P21
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CL15 | C11 | sing | 1.74Å | 1.77Å | |
| C11 | C14 | sing | 1.38Å | 1.39Å | Aromatic |
| C11 | C13 | doub | 1.39Å | 1.38Å | Aromatic |
| C14 | C9 | doub | 1.38Å | 1.38Å | Aromatic |
| C9 | C5 | sing | 1.40Å | 1.39Å | Aromatic |
| C13 | C8 | sing | 1.38Å | 1.38Å | Aromatic |
| C8 | C5 | doub | 1.40Å | 1.38Å | Aromatic |
| C5 | C1 | sing | 1.48Å | 1.48Å | |
| C1 | O7 | doub | 1.22Å | 1.22Å | |
| C1 | N2 | sing | 1.35Å | 1.33Å | |
| N2 | C12 | sing | 1.46Å | 1.48Å | |
| N2 | C3 | sing | 1.47Å | 1.48Å | |
| C12 | C19 | sing | 1.53Å | 1.53Å | |
| C19 | C23 | sing | 1.53Å | 1.53Å | |
| C3 | C6 | sing | 1.53Å | 1.54Å | |
| C3 | C20 | sing | 1.53Å | 1.53Å | |
| C6 | N4 | sing | 1.47Å | 1.47Å | |
| N4 | C18 | sing | 1.47Å | 1.47Å | |
| N4 | C10 | sing | 1.47Å | 1.48Å | |
| C18 | C21 | sing | 1.53Å | 1.54Å | |
| C21 | C20 | sing | 1.53Å | 1.52Å | |
| C10 | C16 | sing | 1.53Å | 1.53Å | |
| C16 | C17 | sing | 1.51Å | 1.52Å | |
| C17 | C24 | sing | 1.38Å | 1.40Å | Aromatic |
| C17 | C25 | doub | 1.38Å | 1.39Å | Aromatic |
| C24 | C28 | doub | 1.38Å | 1.40Å | Aromatic |
| C28 | C29 | sing | 1.38Å | 1.39Å | Aromatic |
| C29 | C27 | doub | 1.38Å | 1.39Å | Aromatic |
| C27 | C25 | sing | 1.38Å | 1.39Å | Aromatic |
| C23 | O22 | sing | 1.43Å | 1.43Å | |
| O22 | C26 | sing | 1.43Å | 1.43Å | |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C9 | H9 | sing | 1.08Å | 1.08Å | |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C19 | H191 | sing | 1.09Å | 1.10Å | |
| C19 | H192 | sing | 1.09Å | 1.10Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.09Å | 1.10Å | |
| C6 | H6C1 | sing | 1.09Å | 1.10Å | |
| C6 | H6C2 | sing | 1.09Å | 1.10Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C20 | H202 | sing | 1.09Å | 1.10Å | |
| C18 | H181 | sing | 1.09Å | 1.10Å | |
| C18 | H182 | sing | 1.09Å | 1.10Å | |
| C10 | H101 | sing | 1.09Å | 1.10Å | |
| C10 | H102 | sing | 1.09Å | 1.10Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C21 | H212 | sing | 1.09Å | 1.10Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C24 | H24 | sing | 1.08Å | 1.08Å | |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C28 | H28 | sing | 1.08Å | 1.08Å | |
| C29 | H29 | sing | 1.08Å | 1.08Å | |
| C27 | H27 | sing | 1.08Å | 1.08Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C26 | H262 | sing | 1.09Å | 1.10Å | |
