3H1
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C01 | C02 | doub | 1.41Å | 1.43Å | Aromatic |
| C01 | C06 | sing | 1.38Å | 1.42Å | Aromatic |
| C01 | O09 | sing | 1.36Å | 1.37Å | |
| C02 | C03 | sing | 1.40Å | 1.46Å | Aromatic |
| C02 | C07 | sing | 1.46Å | 1.52Å | |
| C03 | C04 | doub | 1.36Å | 1.44Å | Aromatic |
| C03 | C08 | sing | 1.51Å | 1.55Å | |
| C04 | C05 | sing | 1.39Å | 1.40Å | Aromatic |
| C04 | CL12 | sing | 1.74Å | 1.77Å | |
| C05 | C06 | doub | 1.39Å | 1.42Å | Aromatic |
| C05 | O11 | sing | 1.36Å | 1.38Å | |
| C06 | C13 | sing | 1.51Å | 1.54Å | |
| C07 | O10 | doub | 1.21Å | 1.23Å | |
| C07 | H07 | sing | 1.08Å | 1.08Å | |
| C08 | H08 | sing | 1.09Å | 1.10Å | |
| C08 | H08A | sing | 1.09Å | 1.10Å | |
| C08 | H08B | sing | 1.09Å | 1.10Å | |
| O09 | HO09 | sing | 0.97Å | 0.95Å | |
| O11 | HO11 | sing | 0.97Å | 0.95Å | |
| C13 | C14 | sing | 1.51Å | 1.52Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H13A | sing | 1.09Å | 1.10Å | |
| C14 | C15 | doub | 1.33Å | 1.34Å | |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| C15 | C16 | sing | 1.51Å | 1.54Å | |
| C15 | C17 | sing | 1.47Å | 1.35Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H16A | sing | 1.09Å | 1.10Å | |
| C16 | H16B | sing | 1.09Å | 1.10Å | |
| C17 | C18 | doub | 1.33Å | 1.34Å | |
| C18 | C19 | sing | 1.51Å | 1.55Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C19 | C20 | sing | 1.53Å | 1.63Å | |
| C19 | C24 | sing | 1.53Å | 1.60Å | |
| C19 | C28 | sing | 1.53Å | 1.58Å | |
| C20 | C21 | sing | 1.53Å | 1.60Å | |
| C20 | C25 | sing | 1.53Å | 1.57Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C21 | C22 | sing | 1.53Å | 1.57Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H21A | sing | 1.09Å | 1.10Å | |
| C22 | C23 | sing | 1.51Å | 1.55Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H22A | sing | 1.09Å | 1.10Å | |
| C23 | C24 | sing | 1.51Å | 1.54Å | |
| C23 | O26 | doub | 1.21Å | 1.23Å | |
| C24 | C27 | sing | 1.53Å | 1.57Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C25 | H25A | sing | 1.09Å | 1.10Å | |
| C25 | H25B | sing | 1.09Å | 1.10Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C27 | H27A | sing | 1.09Å | 1.10Å | |
| C27 | H27B | sing | 1.09Å | 1.10Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| C28 | H28A | sing | 1.09Å | 1.10Å | |
| C28 | H28B | sing | 1.09Å | 1.10Å | |
| C17 | H29 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C02 | C01 | C06 | 121.0° | 119.6° |
| C02 | C01 | O09 | 120.7° | 120.2° |
| C01 | C02 | C03 | 118.6° | 119.6° |
| C01 | C02 | C07 | 119.0° | 120.2° |
