JY
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O2 | C3 | sing | 1.43Å | 1.43Å | |
| O2 | HO21 | sing | 0.97Å | 0.95Å | |
| C1 | C2 | sing | 1.53Å | 1.56Å | |
| C1 | C10 | sing | 1.52Å | 1.53Å | |
| C1 | H11 | sing | 1.09Å | 1.12Å | |
| C1 | H12 | sing | 1.09Å | 1.12Å | |
| C2 | C3 | sing | 1.53Å | 1.58Å | |
| C2 | H21 | sing | 1.09Å | 1.12Å | |
| C2 | H22 | sing | 1.09Å | 1.12Å | |
| C3 | C4 | sing | 1.53Å | 1.56Å | |
| C3 | H31 | sing | 1.09Å | 1.12Å | |
| C4 | C5 | sing | 1.52Å | 1.54Å | |
| C4 | H41 | sing | 1.09Å | 1.12Å | |
| C4 | H42 | sing | 1.09Å | 1.11Å | |
| C5 | C6 | doub | 1.35Å | 1.44Å | |
| C5 | C10 | sing | 1.48Å | 1.53Å | |
| C6 | C7 | sing | 1.46Å | 1.51Å | |
| C6 | H61 | sing | 1.08Å | 1.10Å | |
| C7 | C8 | doub | 1.33Å | 1.36Å | |
| C7 | H71 | sing | 1.08Å | 1.10Å | |
| C8 | C9 | sing | 1.52Å | 1.55Å | |
| C8 | C14 | sing | 1.50Å | 1.54Å | |
| C9 | C11 | sing | 1.53Å | 1.55Å | |
| C9 | H91 | sing | 1.09Å | 1.12Å | |
| C9 | H92 | sing | 1.09Å | 1.12Å | |
| C10 | C19 | doub | 1.33Å | 1.36Å | |
| C11 | C12 | sing | 1.54Å | 1.57Å | |
| C11 | H111 | sing | 1.09Å | 1.12Å | |
| C11 | H112 | sing | 1.09Å | 1.11Å | |
| C12 | C13 | sing | 1.51Å | 1.58Å | |
| C12 | H121 | sing | 1.09Å | 1.11Å | |
| C12 | H122 | sing | 1.09Å | 1.11Å | |
| C13 | C14 | sing | 1.56Å | 1.57Å | |
| C13 | C17 | sing | 1.52Å | 1.59Å | |
| C13 | C18 | sing | 1.53Å | 1.59Å | |
| C14 | C15 | sing | 1.53Å | 1.58Å | |
| C14 | H141 | sing | 1.09Å | 1.12Å | |
| C15 | C16 | sing | 1.55Å | 1.57Å | |
| C15 | H151 | sing | 1.09Å | 1.12Å | |
| C15 | H152 | sing | 1.09Å | 1.11Å | |
| C16 | C17 | sing | 1.55Å | 1.56Å | |
| C16 | H161 | sing | 1.09Å | 1.11Å | |
| C16 | H162 | sing | 1.09Å | 1.11Å | |
| C17 | C20 | sing | 1.53Å | 1.61Å | |
| C17 | H171 | sing | 1.09Å | 1.11Å | |
| C18 | H181 | sing | 1.09Å | 1.12Å | |
| C18 | H182 | sing | 1.09Å | 1.11Å | |
| C18 | H183 | sing | 1.09Å | 1.12Å | |
| C19 | H191 | sing | 1.08Å | 1.10Å | |
| C19 | H192 | sing | 1.08Å | 1.10Å | |
| C20 | C21 | sing | 1.53Å | 1.55Å | |
| C20 | C22 | sing | 1.53Å | 1.57Å | |
| C20 | H201 | sing | 1.09Å | 1.11Å | |
| C21 | H211 | sing | 1.09Å | 1.12Å | |
| C21 | H212 | sing | 1.09Å | 1.12Å | |
| C21 | H213 | sing | 1.09Å | 1.12Å | |
| C22 | C27 | sing | 1.51Å | 1.53Å | |
| C22 | H221 | sing | 1.09Å | 1.11Å | |
| C22 | H222 | sing | 1.09Å | 1.11Å | |
| C23 | C24 | doub | 1.38Å | 1.42Å | Aromatic |
| C23 | C28 | sing | 1.38Å | 1.42Å | Aromatic |
| C23 | H231 | sing | 1.08Å | 1.10Å | |
| C24 | C25 | sing | 1.39Å | 1.44Å | Aromatic |