| C26 | H263 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CL15 | C11 | C14 | 119.2° | 119.9° |
| CL15 | C11 | C13 | 118.1° | 119.8° |
| C14 | C11 | C13 | 122.6° | 120.2° |
| C11 | C14 | C9 | 118.5° | 120.1° |
| C11 | C14 | H14 | 120.7° | 120.0° |
| C11 | C13 | C8 | 118.8° | 120.1° |
| C11 | C13 | H13 | 120.6° | 119.9° |
| C14 | C9 | C5 | 118.7° | 119.9° |
| C9 | C14 | H14 | 120.8° | 119.9° |
| C14 | C9 | H9 | 120.6° | 120.1° |
| C9 | C5 | C8 | 122.5° | 119.7° |
| C9 | C5 | C1 | 119.5° | 120.1° |
| C5 | C9 | H9 | 120.7° | 120.1° |
| C13 | C8 | C5 | 118.8° | 119.9° |
| C8 | C13 | H13 | 120.6° | 119.9° |
| C13 | C8 | H8 | 120.6° | 120.1° |
| C8 | C5 | C1 | 118.0° | 120.2° |
| C5 | C8 | H8 | 120.6° | 120.0° |
| C5 | C1 | O7 | 113.6° | 120.0° |
| C5 | C1 | N2 | 122.2° | 120.0° |
| O7 | C1 | N2 | 124.3° | 120.0° |
| C1 | N2 | C12 | 123.9° | 120.0° |
| C1 | N2 | C3 | 120.0° | 120.0° |
| C12 | N2 | C3 | 116.1° | 120.0° |
| N2 | C12 | C19 | 110.9° | 109.5° |
| N2 | C12 | H121 | 109.0° | 109.5° |
| N2 | C12 | H122 | 108.6° | 109.5° |
| N2 | C3 | C6 | 108.6° | 109.5° |
| N2 | C3 | C20 | 110.3° | 109.5° |
| N2 | C3 | H3 | 110.1° | 109.5° |
| C12 | C19 | C23 | 112.4° | 109.4° |
| C19 | C12 | H121 | 109.0° | 109.5° |
| C19 | C12 | H122 | 108.7° | 109.5° |
| C12 | C19 | H191 | 108.5° | 109.4° |
| C12 | C19 | H192 | 107.9° | 109.4° |
| C19 | C23 | O22 | 110.6° | 109.4° |
| C23 | C19 | H191 | 108.5° | 109.5° |
| C23 | C19 | H192 | 107.8° | 109.4° |
| C19 | C23 | H231 | 109.1° | 109.5° |
| C19 | C23 | H232 | 108.8° | 109.4° |
| C6 | C3 | C20 | 111.2° | 109.3° |
| C3 | C6 | N4 | 111.7° | 109.5° |
| C6 | C3 | H3 | 109.2° | 109.5° |
| C3 | C6 | H6C1 | 108.7° | 109.5° |
| C3 | C6 | H6C2 | 108.2° | 109.4° |
| C3 | C20 | C21 | 108.0° | 109.1° |
| C20 | C3 | H3 | 107.5° | 109.5° |
| C3 | C20 | H201 | 110.0° | 109.5° |
| C3 | C20 | H202 | 110.3° | 109.5° |
| C6 | N4 | C18 | 118.1° | 111.2° |
| C6 | N4 | C10 | 111.7° | 111.0° |
| N4 | C6 | H6C1 | 108.8° | 109.5° |
| N4 | C6 | H6C2 | 108.3° | 109.5° |
| C18 | N4 | C10 | 116.9° | 111.0° |
| N4 | C18 | C21 | 110.6° | 109.5° |
| N4 | C18 | H181 | 109.1° | 109.4° |
| N4 | C18 | H182 | 108.8° | 109.5° |
| N4 | C10 | C16 | 113.6° | 109.5° |
| N4 | C10 | H101 | 108.2° | 109.5° |
| N4 | C10 | H102 | 107.2° | 109.5° |
| C18 | C21 | C20 | 110.8° | 109.3° |
| C21 | C18 | H181 | 109.1° | 109.5° |
| C21 | C18 | H182 | 108.8° | 109.4° |
| C18 | C21 | H211 | 109.0° | 109.5° |
