CHO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.53Å | |
| C1 | C10 | sing | 1.53Å | 1.55Å | |
| C1 | H11 | sing | 1.09Å | 1.10Å | |
| C1 | H12 | sing | 1.09Å | 1.10Å | |
| C2 | C3 | sing | 1.53Å | 1.53Å | |
| C2 | H21 | sing | 1.09Å | 1.10Å | |
| C2 | H22 | sing | 1.09Å | 1.10Å | |
| C3 | O3 | sing | 1.43Å | 1.44Å | |
| C3 | C4 | sing | 1.53Å | 1.53Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| O3 | HO3 | sing | 0.97Å | 0.95Å | |
| C4 | C5 | sing | 1.53Å | 1.55Å | |
| C4 | H41 | sing | 1.09Å | 1.10Å | |
| C4 | H42 | sing | 1.09Å | 1.10Å | |
| C5 | C6 | sing | 1.53Å | 1.52Å | |
| C5 | C10 | sing | 1.53Å | 1.59Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C6 | C7 | sing | 1.53Å | 1.51Å | |
| C6 | H61 | sing | 1.09Å | 1.10Å | |
| C6 | H62 | sing | 1.09Å | 1.10Å | |
| C7 | O7 | sing | 1.43Å | 1.25Å | |
| C7 | C8 | sing | 1.53Å | 1.51Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| O7 | HO7 | sing | 0.97Å | 0.95Å | |
| C8 | C9 | sing | 1.54Å | 1.55Å | |
| C8 | C14 | sing | 1.52Å | 1.54Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C9 | C10 | sing | 1.53Å | 1.60Å | |
| C9 | C11 | sing | 1.52Å | 1.52Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C10 | C19 | sing | 1.53Å | 1.53Å | |
| C11 | C12 | sing | 1.54Å | 1.54Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C11 | H112 | sing | 1.09Å | 1.10Å | |
| C12 | C13 | sing | 1.52Å | 1.52Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| C13 | C14 | sing | 1.55Å | 1.54Å | |
| C13 | C17 | sing | 1.53Å | 1.57Å | |
| C13 | C18 | sing | 1.53Å | 1.56Å | |
| C14 | C15 | sing | 1.53Å | 1.51Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C15 | C16 | sing | 1.55Å | 1.53Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C15 | H152 | sing | 1.09Å | 1.10Å | |
| C16 | C17 | sing | 1.55Å | 1.54Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C17 | C20 | sing | 1.53Å | 1.55Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | H181 | sing | 1.09Å | 1.10Å | |
| C18 | H182 | sing | 1.09Å | 1.10Å | |
| C18 | H183 | sing | 1.09Å | 1.10Å | |
| C19 | H191 | sing | 1.09Å | 1.10Å | |
| C19 | H192 | sing | 1.09Å | 1.10Å | |
| C19 | H193 | sing | 1.09Å | 1.10Å | |
| C20 | C21 | sing | 1.53Å | 1.55Å | |
| C20 | C22 | sing | 1.53Å | 1.51Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C21 | H212 | sing | 1.09Å | 1.10Å | |
| C21 | H213 | sing | 1.09Å | 1.10Å | |
| C22 | C23 | sing | 1.53Å | 1.50Å | |
| C22 | H221 | sing | 1.09Å | 1.10Å | |
| C22 | H222 | sing | 1.09Å | 1.10Å | |
| C23 | C24 | sing | 1.51Å | 1.55Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.09Å | 1.10Å | |
| C24 | O24 | doub | 1.21Å | 1.23Å | |
| C24 | N25 | sing | 1.35Å | 1.24Å | |
| N25 | C26 | sing | 1.47Å | 57.08Å | |
| N25 | HN | sing | 0.97Å | 1.00Å | |
| C26 | C27 | sing | 1.51Å | 0.00Å | |
| C26 | H261 | sing | 1.09Å | 0.00Å | |
| C26 | H262 | sing | 1.09Å | 0.00Å | |
| C27 | OT1 | doub | 1.21Å | 0.00Å | |
| C27 | OT2 | sing | 1.34Å | 0.00Å | |
| OT2 | HOT | sing | 0.97Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C10 | 114.5° | 109.5° |
