 109.5° |
| H8 | C18 | H10 | 109.4° | 109.5° |
| H9 | C18 | H10 | 109.5° | 109.5° |
| H11 | C19 | H12 | 120.0° | 120.0° |
| H13 | C21 | H14 | 109.4° | 109.5° |
| H13 | C21 | H15 | 109.4° | 109.5° |
| H14 | C21 | H15 | 109.5° | 109.4° |
| H22 | C2 | H23 | 109.5° | 109.4° |
| H25 | C16 | H26 | 109.5° | 110.1° |
| H28 | C22 | H29 | 109.5° | 109.5° |
| H31 | C26 | H32 | 109.5° | 109.5° |
| H31 | C26 | H33 | 109.4° | 109.5° |
| H32 | C26 | H33 | 109.5° | 109.4° |
| H34 | C15 | H35 | 109.5° | 110.8° |
| H36 | C27 | H37 | 109.5° | 109.5° |
| H36 | C27 | H38 | 109.5° | 109.4° |
| H37 | C27 | H38 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C26 | C25 | C27 | O3 | 116.7° | 120.0° |
| C26 | C25 | C27 | C24 | 124.9° | 120.0° |
| C26 | C25 | O3 | C24 | 121.7° | 120.0° |
| C26 | C25 | C24 | C23 | 178.7° | 120.0° |
| C26 | C25 | C24 | H30 | 1.3° | 60.0° |
| C25 | C26 | H31 | H32 | 120.0° | 120.0° |
| C25 | C26 | H31 | H33 | 120.0° | 120.0° |
| C25 | C26 | H32 | H33 | 120.0° | 120.0° |
| C26 | C25 | C27 | H36 | 180.0° | 60.0° |
| C26 | C25 | C27 | H37 | 60.0° | 60.0° |
| C26 | C25 | C27 | H38 | 60.0° | 179.9° |
| C26 | C25 | O3 | H42 | 180.0° | 60.0° |
| C27 | C25 | O3 | C24 | 119.9° | 120.0° |
| C27 | C25 | C24 | C23 | 54.7° | 120.0° |
| C27 | C25 | C24 | H30 | 125.4° | 60.0° |
| C27 | C25 | C26 | H31 | 180.0° | 180.0° |
| C27 | C25 | C26 | H32 | 60.0° | 60.0° |
| C27 | C25 | C26 | H33 | 60.0° | 60.0° |
| C25 | C27 | H36 | H37 | 120.0° | 120.0° |
| C25 | C27 | H36 | H38 | 120.0° | 120.0° |
| C25 | C27 | H37 | H38 | 120.0° | 120.1° |
| C27 | C25 | O3 | H42 | 61.7° | 60.0° |
| O3 | C25 | C24 | C23 | 62.1° | 0.0° |
| O3 | C25 | C24 | H30 | 117.9° | 180.0° |
| O3 | C25 | C26 | H31 | 64.4° | 60.0° |
| O3 | C25 | C26 | H32 | 55.6° | 180.0° |
| O3 | C25 | C26 | H33 | 175.6° | 60.1° |
| O3 | C25 | C27 | H36 | 63.3° | 60.0° |
| O3 | C25 | C27 | H37 | 176.6° | 180.0° |
| O3 | C25 | C27 | H38 | 56.7° | 59.9° |
| C25 | C24 | C23 | H30 | 180.0° | 180.0° |
| C25 | C24 | C23 | C22 | 170.5° | 180.0° |
| C25 | C24 | C23 | H16 | 9.5° | 0.0° |
| C24 | C25 | C26 | H31 | 55.5° | 60.0° |
| C24 | C25 | C26 | H32 | 175.5° | 60.1° |
| C24 | C25 | C26 | H33 | 64.5° | 180.0° |
| C24 | C25 | C27 | H36 | 55.1° | 180.0° |
| C24 | C25 | C27 | H37 | 64.9° | 60.0° |
