7EZ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O4 | C22 | doub | 1.21Å | 1.26Å | |
| C22 | C21 | sing | 1.51Å | 1.53Å | |
| C22 | O3 | sing | 1.34Å | 1.26Å | |
| C21 | C20 | sing | 1.53Å | 1.53Å | |
| C20 | C19 | sing | 1.51Å | 1.54Å | |
| C19 | C18 | doub | 1.31Å | 1.32Å | |
| C18 | C17 | sing | 1.51Å | 1.52Å | |
| C16 | C17 | sing | 1.51Å | 1.52Å | |
| C16 | C15 | doub | 1.31Å | 1.31Å | |
| C15 | C14 | sing | 1.51Å | 1.53Å | |
| C14 | C13 | sing | 1.51Å | 1.53Å | |
| C13 | C12 | doub | 1.31Å | 1.32Å | |
| C12 | C11 | sing | 1.51Å | 1.53Å | |
| C10 | C11 | sing | 1.51Å | 1.54Å | |
| C10 | C9 | doub | 1.31Å | 1.33Å | |
| C9 | C8 | sing | 1.51Å | 1.53Å | |
| C8 | C7 | sing | 1.53Å | 1.53Å | |
| C7 | C6 | sing | 1.53Å | 1.54Å | |
| C7 | O2 | sing | 1.43Å | 1.41Å | |
| C6 | C5 | sing | 1.53Å | 1.54Å | |
| C5 | C4 | sing | 1.51Å | 1.53Å | |
| C4 | C3 | doub | 1.31Å | 1.33Å | |
| C3 | C2 | sing | 1.51Å | 1.53Å | |
| C2 | C1 | sing | 1.53Å | 1.53Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C2 | H4 | sing | 1.09Å | 1.10Å | |
| C2 | H5 | sing | 1.09Å | 1.10Å | |
| C3 | H6 | sing | 1.08Å | 1.08Å | |
| C4 | H7 | sing | 1.08Å | 1.08Å | |
| C5 | H8 | sing | 1.09Å | 1.10Å | |
| C5 | H9 | sing | 1.09Å | 1.10Å | |
| C6 | H10 | sing | 1.09Å | 1.10Å | |
| C7 | H12 | sing | 1.09Å | 1.10Å | |
| C8 | H13 | sing | 1.09Å | 1.10Å | |
| C8 | H14 | sing | 1.09Å | 1.10Å | |
| C9 | H15 | sing | 1.08Å | 1.08Å | |
| C10 | H16 | sing | 1.08Å | 1.08Å | |
| C11 | H17 | sing | 1.09Å | 1.10Å | |
| C11 | H18 | sing | 1.09Å | 1.10Å | |
| O3 | H19 | sing | 0.97Å | 0.95Å | |
| C21 | H20 | sing | 1.09Å | 1.10Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C20 | H22 | sing | 1.09Å | 1.10Å | |
| C20 | H23 | sing | 1.09Å | 1.10Å | |
| C19 | H24 | sing | 1.08Å | 1.08Å | |
| C18 | H25 | sing | 1.08Å | 1.08Å | |
| C17 | H26 | sing | 1.09Å | 1.10Å | |
| C17 | H27 | sing | 1.09Å | 1.10Å | |
| C16 | H28 | sing | 1.08Å | 1.08Å | |
| C15 | H29 | sing | 1.08Å | 1.08Å | |
| C14 | H30 | sing | 1.09Å | 1.10Å | |
| C14 | H31 | sing | 1.09Å | 1.10Å | |
| C13 | H32 | sing | 1.08Å | 1.08Å | |
| C12 | H33 | sing | 1.08Å | 1.08Å | |
| O2 | H34 | sing | 0.97Å | 0.95Å | |
| C6 | O1 | sing | 1.43Å | 1.42Å | |
| O1 | H11 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O4 | C22 | C21 | 119.5° | 120.0° |
| O4 | C22 | O3 | 120.2° | 120.0° |