| C2 | C1 | H11 | 108.2° | 109.5° |
| C2 | C1 | H12 | 108.2° | 109.5° |
| C1 | C2 | C3 | 111.7° | 109.5° |
| C1 | C2 | H21 | 108.9° | 109.5° |
| C1 | C2 | H22 | 108.9° | 109.4° |
| C10 | C1 | H11 | 108.2° | 109.5° |
| C10 | C1 | H12 | 108.2° | 109.5° |
| C1 | C10 | C5 | 108.1° | 109.3° |
| C1 | C10 | C9 | 113.1° | 109.3° |
| C1 | C10 | C19 | 104.2° | 109.5° |
| H11 | C1 | H12 | 109.5° | 109.4° |
| C3 | C2 | H21 | 109.0° | 109.5° |
| C3 | C2 | H22 | 108.9° | 109.5° |
| C2 | C3 | O3 | 112.9° | 109.5° |
| C2 | C3 | C4 | 110.6° | 109.5° |
| C2 | C3 | H3 | 107.3° | 109.5° |
| H21 | C2 | H22 | 109.4° | 109.5° |
| O3 | C3 | C4 | 110.1° | 109.4° |
| O3 | C3 | H3 | 108.4° | 109.5° |
| C3 | O3 | HO3 | 109.5° | 113.9° |
| C4 | C3 | H3 | 107.3° | 109.5° |
| C3 | C4 | C5 | 113.6° | 109.5° |
| C3 | C4 | H41 | 108.4° | 109.5° |
| C3 | C4 | H42 | 108.4° | 109.5° |
| C5 | C4 | H41 | 108.4° | 109.5° |
| C5 | C4 | H42 | 108.4° | 109.4° |
| C4 | C5 | C6 | 109.1° | 109.4° |
| C4 | C5 | C10 | 114.1° | 109.4° |
| C4 | C5 | H5 | 107.2° | 109.5° |
| H41 | C4 | H42 | 109.5° | 109.4° |
| C6 | C5 | C10 | 111.7° | 109.4° |
| C6 | C5 | H5 | 107.6° | 109.5° |
| C5 | C6 | C7 | 112.5° | 109.5° |
| C5 | C6 | H61 | 108.7° | 109.4° |
| C5 | C6 | H62 | 108.7° | 109.5° |
| C10 | C5 | H5 | 106.8° | 109.6° |
| C5 | C10 | C9 | 109.7° | 109.3° |
| C5 | C10 | C19 | 112.2° | 109.6° |
| C7 | C6 | H61 | 108.7° | 109.5° |
| C7 | C6 | H62 | 108.7° | 109.5° |
| C6 | C7 | O7 | 124.0° | 109.5° |
| C6 | C7 | C8 | 111.6° | 109.5° |
| C6 | C7 | H7 | 91.5° | 109.4° |
| H61 | C6 | H62 | 109.5° | 109.5° |
| O7 | C7 | C8 | 124.1° | 109.5° |
| O7 | C7 | H7 | 91.8° | 109.5° |
| C7 | O7 | HO7 | 109.5° | 114.1° |
| C8 | C7 | H7 | 91.5° | 109.5° |
| C7 | C8 | C9 | 107.5° | 109.2° |
| C7 | C8 | C14 | 112.7° | 110.4° |
| C7 | C8 | H8 | 109.1° | 109.8° |
| C9 | C8 | C14 | 110.3° | 107.2° |
| C9 | C8 | H8 | 108.6° | 109.7° |
| C8 | C9 | C10 | 111.3° | 109.2° |
| C8 | C9 | C11 | 111.0° | 111.5° |
| C8 | C9 | H9 | 106.6° | 108.8° |
| C14 | C8 | H8 | 108.7° | 110.6° |
| C8 | C14 | C13 | 115.3° | 107.0° |
| C8 | C14 | C15 | 119.1° | 115.8° |
| C8 | C14 | H14 | 106.0° | 110.3° |
| C10 | C9 | C11 | 114.3° | 110.1° |
| C10 | C9 | H9 | 106.1° | 108.9° |
| C9 | C10 | C19 | 109.4° | 109.7° |
| C11 | C9 | H9 | 107.0° | 108.3° |
| C9 | C11 | C12 | 114.8° | 111.4° |
| C9 | C11 | H111 | 108.1° | 109.1° |
| C9 | C11 | H112 | 108.1° | 109.1° |
| C10 | C19 | H191 | 109.5° | 109.5° |
| C10 | C19 | H192 | 109.5° | 109.4° |
| C10 | C19 | H193 | 109.5° | 109.5° |
| C12 | C11 | H111 | 108.1° | 109.1° |
| C12 | C11 | H112 | 108.1° | 109.1° |
| C11 | C12 | C13 | 112.7° | 107.3° |
| C11 | C12 | H121 | 108.7° | 109.9° |
| C11 | C12 | H122 | 108.7° | 109.9° |
| H111 | C11 | H112 | 109.5° | 109.0° |
| C13 | C12 | H121 | 108.7° | 109.9° |
| C13 | C12 | H122 | 108.6° | 109.9° |
| C12 | C13 | C14 | 105.9° | 107.4° |
| C12 | C13 | C17 | 115.6° | 116.5° |
| C12 | C13 | C18 | 112.0° | 109.8° |
| H121 | C12 | H122 | 109.5° | 109.9° |