| C24 | C25 | C27 | H38 | 175.1° | 60.0° |
| C24 | C25 | O3 | H42 | 58.3° | 180.0° |
| C24 | C23 | C22 | H16 | 180.0° | 179.9° |
| C24 | C23 | C22 | C20 | 179.3° | 125.0° |
| C24 | C23 | C22 | H28 | 60.1° | 115.0° |
| C24 | C23 | C22 | H29 | 58.6° | 5.0° |
| C23 | C22 | C20 | H28 | 120.7° | 119.9° |
| C23 | C22 | C20 | H29 | 120.7° | 120.0° |
| C23 | C22 | C20 | C21 | 73.2° | 65.0° |
| C23 | C22 | C20 | C17 | 160.4° | 175.0° |
| C23 | C22 | C20 | H27 | 42.6° | 55.0° |
| C23 | C22 | H28 | H29 | 118.0° | 119.9° |
| C22 | C23 | C24 | H30 | 9.5° | 0.0° |
| C22 | C20 | C21 | C17 | 127.9° | 120.0° |
| C22 | C20 | C21 | H27 | 115.7° | 120.0° |
| C22 | C20 | C17 | H27 | 117.8° | 120.0° |
| C22 | C20 | C17 | C13 | 72.8° | 176.4° |
| C22 | C20 | C17 | C16 | 51.0° | 61.5° |
| C22 | C20 | C21 | H13 | 180.0° | 60.0° |
| C22 | C20 | C21 | H14 | 60.0° | 60.0° |
| C22 | C20 | C21 | H15 | 60.0° | 180.0° |
| C20 | C22 | C23 | H16 | 0.7° | 55.0° |
| C22 | C20 | C17 | H17 | 166.7° | 60.7° |
| C20 | C22 | H28 | H29 | 118.0° | 120.1° |
| O4 | C4 | C3 | C2 | 67.4° | 177.4° |
| O4 | C4 | C5 | C10 | 79.9° | 166.6° |
| O4 | C4 | C5 | C3 | 124.3° | 119.7° |
| O4 | C4 | C5 | H20 | 117.5° | 120.6° |
| O4 | C4 | C3 | H20 | 117.4° | 120.5° |
| O4 | C4 | C5 | C28 | 92.2° | 13.7° |
| O4 | C4 | C3 | O2 | 170.4° | 62.5° |
| O4 | C4 | C3 | H21 | 50.6° | 57.3° |
| C18 | C13 | C12 | C11 | 63.5° | 50.4° |
| C18 | C13 | C12 | C17 | 131.5° | 125.9° |
| C18 | C13 | C12 | C14 | 118.9° | 117.6° |
| C18 | C13 | C17 | C20 | 60.6° | 34.2° |
| C18 | C13 | C17 | C14 | 115.2° | 115.3° |
| C18 | C13 | C17 | C16 | 67.7° | 84.3° |
| C18 | C13 | C14 | C6 | 62.1° | 52.5° |
| C18 | C13 | C14 | C15 | 71.0° | 69.7° |
| C18 | C13 | C14 | H1 | 177.7° | 172.7° |
| C18 | C13 | C12 | H6 | 176.0° | 169.9° |
| C18 | C13 | C12 | H7 | 57.0° | 69.4° |
| C13 | C18 | H8 | H9 | 120.0° | 120.0° |
| C13 | C18 | H8 | H10 | 120.0° | 120.0° |
| C13 | C18 | H9 | H10 | 120.0° | 120.0° |
| C18 | C13 | C17 | H17 | 179.0° | 156.6° |
| C19 | C10 | C1 | C2 | 119.1° | 133.5° |
| C19 | C10 | C1 | O1 | 3.1° | 106.9° |
| C19 | C10 | C5 | C1 | 173.2° | 179.9° |
| C19 | C10 | C5 | C4 | 130.0° | 136.7° |
| C19 | C10 | C5 | C28 | 41.9° | 43.0° |
| C10 | C19 | H11 | H12 | 180.0° | 179.9° |