| C24 | H241 | sing | 1.08Å | 1.10Å | |
| C25 | C26 | doub | 1.39Å | 1.42Å | Aromatic |
| C25 | O1 | sing | 1.36Å | 1.36Å | |
| C26 | C27 | sing | 1.38Å | 1.42Å | Aromatic |
| C26 | H261 | sing | 1.08Å | 1.10Å | |
| C27 | C28 | doub | 1.38Å | 1.43Å | Aromatic |
| C28 | H281 | sing | 1.08Å | 1.10Å | |
| O1 | HO11 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C3 | O2 | HO21 | 111.9° | 106.8° |
| O2 | C3 | C2 | 111.9° | 109.4° |
| O2 | C3 | C4 | 107.1° | 109.4° |
| O2 | C3 | H31 | 110.8° | 109.4° |
| C2 | C1 | C10 | 109.4° | 108.3° |
| C2 | C1 | H11 | 112.2° | 109.7° |
| C2 | C1 | H12 | 112.2° | 109.6° |
| C1 | C2 | C3 | 114.9° | 109.8° |
| C1 | C2 | H21 | 110.2° | 109.4° |
| C1 | C2 | H22 | 110.2° | 109.5° |
| C10 | C1 | H11 | 112.2° | 109.9° |
| C10 | C1 | H12 | 112.2° | 109.6° |
| C1 | C10 | C5 | 116.1° | 116.6° |
| C1 | C10 | C19 | 122.1° | 121.6° |
| H11 | C1 | H12 | 98.2° | 109.7° |
| C3 | C2 | H21 | 110.2° | 109.4° |
| C3 | C2 | H22 | 110.2° | 109.3° |
| C2 | C3 | C4 | 113.2° | 109.8° |
| C2 | C3 | H31 | 104.4° | 109.4° |
| H21 | C2 | H22 | 100.0° | 109.3° |
| C4 | C3 | H31 | 109.5° | 109.4° |
| C3 | C4 | C5 | 112.1° | 108.3° |
| C3 | C4 | H41 | 111.3° | 109.7° |
| C3 | C4 | H42 | 111.2° | 109.7° |
| C5 | C4 | H41 | 111.3° | 109.7° |
| C5 | C4 | H42 | 111.3° | 109.7° |
| C4 | C5 | C6 | 120.6° | 121.6° |
| C4 | C5 | C10 | 114.5° | 116.8° |
| H41 | C4 | H42 | 99.1° | 109.8° |
| C6 | C5 | C10 | 124.9° | 121.6° |
| C5 | C6 | C7 | 122.8° | 120.1° |
| C5 | C6 | H61 | 116.3° | 119.9° |
| C5 | C10 | C19 | 121.7° | 121.8° |
| C7 | C6 | H61 | 120.9° | 120.0° |
| C6 | C7 | C8 | 125.7° | 120.0° |
| C6 | C7 | H71 | 122.7° | 120.0° |
| C8 | C7 | H71 | 111.6° | 120.0° |
| C7 | C8 | C9 | 123.7° | 122.4° |
| C7 | C8 | C14 | 125.2° | 122.4° |
| C9 | C8 | C14 | 111.1° | 115.2° |
| C8 | C9 | C11 | 113.0° | 110.7° |
| C8 | C9 | H91 | 110.9° | 109.3° |
| C8 | C9 | H92 | 110.9° | 109.2° |
| C8 | C14 | C13 | 116.2° | 106.0° |
| C8 | C14 | C15 | 120.6° | 116.7° |
| C8 | C14 | H141 | 93.5° | 110.6° |
| C11 | C9 | H91 | 110.9° | 109.2° |
| C11 | C9 | H92 | 110.9° | 109.2° |
| C9 | C11 | C12 | 112.2° | 111.7° |
| C9 | C11 | H111 | 111.2° | 109.0° |
| C9 | C11 | H112 | 111.2° | 109.0° |
| H91 | C9 | H92 | 99.4° | 109.2° |
| C10 | C19 | H191 | 122.1° | 120.0° |
| C10 | C19 | H192 | 121.6° | 120.0° |
| C12 | C11 | H111 | 111.2° | 109.0° |
| C12 | C11 | H112 | 111.2° | 109.1° |
| C11 | C12 | C13 | 113.1° | 108.1° |
| C11 | C12 | H121 | 110.9° | 109.9° |
| C11 | C12 | H122 | 110.9° | 109.8° |
| H111 | C11 | H112 | 99.1° | 108.9° |