| C14 | C13 | C17 | 99.3° | 103.2° |
| C14 | C13 | C18 | 113.1° | 109.8° |
| C13 | C14 | C15 | 102.9° | 101.7° |
| C13 | C14 | H14 | 106.1° | 110.5° |
| C17 | C13 | C18 | 110.2° | 109.8° |
| C13 | C17 | C16 | 103.8° | 105.3° |
| C13 | C17 | C20 | 121.1° | 110.3° |
| C13 | C17 | H17 | 106.2° | 110.3° |
| C13 | C18 | H181 | 109.5° | 109.5° |
| C13 | C18 | H182 | 109.5° | 109.5° |
| C13 | C18 | H183 | 109.5° | 109.5° |
| C15 | C14 | H14 | 106.4° | 111.0° |
| C14 | C15 | C16 | 101.2° | 102.9° |
| C14 | C15 | H151 | 111.5° | 110.8° |
| C14 | C15 | H152 | 111.5° | 110.8° |
| C16 | C15 | H151 | 111.5° | 110.7° |
| C16 | C15 | H152 | 111.5° | 110.7° |
| C15 | C16 | C17 | 107.6° | 106.4° |
| C15 | C16 | H161 | 109.9° | 110.1° |
| C15 | C16 | H162 | 109.9° | 110.1° |
| H151 | C15 | H152 | 109.5° | 110.8° |
| C17 | C16 | H161 | 110.0° | 110.1° |
| C17 | C16 | H162 | 109.9° | 110.1° |
| C16 | C17 | C20 | 112.0° | 110.3° |
| C16 | C17 | H17 | 106.5° | 110.2° |
| H161 | C16 | H162 | 109.5° | 110.1° |
| C20 | C17 | H17 | 106.3° | 110.3° |
| C17 | C20 | C21 | 113.3° | 109.5° |
| C17 | C20 | C22 | 108.7° | 109.5° |
| C17 | C20 | H20 | 107.8° | 109.5° |
| H181 | C18 | H182 | 109.5° | 109.5° |
| H181 | C18 | H183 | 109.5° | 109.5° |
| H182 | C18 | H183 | 109.4° | 109.4° |
| H191 | C19 | H192 | 109.5° | 109.5° |
| H191 | C19 | H193 | 109.5° | 109.4° |
| H192 | C19 | H193 | 109.4° | 109.4° |
| C21 | C20 | C22 | 110.7° | 109.5° |
| C21 | C20 | H20 | 107.9° | 109.5° |
| C20 | C21 | H211 | 109.5° | 109.5° |
| C20 | C21 | H212 | 109.5° | 109.5° |
| C20 | C21 | H213 | 109.5° | 109.5° |
| C22 | C20 | H20 | 108.3° | 109.5° |
| C20 | C22 | C23 | 114.2° | 109.5° |
| C20 | C22 | H221 | 108.3° | 109.5° |
| C20 | C22 | H222 | 108.3° | 109.4° |
| H211 | C21 | H212 | 109.5° | 109.5° |
| H211 | C21 | H213 | 109.5° | 109.4° |
| H212 | C21 | H213 | 109.5° | 109.4° |
| C23 | C22 | H221 | 108.3° | 109.5° |
| C23 | C22 | H222 | 108.3° | 109.5° |
| C22 | C23 | C24 | 112.6° | 109.5° |
| C22 | C23 | H231 | 108.7° | 109.5° |
| C22 | C23 | H232 | 108.7° | 109.5° |
| H221 | C22 | H222 | 109.5° | 109.5° |
| C24 | C23 | H231 | 108.7° | 109.5° |
| C24 | C23 | H232 | 108.7° | 109.4° |
| C23 | C24 | O24 | 119.1° | 119.9° |
| C23 | C24 | N25 | 118.5° | 120.0° |
| H231 | C23 | H232 | 109.5° | 109.4° |
| O24 | C24 | N25 | 122.4° | 120.0° |
| C24 | N25 | C26 | 48.1° | 120.0° |
| C24 | N25 | HN | 155.9° | 120.0° |
| C26 | N25 | HN | 155.9° | 120.0° |
| N25 | C26 | C27 | 90.0° | 109.5° |
| N25 | C26 | H261 | 90.0° | 109.5° |
| N25 | C26 | H262 | 90.0° | 109.5° |
| C27 | C26 | H261 | 90.0° | 109.5° |
| C27 | C26 | H262 | 90.0° | 109.5° |
| C26 | C27 | OT1 | 90.0° | 120.0° |
| C26 | C27 | OT2 | 90.0° | 120.0° |
| H261 | C26 | H262 | 90.0° | 109.5° |
| OT1 | C27 | OT2 | 90.0° | 120.0° |
| C27 | OT2 | HOT | 90.0° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C10 | H11 | 120.7° | 120.0° |
| C2 | C1 | C10 | H12 | 120.8° | 120.0° |
| C2 | C1 | H11 | H12 | 117.8° | 119.9° |
| C1 | C2 | C3 | H21 | 120.3° | 120.0° |