| C06 | C01 | O09 | 118.3° | 120.2° |
| C01 | C06 | C05 | 119.7° | 120.0° |
| C01 | C06 | C13 | 121.9° | 120.0° |
| C01 | O09 | HO09 | 109.5° | 114.0° |
| C03 | C02 | C07 | 122.4° | 120.2° |
| C02 | C03 | C04 | 119.4° | 120.1° |
| C02 | C03 | C08 | 122.3° | 120.0° |
| C02 | C07 | O10 | 126.6° | 120.0° |
| C02 | C07 | H07 | 116.7° | 120.0° |
| C04 | C03 | C08 | 118.3° | 120.0° |
| C03 | C04 | C05 | 120.2° | 120.4° |
| C03 | C04 | CL12 | 122.6° | 119.8° |
| C03 | C08 | H08 | 109.5° | 109.5° |
| C03 | C08 | H08A | 109.5° | 109.5° |
| C03 | C08 | H08B | 109.4° | 109.5° |
| C05 | C04 | CL12 | 117.2° | 119.8° |
| C04 | C05 | C06 | 121.0° | 120.3° |
| C04 | C05 | O11 | 118.6° | 119.8° |
| C06 | C05 | O11 | 120.4° | 119.9° |
| C05 | C06 | C13 | 118.4° | 120.0° |
| C05 | O11 | HO11 | 109.5° | 114.0° |
| C06 | C13 | C14 | 115.6° | 109.5° |
| C06 | C13 | H13 | 107.5° | 109.4° |
| C06 | C13 | H13A | 106.1° | 109.5° |
| O10 | C07 | H07 | 116.7° | 120.0° |
| H08 | C08 | H08A | 109.4° | 109.4° |
| H08 | C08 | H08B | 109.5° | 109.4° |
| H08A | C08 | H08B | 109.5° | 109.5° |
| C14 | C13 | H13 | 107.5° | 109.4° |
| C14 | C13 | H13A | 106.1° | 109.5° |
| C13 | C14 | C15 | 127.4° | 120.0° |
| C13 | C14 | H14 | 116.3° | 120.0° |
| H13 | C13 | H13A | 114.4° | 109.4° |
| C15 | C14 | H14 | 116.3° | 120.0° |
| C14 | C15 | C16 | 119.5° | 120.0° |
| C14 | C15 | C17 | 118.5° | 120.0° |
| C16 | C15 | C17 | 122.0° | 120.0° |
| C15 | C16 | H16 | 109.5° | 109.5° |
| C15 | C16 | H16A | 109.5° | 109.5° |
| C15 | C16 | H16B | 109.4° | 109.4° |
| C15 | C17 | C18 | 125.1° | 120.0° |
| C15 | C17 | H29 | 117.5° | 120.0° |
| H16 | C16 | H16A | 109.4° | 109.5° |
| H16 | C16 | H16B | 109.5° | 109.4° |
| H16A | C16 | H16B | 109.5° | 109.4° |
| C17 | C18 | C19 | 133.1° | 120.0° |
| C17 | C18 | H18 | 113.5° | 120.0° |
| C18 | C17 | H29 | 117.4° | 120.0° |
| C19 | C18 | H18 | 113.5° | 120.0° |
| C18 | C19 | C20 | 112.3° | 109.5° |
| C18 | C19 | C24 | 108.0° | 109.5° |
| C18 | C19 | C28 | 102.1° | 109.5° |
| C20 | C19 | C24 | 110.7° | 109.4° |
| C20 | C19 | C28 | 112.2° | 109.5° |
| C19 | C20 | C21 | 112.6° | 109.8° |
| C19 | C20 | C25 | 115.6° | 109.4° |
| C19 | C20 | H20 | 101.8° | 109.5° |
| C24 | C19 | C28 | 111.1° | 109.5° |
| C19 | C24 | C23 | 106.3° | 108.5° |
| C19 | C24 | C27 | 117.5° | 109.6° |
| C19 | C24 | H24 | 105.5° | 109.7° |
| C19 | C28 | H28 | 109.5° | 109.5° |
| C19 | C28 | H28A | 109.5° | 109.5° |
| C19 | C28 | H28B | 109.4° | 109.5° |
| C21 | C20 | C25 | 106.1° | 109.4° |
| C21 | C20 | H20 | 112.0° | 109.4° |