| C13 | C12 | H121 | 110.9° | 109.4° |
| C13 | C12 | H122 | 110.9° | 109.7° |
| C12 | C13 | C14 | 108.6° | 107.8° |
| C12 | C13 | C17 | 117.8° | 119.0° |
| C12 | C13 | C18 | 106.3° | 109.3° |
| H121 | C12 | H122 | 99.4° | 109.9° |
| C14 | C13 | C17 | 95.1° | 103.1° |
| C14 | C13 | C18 | 112.2° | 107.8° |
| C13 | C14 | C15 | 101.8° | 101.4° |
| C13 | C14 | H141 | 115.2° | 110.9° |
| C17 | C13 | C18 | 116.3° | 109.2° |
| C13 | C17 | C16 | 101.3° | 105.1° |
| C13 | C17 | C20 | 123.4° | 110.4° |
| C13 | C17 | H171 | 107.6° | 110.3° |
| C13 | C18 | H181 | 113.4° | 109.5° |
| C13 | C18 | H182 | 106.3° | 109.4° |
| C13 | C18 | H183 | 113.4° | 109.5° |
| C15 | C14 | H141 | 110.2° | 110.8° |
| C14 | C15 | C16 | 103.6° | 102.8° |
| C14 | C15 | H151 | 114.4° | 110.8° |
| C14 | C15 | H152 | 114.4° | 110.7° |
| C16 | C15 | H151 | 114.4° | 110.8° |
| C16 | C15 | H152 | 114.4° | 110.8° |
| C15 | C16 | C17 | 104.3° | 106.3° |
| C15 | C16 | H161 | 114.1° | 110.1° |
| C15 | C16 | H162 | 114.1° | 110.1° |
| H151 | C15 | H152 | 96.1° | 110.8° |
| C17 | C16 | H161 | 114.2° | 110.1° |
| C17 | C16 | H162 | 114.2° | 110.1° |
| C16 | C17 | C20 | 113.6° | 110.3° |
| C16 | C17 | H171 | 118.7° | 110.3° |
| H161 | C16 | H162 | 96.3° | 110.2° |
| C20 | C17 | H171 | 93.3° | 110.3° |
| C17 | C20 | C21 | 113.6° | 109.5° |
| C17 | C20 | C22 | 114.4° | 109.5° |
| C17 | C20 | H201 | 102.3° | 109.5° |
| H181 | C18 | H182 | 113.4° | 109.5° |
| H181 | C18 | H183 | 97.1° | 109.4° |
| H182 | C18 | H183 | 113.3° | 109.5° |
| H191 | C19 | H192 | 116.2° | 120.0° |
| C21 | C20 | C22 | 107.8° | 109.4° |
| C21 | C20 | H201 | 109.7° | 109.4° |
| C20 | C21 | H211 | 110.7° | 109.5° |
| C20 | C21 | H212 | 113.6° | 109.4° |
| C20 | C21 | H213 | 110.7° | 109.5° |
| C22 | C20 | H201 | 108.7° | 109.5° |
| C20 | C22 | C27 | 112.6° | 109.5° |
| C20 | C22 | H221 | 111.1° | 109.4° |
| C20 | C22 | H222 | 111.1° | 109.4° |
| H211 | C21 | H212 | 110.7° | 109.4° |
| H211 | C21 | H213 | 99.6° | 109.5° |
| H212 | C21 | H213 | 110.7° | 109.4° |
| C27 | C22 | H221 | 111.0° | 109.6° |
| C27 | C22 | H222 | 111.1° | 109.5° |
| C22 | C27 | C26 | 120.9° | 120.0° |
| C22 | C27 | C28 | 120.7° | 119.9° |
| H221 | C22 | H222 | 99.3° | 109.4° |
| C24 | C23 | C28 | 120.0° | 120.1° |
| C24 | C23 | H231 | 120.0° | 119.9° |
| C23 | C24 | C25 | 120.0° | 119.9° |
| C23 | C24 | H241 | 119.4° | 120.0° |
| C28 | C23 | H231 | 120.0° | 120.0° |
| C23 | C28 | C27 | 121.0° | 120.1° |
| C23 | C28 | H281 | 119.2° | 119.9° |
| C25 | C24 | H241 | 120.7° | 120.0° |
| C24 | C25 | C26 | 119.0° | 119.9° |