| C1 | C2 | C3 | H22 | 120.3° | 120.0° |
| C1 | C2 | H21 | H22 | 119.0° | 120.0° |
| C1 | C2 | C3 | O3 | 179.1° | 179.8° |
| C1 | C2 | C3 | C4 | 55.2° | 59.9° |
| C1 | C2 | C3 | H3 | 61.5° | 60.1° |
| C2 | C1 | C10 | C5 | 52.4° | 60.3° |
| C2 | C1 | C10 | C9 | 69.3° | 59.4° |
| C2 | C1 | C10 | C19 | 172.0° | 179.7° |
| C10 | C1 | H11 | H12 | 117.7° | 120.0° |
| C10 | C1 | C2 | C3 | 57.8° | 60.1° |
| C10 | C1 | C2 | H21 | 178.2° | 179.9° |
| C10 | C1 | C2 | H22 | 62.5° | 59.9° |
| C1 | C10 | C5 | C4 | 48.3° | 60.2° |
| C1 | C10 | C5 | C6 | 172.7° | 180.0° |
| C1 | C10 | C5 | C9 | 123.8° | 119.7° |
| C1 | C10 | C5 | C19 | 114.3° | 120.1° |
| C1 | C10 | C5 | H5 | 70.0° | 59.9° |
| C1 | C10 | C9 | C8 | 174.3° | 179.7° |
| C1 | C10 | C9 | C19 | 115.7° | 120.2° |
| C1 | C10 | C9 | C11 | 59.0° | 57.0° |
| C1 | C10 | C9 | H9 | 58.7° | 61.5° |
| C1 | C10 | C19 | H191 | 180.0° | 60.0° |
| C1 | C10 | C19 | H192 | 60.0° | 179.9° |
| C1 | C10 | C19 | H193 | 60.0° | 60.0° |
| H11 | C1 | C2 | C3 | 178.6° | 179.8° |
| H11 | C1 | C2 | H21 | 61.1° | 59.8° |
| H11 | C1 | C2 | H22 | 58.2° | 60.2° |
| H11 | C1 | C10 | C5 | 173.1° | 179.7° |
| H11 | C1 | C10 | C9 | 51.4° | 60.7° |
| H11 | C1 | C10 | C19 | 67.3° | 59.6° |
| H12 | C1 | C2 | C3 | 62.9° | 59.9° |
| H12 | C1 | C2 | H21 | 57.5° | 60.1° |
| H12 | C1 | C2 | H22 | 176.8° | 179.9° |
| H12 | C1 | C10 | C5 | 68.3° | 59.7° |
| H12 | C1 | C10 | C9 | 169.9° | 179.4° |
| H12 | C1 | C10 | C19 | 51.2° | 60.3° |
| C3 | C2 | H21 | H22 | 119.0° | 120.0° |
| C2 | C3 | O3 | C4 | 124.1° | 120.0° |
| C2 | C3 | O3 | H3 | 118.7° | 120.0° |
| C2 | C3 | C4 | H3 | 116.7° | 120.0° |
| C2 | C3 | O3 | HO3 | 180.0° | 60.1° |
| C2 | C3 | C4 | C5 | 52.5° | 59.9° |
| C2 | C3 | C4 | H41 | 173.1° | 179.9° |
| C2 | C3 | C4 | H42 | 68.1° | 60.1° |
| H21 | C2 | C3 | O3 | 60.6° | 60.2° |
| H21 | C2 | C3 | C4 | 175.6° | 179.9° |
| H21 | C2 | C3 | H3 | 58.8° | 59.9° |
| H22 | C2 | C3 | O3 | 58.7° | 59.9° |
| H22 | C2 | C3 | C4 | 65.1° | 60.1° |
| H22 | C2 | C3 | H3 | 178.1° | 179.9° |
| O3 | C3 | C4 | H3 | 117.8° | 120.0° |
| O3 | C3 | C4 | C5 | 177.9° | 179.9° |
| O3 | C3 | C4 | H41 | 61.5° | 60.1° |
| O3 | C3 | C4 | H42 | 57.3° | 59.9° |
| C4 | C3 | O3 | HO3 | 55.8° | 180.0° |
| C3 | C4 | C5 | H41 | 120.6° | 120.0° |
| C3 | C4 | C5 | H42 | 120.6° | 120.0° |
| C3 | C4 | H41 | H42 | 118.1° | 120.0° |
| C3 | C4 | C5 | C6 | 176.4° | 179.9° |
| C3 | C4 | C5 | C10 | 50.7° | 60.1° |
| C3 | C4 | C5 | H5 | 67.3° | 60.1° |
| H3 | C3 | O3 | HO3 | 61.3° | 60.0° |
| H3 | C3 | C4 | C5 | 64.3° | 60.1° |
| H3 | C3 | C4 | H41 | 56.3° | 59.9° |
| H3 | C3 | C4 | H42 | 175.1° | 179.9° |
| C5 | C4 | H41 | H42 | 118.1° | 119.9° |
| C4 | C5 | C6 | C10 | 127.1° | 119.8° |
| C4 | C5 | C6 | H5 | 116.0° | 120.0° |
| C4 | C5 | C10 | H5 | 118.3° | 120.1° |
| C4 | C5 | C6 | C7 | 74.3° | 59.8° |
| C4 | C5 | C6 | H61 | 165.2° | 179.7° |
| C4 | C5 | C6 | H62 | 46.2° | 60.3° |
| C4 | C5 | C10 | C9 | 75.5° | 59.4° |
| C4 | C5 | C10 | C19 | 162.7° | 179.7° |
| H41 | C4 | C5 | C6 | 63.0° | 60.0° |
