A1ECX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O1 | C1 | doub | 1.21Å | 1.25Å | |
| C1 | C2 | sing | 1.47Å | 1.53Å | |
| C2 | C3 | doub | 1.40Å | 1.42Å | Aromatic |
| C3 | C4 | sing | 1.38Å | 1.40Å | Aromatic |
| C4 | C5 | doub | 1.38Å | 1.38Å | Aromatic |
| C5 | C6 | sing | 1.38Å | 1.37Å | Aromatic |
| C6 | C7 | doub | 1.39Å | 1.40Å | Aromatic |
| C7 | O2 | sing | 1.36Å | 1.37Å | |
| C3 | C8 | sing | 1.51Å | 1.52Å | |
| C8 | C9 | sing | 1.53Å | 1.52Å | |
| C9 | C10 | sing | 1.53Å | 1.53Å | |
| C10 | C11 | sing | 1.53Å | 1.52Å | |
| C11 | C12 | sing | 1.53Å | 1.52Å | |
| C12 | C13 | sing | 1.53Å | 1.52Å | |
| C13 | C14 | sing | 1.53Å | 1.52Å | |
| C14 | C15 | sing | 1.53Å | 1.53Å | |
| C15 | C16 | sing | 1.53Å | 1.51Å | |
| C16 | C17 | sing | 1.51Å | 1.50Å | |
| C17 | C18 | doub | 1.31Å | 1.30Å | |
| C18 | C19 | sing | 1.51Å | 1.49Å | |
| C19 | C20 | sing | 1.53Å | 1.51Å | |
| C20 | C21 | sing | 1.53Å | 1.53Å | |
| C21 | C22 | sing | 1.53Å | 1.52Å | |
| C22 | C23 | sing | 1.53Å | 1.51Å | |
| C23 | C24 | sing | 1.53Å | 1.52Å | |
| C1 | O3 | sing | 1.35Å | 1.23Å | |
| C2 | C7 | sing | 1.40Å | 1.41Å | Aromatic |
| C4 | H1 | sing | 1.08Å | 1.08Å | |
| C5 | H2 | sing | 1.08Å | 1.08Å | |
| C6 | H3 | sing | 1.08Å | 1.08Å | |
| C8 | H5 | sing | 1.09Å | 1.10Å | |
| C8 | H6 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.09Å | 1.10Å | |
| C13 | H15 | sing | 1.09Å | 1.10Å | |
| C13 | H16 | sing | 1.09Å | 1.10Å | |
| C15 | H20 | sing | 1.09Å | 1.10Å | |
| C15 | H19 | sing | 1.09Å | 1.10Å | |
| C17 | H23 | sing | 1.08Å | 1.08Å | |
| C20 | H27 | sing | 1.09Å | 1.10Å | |
| C20 | H28 | sing | 1.09Å | 1.10Å | |
| C21 | H30 | sing | 1.09Å | 1.10Å | |
| C21 | H29 | sing | 1.09Å | 1.10Å | |
| C22 | H31 | sing | 1.09Å | 1.10Å | |
| C22 | H32 | sing | 1.09Å | 1.10Å | |
| C24 | H36 | sing | 1.09Å | 1.10Å | |
| C24 | H35 | sing | 1.09Å | 1.10Å | |
| C24 | H37 | sing | 1.09Å | 1.10Å | |
| O2 | H4 | sing | 0.97Å | 0.95Å | |
| C9 | H7 | sing | 1.09Å | 1.10Å | |
| C9 | H8 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H14 | sing | 1.09Å | 1.10Å | |
| C12 | H13 | sing | 1.09Å | 1.10Å | |
| C14 | H18 | sing | 1.09Å | 1.10Å | |
| C14 | H17 | sing | 1.09Å | 1.10Å | |
| C16 | H21 | sing | 1.09Å | 1.10Å | |
| C16 | H22 | sing | 1.09Å | 1.10Å | |
| C18 | H24 | sing | 1.08Å | 1.08Å | |
| C19 | H25 | sing | 1.09Å | 1.10Å | |
| C19 | H26 | sing | 1.09Å | 1.10Å | |
| C23 | H34 | sing | 1.09Å | 1.10Å | |