| C18 | C21 | H212 | 108.7° | 109.5° |
| C21 | C20 | H201 | 110.0° | 109.6° |
| C21 | C20 | H202 | 110.3° | 109.6° |
| C20 | C21 | H211 | 109.0° | 109.5° |
| C20 | C21 | H212 | 108.7° | 109.5° |
| C10 | C16 | C17 | 107.6° | 109.5° |
| C16 | C10 | H101 | 108.1° | 109.5° |
| C16 | C10 | H102 | 107.2° | 109.4° |
| C10 | C16 | H161 | 110.1° | 109.5° |
| C10 | C16 | H162 | 110.5° | 109.4° |
| C16 | C17 | C24 | 120.8° | 120.0° |
| C16 | C17 | C25 | 119.7° | 120.0° |
| C17 | C16 | H161 | 110.1° | 109.5° |
| C17 | C16 | H162 | 110.5° | 109.5° |
| C24 | C17 | C25 | 119.5° | 120.1° |
| C17 | C24 | C28 | 120.0° | 120.0° |
| C17 | C24 | H24 | 120.0° | 120.0° |
| C17 | C25 | C27 | 120.4° | 120.0° |
| C17 | C25 | H25 | 119.8° | 120.1° |
| C24 | C28 | C29 | 120.0° | 120.1° |
| C28 | C24 | H24 | 120.0° | 120.0° |
| C24 | C28 | H28 | 120.0° | 120.0° |
| C28 | C29 | C27 | 119.7° | 120.0° |
| C29 | C28 | H28 | 120.0° | 119.9° |
| C28 | C29 | H29 | 120.1° | 120.0° |
| C29 | C27 | C25 | 120.4° | 120.0° |
| C27 | C29 | H29 | 120.2° | 120.0° |
| C29 | C27 | H27 | 119.8° | 120.0° |
| C27 | C25 | H25 | 119.8° | 120.0° |
| C25 | C27 | H27 | 119.8° | 120.0° |
| C23 | O22 | C26 | 113.0° | 114.0° |
| O22 | C23 | H231 | 109.1° | 109.5° |
| O22 | C23 | H232 | 108.8° | 109.5° |
| O22 | C26 | H261 | 109.5° | 109.4° |
| O22 | C26 | H262 | 109.5° | 109.5° |
| O22 | C26 | H263 | 109.5° | 109.5° |
| H121 | C12 | H122 | 110.6° | 109.4° |
| H191 | C19 | H192 | 111.8° | 109.5° |
| H231 | C23 | H232 | 110.4° | 109.4° |
| H6C1 | C6 | H6C2 | 111.2° | 109.4° |
| H201 | C20 | H202 | 108.4° | 109.6° |
| H181 | C18 | H182 | 110.4° | 109.4° |
| H101 | C10 | H102 | 112.8° | 109.5° |
| H211 | C21 | H212 | 110.5° | 109.5° |
| H161 | C16 | H162 | 108.1° | 109.5° |
| H261 | C26 | H262 | 109.4° | 109.4° |
| H261 | C26 | H263 | 109.4° | 109.5° |
| H262 | C26 | H263 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CL15 | C11 | C14 | C13 | 179.7° | 179.8° |
| CL15 | C11 | C14 | C9 | 179.3° | 180.0° |
| CL15 | C11 | C13 | C8 | 179.8° | 180.0° |
| CL15 | C11 | C14 | H14 | 0.7° | 0.0° |
| CL15 | C11 | C13 | H13 | 0.2° | 0.0° |
| C11 | C14 | C9 | H14 | 180.0° | 180.0° |
| C11 | C14 | C9 | C5 | 1.1° | 0.0° |
| C14 | C11 | C13 | C8 | 0.6° | 0.2° |
| C14 | C11 | C13 | H13 | 179.5° | 179.7° |
| C11 | C14 | C9 | H9 | 178.9° | 180.0° |
| C13 | C11 | C14 | C9 | 1.0° | 0.2° |
| C11 | C13 | C8 | H13 | 180.0° | 180.0° |