| H41 | C4 | C5 | C10 | 171.3° | 179.9° |
| H41 | C4 | C5 | H5 | 53.3° | 60.0° |
| H42 | C4 | C5 | C6 | 55.8° | 59.9° |
| H42 | C4 | C5 | C10 | 69.9° | 59.9° |
| H42 | C4 | C5 | H5 | 172.1° | 179.9° |
| C6 | C5 | C10 | H5 | 117.3° | 120.1° |
| C5 | C6 | C7 | H61 | 120.5° | 119.9° |
| C5 | C6 | C7 | H62 | 120.5° | 120.1° |
| C5 | C6 | H61 | H62 | 118.6° | 120.0° |
| C5 | C6 | C7 | O7 | 113.9° | 59.9° |
| C5 | C6 | C7 | C8 | 60.8° | 60.1° |
| C5 | C6 | C7 | H7 | 153.0° | 179.9° |
| C6 | C5 | C10 | C9 | 48.9° | 60.4° |
| C6 | C5 | C10 | C19 | 73.0° | 59.9° |
| C10 | C5 | C6 | C7 | 52.8° | 60.0° |
| C10 | C5 | C6 | H61 | 67.6° | 59.9° |
| C10 | C5 | C6 | H62 | 173.3° | 179.9° |
| C5 | C10 | C9 | C8 | 53.5° | 60.6° |
| C5 | C10 | C9 | C19 | 123.5° | 120.2° |
| C5 | C10 | C9 | C11 | 179.8° | 176.6° |
| C5 | C10 | C9 | H9 | 62.1° | 58.1° |
| C5 | C10 | C19 | H191 | 63.3° | 59.9° |
| C5 | C10 | C19 | H192 | 176.7° | 60.1° |
| C5 | C10 | C19 | H193 | 56.7° | 179.9° |
| H5 | C5 | C6 | C7 | 169.7° | 179.8° |
| H5 | C5 | C6 | H61 | 49.2° | 60.2° |
| H5 | C5 | C6 | H62 | 69.8° | 59.8° |
| H5 | C5 | C10 | C9 | 166.2° | 179.5° |
| H5 | C5 | C10 | C19 | 44.4° | 60.2° |
| C7 | C6 | H61 | H62 | 118.6° | 120.0° |
| C6 | C7 | O7 | C8 | 174.1° | 120.0° |
| C6 | C7 | O7 | H7 | 93.0° | 119.9° |
| C6 | C7 | C8 | H7 | 92.2° | 119.9° |
| C6 | C7 | O7 | HO7 | 180.0° | 60.0° |
| C6 | C7 | C8 | C9 | 62.9° | 60.2° |
| C6 | C7 | C8 | C14 | 175.4° | 177.8° |
| C6 | C7 | C8 | H8 | 54.6° | 60.0° |
| H61 | C6 | C7 | O7 | 125.7° | 179.9° |
| H61 | C6 | C7 | C8 | 59.6° | 59.8° |
| H61 | C6 | C7 | H7 | 32.5° | 60.1° |
| H62 | C6 | C7 | O7 | 6.6° | 60.1° |
| H62 | C6 | C7 | C8 | 178.7° | 179.8° |
| H62 | C6 | C7 | H7 | 86.6° | 59.9° |
| O7 | C7 | C8 | H7 | 93.1° | 120.1° |
| O7 | C7 | C8 | C9 | 111.8° | 59.8° |
| O7 | C7 | C8 | C14 | 9.9° | 57.8° |
| O7 | C7 | C8 | H8 | 130.7° | 179.9° |
| C8 | C7 | O7 | HO7 | 5.9° | 180.0° |
| C7 | C8 | C9 | C14 | 123.2° | 119.5° |
| C7 | C8 | C9 | H8 | 117.9° | 120.3° |
| C7 | C8 | C14 | H8 | 121.0° | 121.7° |
| C7 | C8 | C9 | C10 | 59.9° | 60.6° |
| C7 | C8 | C9 | C11 | 171.6° | 177.6° |
| C7 | C8 | C9 | H9 | 55.4° | 58.2° |
| C7 | C8 | C14 | C13 | 176.7° | 176.7° |
| C7 | C8 | C14 | C15 | 60.2° | 64.1° |
| C7 | C8 | C14 | H14 | 59.6° | 63.1° |
| H7 | C7 | O7 | HO7 | 87.0° | 60.0° |
| H7 | C7 | C8 | C9 | 155.1° | 179.8° |
| H7 | C7 | C8 | C14 | 83.2° | 62.3° |
| H7 | C7 | C8 | H8 | 37.5° | 59.9° |
| C9 | C8 | C14 | H8 | 118.9° | 119.6° |
| C8 | C9 | C10 | C11 | 126.7° | 122.8° |
| C8 | C9 | C10 | H9 | 115.6° | 118.7° |
| C8 | C9 | C11 | H9 | 115.9° | 119.7° |
| C8 | C9 | C10 | C19 | 70.0° | 59.6° |
| C8 | C9 | C11 | C12 | 49.3° | 54.9° |
| C8 | C9 | C11 | H111 | 170.1° | 175.4° |
| C8 | C9 | C11 | H112 | 71.4° | 65.6° |
| C9 | C8 | C14 | C13 | 56.6° | 64.6° |
| C9 | C8 | C14 | C15 | 179.7° | 177.1° |
| C9 | C8 | C14 | H14 | 60.5° | 55.7° |
| C14 | C8 | C9 | C10 | 177.0° | 179.9° |
| C14 | C8 | C9 | C11 | 48.5° | 58.0° |
| C14 | C8 | C9 | H9 | 67.7° | 61.4° |
| C8 | C14 | C13 | C12 | 59.0° | 70.0° |