| C21 | C22 | O3 | 120.2° | 120.0° |
| C22 | C21 | C20 | 110.4° | 109.5° |
| C22 | C21 | H20 | 109.2° | 109.5° |
| C22 | C21 | H21 | 109.2° | 109.5° |
| C22 | O3 | H19 | 109.5° | 117.0° |
| C21 | C20 | C19 | 110.7° | 109.5° |
| C20 | C21 | H20 | 109.3° | 109.5° |
| C20 | C21 | H21 | 109.3° | 109.4° |
| C21 | C20 | H22 | 109.1° | 109.5° |
| C21 | C20 | H23 | 109.2° | 109.4° |
| C20 | C19 | C18 | 118.9° | 120.0° |
| C19 | C20 | H22 | 109.2° | 109.5° |
| C19 | C20 | H23 | 109.1° | 109.4° |
| C20 | C19 | H24 | 120.6° | 120.0° |
| C19 | C18 | C17 | 118.9° | 120.0° |
| C18 | C19 | H24 | 120.6° | 120.0° |
| C19 | C18 | H25 | 120.6° | 120.0° |
| C18 | C17 | C16 | 109.4° | 109.5° |
| C17 | C18 | H25 | 120.5° | 120.0° |
| C18 | C17 | H26 | 109.5° | 109.5° |
| C18 | C17 | H27 | 109.5° | 109.4° |
| C17 | C16 | C15 | 119.1° | 120.0° |
| C16 | C17 | H26 | 109.5° | 109.5° |
| C16 | C17 | H27 | 109.5° | 109.5° |
| C17 | C16 | H28 | 120.4° | 120.0° |
| C16 | C15 | C14 | 119.4° | 120.0° |
| C15 | C16 | H28 | 120.5° | 120.0° |
| C16 | C15 | H29 | 120.3° | 120.0° |
| C15 | C14 | C13 | 107.0° | 109.5° |
| C14 | C15 | H29 | 120.3° | 120.0° |
| C15 | C14 | H30 | 110.1° | 109.5° |
| C15 | C14 | H31 | 110.1° | 109.5° |
| C14 | C13 | C12 | 122.1° | 120.0° |
| C13 | C14 | H30 | 110.1° | 109.4° |
| C13 | C14 | H31 | 110.1° | 109.4° |
| C14 | C13 | H32 | 119.0° | 120.0° |
| C13 | C12 | C11 | 123.4° | 120.0° |
| C12 | C13 | H32 | 119.0° | 120.0° |
| C13 | C12 | H33 | 118.3° | 120.0° |
| C12 | C11 | C10 | 112.0° | 109.5° |
| C12 | C11 | H17 | 108.8° | 109.5° |
| C12 | C11 | H18 | 108.8° | 109.5° |
| C11 | C12 | H33 | 118.3° | 120.0° |
| C11 | C10 | C9 | 125.3° | 120.0° |
| C11 | C10 | H16 | 117.4° | 120.0° |
| C10 | C11 | H17 | 108.8° | 109.5° |
| C10 | C11 | H18 | 108.8° | 109.4° |
| C10 | C9 | C8 | 123.0° | 120.0° |
| C10 | C9 | H15 | 118.5° | 120.0° |
| C9 | C10 | H16 | 117.3° | 120.0° |
| C9 | C8 | C7 | 113.2° | 109.5° |
| C9 | C8 | H13 | 108.5° | 109.5° |
| C9 | C8 | H14 | 108.5° | 109.5° |
| C8 | C9 | H15 | 118.5° | 120.0° |
| C8 | C7 | C6 | 113.4° | 109.5° |
| C8 | C7 | O2 | 104.6° | 109.5° |
| C8 | C7 | H12 | 109.1° | 109.4° |
| C7 | C8 | H13 | 108.5° | 109.4° |
| C7 | C8 | H14 | 108.5° | 109.5° |
| C6 | C7 | O2 | 110.0° | 109.5° |
| C7 | C6 | C5 | 110.9° | 109.4° |
| C7 | C6 | H10 | 106.6° | 109.5° |
| C6 | C7 | H12 | 108.9° | 109.5° |