| C23 | H33 | sing | 1.09Å | 1.10Å | |
| O3 | H38 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C1 | C2 | 117.8° | 120.0° |
| O1 | C1 | O3 | 124.0° | 120.1° |
| C1 | C2 | C3 | 121.7° | 120.2° |
| C2 | C1 | O3 | 118.1° | 120.0° |
| C1 | C2 | C7 | 119.6° | 120.2° |
| C2 | C3 | C4 | 118.6° | 119.9° |
| C2 | C3 | C8 | 123.3° | 120.0° |
| C3 | C2 | C7 | 118.7° | 119.6° |
| C3 | C4 | C5 | 121.6° | 120.3° |
| C4 | C3 | C8 | 118.1° | 120.1° |
| C3 | C4 | H1 | 119.2° | 119.8° |
| C4 | C5 | C6 | 120.2° | 120.4° |
| C5 | C4 | H1 | 119.2° | 119.8° |
| C4 | C5 | H2 | 119.9° | 119.8° |
| C5 | C6 | C7 | 120.2° | 120.1° |
| C6 | C5 | H2 | 119.9° | 119.8° |
| C5 | C6 | H3 | 119.9° | 120.0° |
| C6 | C7 | O2 | 118.1° | 120.2° |
| C6 | C7 | C2 | 120.6° | 119.7° |
| C7 | C6 | H3 | 119.9° | 119.9° |
| O2 | C7 | C2 | 121.3° | 120.1° |
| C7 | O2 | H4 | 109.5° | 113.9° |
| C3 | C8 | C9 | 114.0° | 109.5° |
| C3 | C8 | H5 | 108.3° | 109.5° |
| C3 | C8 | H6 | 108.3° | 109.4° |
| C8 | C9 | C10 | 114.2° | 109.5° |
| C9 | C8 | H5 | 108.3° | 109.5° |
| C9 | C8 | H6 | 108.3° | 109.5° |
| C8 | C9 | H7 | 108.3° | 109.5° |
| C8 | C9 | H8 | 108.3° | 109.5° |
| C9 | C10 | C11 | 114.6° | 109.5° |
| C9 | C10 | H10 | 108.2° | 109.4° |
| C9 | C10 | H9 | 108.2° | 109.4° |
| C10 | C9 | H7 | 108.3° | 109.4° |
| C10 | C9 | H8 | 108.3° | 109.5° |
| C10 | C11 | C12 | 114.6° | 109.4° |
| C11 | C10 | H10 | 108.2° | 109.5° |
| C11 | C10 | H9 | 108.2° | 109.5° |
| C10 | C11 | H11 | 108.2° | 109.5° |
| C10 | C11 | H12 | 108.2° | 109.5° |
| C11 | C12 | C13 | 114.3° | 109.4° |
| C12 | C11 | H11 | 108.2° | 109.5° |
| C12 | C11 | H12 | 108.2° | 109.4° |
| C11 | C12 | H14 | 108.3° | 109.4° |
| C11 | C12 | H13 | 108.3° | 109.5° |
| C12 | C13 | C14 | 114.2° | 109.5° |
| C12 | C13 | H15 | 108.3° | 109.5° |
| C12 | C13 | H16 | 108.3° | 109.5° |
| C13 | C12 | H14 | 108.2° | 109.5° |
| C13 | C12 | H13 | 108.2° | 109.5° |
| C13 | C14 | C15 | 114.5° | 109.5° |
| C14 | C13 | H15 | 108.3° | 109.4° |
| C14 | C13 | H16 | 108.3° | 109.4° |
| C13 | C14 | H18 | 108.2° | 109.4° |
| C13 | C14 | H17 | 108.2° | 109.5° |
| C14 | C15 | C16 | 114.7° | 109.5° |
| C14 | C15 | H20 | 108.2° | 109.5° |
| C14 | C15 | H19 | 108.1° | 109.5° |
| C15 | C14 | H18 | 108.2° | 109.5° |
| C15 | C14 | H17 | 108.2° | 109.5° |
| C15 | C16 | C17 | 113.2° | 109.5° |
| C16 | C15 | H20 | 108.1° | 109.4° |
| C16 | C15 | H19 | 108.1° | 109.4° |
| C15 | C16 | H21 | 108.5° | 109.4° |