| C24 | C25 | O1 | 118.5° | 120.0° |
| C26 | C25 | O1 | 122.5° | 120.1° |
| C25 | C26 | C27 | 121.6° | 119.9° |
| C25 | C26 | H261 | 119.2° | 120.1° |
| C25 | O1 | HO11 | 118.5° | 106.8° |
| C27 | C26 | H261 | 119.1° | 120.0° |
| C26 | C27 | C28 | 118.4° | 120.1° |
| C27 | C28 | H281 | 119.8° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O2 | C3 | C2 | C1 | 170.0° | 173.7° |
| O2 | C3 | C2 | C4 | 121.1° | 120.1° |
| O2 | C3 | C2 | H31 | 119.9° | 119.8° |
| O2 | C3 | C2 | H21 | 64.8° | 53.5° |
| O2 | C3 | C2 | H22 | 44.7° | 66.2° |
| O2 | C3 | C4 | H31 | 120.2° | 119.8° |
| O2 | C3 | C4 | C5 | 169.7° | 177.7° |
| O2 | C3 | C4 | H41 | 65.0° | 62.6° |
| O2 | C3 | C4 | H42 | 44.4° | 58.1° |
| HO21 | O2 | C3 | C2 | 180.0° | 179.7° |
| HO21 | O2 | C3 | C4 | 55.4° | 60.0° |
| HO21 | O2 | C3 | H31 | 64.0° | 59.9° |
| C2 | C1 | C10 | H11 | 125.3° | 119.8° |
| C2 | C1 | C10 | H12 | 125.3° | 119.6° |
| C2 | C1 | H11 | H12 | 118.1° | 120.5° |
| C1 | C2 | C3 | H21 | 125.3° | 120.1° |
| C1 | C2 | C3 | H22 | 125.3° | 120.1° |
| C1 | C2 | H21 | H22 | 116.1° | 119.9° |
| C1 | C2 | C3 | C4 | 48.8° | 66.2° |
| C1 | C2 | C3 | H31 | 70.2° | 53.9° |
| C2 | C1 | C10 | C5 | 50.7° | 46.9° |
| C2 | C1 | C10 | C19 | 126.1° | 133.4° |
| C10 | C1 | H11 | H12 | 118.2° | 120.6° |
| C10 | C1 | C2 | C3 | 49.3° | 57.8° |
| C10 | C1 | C2 | H21 | 174.5° | 178.0° |
| C10 | C1 | C2 | H22 | 76.0° | 62.2° |
| C1 | C10 | C5 | C4 | 51.6° | 43.5° |
| C1 | C10 | C5 | C6 | 126.4° | 136.8° |
| C1 | C10 | C5 | C19 | 176.8° | 179.7° |
| C1 | C10 | C19 | H191 | 180.0° | 180.0° |
| C1 | C10 | C19 | H192 | 3.4° | 0.0° |
| H11 | C1 | C2 | C3 | 174.5° | 62.1° |
| H11 | C1 | C2 | H21 | 60.2° | 58.1° |
| H11 | C1 | C2 | H22 | 49.2° | 177.9° |
| H11 | C1 | C10 | C5 | 175.9° | 72.9° |
| H11 | C1 | C10 | C19 | 0.8° | 106.8° |
| H12 | C1 | C2 | C3 | 76.0° | 177.4° |
| H12 | C1 | C2 | H21 | 49.3° | 62.5° |
| H12 | C1 | C2 | H22 | 158.7° | 57.3° |
| H12 | C1 | C10 | C5 | 74.6° | 166.5° |
| H12 | C1 | C10 | C19 | 108.7° | 13.8° |
| C3 | C2 | H21 | H22 | 116.1° | 119.7° |
| C2 | C3 | C4 | H31 | 116.0° | 120.1° |
| C2 | C3 | C4 | C5 | 45.9° | 57.7° |
| C2 | C3 | C4 | H41 | 171.1° | 177.3° |
| C2 | C3 | C4 | H42 | 79.4° | 62.0° |
| H21 | C2 | C3 | C4 | 174.1° | 173.7° |
| H21 | C2 | C3 | H31 | 55.1° | 66.2° |
| H22 | C2 | C3 | C4 | 76.4° | 53.9° |
| H22 | C2 | C3 | H31 | 164.6° | 174.0° |
| C3 | C4 | C5 | H41 | 125.3° | 119.7° |
| C3 | C4 | C5 | H42 | 125.3° | 119.7° |
| C3 | C4 | H41 | H42 | 117.1° | 120.6° |
| C3 | C4 | C5 | C6 | 130.9° | 133.4° |
