E5L
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C22 | C21 | sing | 1.53Å | 1.51Å | |
| C21 | C20 | sing | 1.53Å | 1.52Å | |
| C20 | C19 | sing | 1.53Å | 1.53Å | |
| C19 | C18 | sing | 1.53Å | 1.52Å | |
| C18 | C17 | sing | 1.53Å | 1.52Å | |
| C16 | C17 | sing | 1.53Å | 1.52Å | |
| C16 | C15 | sing | 1.53Å | 1.52Å | |
| C15 | C11 | sing | 1.53Å | 1.52Å | |
| C11 | C8 | sing | 1.53Å | 1.52Å | |
| C12 | O | sing | 1.43Å | 1.43Å | |
| O | C1 | sing | 1.36Å | 1.37Å | |
| C10 | C4 | sing | 1.53Å | 1.52Å | |
| C8 | C4 | sing | 1.53Å | 1.52Å | |
| N | C3 | sing | 1.35Å | 1.34Å | |
| N | C | sing | 1.41Å | 1.35Å | |
| C4 | C3 | sing | 1.51Å | 1.51Å | |
| C4 | C9 | sing | 1.53Å | 1.52Å | |
| C1 | C | doub | 1.39Å | 1.49Å | Aromatic |
| C1 | C6 | sing | 1.39Å | 1.39Å | Aromatic |
| C3 | O3 | doub | 1.21Å | 1.22Å | |
| C | C2 | sing | 1.39Å | 1.48Å | Aromatic |
| C6 | C5 | doub | 1.39Å | 1.39Å | Aromatic |
| C13 | O1 | sing | 1.43Å | 1.43Å | |
| C2 | O1 | sing | 1.36Å | 1.37Å | |
| C2 | C7 | doub | 1.39Å | 1.39Å | Aromatic |
| C5 | C7 | sing | 1.39Å | 1.39Å | Aromatic |
| C5 | O2 | sing | 1.36Å | 1.37Å | |
| O2 | C14 | sing | 1.43Å | 1.42Å | |
| N | H1 | sing | 0.97Å | 1.00Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C10 | H3 | sing | 1.09Å | 1.10Å | |
| C10 | H4 | sing | 1.09Å | 1.10Å | |
| C11 | H5 | sing | 1.09Å | 1.10Å | |
| C11 | H6 | sing | 1.09Å | 1.10Å | |
| C12 | H7 | sing | 1.09Å | 1.10Å | |
| C12 | H8 | sing | 1.09Å | 1.10Å | |
| C12 | H9 | sing | 1.09Å | 1.10Å | |
| C13 | H10 | sing | 1.09Å | 1.10Å | |
| C13 | H11 | sing | 1.09Å | 1.10Å | |
| C13 | H12 | sing | 1.09Å | 1.10Å | |
| C14 | H13 | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H16 | sing | 1.09Å | 1.10Å | |
| C15 | H17 | sing | 1.09Å | 1.10Å | |
| C16 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | H19 | sing | 1.09Å | 1.10Å | |
| C17 | H20 | sing | 1.09Å | 1.10Å | |
| C17 | H21 | sing | 1.09Å | 1.10Å | |
| C18 | H22 | sing | 1.09Å | 1.10Å | |
| C18 | H23 | sing | 1.09Å | 1.10Å | |
| C19 | H24 | sing | 1.09Å | 1.10Å | |
| C19 | H25 | sing | 1.09Å | 1.10Å | |
| C20 | H26 | sing | 1.09Å | 1.10Å | |
| C20 | H27 | sing | 1.09Å | 1.10Å | |
| C21 | H28 | sing | 1.09Å | 1.10Å | |
| C21 | H29 | sing | 1.09Å | 1.10Å | |
| C22 | H30 | sing | 1.09Å | 1.10Å | |
| C22 | H31 | sing | 1.09Å | 1.10Å | |
| C22 | H32 | sing | 1.09Å | 1.10Å | |
| C6 | H33 | sing | 1.08Å | 1.08Å | |