| C20 | C21 | C22 | 117.2° | 109.4° |
| C20 | C21 | H21 | 107.0° | 109.5° |
| C20 | C21 | H21A | 105.2° | 109.5° |
| C25 | C20 | H20 | 108.8° | 109.4° |
| C20 | C25 | H25 | 109.5° | 109.5° |
| C20 | C25 | H25A | 109.5° | 109.5° |
| C20 | C25 | H25B | 109.5° | 109.5° |
| C22 | C21 | H21 | 107.0° | 109.5° |
| C22 | C21 | H21A | 105.2° | 109.5° |
| C21 | C22 | C23 | 112.1° | 108.5° |
| C21 | C22 | H22 | 108.6° | 109.6° |
| C21 | C22 | H22A | 108.0° | 109.7° |
| H21 | C21 | H21A | 115.8° | 109.5° |
| C23 | C22 | H22 | 108.6° | 109.6° |
| C23 | C22 | H22A | 108.1° | 109.6° |
| C22 | C23 | C24 | 117.0° | 118.3° |
| C22 | C23 | O26 | 121.3° | 120.8° |
| H22 | C22 | H22A | 111.5° | 109.8° |
| C24 | C23 | O26 | 121.5° | 120.8° |
| C23 | C24 | C27 | 107.2° | 109.6° |
| C23 | C24 | H24 | 116.2° | 109.6° |
| C27 | C24 | H24 | 104.6° | 109.8° |
| C24 | C27 | H27 | 109.5° | 109.5° |
| C24 | C27 | H27A | 109.5° | 109.4° |
| C24 | C27 | H27B | 109.4° | 109.4° |
| H25 | C25 | H25A | 109.4° | 109.5° |
| H25 | C25 | H25B | 109.5° | 109.5° |
| H25A | C25 | H25B | 109.5° | 109.5° |
| H27 | C27 | H27A | 109.5° | 109.5° |
| H27 | C27 | H27B | 109.5° | 109.5° |
| H27A | C27 | H27B | 109.5° | 109.5° |
| H28 | C28 | H28A | 109.4° | 109.5° |
| H28 | C28 | H28B | 109.4° | 109.4° |
| H28A | C28 | H28B | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C02 | C01 | C06 | O09 | 179.5° | 179.7° |
| C01 | C02 | C03 | C07 | 179.5° | 180.0° |
| C01 | C02 | C03 | C04 | 0.6° | 0.1° |
| C01 | C02 | C03 | C08 | 180.0° | 180.0° |
| C02 | C01 | C06 | C05 | 0.6° | 0.1° |
| C02 | C01 | C06 | C13 | 179.9° | 180.0° |
| C01 | C02 | C07 | O10 | 0.4° | 0.1° |
| C01 | C02 | C07 | H07 | 179.6° | 180.0° |
| C02 | C01 | O09 | HO09 | 42.2° | 90.0° |
| C06 | C01 | C02 | C03 | 0.7° | 0.0° |
| C06 | C01 | C02 | C07 | 179.8° | 180.0° |
| C01 | C06 | C05 | C04 | 0.4° | 0.1° |
| C01 | C06 | C05 | C13 | 179.2° | 179.9° |
| C01 | C06 | C05 | O11 | 179.9° | 179.9° |
| C06 | C01 | O09 | HO09 | 137.4° | 90.3° |
| C01 | C06 | C13 | C14 | 62.4° | 90.0° |
| C01 | C06 | C13 | H13 | 57.5° | 150.1° |
| C01 | C06 | C13 | H13A | 179.7° | 30.1° |
| O09 | C01 | C02 | C03 | 179.8° | 179.7° |
| O09 | C01 | C02 | C07 | 0.3° | 0.3° |
| O09 | C01 | C06 | C05 | 179.9° | 179.8° |
| O09 | C01 | C06 | C13 | 0.6° | 0.3° |
| C02 | C03 | C04 | C08 | 179.4° | 179.9° |
| C02 | C03 | C04 | C05 | 0.4° | 0.0° |
| C02 | C03 | C04 | CL12 | 179.9° | 180.0° |
| C03 | C02 | C07 | O10 | 179.9° | 180.0° |
| C03 | C02 | C07 | H07 | 0.1° | 0.1° |
| C02 | C03 | C08 | H08 | 162.1° | 90.0° |
| C02 | C03 | C08 | H08A | 42.2° | 150.0° |