| C15 | C16 | H22 | 108.5° | 109.5° |
| C16 | C17 | C18 | 125.0° | 120.0° |
| C16 | C17 | H23 | 117.5° | 120.0° |
| C17 | C16 | H21 | 108.6° | 109.5° |
| C17 | C16 | H22 | 108.6° | 109.5° |
| C17 | C18 | C19 | 125.9° | 120.0° |
| C18 | C17 | H23 | 117.5° | 120.0° |
| C17 | C18 | H24 | 117.1° | 120.0° |
| C18 | C19 | C20 | 113.4° | 109.5° |
| C19 | C18 | H24 | 117.0° | 120.1° |
| C18 | C19 | H25 | 108.5° | 109.5° |
| C18 | C19 | H26 | 108.5° | 109.5° |
| C19 | C20 | C21 | 114.7° | 109.5° |
| C19 | C20 | H27 | 108.2° | 109.4° |
| C19 | C20 | H28 | 108.1° | 109.5° |
| C20 | C19 | H25 | 108.5° | 109.5° |
| C20 | C19 | H26 | 108.5° | 109.5° |
| C20 | C21 | C22 | 114.5° | 109.4° |
| C21 | C20 | H27 | 108.1° | 109.4° |
| C21 | C20 | H28 | 108.2° | 109.5° |
| C20 | C21 | H30 | 108.2° | 109.5° |
| C20 | C21 | H29 | 108.2° | 109.4° |
| C21 | C22 | C23 | 114.5° | 109.4° |
| C22 | C21 | H30 | 108.2° | 109.5° |
| C22 | C21 | H29 | 108.2° | 109.5° |
| C21 | C22 | H31 | 108.2° | 109.5° |
| C21 | C22 | H32 | 108.2° | 109.5° |
| C22 | C23 | C24 | 113.8° | 109.4° |
| C23 | C22 | H31 | 108.2° | 109.4° |
| C23 | C22 | H32 | 108.2° | 109.5° |
| C22 | C23 | H34 | 108.4° | 109.5° |
| C22 | C23 | H33 | 108.4° | 109.5° |
| C23 | C24 | H36 | 109.5° | 109.5° |
| C23 | C24 | H35 | 109.5° | 109.5° |
| C23 | C24 | H37 | 109.5° | 109.5° |
| C24 | C23 | H34 | 108.4° | 109.5° |
| C24 | C23 | H33 | 108.4° | 109.5° |
| C1 | O3 | H38 | 109.5° | 117.0° |
| H5 | C8 | H6 | 109.5° | 109.5° |
| H10 | C10 | H9 | 109.5° | 109.5° |
| H15 | C13 | H16 | 109.5° | 109.5° |
| H20 | C15 | H19 | 109.5° | 109.5° |
| H27 | C20 | H28 | 109.5° | 109.5° |
| H30 | C21 | H29 | 109.5° | 109.5° |
| H31 | C22 | H32 | 109.5° | 109.6° |
| H36 | C24 | H35 | 109.5° | 109.5° |
| H36 | C24 | H37 | 109.4° | 109.5° |
| H35 | C24 | H37 | 109.5° | 109.4° |
| H7 | C9 | H8 | 109.5° | 109.4° |
| H11 | C11 | H12 | 109.5° | 109.5° |
| H14 | C12 | H13 | 109.5° | 109.5° |
| H18 | C14 | H17 | 109.4° | 109.4° |
| H21 | C16 | H22 | 109.4° | 109.4° |
| H25 | C19 | H26 | 109.5° | 109.4° |
| H34 | C23 | H33 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C1 | C2 | O3 | 177.3° | 179.9° |
| O1 | C1 | C2 | C3 | 172.1° | 90.0° |
| O1 | C1 | C2 | C7 | 9.4° | 90.6° |
| O1 | C1 | O3 | H38 | 0.0° | 0.1° |
| C1 | C2 | C3 | C7 | 178.5° | 179.4° |
| C1 | C2 | C3 | C4 | 179.8° | 180.0° |
| C1 | C2 | C7 | C6 | 179.4° | 179.7° |
| C1 | C2 | C7 | O2 | 0.7° | 0.4° |