| C7 | H34 | sing | 1.08Å | 1.08Å | |
| C8 | H35 | sing | 1.09Å | 1.10Å | |
| C8 | H36 | sing | 1.09Å | 1.10Å | |
| C9 | H37 | sing | 1.09Å | 1.10Å | |
| C9 | H38 | sing | 1.09Å | 1.10Å | |
| C9 | H39 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C22 | C21 | C20 | 110.4° | 109.4° |
| C22 | C21 | H28 | 109.2° | 109.5° |
| C22 | C21 | H29 | 109.2° | 109.5° |
| C21 | C22 | H30 | 109.5° | 109.5° |
| C21 | C22 | H31 | 109.5° | 109.5° |
| C21 | C22 | H32 | 109.5° | 109.5° |
| C21 | C20 | C19 | 111.1° | 109.5° |
| C21 | C20 | H26 | 109.1° | 109.5° |
| C21 | C20 | H27 | 109.0° | 109.5° |
| C20 | C21 | H28 | 109.2° | 109.5° |
| C20 | C21 | H29 | 109.2° | 109.4° |
| C20 | C19 | C18 | 110.6° | 109.5° |
| C20 | C19 | H24 | 109.2° | 109.5° |
| C20 | C19 | H25 | 109.2° | 109.5° |
| C19 | C20 | H26 | 109.0° | 109.5° |
| C19 | C20 | H27 | 109.1° | 109.4° |
| C19 | C18 | C17 | 110.9° | 109.5° |
| C19 | C18 | H22 | 109.1° | 109.5° |
| C19 | C18 | H23 | 109.1° | 109.5° |
| C18 | C19 | H24 | 109.2° | 109.5° |
| C18 | C19 | H25 | 109.2° | 109.4° |
| C18 | C17 | C16 | 110.5° | 109.5° |
| C18 | C17 | H20 | 109.2° | 109.5° |
| C18 | C17 | H21 | 109.2° | 109.5° |
| C17 | C18 | H22 | 109.1° | 109.5° |
| C17 | C18 | H23 | 109.1° | 109.5° |
| C17 | C16 | C15 | 110.9° | 109.5° |
| C17 | C16 | H18 | 109.1° | 109.5° |
| C17 | C16 | H19 | 109.1° | 109.4° |
| C16 | C17 | H20 | 109.2° | 109.4° |
| C16 | C17 | H21 | 109.2° | 109.5° |
| C16 | C15 | C11 | 110.4° | 109.5° |
| C16 | C15 | H16 | 109.2° | 109.5° |
| C16 | C15 | H17 | 109.3° | 109.5° |
| C15 | C16 | H18 | 109.1° | 109.5° |
| C15 | C16 | H19 | 109.1° | 109.5° |
| C15 | C11 | C8 | 111.0° | 109.5° |
| C15 | C11 | H5 | 109.1° | 109.5° |
| C15 | C11 | H6 | 109.1° | 109.4° |
| C11 | C15 | H16 | 109.3° | 109.5° |
| C11 | C15 | H17 | 109.2° | 109.4° |
| C11 | C8 | C4 | 111.2° | 109.5° |
| C8 | C11 | H5 | 109.1° | 109.5° |
| C8 | C11 | H6 | 109.1° | 109.5° |
| C11 | C8 | H35 | 109.0° | 109.5° |
| C11 | C8 | H36 | 109.0° | 109.5° |
| C12 | O | C1 | 121.0° | 117.0° |
| O | C12 | H7 | 109.5° | 109.5° |
| O | C12 | H8 | 109.5° | 109.4° |
| O | C12 | H9 | 109.5° | 109.5° |
| O | C1 | C | 120.8° | 120.1° |
| O | C1 | C6 | 120.6° | 120.1° |
| C10 | C4 | C8 | 110.6° | 109.5° |
| C10 | C4 | C3 | 108.9° | 109.5° |
| C10 | C4 | C9 | 109.5° | 109.5° |
| C4 | C10 | H2 | 109.5° | 109.4° |
| C4 | C10 | H3 | 109.5° | 109.4° |