| C02 | C03 | C08 | H08B | 77.9° | 30.0° |
| C07 | C02 | C03 | C04 | 179.9° | 180.0° |
| C07 | C02 | C03 | C08 | 0.5° | 0.1° |
| C02 | C07 | O10 | H07 | 180.0° | 179.9° |
| C03 | C04 | C05 | CL12 | 179.5° | 180.0° |
| C03 | C04 | C05 | C06 | 0.3° | 0.0° |
| C03 | C04 | C05 | O11 | 180.0° | 180.0° |
| C04 | C03 | C08 | H08 | 18.5° | 90.0° |
| C04 | C03 | C08 | H08A | 138.4° | 30.0° |
| C04 | C03 | C08 | H08B | 101.5° | 150.0° |
| C08 | C03 | C04 | C05 | 179.8° | 180.0° |
| C08 | C03 | C04 | CL12 | 0.7° | 0.1° |
| C03 | C08 | H08 | H08A | 120.0° | 120.0° |
| C03 | C08 | H08 | H08B | 120.0° | 120.0° |
| C03 | C08 | H08A | H08B | 120.0° | 120.0° |
| C04 | C05 | C06 | O11 | 179.6° | 180.0° |
| C04 | C05 | C06 | C13 | 179.7° | 180.0° |
| C04 | C05 | O11 | HO11 | 131.4° | 90.0° |
| CL12 | C04 | C05 | C06 | 179.8° | 179.9° |
| CL12 | C04 | C05 | O11 | 0.5° | 0.1° |
| C06 | C05 | O11 | HO11 | 48.3° | 90.0° |
| C05 | C06 | C13 | C14 | 118.3° | 89.9° |
| C05 | C06 | C13 | H13 | 121.7° | 30.0° |
| C05 | C06 | C13 | H13A | 1.1° | 150.0° |
| O11 | C05 | C06 | C13 | 0.7° | 0.0° |
| C06 | C13 | C14 | H13 | 120.0° | 120.0° |
| C06 | C13 | C14 | H13A | 117.2° | 120.1° |
| C06 | C13 | H13 | H13A | 117.5° | 120.0° |
| C06 | C13 | C14 | C15 | 169.0° | 125.9° |
| C06 | C13 | C14 | H14 | 11.0° | 54.1° |
| H08 | C08 | H08A | H08B | 120.0° | 119.9° |
| C14 | C13 | H13 | H13A | 117.5° | 120.0° |
| C13 | C14 | C15 | H14 | 180.0° | 180.0° |
| C13 | C14 | C15 | C16 | 0.3° | 5.9° |
| C13 | C14 | C15 | C17 | 179.3° | 174.1° |
| H13 | C13 | C14 | C15 | 71.0° | 114.2° |
| H13 | C13 | C14 | H14 | 109.0° | 65.9° |
| H13A | C13 | C14 | C15 | 51.8° | 5.8° |
| H13A | C13 | C14 | H14 | 128.2° | 174.2° |
| C14 | C15 | C16 | C17 | 179.5° | 180.0° |
| C14 | C15 | C16 | H16 | 116.0° | 84.9° |
| C14 | C15 | C16 | H16A | 4.0° | 155.0° |
| C14 | C15 | C16 | H16B | 124.0° | 35.0° |
| C14 | C15 | C17 | C18 | 179.6° | 180.0° |
| C14 | C15 | C17 | H29 | 0.4° | 0.0° |
| H14 | C14 | C15 | C16 | 179.7° | 174.1° |
| H14 | C14 | C15 | C17 | 0.7° | 5.9° |
| C15 | C16 | H16 | H16A | 120.0° | 120.1° |
| C15 | C16 | H16 | H16B | 120.0° | 120.0° |
| C15 | C16 | H16A | H16B | 120.0° | 120.0° |
| C16 | C15 | C17 | C18 | 0.1° | 0.0° |
| C16 | C15 | C17 | H29 | 179.9° | 180.0° |
| C17 | C15 | C16 | H16 | 63.5° | 95.0° |
| C17 | C15 | C16 | H16A | 176.5° | 25.0° |
| C17 | C15 | C16 | H16B | 56.5° | 145.0° |
| C15 | C17 | C18 | H29 | 180.0° | 179.9° |
| C15 | C17 | C18 | C19 | 179.3° | 180.0° |
| C15 | C17 | C18 | H18 | 0.7° | 0.1° |
| H16 | C16 | H16A | H16B | 120.0° | 119.9° |