| C1 | C2 | C3 | C8 | 2.3° | 0.1° |
| C2 | C1 | O3 | H38 | 177.1° | 180.0° |
| C2 | C3 | C4 | C8 | 177.6° | 179.9° |
| C2 | C3 | C4 | C5 | 1.3° | 0.5° |
| C3 | C2 | C7 | C6 | 0.9° | 0.3° |
| C3 | C2 | C7 | O2 | 179.2° | 179.8° |
| C2 | C3 | C8 | C9 | 121.9° | 85.0° |
| C3 | C2 | C1 | O3 | 10.6° | 89.9° |
| C2 | C3 | C4 | H1 | 178.8° | 179.7° |
| C2 | C3 | C8 | H5 | 117.4° | 155.0° |
| C2 | C3 | C8 | H6 | 1.3° | 35.0° |
| C3 | C4 | C5 | H1 | 180.0° | 179.8° |
| C3 | C4 | C5 | C6 | 0.1° | 0.2° |
| C4 | C3 | C8 | C9 | 60.5° | 95.0° |
| C4 | C3 | C2 | C7 | 1.7° | 0.5° |
| C3 | C4 | C5 | H2 | 179.9° | 179.7° |
| C4 | C3 | C8 | H5 | 60.1° | 25.0° |
| C4 | C3 | C8 | H6 | 178.8° | 145.0° |
| C4 | C5 | C6 | H2 | 180.0° | 179.9° |
| C4 | C5 | C6 | C7 | 1.0° | 0.0° |
| C5 | C4 | C3 | C8 | 178.9° | 179.5° |
| C4 | C5 | C6 | H3 | 179.0° | 180.0° |
| C5 | C6 | C7 | H3 | 180.0° | 180.0° |
| C5 | C6 | C7 | O2 | 179.4° | 179.9° |
| C5 | C6 | C7 | C2 | 0.5° | 0.0° |
| C6 | C5 | C4 | H1 | 179.9° | 180.0° |
| C6 | C7 | O2 | C2 | 179.9° | 179.9° |
| C7 | C6 | C5 | H2 | 179.0° | 179.9° |
| C6 | C7 | O2 | H4 | 176.5° | 90.0° |
| O2 | C7 | C6 | H3 | 0.6° | 0.1° |
| C3 | C8 | C9 | H5 | 120.7° | 120.0° |
| C3 | C8 | C9 | H6 | 120.7° | 120.0° |
| C3 | C8 | C9 | C10 | 63.0° | 180.0° |
| C8 | C3 | C2 | C7 | 179.2° | 179.5° |
| C8 | C3 | C4 | H1 | 1.1° | 0.2° |
| C3 | C8 | H5 | H6 | 117.9° | 120.0° |
| C3 | C8 | C9 | H7 | 57.7° | 60.0° |
| C3 | C8 | C9 | H8 | 176.3° | 59.9° |
| C8 | C9 | C10 | H7 | 120.7° | 120.0° |
| C8 | C9 | C10 | H8 | 120.7° | 120.0° |
| C8 | C9 | C10 | C11 | 114.0° | 180.0° |
| C9 | C8 | H5 | H6 | 118.0° | 120.0° |
| C8 | C9 | C10 | H10 | 6.8° | 60.0° |
| C8 | C9 | C10 | H9 | 125.3° | 60.0° |
| C8 | C9 | H7 | H8 | 117.8° | 120.0° |
| C9 | C10 | C11 | H10 | 120.7° | 120.0° |
| C9 | C10 | C11 | H9 | 120.7° | 119.9° |
| C9 | C10 | C11 | C12 | 95.3° | 180.0° |
| C10 | C9 | C8 | H5 | 176.4° | 60.0° |
| C10 | C9 | C8 | H6 | 57.7° | 60.0° |
| C9 | C10 | H10 | H9 | 117.6° | 120.0° |
| C10 | C9 | H7 | H8 | 117.9° | 120.0° |
| C9 | C10 | C11 | H11 | 144.0° | 60.0° |
| C9 | C10 | C11 | H12 | 25.5° | 60.1° |
| C10 | C11 | C12 | H11 | 120.8° | 120.0° |
| C10 | C11 | C12 | H12 | 120.7° | 120.0° |
| C10 | C11 | C12 | C13 | 112.0° | 180.0° |
| C11 | C10 | H10 | H9 | 117.7° | 120.0° |
| C11 | C10 | C9 | H7 | 125.3° | 60.0° |
| C11 | C10 | C9 | H8 | 6.7° | 60.0° |
| C10 | C11 | H11 | H12 | 117.7° | 120.0° |