| C19 | C10 | C1 | H24 | 122.7° | 13.7° |
| C12 | C11 | C9 | H4 | 120.3° | 120.8° |
| C12 | C11 | C9 | H5 | 120.3° | 120.5° |
| C11 | C12 | C13 | H6 | 120.5° | 119.5° |
| C11 | C12 | C13 | H7 | 120.5° | 119.8° |
| C11 | C12 | C13 | C17 | 165.0° | 176.3° |
| C11 | C12 | C13 | C14 | 55.4° | 67.2° |
| C12 | C11 | C9 | C6 | 55.7° | 48.6° |
| C12 | C11 | C9 | H2 | 175.8° | 71.7° |
| C12 | C11 | C9 | H3 | 64.4° | 168.9° |
| C12 | C11 | H4 | H5 | 119.2° | 118.9° |
| C11 | C12 | H6 | H7 | 118.6° | 121.0° |
| C9 | C11 | C12 | C13 | 56.4° | 58.8° |
| C11 | C9 | C6 | H2 | 120.1° | 120.3° |
| C11 | C9 | C6 | H3 | 120.1° | 120.4° |
| C11 | C9 | C6 | C7 | 116.6° | 129.8° |
| C11 | C9 | C6 | C14 | 57.4° | 50.2° |
| C11 | C9 | H2 | H3 | 119.8° | 119.5° |
| C9 | C11 | H4 | H5 | 119.1° | 118.7° |
| C9 | C11 | C12 | H6 | 64.0° | 60.4° |
| C9 | C11 | C12 | H7 | 176.9° | 178.6° |
| C12 | C13 | C17 | C20 | 70.0° | 91.7° |
| C12 | C13 | C17 | C14 | 114.2° | 118.8° |
| C12 | C13 | C17 | C16 | 161.7° | 149.8° |
| C12 | C13 | C14 | C6 | 57.6° | 65.7° |
| C12 | C13 | C14 | C15 | 169.3° | 172.1° |
| C12 | C13 | C14 | H1 | 58.0° | 54.5° |
| C13 | C12 | C11 | H4 | 63.9° | 179.6° |
| C13 | C12 | C11 | H5 | 176.7° | 61.5° |
| C13 | C12 | H6 | H7 | 118.5° | 120.6° |
| C12 | C13 | C18 | H8 | 180.0° | 59.3° |
| C12 | C13 | C18 | H9 | 60.0° | 179.3° |
| C12 | C13 | C18 | H10 | 60.0° | 60.7° |
| C12 | C13 | C17 | H17 | 50.5° | 30.7° |
| C21 | C20 | C17 | H27 | 116.6° | 120.0° |
| C21 | C20 | C17 | C13 | 161.6° | 63.6° |
| C21 | C20 | C17 | C16 | 74.5° | 178.5° |
| C20 | C21 | H13 | H14 | 120.0° | 120.0° |
| C20 | C21 | H13 | H15 | 120.0° | 120.0° |
| C20 | C21 | H14 | H15 | 120.0° | 120.0° |
| C21 | C20 | C17 | H17 | 41.2° | 59.3° |
| C21 | C20 | C22 | H28 | 47.5° | 55.0° |
| C21 | C20 | C22 | H29 | 166.1° | 175.1° |
| C20 | C17 | C13 | C16 | 128.3° | 118.5° |
| C20 | C17 | C13 | H17 | 120.4° | 122.4° |
| C20 | C17 | C13 | C14 | 175.8° | 149.5° |
| C20 | C17 | C16 | H17 | 115.7° | 122.1° |
| C20 | C17 | C16 | C15 | 163.8° | 123.0° |
| C17 | C20 | C21 | H13 | 52.1° | 180.0° |
| C17 | C20 | C21 | H14 | 172.1° | 60.0° |
| C17 | C20 | C21 | H15 | 67.9° | 60.0° |
| C20 | C17 | C16 | H25 | 76.9° | 117.8° |
| C20 | C17 | C16 | H26 | 44.6° | 3.8° |
| C17 | C20 | C22 | H28 | 78.9° | 65.0° |