| C17 | C18 | C19 | H18 | 180.0° | 179.9° |
| C17 | C18 | C19 | C20 | 58.4° | 120.0° |
| C17 | C18 | C19 | C24 | 64.1° | 120.1° |
| C17 | C18 | C19 | C28 | 178.7° | 0.1° |
| C18 | C19 | C20 | C24 | 120.9° | 120.0° |
| C18 | C19 | C20 | C28 | 114.4° | 120.0° |
| C18 | C19 | C24 | C28 | 111.2° | 120.1° |
| C18 | C19 | C20 | C21 | 171.1° | 176.4° |
| C18 | C19 | C20 | C25 | 66.8° | 56.3° |
| C18 | C19 | C20 | H20 | 50.9° | 63.5° |
| C18 | C19 | C24 | C23 | 176.5° | 174.6° |
| C18 | C19 | C24 | C27 | 56.5° | 65.7° |
| C18 | C19 | C24 | H24 | 59.6° | 54.9° |
| C18 | C19 | C28 | H28 | 123.8° | 60.0° |
| C18 | C19 | C28 | H28A | 3.8° | 180.0° |
| C18 | C19 | C28 | H28B | 116.3° | 59.9° |
| C19 | C18 | C17 | H29 | 0.7° | 0.1° |
| H18 | C18 | C19 | C20 | 121.6° | 59.9° |
| H18 | C18 | C19 | C24 | 116.0° | 60.0° |
| H18 | C18 | C19 | C28 | 1.2° | 180.0° |
| H18 | C18 | C17 | H29 | 179.3° | 180.0° |
| C20 | C19 | C24 | C28 | 125.4° | 120.0° |
| C19 | C20 | C21 | C25 | 127.3° | 120.1° |
| C19 | C20 | C21 | H20 | 114.0° | 120.1° |
| C19 | C20 | C25 | H20 | 113.7° | 119.9° |
| C19 | C20 | C21 | C22 | 38.1° | 63.6° |
| C19 | C20 | C21 | H21 | 81.9° | 56.4° |
| C19 | C20 | C21 | H21A | 154.5° | 176.4° |
| C20 | C19 | C24 | C23 | 60.1° | 54.7° |
| C20 | C19 | C24 | C27 | 179.9° | 174.3° |
| C20 | C19 | C24 | H24 | 63.8° | 65.0° |
| C19 | C20 | C25 | H25 | 111.8° | 60.0° |
| C19 | C20 | C25 | H25A | 8.2° | 180.0° |
| C19 | C20 | C25 | H25B | 128.2° | 60.0° |
| C20 | C19 | C28 | H28 | 115.8° | 60.1° |
| C20 | C19 | C28 | H28A | 124.2° | 60.0° |
| C20 | C19 | C28 | H28B | 4.2° | 180.0° |
| C24 | C19 | C20 | C21 | 50.2° | 63.6° |
| C24 | C19 | C20 | C25 | 172.3° | 176.3° |
| C24 | C19 | C20 | H20 | 70.0° | 56.5° |
| C19 | C24 | C23 | C22 | 62.3° | 51.4° |
| C19 | C24 | C23 | C27 | 126.5° | 119.7° |
| C19 | C24 | C23 | H24 | 117.0° | 119.8° |
| C19 | C24 | C23 | O26 | 112.9° | 128.7° |
| C19 | C24 | C27 | H24 | 116.6° | 120.5° |
| C19 | C24 | C27 | H27 | 170.6° | 60.0° |
| C19 | C24 | C27 | H27A | 69.4° | 180.0° |
| C19 | C24 | C27 | H27B | 50.6° | 60.0° |
| C24 | C19 | C28 | H28 | 8.8° | 180.0° |
| C24 | C19 | C28 | H28A | 111.2° | 59.9° |
| C24 | C19 | C28 | H28B | 128.7° | 60.1° |
| C28 | C19 | C20 | C21 | 74.6° | 56.4° |
| C28 | C19 | C20 | C25 | 47.6° | 63.7° |
| C28 | C19 | C20 | H20 | 165.3° | 176.5° |
| C28 | C19 | C24 | C23 | 65.3° | 65.3° |
| C28 | C19 | C24 | C27 | 54.7° | 54.4° |
| C28 | C19 | C24 | H24 | 170.8° | 175.0° |
| C19 | C28 | H28 | H28A | 120.0° | 120.0° |
| C19 | C28 | H28 | H28B | 120.0° | 120.0° |