| C8 | C14 | C13 | C15 | 131.3° | 121.9° |
| C8 | C14 | C13 | H14 | 117.0° | 120.2° |
| C8 | C14 | C13 | C17 | 179.1° | 166.3° |
| C8 | C14 | C13 | C18 | 64.0° | 49.3° |
| C8 | C14 | C15 | H14 | 119.6° | 126.8° |
| C8 | C14 | C15 | C16 | 174.7° | 157.2° |
| C8 | C14 | C15 | H151 | 56.0° | 38.9° |
| C8 | C14 | C15 | H152 | 66.7° | 84.4° |
| H8 | C8 | C9 | C10 | 58.0° | 59.8° |
| H8 | C8 | C9 | C11 | 70.5° | 62.1° |
| H8 | C8 | C9 | H9 | 173.3° | 178.5° |
| H8 | C8 | C14 | C13 | 62.3° | 55.0° |
| H8 | C8 | C14 | C15 | 60.8° | 57.6° |
| H8 | C8 | C14 | H14 | 179.4° | 175.2° |
| C10 | C9 | C11 | H9 | 117.2° | 118.9° |
| C10 | C9 | C11 | C12 | 176.2° | 176.3° |
| C10 | C9 | C11 | H111 | 63.1° | 63.2° |
| C10 | C9 | C11 | H112 | 55.4° | 55.9° |
| C9 | C10 | C19 | H191 | 58.8° | 179.9° |
| C9 | C10 | C19 | H192 | 61.3° | 59.9° |
| C9 | C10 | C19 | H193 | 178.8° | 60.1° |
| C11 | C9 | C10 | C19 | 56.7° | 63.2° |
| C9 | C11 | C12 | H111 | 120.8° | 120.5° |
| C9 | C11 | C12 | H112 | 120.8° | 120.5° |
| C9 | C11 | H111 | H112 | 117.6° | 119.1° |
| C9 | C11 | C12 | C13 | 55.0° | 57.4° |
| C9 | C11 | C12 | H121 | 65.5° | 62.1° |
| C9 | C11 | C12 | H122 | 175.5° | 176.9° |
| H9 | C9 | C10 | C19 | 174.4° | 178.3° |
| H9 | C9 | C11 | C12 | 66.6° | 64.8° |
| H9 | C9 | C11 | H111 | 54.2° | 55.7° |
| H9 | C9 | C11 | H112 | 172.6° | 174.7° |
| C10 | C19 | H191 | H192 | 120.0° | 120.0° |
| C10 | C19 | H191 | H193 | 120.0° | 120.0° |
| C10 | C19 | H192 | H193 | 120.0° | 120.0° |
| C12 | C11 | H111 | H112 | 117.5° | 119.0° |
| C11 | C12 | C13 | H121 | 120.5° | 119.4° |
| C11 | C12 | C13 | H122 | 120.5° | 119.5° |
| C11 | C12 | H121 | H122 | 118.5° | 121.1° |
| C11 | C12 | C13 | C14 | 55.8° | 64.4° |
| C11 | C12 | C13 | C17 | 164.6° | 179.5° |
| C11 | C12 | C13 | C18 | 68.0° | 54.9° |
| H111 | C11 | C12 | C13 | 175.8° | 178.0° |
| H111 | C11 | C12 | H121 | 55.3° | 58.5° |
| H111 | C11 | C12 | H122 | 63.7° | 62.6° |
| H112 | C11 | C12 | C13 | 65.7° | 63.1° |
| H112 | C11 | C12 | H121 | 173.8° | 177.4° |
| H112 | C11 | C12 | H122 | 54.7° | 56.4° |
| C13 | C12 | H121 | H122 | 118.5° | 121.1° |
| C12 | C13 | C14 | C17 | 120.1° | 123.7° |
| C12 | C13 | C14 | C18 | 123.1° | 119.3° |
| C12 | C13 | C17 | C18 | 128.2° | 125.5° |
| C12 | C13 | C14 | C15 | 169.6° | 168.1° |
| C12 | C13 | C14 | H14 | 58.0° | 50.2° |
| C12 | C13 | C17 | C16 | 146.1° | 146.7° |
| C12 | C13 | C17 | C20 | 87.1° | 94.3° |
| C12 | C13 | C17 | H17 | 34.0° | 27.8° |
| C12 | C13 | C18 | H181 | 180.0° | 57.9° |
| C12 | C13 | C18 | H182 | 60.0° | 177.9° |
| C12 | C13 | C18 | H183 | 60.0° | 62.2° |
| H121 | C12 | C13 | C14 | 64.7° | 55.1° |
| H121 | C12 | C13 | C17 | 44.2° | 60.1° |
| H121 | C12 | C13 | C18 | 171.5° | 174.4° |
| H122 | C12 | C13 | C14 | 176.3° | 176.1° |
| H122 | C12 | C13 | C17 | 74.9° | 61.0° |
| H122 | C12 | C13 | C18 | 52.5° | 64.6° |
| C14 | C13 | C17 | C18 | 119.0° | 117.0° |
| C13 | C14 | C15 | H14 | 111.4° | 117.6° |
| C13 | C14 | C15 | C16 | 45.7° | 41.6° |
| C13 | C14 | C15 | H151 | 73.0° | 76.7° |