| C11 | C13 | C8 | C5 | 0.3° | 0.1° |
| C13 | C11 | C14 | H14 | 179.0° | 179.8° |
| C11 | C13 | C8 | H8 | 179.7° | 180.0° |
| C14 | C9 | C5 | H9 | 180.0° | 179.9° |
| C14 | C9 | C5 | C8 | 0.9° | 0.3° |
| C14 | C9 | C5 | C1 | 179.4° | 180.0° |
| C9 | C5 | C8 | C13 | 0.5° | 0.4° |
| C9 | C5 | C8 | C1 | 178.4° | 179.7° |
| C9 | C5 | C1 | O7 | 84.6° | 45.6° |
| C9 | C5 | C1 | N2 | 95.8° | 134.3° |
| C5 | C9 | C14 | H14 | 178.9° | 180.0° |
| C9 | C5 | C8 | H8 | 179.5° | 179.7° |
| C13 | C8 | C5 | H8 | 180.0° | 180.0° |
| C13 | C8 | C5 | C1 | 178.9° | 180.0° |
| C8 | C5 | C1 | O7 | 93.9° | 134.7° |
| C8 | C5 | C1 | N2 | 85.7° | 45.3° |
| C5 | C8 | C13 | H13 | 179.7° | 180.0° |
| C8 | C5 | C9 | H9 | 179.1° | 179.7° |
| C5 | C1 | O7 | N2 | 179.6° | 179.9° |
| C5 | C1 | N2 | C12 | 173.6° | 5.9° |
| C5 | C1 | N2 | C3 | 9.2° | 174.2° |
| C1 | C5 | C9 | H9 | 0.7° | 0.1° |
| C1 | C5 | C8 | H8 | 1.0° | 0.0° |
| O7 | C1 | N2 | C12 | 5.9° | 174.2° |
| O7 | C1 | N2 | C3 | 171.3° | 5.7° |
| C1 | N2 | C12 | C3 | 177.3° | 179.9° |
| C1 | N2 | C12 | C19 | 39.5° | 98.0° |
| C1 | N2 | C3 | C6 | 109.9° | 60.0° |
| C1 | N2 | C3 | C20 | 128.1° | 59.7° |
| C1 | N2 | C12 | H121 | 159.5° | 142.0° |
| C1 | N2 | C12 | H122 | 79.9° | 22.0° |
| C1 | N2 | C3 | H3 | 9.6° | 179.9° |
| N2 | C12 | C19 | H121 | 120.0° | 120.0° |
| N2 | C12 | C19 | H122 | 119.4° | 120.0° |
| N2 | C12 | C19 | C23 | 151.7° | 174.6° |
| C12 | N2 | C3 | C6 | 72.7° | 120.0° |
| C12 | N2 | C3 | C20 | 49.4° | 120.2° |
| N2 | C12 | H121 | H122 | 119.4° | 120.0° |
| C12 | N2 | C3 | H3 | 167.8° | 0.1° |
| N2 | C12 | C19 | H191 | 88.3° | 54.6° |
| N2 | C12 | C19 | H192 | 33.0° | 65.5° |
| C3 | N2 | C12 | C19 | 143.2° | 81.9° |
| N2 | C3 | C6 | C20 | 121.6° | 119.9° |
| N2 | C3 | C6 | H3 | 120.0° | 120.1° |
| N2 | C3 | C20 | H3 | 120.0° | 120.1° |
| N2 | C3 | C6 | N4 | 172.6° | 179.1° |
| N2 | C3 | C20 | C21 | 179.8° | 177.6° |
| C3 | N2 | C12 | H121 | 23.2° | 38.1° |
| C3 | N2 | C12 | H122 | 97.4° | 158.1° |
| N2 | C3 | C6 | H6C1 | 52.6° | 59.1° |
| N2 | C3 | C6 | H6C2 | 68.3° | 60.8° |
| N2 | C3 | C20 | H201 | 60.2° | 62.5° |
| N2 | C3 | C20 | H202 | 59.3° | 57.6° |
| C12 | C19 | C23 | H191 | 120.0° | 120.0° |
| C12 | C19 | C23 | H192 | 118.7° | 119.9° |
| C12 | C19 | C23 | O22 | 57.3° | 180.0° |
| C19 | C12 | H121 | H122 | 119.4° | 120.0° |
| C12 | C19 | H191 | H192 | 118.8° | 120.0° |
| C12 | C19 | C23 | H231 | 177.3° | 60.0° |