| C10 | C11 | C12 | H14 | 127.3° | 60.0° |
| C10 | C11 | C12 | H13 | 8.6° | 60.0° |
| C11 | C12 | C13 | H14 | 120.7° | 119.9° |
| C11 | C12 | C13 | H13 | 120.7° | 120.0° |
| C11 | C12 | C13 | C14 | 69.4° | 180.0° |
| C12 | C11 | C10 | H10 | 25.5° | 60.0° |
| C12 | C11 | C10 | H9 | 144.0° | 60.1° |
| C11 | C12 | C13 | H15 | 51.3° | 60.0° |
| C11 | C12 | C13 | H16 | 169.9° | 60.1° |
| C12 | C11 | H11 | H12 | 117.7° | 120.0° |
| C11 | C12 | H14 | H13 | 117.8° | 120.0° |
| C12 | C13 | C14 | H15 | 120.7° | 120.0° |
| C12 | C13 | C14 | H16 | 120.7° | 120.0° |
| C12 | C13 | C14 | C15 | 133.7° | 180.0° |
| C12 | C13 | H15 | H16 | 117.9° | 120.0° |
| C13 | C12 | C11 | H11 | 8.7° | 60.0° |
| C13 | C12 | C11 | H12 | 127.2° | 60.0° |
| C13 | C12 | H14 | H13 | 117.8° | 120.1° |
| C12 | C13 | C14 | H18 | 105.6° | 60.0° |
| C12 | C13 | C14 | H17 | 12.9° | 60.0° |
| C13 | C14 | C15 | H18 | 120.8° | 120.0° |
| C13 | C14 | C15 | H17 | 120.8° | 120.0° |
| C13 | C14 | C15 | C16 | 81.4° | 180.0° |
| C14 | C13 | H15 | H16 | 117.9° | 120.0° |
| C13 | C14 | C15 | H20 | 39.4° | 60.0° |
| C13 | C14 | C15 | H19 | 157.8° | 60.0° |
| C14 | C13 | C12 | H14 | 169.9° | 60.1° |
| C14 | C13 | C12 | H13 | 51.3° | 60.0° |
| C13 | C14 | H18 | H17 | 117.7° | 120.0° |
| C14 | C15 | C16 | H20 | 120.8° | 120.0° |
| C14 | C15 | C16 | H19 | 120.8° | 120.0° |
| C14 | C15 | C16 | C17 | 135.3° | 180.0° |
| C15 | C14 | C13 | H15 | 13.0° | 60.0° |
| C15 | C14 | C13 | H16 | 105.7° | 60.0° |
| C14 | C15 | H20 | H19 | 117.6° | 120.0° |
| C15 | C14 | H18 | H17 | 117.7° | 120.0° |
| C14 | C15 | C16 | H21 | 104.1° | 60.0° |
| C14 | C15 | C16 | H22 | 14.7° | 59.9° |
| C15 | C16 | C17 | H21 | 120.5° | 120.0° |
| C15 | C16 | C17 | H22 | 120.6° | 120.0° |
| C15 | C16 | C17 | C18 | 49.5° | 125.0° |
| C16 | C15 | H20 | H19 | 117.6° | 120.0° |
| C15 | C16 | C17 | H23 | 130.5° | 55.0° |
| C16 | C15 | C14 | H18 | 157.9° | 60.0° |
| C16 | C15 | C14 | H17 | 39.4° | 60.0° |
| C15 | C16 | H21 | H22 | 118.3° | 120.0° |
| C16 | C17 | C18 | H23 | 180.0° | 179.9° |
| C16 | C17 | C18 | C19 | 159.4° | 180.0° |
| C17 | C16 | C15 | H20 | 14.5° | 60.0° |
| C17 | C16 | C15 | H19 | 103.9° | 60.0° |
| C17 | C16 | H21 | H22 | 118.3° | 120.0° |
| C16 | C17 | C18 | H24 | 20.6° | 0.0° |
| C17 | C18 | C19 | H24 | 180.0° | 180.0° |
| C17 | C18 | C19 | C20 | 89.0° | 125.0° |
| C18 | C17 | C16 | H21 | 71.1° | 5.1° |
| C18 | C17 | C16 | H22 | 170.0° | 114.9° |
| C17 | C18 | C19 | H25 | 150.5° | 4.9° |