| C13 | C14 | C15 | H152 | 164.3° | 160.0° |
| C14 | C13 | C17 | C16 | 33.3° | 29.2° |
| C14 | C13 | C17 | C20 | 160.1° | 148.2° |
| C14 | C13 | C17 | H17 | 78.7° | 89.7° |
| C14 | C13 | C18 | H181 | 60.4° | 60.0° |
| C14 | C13 | C18 | H182 | 179.6° | 60.0° |
| C14 | C13 | C18 | H183 | 59.6° | 180.0° |
| C17 | C13 | C14 | C15 | 49.5° | 44.4° |
| C17 | C13 | C14 | H14 | 62.1° | 73.5° |
| C13 | C17 | C16 | C15 | 6.5° | 3.4° |
| C13 | C17 | C16 | C20 | 132.3° | 119.0° |
| C13 | C17 | C16 | H17 | 111.8° | 119.0° |
| C13 | C17 | C16 | H161 | 113.2° | 115.8° |
| C13 | C17 | C16 | H162 | 126.2° | 122.7° |
| C13 | C17 | C20 | H17 | 121.0° | 122.1° |
| C17 | C13 | C18 | H181 | 49.8° | 172.8° |
| C17 | C13 | C18 | H182 | 70.2° | 52.8° |
| C17 | C13 | C18 | H183 | 169.8° | 67.1° |
| C13 | C17 | C20 | C21 | 57.2° | 65.8° |
| C13 | C17 | C20 | C22 | 179.3° | 174.2° |
| C13 | C17 | C20 | H20 | 62.1° | 54.2° |
| C18 | C13 | C14 | C15 | 67.3° | 72.6° |
| C18 | C13 | C14 | H14 | 179.0° | 169.5° |
| C18 | C13 | C17 | C16 | 85.7° | 87.8° |
| C18 | C13 | C17 | C20 | 41.1° | 31.2° |
| C18 | C13 | C17 | H17 | 162.2° | 153.3° |
| C13 | C18 | H181 | H182 | 120.0° | 120.0° |
| C13 | C18 | H181 | H183 | 120.0° | 120.0° |
| C13 | C18 | H182 | H183 | 120.0° | 120.0° |
| C14 | C15 | C16 | H151 | 118.7° | 118.4° |
| C14 | C15 | C16 | H152 | 118.6° | 118.4° |
| C14 | C15 | H151 | H152 | 123.8° | 123.3° |
| C14 | C15 | C16 | C17 | 23.6° | 24.0° |
| C14 | C15 | C16 | H161 | 143.3° | 143.2° |
| C14 | C15 | C16 | H162 | 96.1° | 95.3° |
| H14 | C14 | C15 | C16 | 65.7° | 76.0° |
| H14 | C14 | C15 | H151 | 175.6° | 165.7° |
| H14 | C14 | C15 | H152 | 53.0° | 42.4° |
| C16 | C15 | H151 | H152 | 123.8° | 123.2° |
| C15 | C16 | C17 | H161 | 119.7° | 119.3° |
| C15 | C16 | C17 | H162 | 119.7° | 119.2° |
| C15 | C16 | H161 | H162 | 120.9° | 121.5° |
| C15 | C16 | C17 | C20 | 138.9° | 122.4° |
| C15 | C16 | C17 | H17 | 105.3° | 115.5° |
| H151 | C15 | C16 | C17 | 95.1° | 94.4° |
| H151 | C15 | C16 | H161 | 24.6° | 24.8° |
| H151 | C15 | C16 | H162 | 145.2° | 146.4° |
| H152 | C15 | C16 | C17 | 142.2° | 142.4° |
| H152 | C15 | C16 | H161 | 98.1° | 98.4° |
| H152 | C15 | C16 | H162 | 22.5° | 23.1° |
| C17 | C16 | H161 | H162 | 120.9° | 121.5° |
| C16 | C17 | C20 | H17 | 115.9° | 122.0° |
| C16 | C17 | C20 | C21 | 179.7° | 178.3° |
| C16 | C17 | C20 | C22 | 56.2° | 58.2° |
| C16 | C17 | C20 | H20 | 61.0° | 61.7° |
| H161 | C16 | C17 | C20 | 19.2° | 3.2° |
| H161 | C16 | C17 | H17 | 135.0° | 125.2° |
| H162 | C16 | C17 | C20 | 101.4° | 118.3° |
| H162 | C16 | C17 | H17 | 14.4° | 3.7° |
| C17 | C20 | C21 | C22 | 122.4° | 120.0° |
| C17 | C20 | C21 | H20 | 119.2° | 120.0° |
| C17 | C20 | C22 | H20 | 116.9° | 120.0° |
| C17 | C20 | C21 | H211 | 180.0° | 56.2° |
| C17 | C20 | C21 | H212 | 60.0° | 63.9° |
| C17 | C20 | C21 | H213 | 60.0° | 176.1° |
| C17 | C20 | C22 | C23 | 172.6° | 175.0° |
| C17 | C20 | C22 | H221 | 51.9° | 55.0° |
| C17 | C20 | C22 | H222 | 66.7° | 65.1° |
| H17 | C17 | C20 | C21 | 63.8° | 56.2° |