| C3 | C4 | C5 | C10 | 47.2° | 46.8° |
| H31 | C3 | C4 | C5 | 70.1° | 62.4° |
| H31 | C3 | C4 | H41 | 55.2° | 57.3° |
| H31 | C3 | C4 | H42 | 164.6° | 177.9° |
| C5 | C4 | H41 | H42 | 117.2° | 120.6° |
| C4 | C5 | C6 | C10 | 177.9° | 179.7° |
| C4 | C5 | C6 | C7 | 163.0° | 180.0° |
| C4 | C5 | C6 | H61 | 17.0° | 0.0° |
| C4 | C5 | C10 | C19 | 125.2° | 136.8° |
| H41 | C4 | C5 | C6 | 5.6° | 13.7° |
| H41 | C4 | C5 | C10 | 172.5° | 166.5° |
| H42 | C4 | C5 | C6 | 103.8° | 106.9° |
| H42 | C4 | C5 | C10 | 78.1° | 72.8° |
| C5 | C6 | C7 | H61 | 180.0° | 180.0° |
| C5 | C6 | C7 | C8 | 147.7° | 180.0° |
| C5 | C6 | C7 | H71 | 32.3° | 0.1° |
| C6 | C5 | C10 | C19 | 56.8° | 42.9° |
| C10 | C5 | C6 | C7 | 14.9° | 0.3° |
| C10 | C5 | C6 | H61 | 165.1° | 179.7° |
| C5 | C10 | C19 | H191 | 3.4° | 0.3° |
| C5 | C10 | C19 | H192 | 180.0° | 179.6° |
| C6 | C7 | C8 | H71 | 180.0° | 179.9° |
| C6 | C7 | C8 | C9 | 3.1° | 0.0° |
| C6 | C7 | C8 | C14 | 175.5° | 180.0° |
| H61 | C6 | C7 | C8 | 32.3° | 0.0° |
| H61 | C6 | C7 | H71 | 147.7° | 179.9° |
| C7 | C8 | C9 | C14 | 178.7° | 180.0° |
| C7 | C8 | C9 | C11 | 127.6° | 129.8° |
| C7 | C8 | C9 | H91 | 2.3° | 109.9° |
| C7 | C8 | C9 | H92 | 107.1° | 9.5° |
| C7 | C8 | C14 | C13 | 126.1° | 122.3° |
| C7 | C8 | C14 | C15 | 2.4° | 10.4° |
| C7 | C8 | C14 | H141 | 113.5° | 117.5° |
| H71 | C7 | C8 | C9 | 177.0° | 179.9° |
| H71 | C7 | C8 | C14 | 4.5° | 0.1° |
| C8 | C9 | C11 | H91 | 125.3° | 120.4° |
| C8 | C9 | C11 | H92 | 125.3° | 120.3° |
| C8 | C9 | H91 | H92 | 116.8° | 119.4° |
| C8 | C9 | C11 | C12 | 52.6° | 48.7° |
| C8 | C9 | C11 | H111 | 72.7° | 169.2° |
| C8 | C9 | C11 | H112 | 177.9° | 72.0° |
| C9 | C8 | C14 | C13 | 52.6° | 57.8° |
| C9 | C8 | C14 | C15 | 176.3° | 169.7° |
| C9 | C8 | C14 | H141 | 67.8° | 62.5° |
| C14 | C8 | C9 | C11 | 51.1° | 50.3° |
| C14 | C8 | C9 | H91 | 176.4° | 70.1° |
| C14 | C8 | C9 | H92 | 74.1° | 170.6° |
| C8 | C14 | C13 | C12 | 52.0° | 65.6° |
| C8 | C14 | C13 | C15 | 133.0° | 122.3° |
| C8 | C14 | C13 | H141 | 107.8° | 120.1° |
| C8 | C14 | C13 | C17 | 173.6° | 167.7° |
| C8 | C14 | C13 | C18 | 65.2° | 52.3° |
| C8 | C14 | C15 | H141 | 106.9° | 127.8° |
| C8 | C14 | C15 | C16 | 163.5° | 156.8° |
| C8 | C14 | C15 | H151 | 71.2° | 84.9° |
| C8 | C14 | C15 | H152 | 38.3° | 38.5° |
| C11 | C9 | H91 | H92 | 116.8° | 119.4° |
| C9 | C11 | C12 | H111 | 125.3° | 120.6° |
| C9 | C11 | C12 | H112 | 125.3° | 120.6° |
| C9 | C11 | H111 | H112 | 117.1° | 118.9° |
| C9 | C11 | C12 | C13 | 53.3° | 58.9° |
| C9 | C11 | C12 | H121 | 178.6° | 60.4° |