| C12 | C19 | C23 | H232 | 62.2° | 60.0° |
| C19 | C23 | O22 | H231 | 120.0° | 120.0° |
| C19 | C23 | O22 | H232 | 119.5° | 120.0° |
| C19 | C23 | O22 | C26 | 168.3° | 180.0° |
| C23 | C19 | C12 | H121 | 31.7° | 65.4° |
| C23 | C19 | C12 | H122 | 88.9° | 54.6° |
| C23 | C19 | H191 | H192 | 118.8° | 120.0° |
| C19 | C23 | H231 | H232 | 119.5° | 120.0° |
| C6 | C3 | C20 | H3 | 119.4° | 120.0° |
| C3 | C6 | N4 | H6C1 | 120.0° | 120.0° |
| C3 | C6 | N4 | H6C2 | 119.1° | 120.0° |
| C3 | C6 | N4 | C18 | 46.3° | 61.8° |
| C3 | C6 | N4 | C10 | 174.0° | 174.2° |
| C6 | C3 | C20 | C21 | 59.2° | 57.7° |
| C3 | C6 | H6C1 | H6C2 | 119.1° | 119.9° |
| C6 | C3 | C20 | H201 | 179.3° | 177.6° |
| C6 | C3 | C20 | H202 | 61.3° | 62.3° |
| C20 | C3 | C6 | N4 | 51.0° | 59.2° |
| C3 | C20 | C21 | C18 | 61.1° | 57.7° |
| C3 | C20 | C21 | H201 | 120.0° | 119.9° |
| C3 | C20 | C21 | H202 | 120.6° | 119.9° |
| C20 | C3 | C6 | H6C1 | 69.0° | 60.9° |
| C20 | C3 | C6 | H6C2 | 170.1° | 179.2° |
| C3 | C20 | H201 | H202 | 120.6° | 120.1° |
| C3 | C20 | C21 | H211 | 178.9° | 177.6° |
| C3 | C20 | C21 | H212 | 58.3° | 62.3° |
| C6 | N4 | C18 | C10 | 137.7° | 124.0° |
| C6 | N4 | C18 | C21 | 47.8° | 61.8° |
| C6 | N4 | C10 | C16 | 158.7° | 170.0° |
| N4 | C6 | C3 | H3 | 67.4° | 60.8° |
| N4 | C6 | H6C1 | H6C2 | 119.1° | 120.0° |
| C6 | N4 | C18 | H181 | 72.2° | 58.3° |
| C6 | N4 | C18 | H182 | 167.3° | 178.2° |
| C6 | N4 | C10 | H101 | 81.3° | 70.0° |
| C6 | N4 | C10 | H102 | 40.5° | 50.1° |
| N4 | C18 | C21 | H181 | 120.0° | 120.0° |
| N4 | C18 | C21 | H182 | 119.5° | 120.0° |
| N4 | C18 | C21 | C20 | 54.5° | 59.2° |
| C18 | N4 | C10 | C16 | 61.0° | 65.8° |
| C18 | N4 | C6 | H6C1 | 73.7° | 58.2° |
| C18 | N4 | C6 | H6C2 | 165.4° | 178.3° |
| N4 | C18 | H181 | H182 | 119.5° | 120.0° |
| C18 | N4 | C10 | H101 | 58.9° | 54.2° |
| C18 | N4 | C10 | H102 | 179.2° | 174.3° |
| N4 | C18 | C21 | H211 | 174.5° | 179.1° |
| N4 | C18 | C21 | H212 | 64.9° | 60.8° |
| C10 | N4 | C18 | C21 | 174.6° | 174.2° |
| N4 | C10 | C16 | H101 | 120.0° | 120.0° |
| N4 | C10 | C16 | H102 | 118.2° | 120.0° |
| N4 | C10 | C16 | C17 | 167.9° | 180.0° |
| C10 | N4 | C6 | H6C1 | 66.0° | 65.8° |
| C10 | N4 | C6 | H6C2 | 54.9° | 54.2° |
| C10 | N4 | C18 | H181 | 65.5° | 65.8° |
| C10 | N4 | C18 | H182 | 55.0° | 54.2° |
| N4 | C10 | H101 | H102 | 118.3° | 120.1° |
| N4 | C10 | C16 | H161 | 47.9° | 60.0° |