| C7 | C6 | O1 | 112.5° | 109.4° |
| O2 | C7 | H12 | 110.8° | 109.5° |
| C7 | O2 | H34 | 109.5° | 114.0° |
| C6 | C5 | C4 | 109.0° | 109.4° |
| C6 | C5 | H8 | 109.6° | 109.5° |
| C6 | C5 | H9 | 109.6° | 109.5° |
| C5 | C6 | H10 | 106.5° | 109.5° |
| C5 | C6 | O1 | 112.1° | 109.5° |
| C5 | C4 | C3 | 124.4° | 120.0° |
| C5 | C4 | H7 | 117.8° | 120.0° |
| C4 | C5 | H8 | 109.6° | 109.5° |
| C4 | C5 | H9 | 109.6° | 109.5° |
| C4 | C3 | C2 | 122.3° | 120.0° |
| C4 | C3 | H6 | 118.9° | 120.0° |
| C3 | C4 | H7 | 117.8° | 120.0° |
| C3 | C2 | C1 | 111.0° | 109.5° |
| C3 | C2 | H4 | 109.1° | 109.5° |
| C3 | C2 | H5 | 109.1° | 109.5° |
| C2 | C3 | H6 | 118.8° | 120.0° |
| C2 | C1 | H1 | 109.5° | 109.5° |
| C2 | C1 | H2 | 109.5° | 109.4° |
| C2 | C1 | H3 | 109.5° | 109.5° |
| C1 | C2 | H4 | 109.1° | 109.5° |
| C1 | C2 | H5 | 109.1° | 109.5° |
| H1 | C1 | H2 | 109.5° | 109.5° |
| H1 | C1 | H3 | 109.5° | 109.5° |
| H2 | C1 | H3 | 109.4° | 109.4° |
| H4 | C2 | H5 | 109.5° | 109.4° |
| H8 | C5 | H9 | 109.4° | 109.5° |
| H10 | C6 | O1 | 108.0° | 109.5° |
| H13 | C8 | H14 | 109.5° | 109.5° |
| H17 | C11 | H18 | 109.5° | 109.5° |
| H20 | C21 | H21 | 109.5° | 109.4° |
| H22 | C20 | H23 | 109.5° | 109.4° |
| H26 | C17 | H27 | 109.4° | 109.5° |
| H30 | C14 | H31 | 109.5° | 109.5° |
| C6 | O1 | H11 | 109.5° | 114.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O4 | C22 | C21 | O3 | 179.5° | 180.0° |
| O4 | C22 | C21 | C20 | 79.7° | 0.0° |
| O4 | C22 | O3 | H19 | 0.0° | 0.0° |
| O4 | C22 | C21 | H20 | 160.1° | 120.0° |
| O4 | C22 | C21 | H21 | 40.5° | 120.0° |
| C22 | C21 | C20 | H20 | 120.2° | 120.0° |
| C22 | C21 | C20 | H21 | 120.1° | 120.0° |
| C22 | C21 | C20 | C19 | 172.9° | 180.0° |
| C21 | C22 | O3 | H19 | 179.4° | 180.0° |
| C22 | C21 | H20 | H21 | 119.5° | 120.0° |
| C22 | C21 | C20 | H22 | 66.9° | 60.0° |
| C22 | C21 | C20 | H23 | 52.7° | 60.0° |
| O3 | C22 | C21 | C20 | 99.8° | 180.0° |
| O3 | C22 | C21 | H20 | 20.4° | 60.0° |
| O3 | C22 | C21 | H21 | 140.1° | 60.0° |
| C21 | C20 | C19 | H22 | 120.2° | 120.1° |
| C21 | C20 | C19 | H23 | 120.2° | 120.0° |
| C21 | C20 | C19 | C18 | 142.1° | 127.3° |
| C20 | C21 | H20 | H21 | 119.6° | 120.0° |
| C21 | C20 | H22 | H23 | 119.4° | 120.0° |
| C21 | C20 | C19 | H24 | 37.8° | 52.6° |
| C20 | C19 | C18 | H24 | 180.0° | 179.9° |
| C20 | C19 | C18 | C17 | 0.3° | 7.5° |