| C9 | C11 | C12 | H122 | 71.9° | 178.6° |
| H91 | C9 | C11 | C12 | 177.9° | 71.7° |
| H91 | C9 | C11 | H111 | 52.6° | 48.9° |
| H91 | C9 | C11 | H112 | 56.9° | 167.7° |
| H92 | C9 | C11 | C12 | 72.7° | 169.0° |
| H92 | C9 | C11 | H111 | 162.0° | 70.5° |
| H92 | C9 | C11 | H112 | 52.6° | 48.3° |
| C10 | C19 | H191 | H192 | 176.8° | 180.0° |
| C12 | C11 | H111 | H112 | 117.1° | 118.9° |
| C11 | C12 | C13 | H121 | 125.3° | 119.6° |
| C11 | C12 | C13 | H122 | 125.3° | 119.7° |
| C11 | C12 | H121 | H122 | 116.8° | 120.9° |
| C11 | C12 | C13 | C14 | 51.2° | 67.3° |
| C11 | C12 | C13 | C17 | 157.7° | 176.0° |
| C11 | C12 | C13 | C18 | 69.8° | 49.6° |
| H111 | C11 | C12 | C13 | 71.9° | 179.5° |
| H111 | C11 | C12 | H121 | 53.3° | 60.2° |
| H111 | C11 | C12 | H122 | 162.8° | 60.9° |
| H112 | C11 | C12 | C13 | 178.6° | 61.7° |
| H112 | C11 | C12 | H121 | 56.1° | 179.0° |
| H112 | C11 | C12 | H122 | 53.4° | 58.0° |
| C13 | C12 | H121 | H122 | 116.7° | 120.5° |
| C12 | C13 | C14 | C17 | 121.6° | 126.7° |
| C12 | C13 | C14 | C18 | 117.3° | 117.9° |
| C12 | C13 | C17 | C18 | 128.0° | 126.4° |
| C12 | C13 | C14 | C15 | 175.0° | 172.1° |
| C12 | C13 | C14 | H141 | 55.8° | 54.5° |
| C12 | C13 | C17 | C16 | 168.7° | 149.3° |
| C12 | C13 | C17 | C20 | 62.9° | 91.8° |
| C12 | C13 | C17 | H171 | 43.4° | 30.4° |
| C12 | C13 | C18 | H181 | 54.7° | 59.3° |
| C12 | C13 | C18 | H182 | 180.0° | 179.3° |
| C12 | C13 | C18 | H183 | 54.7° | 60.7° |
| H121 | C12 | C13 | C14 | 176.5° | 52.4° |
| H121 | C12 | C13 | C17 | 77.1° | 64.4° |
| H121 | C12 | C13 | C18 | 55.5° | 169.3° |
| H122 | C12 | C13 | C14 | 74.1° | 173.0° |
| H122 | C12 | C13 | C17 | 32.4° | 56.3° |
| H122 | C12 | C13 | C18 | 164.9° | 70.1° |
| C14 | C13 | C17 | C18 | 117.9° | 114.4° |
| C13 | C14 | C15 | H141 | 122.7° | 117.7° |
| C13 | C14 | C15 | C16 | 33.2° | 42.3° |
| C13 | C14 | C15 | H151 | 158.5° | 160.6° |
| C13 | C14 | C15 | H152 | 92.1° | 76.1° |
| C14 | C13 | C17 | C16 | 54.5° | 30.1° |
| C14 | C13 | C17 | C20 | 177.1° | 149.1° |
| C14 | C13 | C17 | H171 | 70.8° | 88.8° |
| C14 | C13 | C18 | H181 | 63.9° | 57.6° |
| C14 | C13 | C18 | H182 | 61.4° | 62.4° |
| C14 | C13 | C18 | H183 | 173.3° | 177.6° |
| C17 | C13 | C14 | C15 | 53.4° | 45.4° |
| C17 | C13 | C14 | H141 | 65.8° | 72.2° |
| C13 | C17 | C16 | C15 | 35.2° | 3.9° |
| C13 | C17 | C16 | C20 | 134.4° | 119.0° |
| C13 | C17 | C16 | H171 | 117.4° | 118.9° |
| C13 | C17 | C16 | H161 | 160.5° | 123.1° |
| C13 | C17 | C16 | H162 | 90.0° | 115.3° |
| C13 | C17 | C20 | H171 | 113.6° | 122.1° |