| C17 | C20 | C22 | H29 | 39.8° | 55.0° |
| C13 | C17 | C16 | H17 | 111.2° | 119.7° |
| C17 | C13 | C14 | C6 | 179.8° | 168.4° |
| C17 | C13 | C14 | C15 | 46.7° | 46.2° |
| C13 | C17 | C16 | C15 | 30.7° | 4.7° |
| C17 | C13 | C14 | H1 | 64.5° | 71.4° |
| C17 | C13 | C12 | H6 | 44.5° | 64.2° |
| C17 | C13 | C12 | H7 | 74.5° | 56.5° |
| C17 | C13 | C18 | H8 | 45.9° | 169.7° |
| C17 | C13 | C18 | H9 | 74.2° | 49.8° |
| C17 | C13 | C18 | H10 | 165.9° | 70.2° |
| C13 | C17 | C16 | H25 | 150.0° | 123.9° |
| C13 | C17 | C16 | H26 | 88.5° | 114.5° |
| C13 | C17 | C20 | H27 | 45.0° | 56.4° |
| C14 | C13 | C17 | C16 | 47.5° | 31.0° |
| C13 | C14 | C6 | C9 | 60.5° | 57.8° |
| C13 | C14 | C6 | C7 | 113.7° | 122.2° |
| C13 | C14 | C6 | C15 | 123.6° | 111.8° |
| C13 | C14 | C6 | H1 | 115.4° | 120.4° |
| C13 | C14 | C15 | H1 | 111.2° | 117.7° |
| C13 | C14 | C15 | C16 | 28.5° | 42.3° |
| C14 | C13 | C12 | H6 | 65.1° | 52.3° |
| C14 | C13 | C12 | H7 | 175.9° | 172.9° |
| C14 | C13 | C18 | H8 | 62.7° | 57.8° |
| C14 | C13 | C18 | H9 | 177.3° | 62.1° |
| C14 | C13 | C18 | H10 | 57.3° | 177.9° |
| C14 | C13 | C17 | H17 | 63.7° | 88.1° |
| C13 | C14 | C15 | H34 | 90.7° | 76.0° |
| C13 | C14 | C15 | H35 | 147.7° | 160.6° |
| C1 | C2 | C3 | H22 | 119.3° | 120.3° |
| C1 | C2 | C3 | H23 | 119.3° | 120.0° |
| C2 | C1 | O1 | C10 | 123.2° | 118.8° |
| C2 | C1 | O1 | H24 | 117.9° | 120.7° |
| C2 | C1 | C10 | C5 | 54.3° | 46.5° |
| C2 | C1 | C10 | H24 | 118.1° | 119.9° |
| C1 | C2 | C3 | C4 | 63.1° | 66.0° |
| C1 | C2 | C3 | O2 | 59.3° | 173.9° |
| C1 | C2 | C3 | H21 | 178.8° | 54.1° |
| C1 | C2 | H22 | H23 | 122.0° | 119.8° |
| C2 | C1 | O1 | H41 | 180.0° | 178.8° |
| C3 | C2 | C1 | O1 | 175.3° | 62.2° |
| C3 | C2 | C1 | C10 | 61.8° | 57.4° |
| C2 | C3 | C4 | C5 | 56.8° | 57.7° |
| C2 | C3 | C4 | O2 | 122.2° | 120.1° |
| C2 | C3 | C4 | H21 | 118.1° | 120.1° |
| C2 | C3 | O2 | H21 | 118.9° | 119.8° |
| C2 | C3 | C4 | H20 | 175.2° | 62.0° |
| C3 | C2 | H22 | H23 | 122.0° | 119.6° |
| C3 | C2 | C1 | H24 | 56.5° | 177.2° |
| C2 | C3 | O2 | H40 | 180.0° | 59.7° |
| O1 | C1 | C10 | C5 | 176.5° | 73.0° |
| O1 | C1 | C10 | H24 | 119.7° | 120.6° |
| O1 | C1 | C2 | H22 | 56.1° | 58.2° |
| O1 | C1 | C2 | H23 | 65.4° | 177.9° |