| C4 | C10 | H4 | 109.5° | 109.4° |
| C8 | C4 | C3 | 108.8° | 109.5° |
| C8 | C4 | C9 | 109.9° | 109.5° |
| C4 | C8 | H35 | 109.1° | 109.5° |
| C4 | C8 | H36 | 109.0° | 109.5° |
| C3 | N | C | 121.2° | 120.0° |
| N | C3 | C4 | 117.0° | 120.0° |
| N | C3 | O3 | 123.3° | 120.0° |
| C3 | N | H1 | 119.4° | 120.0° |
| N | C | C1 | 122.0° | 120.0° |
| N | C | C2 | 120.2° | 120.1° |
| C | N | H1 | 119.4° | 120.0° |
| C3 | C4 | C9 | 109.0° | 109.5° |
| C4 | C3 | O3 | 119.7° | 120.0° |
| C4 | C9 | H37 | 109.5° | 109.5° |
| C4 | C9 | H38 | 109.5° | 109.5° |
| C4 | C9 | H39 | 109.4° | 109.5° |
| C | C1 | C6 | 118.6° | 119.9° |
| C1 | C | C2 | 117.8° | 119.9° |
| C1 | C6 | C5 | 121.4° | 120.1° |
| C1 | C6 | H33 | 119.3° | 120.0° |
| C | C2 | O1 | 120.2° | 120.0° |
| C | C2 | C7 | 119.3° | 120.0° |
| C6 | C5 | C7 | 122.0° | 120.1° |
| C6 | C5 | O2 | 119.2° | 120.0° |
| C5 | C6 | H33 | 119.3° | 120.0° |
| C13 | O1 | C2 | 118.9° | 117.0° |
| O1 | C13 | H10 | 109.5° | 109.5° |
| O1 | C13 | H11 | 109.5° | 109.5° |
| O1 | C13 | H12 | 109.5° | 109.5° |
| O1 | C2 | C7 | 120.5° | 120.0° |
| C2 | C7 | C5 | 121.0° | 120.1° |
| C2 | C7 | H34 | 119.5° | 119.9° |
| C7 | C5 | O2 | 118.9° | 119.9° |
| C5 | C7 | H34 | 119.5° | 120.0° |
| C5 | O2 | C14 | 119.2° | 117.0° |
| O2 | C14 | H13 | 109.5° | 109.5° |
| O2 | C14 | H14 | 109.5° | 109.5° |
| O2 | C14 | H15 | 109.5° | 109.5° |
| H2 | C10 | H3 | 109.5° | 109.5° |
| H2 | C10 | H4 | 109.5° | 109.5° |
| H3 | C10 | H4 | 109.5° | 109.5° |
| H5 | C11 | H6 | 109.5° | 109.5° |
| H7 | C12 | H8 | 109.5° | 109.5° |
| H7 | C12 | H9 | 109.5° | 109.5° |
| H8 | C12 | H9 | 109.5° | 109.4° |
| H10 | C13 | H11 | 109.5° | 109.4° |
| H10 | C13 | H12 | 109.5° | 109.5° |
| H11 | C13 | H12 | 109.5° | 109.4° |
| H13 | C14 | H14 | 109.5° | 109.5° |
| H13 | C14 | H15 | 109.4° | 109.5° |
| H14 | C14 | H15 | 109.5° | 109.4° |
| H16 | C15 | H17 | 109.5° | 109.4° |
| H18 | C16 | H19 | 109.5° | 109.4° |
| H20 | C17 | H21 | 109.5° | 109.5° |
| H22 | C18 | H23 | 109.5° | 109.5° |
| H24 | C19 | H25 | 109.5° | 109.5° |
| H26 | C20 | H27 | 109.5° | 109.5° |
| H28 | C21 | H29 | 109.5° | 109.5° |
| H30 | C22 | H31 | 109.4° | 109.5° |
| H30 | C22 | H32 | 109.5° | 109.5° |
| H31 | C22 | H32 | 109.4° | 109.4° |
| H35 | C8 | H36 | 109.5° | 109.5° |
| H37 | C9 | H38 | 109.5° | 109.4° |
| H37 | C9 | H39 | 109.5° | 109.5° |
| H38 | C9 | H39 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C22 | C21 | C20 | H28 | 120.2° | 120.0° |