| C17 | C13 | C18 | H181 | 171.9° | 169.0° |
| C17 | C13 | C18 | H182 | 46.6° | 48.9° |
| C17 | C13 | C18 | H183 | 78.6° | 71.0° |
| C13 | C17 | C20 | C21 | 49.4° | 61.4° |
| C13 | C17 | C20 | C22 | 75.1° | 178.6° |
| C13 | C17 | C20 | H201 | 167.5° | 58.5° |
| C18 | C13 | C14 | C15 | 67.7° | 70.0° |
| C18 | C13 | C14 | H141 | 173.0° | 172.4° |
| C18 | C13 | C17 | C16 | 63.4° | 84.3° |
| C18 | C13 | C17 | C20 | 65.0° | 34.7° |
| C18 | C13 | C17 | H171 | 171.4° | 156.8° |
| C13 | C18 | H181 | H182 | 121.4° | 120.0° |
| C13 | C18 | H181 | H183 | 119.3° | 120.0° |
| C13 | C18 | H182 | H183 | 125.3° | 120.0° |
| C14 | C15 | C16 | H151 | 125.2° | 118.3° |
| C14 | C15 | C16 | H152 | 125.3° | 118.3° |
| C14 | C15 | H151 | H152 | 120.3° | 123.3° |
| C14 | C15 | C16 | C17 | 1.6° | 24.2° |
| C14 | C15 | C16 | H161 | 126.9° | 95.0° |
| C14 | C15 | C16 | H162 | 123.7° | 143.3° |
| H141 | C14 | C15 | C16 | 89.5° | 75.4° |
| H141 | C14 | C15 | H151 | 35.7° | 42.9° |
| H141 | C14 | C15 | H152 | 145.2° | 166.3° |
| C16 | C15 | H151 | H152 | 120.3° | 123.4° |
| C15 | C16 | C17 | H161 | 125.3° | 119.2° |
| C15 | C16 | C17 | H162 | 125.3° | 119.2° |
| C15 | C16 | H161 | H162 | 120.0° | 121.6° |
| C15 | C16 | C17 | C20 | 169.7° | 122.9° |
| C15 | C16 | C17 | H171 | 82.2° | 115.0° |
| H151 | C15 | C16 | C17 | 123.6° | 142.5° |
| H151 | C15 | C16 | H161 | 1.6° | 23.3° |
| H151 | C15 | C16 | H162 | 111.1° | 98.3° |
| H152 | C15 | C16 | C17 | 126.9° | 94.1° |
| H152 | C15 | C16 | H161 | 107.9° | 146.7° |
| H152 | C15 | C16 | H162 | 1.6° | 25.1° |
| C17 | C16 | H161 | H162 | 120.1° | 121.6° |
| C16 | C17 | C20 | H171 | 123.4° | 122.1° |
| C16 | C17 | C20 | C21 | 73.6° | 177.2° |
| C16 | C17 | C20 | C22 | 162.0° | 62.8° |
| C16 | C17 | C20 | H201 | 44.6° | 57.3° |
| H161 | C16 | C17 | C20 | 65.1° | 117.9° |
| H161 | C16 | C17 | H171 | 43.0° | 4.2° |
| H162 | C16 | C17 | C20 | 44.4° | 3.7° |
| H162 | C16 | C17 | H171 | 152.5° | 125.8° |
| C17 | C20 | C21 | C22 | 127.9° | 120.0° |
| C17 | C20 | C21 | H201 | 113.8° | 120.0° |
| C17 | C20 | C22 | H201 | 113.7° | 120.0° |
| C17 | C20 | C21 | H211 | 54.8° | 60.0° |
| C17 | C20 | C21 | H212 | 180.0° | 60.0° |
| C17 | C20 | C21 | H213 | 54.8° | 180.0° |
| C17 | C20 | C22 | C27 | 82.2° | 180.0° |
| C17 | C20 | C22 | H221 | 152.6° | 59.9° |
| C17 | C20 | C22 | H222 | 43.1° | 60.0° |
| H171 | C17 | C20 | C21 | 163.0° | 60.7° |
| H171 | C17 | C20 | C22 | 38.6° | 59.3° |
| H171 | C17 | C20 | H201 | 78.8° | 179.3° |
| H181 | C18 | H182 | H183 | 109.4° | 120.0° |
| C21 | C20 | C22 | H201 | 118.9° | 119.9° |