| C10 | C5 | C4 | C28 | 172.0° | 179.7° |
| C10 | C5 | C4 | C3 | 44.4° | 46.9° |
| C10 | C5 | C28 | C7 | 8.7° | 0.0° |
| C5 | C10 | C19 | H11 | 172.9° | 0.1° |
| C5 | C10 | C19 | H12 | 7.1° | 180.0° |
| C10 | C5 | C28 | H19 | 171.3° | 179.9° |
| C10 | C5 | C4 | H20 | 162.7° | 72.8° |
| C5 | C10 | C1 | H24 | 63.9° | 166.4° |
| C1 | C10 | C5 | C4 | 43.2° | 43.4° |
| C1 | C10 | C5 | C28 | 144.9° | 136.9° |
| C1 | C10 | C19 | H11 | 0.0° | 180.0° |
| C1 | C10 | C19 | H12 | 180.0° | 0.1° |
| C10 | C1 | C2 | H22 | 179.0° | 177.8° |
| C10 | C1 | C2 | H23 | 57.5° | 62.5° |
| C10 | C1 | O1 | H41 | 56.8° | 60.0° |
| C5 | C4 | C3 | H20 | 118.3° | 119.8° |
| C5 | C4 | C3 | O2 | 65.4° | 177.8° |
| C4 | C5 | C28 | C7 | 179.7° | 179.7° |
| C4 | C5 | C28 | H19 | 0.3° | 0.3° |
| C5 | C4 | C3 | H21 | 174.9° | 62.4° |
| C5 | C4 | O4 | H39 | 180.0° | 60.0° |
| C3 | C4 | C5 | C28 | 143.5° | 133.4° |
| C4 | C3 | O2 | H21 | 119.0° | 119.8° |
| C4 | C3 | C2 | H22 | 177.6° | 173.7° |
| C4 | C3 | C2 | H23 | 56.2° | 54.0° |
| C3 | C4 | O4 | H39 | 53.4° | 178.8° |
| C4 | C3 | O2 | H40 | 57.9° | 180.0° |
| C5 | C28 | C7 | H19 | 180.0° | 179.9° |
| C5 | C28 | C7 | C6 | 163.3° | 180.0° |
| C5 | C28 | C7 | H18 | 16.6° | 0.0° |
| C28 | C5 | C4 | H20 | 25.3° | 106.9° |
| C17 | C16 | C15 | C14 | 1.3° | 23.7° |
| C17 | C16 | C15 | H25 | 119.3° | 119.2° |
| C17 | C16 | C15 | H26 | 119.2° | 119.2° |
| C17 | C16 | H25 | H26 | 122.2° | 121.6° |
| C16 | C17 | C20 | H27 | 168.9° | 58.5° |
| C17 | C16 | C15 | H34 | 120.5° | 94.7° |
| C17 | C16 | C15 | H35 | 118.0° | 142.0° |
| C9 | C6 | C7 | C28 | 5.9° | 0.0° |
| C9 | C6 | C7 | C14 | 173.3° | 180.0° |
| C9 | C6 | C14 | C15 | 175.9° | 169.6° |
| C9 | C6 | C14 | H1 | 54.9° | 62.6° |
| C6 | C9 | H2 | H3 | 119.8° | 119.4° |
| C6 | C9 | C11 | H4 | 64.6° | 169.3° |
| C6 | C9 | C11 | H5 | 176.0° | 71.9° |
| C9 | C6 | C7 | H18 | 174.0° | 180.0° |
| O2 | C3 | C4 | H20 | 52.9° | 58.1° |
| O2 | C3 | C2 | H22 | 60.0° | 53.7° |
| O2 | C3 | C2 | H23 | 178.5° | 66.1° |
| C28 | C7 | C6 | H18 | 180.0° | 180.0° |
| C28 | C7 | C6 | C14 | 179.2° | 180.0° |
| C7 | C6 | C14 | C15 | 10.0° | 10.4° |
| C7 | C6 | C14 | H1 | 131.0° | 117.4° |
| C7 | C6 | C9 | H2 | 3.4° | 109.9° |
| C7 | C6 | C9 | H3 | 123.3° | 9.4° |
| C6 | C7 | C28 | H19 | 16.7° | 0.1° |