| C22 | C21 | C20 | H29 | 120.2° | 119.9° |
| C22 | C21 | C20 | C19 | 66.9° | 180.0° |
| C22 | C21 | C20 | H26 | 53.3° | 60.0° |
| C22 | C21 | C20 | H27 | 172.8° | 60.1° |
| C22 | C21 | H28 | H29 | 119.6° | 120.0° |
| C21 | C22 | H30 | H31 | 120.0° | 120.0° |
| C21 | C22 | H30 | H32 | 120.0° | 120.0° |
| C21 | C22 | H31 | H32 | 120.0° | 120.0° |
| C21 | C20 | C19 | H26 | 120.3° | 120.0° |
| C21 | C20 | C19 | H27 | 120.2° | 119.9° |
| C21 | C20 | C19 | C18 | 169.7° | 180.0° |
| C21 | C20 | C19 | H24 | 70.2° | 60.0° |
| C21 | C20 | C19 | H25 | 49.5° | 60.1° |
| C21 | C20 | H26 | H27 | 119.2° | 120.0° |
| C20 | C21 | H28 | H29 | 119.6° | 120.0° |
| C20 | C21 | C22 | H30 | 180.0° | 60.0° |
| C20 | C21 | C22 | H31 | 60.0° | 60.1° |
| C20 | C21 | C22 | H32 | 60.0° | 180.0° |
| C20 | C19 | C18 | H24 | 120.2° | 120.0° |
| C20 | C19 | C18 | H25 | 120.2° | 120.0° |
| C20 | C19 | C18 | C17 | 153.0° | 180.0° |
| C20 | C19 | C18 | H22 | 32.8° | 60.0° |
| C20 | C19 | C18 | H23 | 86.8° | 60.0° |
| C20 | C19 | H24 | H25 | 119.5° | 120.0° |
| C19 | C20 | H26 | H27 | 119.3° | 120.0° |
| C19 | C20 | C21 | H28 | 173.0° | 60.0° |
| C19 | C20 | C21 | H29 | 53.3° | 60.1° |
| C19 | C18 | C17 | H22 | 120.2° | 120.0° |
| C19 | C18 | C17 | H23 | 120.2° | 120.0° |
| C19 | C18 | C17 | C16 | 51.6° | 180.0° |
| C19 | C18 | C17 | H20 | 171.8° | 60.0° |
| C19 | C18 | C17 | H21 | 68.6° | 60.0° |
| C19 | C18 | H22 | H23 | 119.3° | 120.0° |
| C18 | C19 | H24 | H25 | 119.5° | 120.0° |
| C18 | C19 | C20 | H26 | 49.4° | 60.0° |
| C18 | C19 | C20 | H27 | 70.1° | 60.0° |
| C18 | C17 | C16 | H20 | 120.1° | 120.0° |
| C18 | C17 | C16 | H21 | 120.1° | 120.0° |
| C18 | C17 | C16 | C15 | 169.1° | 180.0° |
| C18 | C17 | C16 | H18 | 70.7° | 60.0° |
| C18 | C17 | C16 | H19 | 48.8° | 60.0° |
| C18 | C17 | H20 | H21 | 119.5° | 120.0° |
| C17 | C18 | H22 | H23 | 119.3° | 120.0° |
| C17 | C18 | C19 | H24 | 86.8° | 60.0° |
| C17 | C18 | C19 | H25 | 32.8° | 60.0° |
| C17 | C16 | C15 | H18 | 120.2° | 120.0° |
| C17 | C16 | C15 | H19 | 120.2° | 120.0° |
| C17 | C16 | C15 | C11 | 61.7° | 180.0° |
| C17 | C16 | C15 | H16 | 58.4° | 60.0° |
| C17 | C16 | C15 | H17 | 178.2° | 60.0° |
| C17 | C16 | H18 | H19 | 119.3° | 119.9° |
| C16 | C17 | H20 | H21 | 119.5° | 120.0° |
| C16 | C17 | C18 | H22 | 68.7° | 60.0° |
| C16 | C17 | C18 | H23 | 171.8° | 60.0° |