| C19 | C20 | C21 | H20 | 52.8° | 59.9° |
| C19 | C20 | C21 | H21 | 67.0° | 60.0° |
| C19 | C20 | H22 | H23 | 119.4° | 120.0° |
| C20 | C19 | C18 | H25 | 179.7° | 172.5° |
| C19 | C18 | C17 | H25 | 180.0° | 179.9° |
| C19 | C18 | C17 | C16 | 93.6° | 127.3° |
| C18 | C19 | C20 | H22 | 97.7° | 7.2° |
| C18 | C19 | C20 | H23 | 21.9° | 112.8° |
| C19 | C18 | C17 | H26 | 26.4° | 112.7° |
| C19 | C18 | C17 | H27 | 146.4° | 7.3° |
| C18 | C17 | C16 | H26 | 120.0° | 120.0° |
| C18 | C17 | C16 | H27 | 120.0° | 120.0° |
| C18 | C17 | C16 | C15 | 121.1° | 126.7° |
| C17 | C18 | C19 | H24 | 179.7° | 172.6° |
| C18 | C17 | H26 | H27 | 120.0° | 120.0° |
| C18 | C17 | C16 | H28 | 58.9° | 53.4° |
| C17 | C16 | C15 | H28 | 180.0° | 179.9° |
| C17 | C16 | C15 | C14 | 0.5° | 7.4° |
| C16 | C17 | C18 | H25 | 86.4° | 52.8° |
| C16 | C17 | H26 | H27 | 120.0° | 120.0° |
| C17 | C16 | C15 | H29 | 179.5° | 172.6° |
| C16 | C15 | C14 | H29 | 180.0° | 180.0° |
| C16 | C15 | C14 | C13 | 133.3° | 126.7° |
| C15 | C16 | C17 | H26 | 118.9° | 6.7° |
| C15 | C16 | C17 | H27 | 1.1° | 113.3° |
| C16 | C15 | C14 | H30 | 13.7° | 113.3° |
| C16 | C15 | C14 | H31 | 107.0° | 6.7° |
| C15 | C14 | C13 | H30 | 119.6° | 120.0° |
| C15 | C14 | C13 | H31 | 119.6° | 120.0° |
| C15 | C14 | C13 | C12 | 128.4° | 119.0° |
| C14 | C15 | C16 | H28 | 179.5° | 172.6° |
| C15 | C14 | H30 | H31 | 121.1° | 120.1° |
| C15 | C14 | C13 | H32 | 51.6° | 61.0° |
| C14 | C13 | C12 | H32 | 180.0° | 179.9° |
| C14 | C13 | C12 | C11 | 0.7° | 8.9° |
| C13 | C14 | C15 | H29 | 46.7° | 53.3° |
| C13 | C14 | H30 | H31 | 121.1° | 119.9° |
| C14 | C13 | C12 | H33 | 179.2° | 171.1° |
| C13 | C12 | C11 | H33 | 180.0° | 180.0° |
| C13 | C12 | C11 | C10 | 119.9° | 121.7° |
| C13 | C12 | C11 | H17 | 119.8° | 1.6° |
| C13 | C12 | C11 | H18 | 0.5° | 118.4° |
| C12 | C13 | C14 | H30 | 112.0° | 1.1° |
| C12 | C13 | C14 | H31 | 8.7° | 121.0° |
| C12 | C11 | C10 | H17 | 120.4° | 120.0° |
| C12 | C11 | C10 | H18 | 120.4° | 120.0° |
| C12 | C11 | C10 | C9 | 61.6° | 126.2° |
| C12 | C11 | C10 | H16 | 118.4° | 53.8° |
| C12 | C11 | H17 | H18 | 118.8° | 120.0° |
| C11 | C12 | C13 | H32 | 179.3° | 171.0° |
| C11 | C10 | C9 | H16 | 180.0° | 180.0° |
| C11 | C10 | C9 | C8 | 0.2° | 6.3° |
| C11 | C10 | C9 | H15 | 179.8° | 173.7° |
| C10 | C11 | H17 | H18 | 118.9° | 120.0° |