| C6 | C14 | C15 | H1 | 121.2° | 127.8° |
| C6 | C14 | C15 | C16 | 156.2° | 156.8° |
| C14 | C6 | C9 | H2 | 177.5° | 70.1° |
| C14 | C6 | C9 | H3 | 62.6° | 170.6° |
| C14 | C6 | C7 | H18 | 0.8° | 0.0° |
| C6 | C14 | C15 | H34 | 36.9° | 38.5° |
| C6 | C14 | C15 | H35 | 84.6° | 84.9° |
| C14 | C15 | C16 | H34 | 119.2° | 118.3° |
| C14 | C15 | C16 | H35 | 119.3° | 118.4° |
| C14 | C15 | C16 | H25 | 120.5° | 95.5° |
| C14 | C15 | C16 | H26 | 118.0° | 142.9° |
| C14 | C15 | H34 | H35 | 122.3° | 123.3° |
| C16 | C15 | C14 | H1 | 82.7° | 75.4° |
| C15 | C16 | C17 | H17 | 80.5° | 114.9° |
| C15 | C16 | H25 | H26 | 122.2° | 121.6° |
| C16 | C15 | H34 | H35 | 122.3° | 123.3° |
| H1 | C14 | C15 | H34 | 158.1° | 166.3° |
| H1 | C14 | C15 | H35 | 36.6° | 42.9° |
| H2 | C9 | C11 | H4 | 55.5° | 49.1° |
| H2 | C9 | C11 | H5 | 63.9° | 167.8° |
| H3 | C9 | C11 | H4 | 175.4° | 70.3° |
| H3 | C9 | C11 | H5 | 55.9° | 48.4° |
| H4 | C11 | C12 | H6 | 175.7° | 60.4° |
| H4 | C11 | C12 | H7 | 56.6° | 60.6° |
| H5 | C11 | C12 | H6 | 56.3° | 179.2° |
| H5 | C11 | C12 | H7 | 62.8° | 58.3° |
| H8 | C18 | H9 | H10 | 120.0° | 120.1° |
| H13 | C21 | H14 | H15 | 120.0° | 120.0° |
| H13 | C21 | C20 | H27 | 64.3° | 60.0° |
| H14 | C21 | C20 | H27 | 55.6° | 180.0° |
| H15 | C21 | C20 | H27 | 175.7° | 60.1° |
| H16 | C23 | C22 | H28 | 119.9° | 65.1° |
| H16 | C23 | C22 | H29 | 121.4° | 175.0° |
| H16 | C23 | C24 | H30 | 170.6° | 180.0° |
| H17 | C17 | C16 | H25 | 38.8° | 4.3° |
| H17 | C17 | C16 | H26 | 160.2° | 125.8° |
| H17 | C17 | C20 | H27 | 75.4° | 179.4° |
| H18 | C7 | C28 | H19 | 163.4° | 180.0° |
| H20 | C4 | C3 | H21 | 66.8° | 177.9° |
| H20 | C4 | O4 | H39 | 63.2° | 60.6° |
| H21 | C3 | C2 | H22 | 59.5° | 66.1° |
| H21 | C3 | C2 | H23 | 61.9° | 174.1° |
| H21 | C3 | O2 | H40 | 61.1° | 60.2° |
| H22 | C2 | C1 | H24 | 62.8° | 62.5° |
| H23 | C2 | C1 | H24 | 175.8° | 57.3° |
| H24 | C1 | O1 | H41 | 62.1° | 60.5° |
| H25 | C16 | C15 | H34 | 120.3° | 146.2° |
| H25 | C16 | C15 | H35 | 1.3° | 22.9° |
| H26 | C16 | C15 | H34 | 1.2° | 24.6° |
| H26 | C16 | C15 | H35 | 122.8° | 98.7° |
| H27 | C20 | C22 | H28 | 163.3° | 175.0° |
| H27 | C20 | C22 | H29 | 78.1° | 65.0° |
| H31 | C26 | H32 | H33 | 120.0° | 120.0° |
| H36 | C27 | H37 | H38 | 120.0° | 120.0° |