| C16 | C15 | C11 | H16 | 120.1° | 120.0° |
| C16 | C15 | C11 | H17 | 120.1° | 120.0° |
| C16 | C15 | C11 | C8 | 173.1° | 180.0° |
| C16 | C15 | C11 | H5 | 66.7° | 60.0° |
| C16 | C15 | C11 | H6 | 52.8° | 60.0° |
| C16 | C15 | H16 | H17 | 119.6° | 120.0° |
| C15 | C16 | H18 | H19 | 119.3° | 120.0° |
| C15 | C16 | C17 | H20 | 48.9° | 60.0° |
| C15 | C16 | C17 | H21 | 70.8° | 60.0° |
| C15 | C11 | C8 | H5 | 120.2° | 120.0° |
| C15 | C11 | C8 | H6 | 120.2° | 120.0° |
| C15 | C11 | C8 | C4 | 175.8° | 180.0° |
| C15 | C11 | H5 | H6 | 119.3° | 120.0° |
| C11 | C15 | H16 | H17 | 119.6° | 119.9° |
| C11 | C15 | C16 | H18 | 178.1° | 60.0° |
| C11 | C15 | C16 | H19 | 58.5° | 60.0° |
| C15 | C11 | C8 | H35 | 63.9° | 60.0° |
| C15 | C11 | C8 | H36 | 55.6° | 60.0° |
| C11 | C8 | C4 | C10 | 69.6° | 60.0° |
| C11 | C8 | C4 | H35 | 120.3° | 120.0° |
| C11 | C8 | C4 | H36 | 120.2° | 120.0° |
| C11 | C8 | C4 | C3 | 50.0° | 180.0° |
| C11 | C8 | C4 | C9 | 169.3° | 60.0° |
| C8 | C11 | H5 | H6 | 119.3° | 120.0° |
| C8 | C11 | C15 | H16 | 52.9° | 60.0° |
| C8 | C11 | C15 | H17 | 66.8° | 60.0° |
| C11 | C8 | H35 | H36 | 119.2° | 120.0° |
| C12 | O | C1 | C | 168.1° | 180.0° |
| C12 | O | C1 | C6 | 12.1° | 0.1° |
| O | C12 | H7 | H8 | 120.0° | 120.0° |
| O | C12 | H7 | H9 | 120.0° | 120.0° |
| O | C12 | H8 | H9 | 120.0° | 119.9° |
| O | C1 | C | N | 0.4° | 0.0° |
| O | C1 | C | C6 | 179.8° | 180.0° |
| O | C1 | C | C2 | 180.0° | 179.6° |
| O | C1 | C6 | C5 | 179.9° | 180.0° |
| C1 | O | C12 | H7 | 180.0° | 60.0° |
| C1 | O | C12 | H8 | 60.0° | 60.0° |
| C1 | O | C12 | H9 | 60.0° | 179.9° |
| O | C1 | C6 | H33 | 0.1° | 0.1° |
| C10 | C4 | C8 | C3 | 119.6° | 120.0° |
| C10 | C4 | C8 | C9 | 121.0° | 120.0° |
| C10 | C4 | C3 | N | 8.1° | 60.0° |
| C10 | C4 | C3 | C9 | 119.5° | 120.0° |
| C10 | C4 | C3 | O3 | 171.7° | 120.0° |
| C4 | C10 | H2 | H3 | 120.0° | 120.0° |
| C4 | C10 | H2 | H4 | 120.0° | 120.0° |
| C4 | C10 | H3 | H4 | 120.0° | 119.9° |
| C10 | C4 | C8 | H35 | 170.1° | 60.0° |
| C10 | C4 | C8 | H36 | 50.6° | 180.0° |
| C10 | C4 | C9 | H37 | 180.0° | 60.0° |
| C10 | C4 | C9 | H38 | 60.0° | 180.0° |
| C10 | C4 | C9 | H39 | 60.0° | 60.0° |
| C8 | C4 | C3 | N | 112.6° | 180.0° |
| C8 | C4 | C3 | C9 | 119.8° | 120.0° |
| C8 | C4 | C3 | O3 | 67.6° | 0.0° |
| C8 | C4 | C10 | H2 | 180.0° | 180.0° |
| C8 | C4 | C10 | H3 | 60.0° | 60.0° |
| C8 | C4 | C10 | H4 | 60.0° | 60.0° |