| C17 | C18 | C19 | H26 | 31.6° | 115.0° |
| C18 | C19 | C20 | H25 | 120.6° | 120.0° |
| C18 | C19 | C20 | H26 | 120.6° | 120.0° |
| C18 | C19 | C20 | C21 | 48.9° | 180.0° |
| C19 | C18 | C17 | H23 | 20.6° | 0.1° |
| C18 | C19 | C20 | H27 | 169.7° | 60.0° |
| C18 | C19 | C20 | H28 | 71.8° | 60.0° |
| C18 | C19 | H25 | H26 | 118.2° | 120.0° |
| C19 | C20 | C21 | H27 | 120.8° | 119.9° |
| C19 | C20 | C21 | H28 | 120.8° | 120.0° |
| C19 | C20 | C21 | C22 | 62.5° | 180.0° |
| C19 | C20 | H27 | H28 | 117.6° | 120.0° |
| C19 | C20 | C21 | H30 | 176.8° | 59.9° |
| C19 | C20 | C21 | H29 | 58.3° | 60.0° |
| C20 | C19 | C18 | H24 | 91.0° | 55.0° |
| C20 | C19 | H25 | H26 | 118.2° | 120.0° |
| C20 | C21 | C22 | H30 | 120.8° | 120.0° |
| C20 | C21 | C22 | H29 | 120.7° | 119.9° |
| C20 | C21 | C22 | C23 | 170.1° | 180.0° |
| C21 | C20 | H27 | H28 | 117.6° | 120.0° |
| C20 | C21 | H30 | H29 | 117.7° | 119.9° |
| C20 | C21 | C22 | H31 | 49.3° | 60.0° |
| C20 | C21 | C22 | H32 | 69.2° | 60.1° |
| C21 | C20 | C19 | H25 | 71.6° | 60.0° |
| C21 | C20 | C19 | H26 | 169.5° | 59.9° |
| C21 | C22 | C23 | H31 | 120.7° | 119.9° |
| C21 | C22 | C23 | H32 | 120.7° | 120.0° |
| C21 | C22 | C23 | C24 | 73.0° | 180.0° |
| C22 | C21 | C20 | H27 | 58.3° | 60.0° |
| C22 | C21 | C20 | H28 | 176.8° | 60.0° |
| C22 | C21 | H30 | H29 | 117.7° | 120.1° |
| C21 | C22 | H31 | H32 | 117.7° | 120.0° |
| C21 | C22 | C23 | H34 | 47.7° | 60.0° |
| C21 | C22 | C23 | H33 | 166.4° | 60.0° |
| C22 | C23 | C24 | H34 | 120.6° | 120.0° |
| C22 | C23 | C24 | H33 | 120.6° | 120.1° |
| C23 | C22 | C21 | H30 | 69.2° | 60.0° |
| C23 | C22 | C21 | H29 | 49.3° | 60.0° |
| C23 | C22 | H31 | H32 | 117.7° | 120.0° |
| C22 | C23 | C24 | H36 | 180.0° | 60.0° |
| C22 | C23 | C24 | H35 | 60.0° | 60.0° |
| C22 | C23 | C24 | H37 | 60.0° | 180.0° |
| C22 | C23 | H34 | H33 | 118.0° | 120.0° |
| C24 | C23 | C22 | H31 | 166.3° | 60.1° |
| C24 | C23 | C22 | H32 | 47.8° | 60.0° |
| C23 | C24 | H36 | H35 | 120.0° | 120.0° |
| C23 | C24 | H36 | H37 | 120.0° | 120.0° |
| C23 | C24 | H35 | H37 | 120.0° | 120.0° |
| C24 | C23 | H34 | H33 | 118.0° | 120.0° |
| O3 | C1 | C2 | C7 | 167.9° | 89.5° |
| C2 | C7 | C6 | H3 | 179.5° | 180.0° |
| C2 | C7 | O2 | H4 | 3.5° | 90.1° |
| H1 | C4 | C5 | H2 | 0.1° | 0.1° |
| H2 | C5 | C6 | H3 | 1.0° | 0.1° |
| H5 | C8 | C9 | H7 | 62.9° | 180.0° |
| H5 | C8 | C9 | H8 | 55.7° | 60.0° |
| H6 | C8 | C9 | H7 | 178.4° | 60.0° |