| C19 | C28 | H28A | H28B | 120.0° | 120.0° |
| C21 | C20 | C25 | H20 | 120.7° | 119.8° |
| C20 | C21 | C22 | H21 | 120.0° | 120.0° |
| C20 | C21 | C22 | H21A | 116.4° | 119.9° |
| C20 | C21 | H21 | H21A | 116.8° | 120.0° |
| C20 | C21 | C22 | C23 | 36.2° | 54.6° |
| C20 | C21 | C22 | H22 | 156.2° | 174.3° |
| C20 | C21 | C22 | H22A | 82.7° | 65.1° |
| C21 | C20 | C25 | H25 | 13.7° | 179.6° |
| C21 | C20 | C25 | H25A | 133.7° | 59.6° |
| C21 | C20 | C25 | H25B | 106.3° | 60.3° |
| C25 | C20 | C21 | C22 | 165.4° | 176.3° |
| C25 | C20 | C21 | H21 | 45.4° | 63.7° |
| C25 | C20 | C21 | H21A | 78.2° | 56.4° |
| C20 | C25 | H25 | H25A | 120.0° | 120.0° |
| C20 | C25 | H25 | H25B | 120.0° | 120.0° |
| C20 | C25 | H25A | H25B | 120.0° | 120.0° |
| H20 | C20 | C21 | C22 | 75.9° | 56.5° |
| H20 | C20 | C21 | H21 | 164.1° | 176.5° |
| H20 | C20 | C21 | H21A | 40.5° | 63.4° |
| H20 | C20 | C25 | H25 | 134.5° | 59.8° |
| H20 | C20 | C25 | H25A | 105.6° | 60.2° |
| H20 | C20 | C25 | H25B | 14.5° | 179.9° |
| C22 | C21 | H21 | H21A | 116.8° | 120.1° |
| C21 | C22 | C23 | H22 | 120.0° | 119.6° |
| C21 | C22 | C23 | H22A | 118.9° | 119.8° |
| C21 | C22 | H22 | H22A | 118.9° | 120.5° |
| C21 | C22 | C23 | C24 | 50.1° | 51.4° |
| C21 | C22 | C23 | O26 | 125.2° | 128.7° |
| H21 | C21 | C22 | C23 | 83.9° | 65.3° |
| H21 | C21 | C22 | H22 | 36.2° | 54.3° |
| H21 | C21 | C22 | H22A | 157.2° | 175.0° |
| H21A | C21 | C22 | C23 | 152.6° | 174.6° |
| H21A | C21 | C22 | H22 | 87.4° | 65.8° |
| H21A | C21 | C22 | H22A | 33.6° | 54.9° |
| C23 | C22 | H22 | H22A | 119.0° | 120.5° |
| C22 | C23 | C24 | O26 | 175.3° | 179.9° |
| C22 | C23 | C24 | C27 | 171.2° | 171.1° |
| C22 | C23 | C24 | H24 | 54.7° | 68.3° |
| H22 | C22 | C23 | C24 | 170.1° | 171.1° |
| H22 | C22 | C23 | O26 | 5.2° | 9.0° |
| H22A | C22 | C23 | C24 | 68.8° | 68.3° |
| H22A | C22 | C23 | O26 | 116.0° | 111.6° |
| C23 | C24 | C27 | H24 | 123.9° | 120.5° |
| C23 | C24 | C27 | H27 | 51.1° | 59.0° |
| C23 | C24 | C27 | H27A | 171.1° | 61.0° |
| C23 | C24 | C27 | H27B | 68.9° | 179.0° |
| O26 | C23 | C24 | C27 | 13.6° | 9.0° |
| O26 | C23 | C24 | H24 | 130.1° | 111.6° |
| C24 | C27 | H27 | H27A | 120.0° | 120.0° |
| C24 | C27 | H27 | H27B | 120.0° | 120.0° |
| C24 | C27 | H27A | H27B | 120.0° | 119.9° |
| H24 | C24 | C27 | H27 | 72.8° | 179.5° |
| H24 | C24 | C27 | H27A | 47.2° | 59.5° |
| H24 | C24 | C27 | H27B | 167.2° | 60.5° |
| H25 | C25 | H25A | H25B | 120.0° | 120.0° |
| H27 | C27 | H27A | H27B | 120.0° | 120.1° |
| H28 | C28 | H28A | H28B | 120.0° | 119.9° |