| C10 | C11 | C12 | H33 | 60.1° | 58.3° |
| C10 | C9 | C8 | H15 | 180.0° | 180.0° |
| C10 | C9 | C8 | C7 | 159.3° | 129.8° |
| C10 | C9 | C8 | H13 | 80.1° | 9.9° |
| C10 | C9 | C8 | H14 | 38.8° | 110.1° |
| C9 | C10 | C11 | H17 | 58.7° | 113.7° |
| C9 | C10 | C11 | H18 | 178.0° | 6.3° |
| C9 | C8 | C7 | H13 | 120.5° | 120.0° |
| C9 | C8 | C7 | H14 | 120.6° | 120.1° |
| C9 | C8 | C7 | C6 | 58.1° | 175.0° |
| C9 | C8 | C7 | O2 | 178.0° | 65.0° |
| C9 | C8 | C7 | H12 | 63.4° | 55.0° |
| C9 | C8 | H13 | H14 | 118.3° | 120.0° |
| C8 | C9 | C10 | H16 | 179.8° | 173.7° |
| C8 | C7 | C6 | O2 | 116.7° | 120.0° |
| C8 | C7 | C6 | H12 | 121.7° | 120.0° |
| C8 | C7 | O2 | H12 | 117.4° | 120.0° |
| C8 | C7 | C6 | C5 | 44.4° | 175.0° |
| C8 | C7 | C6 | H10 | 159.9° | 65.0° |
| C7 | C8 | H13 | H14 | 118.3° | 120.0° |
| C7 | C8 | C9 | H15 | 20.6° | 50.1° |
| C8 | C7 | O2 | H34 | 180.0° | 60.0° |
| C8 | C7 | C6 | O1 | 82.0° | 55.0° |
| C6 | C7 | O2 | H12 | 120.5° | 120.0° |
| C7 | C6 | C5 | H10 | 115.5° | 120.0° |
| C7 | C6 | C5 | O1 | 126.6° | 120.0° |
| C7 | C6 | C5 | C4 | 158.3° | 175.0° |
| C7 | C6 | C5 | H8 | 38.3° | 65.0° |
| C7 | C6 | C5 | H9 | 81.8° | 55.0° |
| C7 | C6 | H10 | O1 | 121.0° | 120.0° |
| C6 | C7 | C8 | H13 | 178.7° | 55.0° |
| C6 | C7 | C8 | H14 | 62.4° | 65.0° |
| C6 | C7 | O2 | H34 | 57.9° | 60.0° |
| C7 | C6 | O1 | H11 | 180.0° | 60.0° |
| O2 | C7 | C6 | C5 | 72.3° | 55.0° |
| O2 | C7 | C6 | H10 | 43.2° | 175.0° |
| O2 | C7 | C8 | H13 | 61.4° | 175.0° |
| O2 | C7 | C8 | H14 | 57.5° | 55.1° |
| O2 | C7 | C6 | O1 | 161.3° | 65.0° |
| C6 | C5 | C4 | H8 | 120.0° | 119.9° |
| C6 | C5 | C4 | H9 | 119.9° | 120.0° |
| C6 | C5 | C4 | C3 | 136.2° | 126.3° |
| C6 | C5 | C4 | H7 | 43.8° | 53.7° |
| C6 | C5 | H8 | H9 | 120.2° | 120.0° |
| C5 | C6 | H10 | O1 | 120.6° | 120.1° |
| C5 | C6 | C7 | H12 | 166.1° | 65.0° |
| C5 | C6 | O1 | H11 | 54.3° | 59.9° |
| C5 | C4 | C3 | H7 | 180.0° | 180.0° |
| C5 | C4 | C3 | C2 | 0.4° | 6.3° |
| C5 | C4 | C3 | H6 | 179.6° | 173.7° |
| C4 | C5 | H8 | H9 | 120.2° | 120.0° |
| C4 | C5 | C6 | H10 | 42.7° | 55.0° |
| C4 | C5 | C6 | O1 | 75.2° | 65.0° |
| C4 | C3 | C2 | H6 | 180.0° | 180.0° |
| C4 | C3 | C2 | C1 | 143.5° | 129.8° |
| C4 | C3 | C2 | H4 | 23.3° | 9.8° |
| C4 | C3 | C2 | H5 | 96.3° | 110.1° |
| C3 | C4 | C5 | H8 | 16.2° | 113.8° |
| C3 | C4 | C5 | H9 | 103.9° | 6.3° |