| H6 | C8 | C9 | H8 | 63.0° | 179.9° |
| H10 | C10 | C9 | H7 | 113.9° | 180.0° |
| H10 | C10 | C9 | H8 | 127.5° | 60.0° |
| H10 | C10 | C11 | H11 | 95.3° | NaN° |
| H10 | C10 | C11 | H12 | 146.2° | 59.9° |
| H9 | C10 | C9 | H7 | 4.6° | 60.0° |
| H9 | C10 | C9 | H8 | 114.1° | 180.0° |
| H9 | C10 | C11 | H11 | 23.3° | 59.9° |
| H9 | C10 | C11 | H12 | 95.3° | 180.0° |
| H15 | C13 | C12 | H14 | 69.4° | 59.9° |
| H15 | C13 | C12 | H13 | 172.0° | 180.0° |
| H15 | C13 | C14 | H18 | 133.7° | 180.0° |
| H15 | C13 | C14 | H17 | 107.8° | 60.0° |
| H16 | C13 | C12 | H14 | 49.2° | 180.0° |
| H16 | C13 | C12 | H13 | 69.4° | 60.0° |
| H16 | C13 | C14 | H18 | 15.1° | 60.0° |
| H16 | C13 | C14 | H17 | 133.6° | 180.0° |
| H20 | C15 | C14 | H18 | 81.4° | 180.0° |
| H20 | C15 | C14 | H17 | 160.1° | 60.0° |
| H20 | C15 | C16 | H21 | 135.1° | NaN° |
| H20 | C15 | C16 | H22 | 106.1° | 60.0° |
| H19 | C15 | C14 | H18 | 37.1° | 60.0° |
| H19 | C15 | C14 | H17 | 81.4° | 179.9° |
| H19 | C15 | C16 | H21 | 16.6° | 60.0° |
| H19 | C15 | C16 | H22 | 135.5° | 179.9° |
| H23 | C17 | C16 | H21 | 108.9° | 175.0° |
| H23 | C17 | C16 | H22 | 10.0° | 65.0° |
| H23 | C17 | C18 | H24 | 159.4° | 180.0° |
| H27 | C20 | C21 | H30 | 62.4° | 60.0° |
| H27 | C20 | C21 | H29 | 179.1° | 179.9° |
| H27 | C20 | C19 | H25 | 49.1° | 179.9° |
| H27 | C20 | C19 | H26 | 69.7° | 60.0° |
| H28 | C20 | C21 | H30 | 56.0° | 180.0° |
| H28 | C20 | C21 | H29 | 62.5° | 60.0° |
| H28 | C20 | C19 | H25 | 167.6° | 60.1° |
| H28 | C20 | C19 | H26 | 48.7° | 180.0° |
| H30 | C21 | C22 | H31 | 170.1° | 180.0° |
| H30 | C21 | C22 | H32 | 51.5° | 59.9° |
| H29 | C21 | C22 | H31 | 71.4° | 59.9° |
| H29 | C21 | C22 | H32 | 170.1° | 180.0° |
| H31 | C22 | C23 | H34 | 73.0° | 179.9° |
| H31 | C22 | C23 | H33 | 45.7° | 60.0° |
| H32 | C22 | C23 | H34 | 168.4° | 60.0° |
| H32 | C22 | C23 | H33 | 72.9° | 179.9° |
| H36 | C24 | H35 | H37 | 119.9° | 120.0° |
| H36 | C24 | C23 | H34 | 59.4° | 180.0° |
| H36 | C24 | C23 | H33 | 59.4° | 60.0° |
| H35 | C24 | C23 | H34 | 179.4° | 60.0° |
| H35 | C24 | C23 | H33 | 60.6° | 179.9° |
| H37 | C24 | C23 | H34 | 60.6° | 60.0° |
| H37 | C24 | C23 | H33 | 179.4° | 60.0° |
| H11 | C11 | C12 | H14 | 112.0° | 60.0° |
| H11 | C11 | C12 | H13 | 129.4° | 180.0° |
| H12 | C11 | C12 | H14 | 6.5° | 180.0° |
| H12 | C11 | C12 | H13 | 112.1° | 60.0° |
| H24 | C18 | C19 | H25 | 29.5° | 175.0° |
| H24 | C18 | C19 | H26 | 148.4° | 65.0° |