| C20 | C21 | H211 | H212 | 126.8° | 119.9° |
| C20 | C21 | H211 | H213 | 116.6° | 120.1° |
| C20 | C21 | H212 | H213 | 125.3° | 120.0° |
| C21 | C20 | C22 | C27 | 150.4° | 59.9° |
| C21 | C20 | C22 | H221 | 25.1° | 180.0° |
| C21 | C20 | C22 | H222 | 84.4° | 60.0° |
| C22 | C20 | C21 | H211 | 177.3° | 60.1° |
| C22 | C20 | C21 | H212 | 52.1° | 180.0° |
| C22 | C20 | C21 | H213 | 73.2° | 60.0° |
| C20 | C22 | C27 | H221 | 125.2° | 120.0° |
| C20 | C22 | C27 | H222 | 125.3° | 120.0° |
| C20 | C22 | H221 | H222 | 117.0° | 119.9° |
| C20 | C22 | C27 | C26 | 89.1° | 90.3° |
| C20 | C22 | C27 | C28 | 90.9° | 90.0° |
| H201 | C20 | C21 | H211 | 59.0° | 179.9° |
| H201 | C20 | C21 | H212 | 66.2° | 60.0° |
| H201 | C20 | C21 | H213 | 168.6° | 60.0° |
| H201 | C20 | C22 | C27 | 31.5° | 60.0° |
| H201 | C20 | C22 | H221 | 93.7° | 60.1° |
| H201 | C20 | C22 | H222 | 156.8° | 180.0° |
| H211 | C21 | H212 | H213 | 109.5° | 120.0° |
| C27 | C22 | H221 | H222 | 116.9° | 120.0° |
| C22 | C27 | C28 | C23 | 180.0° | 179.9° |
| C22 | C27 | C26 | C25 | 179.9° | 179.8° |
| C22 | C27 | C26 | C28 | 180.0° | 179.8° |
| C22 | C27 | C26 | H261 | 0.1° | 0.2° |
| C22 | C27 | C28 | H281 | 0.0° | 0.0° |
| H221 | C22 | C27 | C26 | 36.1° | 149.7° |
| H221 | C22 | C27 | C28 | 143.9° | 30.1° |
| H222 | C22 | C27 | C26 | 145.6° | 29.7° |
| H222 | C22 | C27 | C28 | 34.4° | 150.1° |
| C24 | C23 | C28 | H231 | 180.0° | 179.9° |
| C23 | C24 | C25 | H241 | 180.0° | 180.0° |
| C23 | C24 | C25 | C26 | 0.0° | 0.2° |
| C23 | C24 | C25 | O1 | 180.0° | 180.0° |
| C24 | C23 | C28 | C27 | 0.1° | 0.1° |
| C24 | C23 | C28 | H281 | 179.9° | 180.0° |
| C28 | C23 | C24 | C25 | 0.0° | 0.1° |
| C28 | C23 | C24 | H241 | 180.0° | 179.9° |
| C23 | C28 | C27 | C26 | 0.0° | 0.2° |
| C23 | C28 | C27 | H281 | 180.0° | 179.9° |
| H231 | C23 | C24 | C25 | 180.0° | 180.0° |
| H231 | C23 | C24 | H241 | 0.0° | 0.0° |
| H231 | C23 | C28 | C27 | 180.0° | 180.0° |
| H231 | C23 | C28 | H281 | 0.1° | 0.1° |
| C24 | C25 | C26 | O1 | 180.0° | 179.7° |
| C24 | C25 | C26 | C27 | 0.0° | 0.5° |
| C24 | C25 | C26 | H261 | 180.0° | 179.9° |
| C24 | C25 | O1 | HO11 | 180.0° | 90.0° |
| H241 | C24 | C25 | C26 | 180.0° | 179.8° |
| H241 | C24 | C25 | O1 | 0.0° | 0.0° |
| C25 | C26 | C27 | H261 | 180.0° | 179.6° |
| C25 | C26 | C27 | C28 | 0.0° | 0.5° |
| C26 | C25 | O1 | HO11 | 0.0° | 89.7° |
| O1 | C25 | C26 | C27 | 180.0° | 179.8° |
| O1 | C25 | C26 | H261 | 0.0° | 0.2° |
| C26 | C27 | C28 | H281 | 180.0° | 179.7° |
| H261 | C26 | C27 | C28 | 180.0° | 180.0° |