| C3 | C2 | C1 | H4 | 120.2° | 120.0° |
| C3 | C2 | C1 | H5 | 120.2° | 120.0° |
| C3 | C2 | C1 | H1 | 180.0° | 60.0° |
| C3 | C2 | C1 | H2 | 60.0° | 60.0° |
| C3 | C2 | C1 | H3 | 60.0° | 179.9° |
| C3 | C2 | H4 | H5 | 119.3° | 120.0° |
| C2 | C3 | C4 | H7 | 179.6° | 173.7° |
| C2 | C1 | H1 | H2 | 120.0° | 120.0° |
| C2 | C1 | H1 | H3 | 120.0° | 120.0° |
| C2 | C1 | H2 | H3 | 120.0° | 119.9° |
| C1 | C2 | H4 | H5 | 119.3° | 120.0° |
| C1 | C2 | C3 | H6 | 36.5° | 50.1° |
| H1 | C1 | H2 | H3 | 120.0° | 120.1° |
| H1 | C1 | C2 | H4 | 59.8° | 60.0° |
| H1 | C1 | C2 | H5 | 59.7° | 180.0° |
| H2 | C1 | C2 | H4 | 179.8° | 180.0° |
| H2 | C1 | C2 | H5 | 60.3° | 60.0° |
| H3 | C1 | C2 | H4 | 60.2° | 60.0° |
| H3 | C1 | C2 | H5 | 179.8° | 59.9° |
| H4 | C2 | C3 | H6 | 156.7° | 170.1° |
| H5 | C2 | C3 | H6 | 83.7° | 69.9° |
| H6 | C3 | C4 | H7 | 0.4° | 6.3° |
| H7 | C4 | C5 | H8 | 163.8° | 66.2° |
| H7 | C4 | C5 | H9 | 76.1° | 173.7° |
| H8 | C5 | C6 | H10 | 77.2° | 175.0° |
| H8 | C5 | C6 | O1 | 164.9° | 54.9° |
| H9 | C5 | C6 | H10 | 162.7° | 65.0° |
| H9 | C5 | C6 | O1 | 44.8° | 175.0° |
| H10 | C6 | C7 | H12 | 78.4° | 55.0° |
| H10 | C6 | O1 | H11 | 62.7° | 180.0° |
| H12 | C7 | C8 | H13 | 57.1° | 65.0° |
| H12 | C7 | C8 | H14 | 176.0° | 175.0° |
| H12 | C7 | O2 | H34 | 62.6° | 180.0° |
| H12 | C7 | C6 | O1 | 39.7° | 175.0° |
| H13 | C8 | C9 | H15 | 99.9° | 170.1° |
| H14 | C8 | C9 | H15 | 141.2° | 69.9° |
| H15 | C9 | C10 | H16 | 0.2° | 6.3° |
| H16 | C10 | C11 | H17 | 121.3° | 66.2° |
| H16 | C10 | C11 | H18 | 2.0° | 173.7° |
| H17 | C11 | C12 | H33 | 60.2° | 178.3° |
| H18 | C11 | C12 | H33 | 179.5° | 61.7° |
| H20 | C21 | C20 | H22 | 173.0° | 180.0° |
| H20 | C21 | C20 | H23 | 67.4° | 60.0° |
| H21 | C21 | C20 | H22 | 53.2° | 60.0° |
| H21 | C21 | C20 | H23 | 172.9° | 180.0° |
| H22 | C20 | C19 | H24 | 82.3° | 172.7° |
| H23 | C20 | C19 | H24 | 158.0° | 67.3° |
| H24 | C19 | C18 | H25 | 0.3° | 7.5° |
| H25 | C18 | C17 | H26 | 153.6° | 67.2° |
| H25 | C18 | C17 | H27 | 33.6° | 172.8° |
| H26 | C17 | C16 | H28 | 61.0° | 173.4° |
| H27 | C17 | C16 | H28 | 179.0° | 66.6° |
| H28 | C16 | C15 | H29 | 0.5° | 7.5° |
| H29 | C15 | C14 | H30 | 166.3° | 66.6° |
| H29 | C15 | C14 | H31 | 73.0° | 173.3° |
| H30 | C14 | C13 | H32 | 68.0° | 179.0° |
| H31 | C14 | C13 | H32 | 171.2° | 59.0° |
| H32 | C13 | C12 | H33 | 0.8° | 9.0° |