| C4 | C8 | C11 | H5 | 55.6° | 60.0° |
| C4 | C8 | C11 | H6 | 64.0° | 60.0° |
| C4 | C8 | H35 | H36 | 119.2° | 120.0° |
| C8 | C4 | C9 | H37 | 58.3° | 180.0° |
| C8 | C4 | C9 | H38 | 61.7° | 60.0° |
| C8 | C4 | C9 | H39 | 178.3° | 60.0° |
| C3 | N | C | H1 | 180.0° | 179.8° |
| N | C3 | C4 | O3 | 179.8° | 180.0° |
| N | C3 | C4 | C9 | 127.5° | 60.0° |
| C3 | N | C | C1 | 119.9° | 91.9° |
| C3 | N | C | C2 | 60.5° | 88.5° |
| C | N | C3 | C4 | 154.2° | 175.2° |
| N | C | C1 | C2 | 179.6° | 179.7° |
| N | C | C1 | C6 | 179.8° | 180.0° |
| C | N | C3 | O3 | 25.6° | 4.8° |
| N | C | C2 | O1 | 0.2° | 0.0° |
| N | C | C2 | C7 | 179.5° | 180.0° |
| C4 | C3 | N | H1 | 25.8° | 4.6° |
| C3 | C4 | C10 | H2 | 60.4° | 60.0° |
| C3 | C4 | C10 | H3 | 179.6° | 180.0° |
| C3 | C4 | C10 | H4 | 59.6° | 60.0° |
| C3 | C4 | C8 | H35 | 70.2° | 60.0° |
| C3 | C4 | C8 | H36 | 170.3° | 60.0° |
| C3 | C4 | C9 | H37 | 60.9° | 60.0° |
| C3 | C4 | C9 | H38 | 179.1° | 60.0° |
| C3 | C4 | C9 | H39 | 59.1° | 180.0° |
| C9 | C4 | C3 | O3 | 52.3° | 120.0° |
| C9 | C4 | C10 | H2 | 58.8° | 60.0° |
| C9 | C4 | C10 | H3 | 61.3° | 60.0° |
| C9 | C4 | C10 | H4 | 178.8° | 180.0° |
| C9 | C4 | C8 | H35 | 49.1° | 180.0° |
| C9 | C4 | C8 | H36 | 70.4° | 60.0° |
| C4 | C9 | H37 | H38 | 120.0° | 120.0° |
| C4 | C9 | H37 | H39 | 120.0° | 120.0° |
| C4 | C9 | H38 | H39 | 120.0° | 120.0° |
| C | C1 | C6 | C5 | 0.3° | 0.0° |
| C1 | C | C2 | O1 | 179.4° | 179.7° |
| C1 | C | C2 | C7 | 0.1° | 0.3° |
| C1 | C | N | H1 | 60.1° | 88.4° |
| C | C1 | C6 | H33 | 179.7° | 179.9° |
| C6 | C1 | C | C2 | 0.2° | 0.3° |
| C1 | C6 | C5 | H33 | 180.0° | 179.9° |
| C1 | C6 | C5 | C7 | 0.0° | 0.3° |
| C1 | C6 | C5 | O2 | 179.9° | 180.0° |
| O3 | C3 | N | H1 | 154.4° | 175.4° |
| C | C2 | O1 | C13 | 83.7° | 179.9° |
| C | C2 | O1 | C7 | 179.3° | 180.0° |
| C | C2 | C7 | C5 | 0.4° | 0.0° |
| C2 | C | N | H1 | 119.5° | 91.3° |
| C | C2 | C7 | H34 | 179.6° | 180.0° |
| C6 | C5 | C7 | C2 | 0.4° | 0.3° |
| C6 | C5 | C7 | O2 | 179.9° | 179.7° |
| C6 | C5 | O2 | C14 | 56.2° | 0.3° |
| C6 | C5 | C7 | H34 | 179.6° | 179.7° |
| C13 | O1 | C2 | C7 | 95.7° | 0.1° |
| O1 | C13 | H10 | H11 | 120.0° | 120.0° |
| O1 | C13 | H10 | H12 | 120.0° | 120.0° |
| O1 | C13 | H11 | H12 | 120.0° | 120.0° |
| O1 | C2 | C7 | C5 | 179.7° | 180.0° |
| C2 | O1 | C13 | H10 | 180.0° | 60.0° |
| C2 | O1 | C13 | H11 | 60.0° | 60.0° |
| C2 | O1 | C13 | H12 | 60.0° | 180.0° |