| H17 | C17 | C20 | C22 | 59.7° | 63.8° |
| H17 | C17 | C20 | H20 | 176.9° | 176.2° |
| H181 | C18 | H182 | H183 | 120.0° | 120.0° |
| H191 | C19 | H192 | H193 | 120.0° | 120.0° |
| C21 | C20 | C22 | H20 | 118.1° | 120.0° |
| C20 | C21 | H211 | H212 | 120.0° | 120.1° |
| C20 | C21 | H211 | H213 | 120.0° | 120.0° |
| C20 | C21 | H212 | H213 | 120.0° | 120.0° |
| C21 | C20 | C22 | C23 | 62.3° | 65.0° |
| C21 | C20 | C22 | H221 | 177.0° | 175.0° |
| C21 | C20 | C22 | H222 | 58.4° | 55.0° |
| C22 | C20 | C21 | H211 | 57.6° | 63.8° |
| C22 | C20 | C21 | H212 | 62.4° | 176.1° |
| C22 | C20 | C21 | H213 | 177.6° | 56.1° |
| C20 | C22 | C23 | H221 | 120.7° | 120.0° |
| C20 | C22 | C23 | H222 | 120.7° | 120.0° |
| C20 | C22 | H221 | H222 | 117.8° | 120.0° |
| C20 | C22 | C23 | C24 | 172.8° | 180.0° |
| C20 | C22 | C23 | H231 | 52.4° | 60.0° |
| C20 | C22 | C23 | H232 | 66.7° | 60.0° |
| H20 | C20 | C21 | H211 | 60.8° | 176.2° |
| H20 | C20 | C21 | H212 | 179.2° | 56.1° |
| H20 | C20 | C21 | H213 | 59.2° | 63.9° |
| H20 | C20 | C22 | C23 | 55.8° | 55.0° |
| H20 | C20 | C22 | H221 | 64.9° | 65.0° |
| H20 | C20 | C22 | H222 | 176.5° | 175.0° |
| H211 | C21 | H212 | H213 | 120.0° | 120.0° |
| C23 | C22 | H221 | H222 | 117.9° | 120.0° |
| C22 | C23 | C24 | H231 | 120.5° | 120.1° |
| C22 | C23 | C24 | H232 | 120.5° | 120.0° |
| C22 | C23 | H231 | H232 | 118.6° | 120.0° |
| C22 | C23 | C24 | O24 | 43.0° | 0.0° |
| C22 | C23 | C24 | N25 | 137.0° | 180.0° |
| H221 | C22 | C23 | C24 | 66.5° | 60.0° |
| H221 | C22 | C23 | H231 | 173.1° | 179.9° |
| H221 | C22 | C23 | H232 | 54.0° | 60.0° |
| H222 | C22 | C23 | C24 | 52.1° | 60.0° |
| H222 | C22 | C23 | H231 | 68.3° | 60.0° |
| H222 | C22 | C23 | H232 | 172.6° | 180.0° |
| C24 | C23 | H231 | H232 | 118.6° | 119.9° |
| C23 | C24 | O24 | N25 | 179.9° | 180.0° |
| C23 | C24 | N25 | C26 | 148.7° | 180.0° |
| C23 | C24 | N25 | HN | 31.2° | 0.0° |
| H231 | C23 | C24 | O24 | 163.4° | 120.1° |
| H231 | C23 | C24 | N25 | 16.5° | 60.0° |
| H232 | C23 | C24 | O24 | 77.5° | 120.0° |
| H232 | C23 | C24 | N25 | 102.6° | 60.0° |
| O24 | C24 | N25 | C26 | 31.2° | 0.1° |
| O24 | C24 | N25 | HN | 148.9° | 180.0° |
| C24 | N25 | C26 | HN | 180.0° | 179.9° |
| C24 | N25 | C26 | C27 | 90.0° | 180.0° |
| C24 | N25 | C26 | H261 | 90.0° | 60.0° |
| C24 | N25 | C26 | H262 | 90.0° | 60.0° |
| N25 | C26 | C27 | H261 | 90.0° | 120.0° |
| N25 | C26 | C27 | H262 | 90.0° | 120.0° |
| N25 | C26 | H261 | H262 | 90.0° | 120.0° |
| N25 | C26 | C27 | OT1 | 90.0° | 0.0° |
| N25 | C26 | C27 | OT2 | 90.0° | 180.0° |
| HN | N25 | C26 | C27 | 90.0° | 0.0° |
| HN | N25 | C26 | H261 | 90.0° | 120.0° |
| HN | N25 | C26 | H262 | 90.0° | 120.0° |
| C27 | C26 | H261 | H262 | 90.0° | 120.0° |
| C26 | C27 | OT1 | OT2 | 90.0° | 180.0° |
| C26 | C27 | OT2 | HOT | 90.0° | 180.0° |
| H261 | C26 | C27 | OT1 | 90.0° | 120.0° |
| H261 | C26 | C27 | OT2 | 90.0° | 60.0° |
| H262 | C26 | C27 | OT1 | 90.0° | 120.0° |
| H262 | C26 | C27 | OT2 | 90.0° | 60.0° |
| OT1 | C27 | OT2 | HOT | 90.0° | 0.0° |