| O1 | C2 | C7 | H34 | 0.3° | 0.0° |
| C2 | C7 | C5 | H34 | 180.0° | 180.0° |
| C2 | C7 | C5 | O2 | 179.6° | 180.0° |
| C7 | C5 | O2 | C14 | 123.7° | 180.0° |
| C7 | C5 | C6 | H33 | 180.0° | 179.8° |
| C5 | O2 | C14 | H13 | 180.0° | 60.0° |
| C5 | O2 | C14 | H14 | 60.0° | 179.9° |
| C5 | O2 | C14 | H15 | 60.0° | 60.0° |
| O2 | C5 | C6 | H33 | 0.1° | 0.1° |
| O2 | C5 | C7 | H34 | 0.4° | 0.0° |
| O2 | C14 | H13 | H14 | 120.0° | 120.0° |
| O2 | C14 | H13 | H15 | 120.0° | 120.0° |
| O2 | C14 | H14 | H15 | 120.0° | 120.0° |
| H2 | C10 | H3 | H4 | 120.0° | 120.1° |
| H5 | C11 | C15 | H16 | 173.2° | 60.0° |
| H5 | C11 | C15 | H17 | 53.4° | 180.0° |
| H5 | C11 | C8 | H35 | 175.8° | 180.0° |
| H5 | C11 | C8 | H36 | 64.7° | 60.0° |
| H6 | C11 | C15 | H16 | 67.3° | 180.0° |
| H6 | C11 | C15 | H17 | 173.0° | 60.0° |
| H6 | C11 | C8 | H35 | 56.3° | 60.0° |
| H6 | C11 | C8 | H36 | 175.8° | 180.0° |
| H7 | C12 | H8 | H9 | 120.0° | 120.1° |
| H10 | C13 | H11 | H12 | 120.0° | 119.9° |
| H13 | C14 | H14 | H15 | 120.0° | 120.0° |
| H16 | C15 | C16 | H18 | 61.8° | 180.0° |
| H16 | C15 | C16 | H19 | 178.7° | 60.0° |
| H17 | C15 | C16 | H18 | 58.0° | 60.0° |
| H17 | C15 | C16 | H19 | 61.6° | 180.0° |
| H18 | C16 | C17 | H20 | 169.1° | 180.0° |
| H18 | C16 | C17 | H21 | 49.4° | 60.0° |
| H19 | C16 | C17 | H20 | 71.3° | 60.0° |
| H19 | C16 | C17 | H21 | 169.0° | 180.0° |
| H20 | C17 | C18 | H22 | 51.5° | NaN° |
| H20 | C17 | C18 | H23 | 68.0° | 60.0° |
| H21 | C17 | C18 | H22 | 171.2° | 60.0° |
| H21 | C17 | C18 | H23 | 51.6° | 180.0° |
| H22 | C18 | C19 | H24 | 153.0° | 180.0° |
| H22 | C18 | C19 | H25 | 87.4° | 60.0° |
| H23 | C18 | C19 | H24 | 33.4° | 60.0° |
| H23 | C18 | C19 | H25 | 153.1° | 180.0° |
| H24 | C19 | C20 | H26 | 169.6° | 180.0° |
| H24 | C19 | C20 | H27 | 50.1° | 60.0° |
| H25 | C19 | C20 | H26 | 70.7° | 59.9° |
| H25 | C19 | C20 | H27 | 169.7° | 180.0° |
| H26 | C20 | C21 | H28 | 66.8° | NaN° |
| H26 | C20 | C21 | H29 | 173.5° | 60.0° |
| H27 | C20 | C21 | H28 | 52.7° | 59.9° |
| H27 | C20 | C21 | H29 | 67.0° | 180.0° |
| H28 | C21 | C22 | H30 | 59.8° | 180.0° |
| H28 | C21 | C22 | H31 | 60.1° | 59.9° |
| H28 | C21 | C22 | H32 | 179.9° | 60.0° |
| H29 | C21 | C22 | H30 | 59.8° | 59.9° |
| H29 | C21 | C22 | H31 | 179.8° | 180.0° |
| H29 | C21 | C22 | H32 | 60.2° | 60.1° |
| H30 | C22 | H31 | H32 | 120.0° | 120.0° |
| H37 | C9 | H38 | H39 | 120.0° | 120.0° |