| N4 | C10 | C16 | H162 | 71.4° | 60.1° |
| C18 | C21 | C20 | H211 | 120.0° | 119.9° |
| C18 | C21 | C20 | H212 | 119.5° | 120.0° |
| C18 | C21 | C20 | H201 | 178.9° | 177.6° |
| C18 | C21 | C20 | H202 | 59.4° | 62.2° |
| C21 | C18 | H181 | H182 | 119.6° | 120.0° |
| C18 | C21 | H211 | H212 | 119.5° | 120.1° |
| C21 | C20 | C3 | H3 | 60.2° | 62.3° |
| C21 | C20 | H201 | H202 | 120.6° | 120.2° |
| C20 | C21 | C18 | H181 | 65.4° | 60.8° |
| C20 | C21 | C18 | H182 | 174.1° | 179.2° |
| C20 | C21 | H211 | H212 | 119.5° | 120.1° |
| C10 | C16 | C17 | H161 | 120.0° | 120.0° |
| C10 | C16 | C17 | H162 | 120.7° | 119.9° |
| C10 | C16 | C17 | C24 | 83.0° | 90.1° |
| C10 | C16 | C17 | C25 | 96.0° | 90.2° |
| C16 | C10 | H101 | H102 | 118.3° | 119.9° |
| C10 | C16 | H161 | H162 | 120.8° | 120.0° |
| C16 | C17 | C24 | C25 | 178.9° | 179.7° |
| C16 | C17 | C24 | C28 | 179.4° | 180.0° |
| C16 | C17 | C25 | C27 | 179.5° | 179.8° |
| C17 | C16 | C10 | H101 | 72.1° | 60.0° |
| C17 | C16 | C10 | H102 | 49.7° | 60.0° |
| C17 | C16 | H161 | H162 | 120.7° | 120.0° |
| C16 | C17 | C24 | H24 | 0.6° | 0.1° |
| C16 | C17 | C25 | H25 | 0.5° | 0.1° |
| C17 | C24 | C28 | H24 | 180.0° | 179.8° |
| C17 | C24 | C28 | C29 | 0.1° | 0.1° |
| C24 | C17 | C25 | C27 | 0.5° | 0.5° |
| C24 | C17 | C16 | H161 | 157.0° | 29.9° |
| C24 | C17 | C16 | H162 | 37.8° | 150.0° |
| C24 | C17 | C25 | H25 | 179.4° | 179.6° |
| C17 | C24 | C28 | H28 | 179.9° | 179.9° |
| C25 | C17 | C24 | C28 | 0.5° | 0.3° |
| C17 | C25 | C27 | C29 | 0.2° | 0.3° |
| C17 | C25 | C27 | H25 | 180.0° | 179.9° |
| C25 | C17 | C16 | H161 | 24.0° | 149.8° |
| C25 | C17 | C16 | H162 | 143.3° | 29.7° |
| C25 | C17 | C24 | H24 | 179.5° | 179.8° |
| C17 | C25 | C27 | H27 | 179.8° | 179.7° |
| C24 | C28 | C29 | H28 | 180.0° | 179.9° |
| C24 | C28 | C29 | C27 | 0.2° | 0.0° |
| C24 | C28 | C29 | H29 | 179.8° | 180.0° |
| C28 | C29 | C27 | H29 | 180.0° | 180.0° |
| C28 | C29 | C27 | C25 | 0.1° | 0.1° |
| C29 | C28 | C24 | H24 | 179.9° | 179.9° |
| C28 | C29 | C27 | H27 | 179.9° | 179.9° |
| C29 | C27 | C25 | H27 | 180.0° | 180.0° |
| C29 | C27 | C25 | H25 | 179.7° | 179.8° |
| C27 | C29 | C28 | H28 | 179.8° | 179.9° |
| C25 | C27 | C29 | H29 | 179.9° | 179.9° |
| O22 | C23 | C19 | H191 | 62.7° | 60.0° |
| O22 | C23 | C19 | H192 | 176.0° | 60.1° |
| O22 | C23 | H231 | H232 | 119.5° | 120.0° |
| C23 | O22 | C26 | H261 | 87.9° | 180.0° |
| C23 | O22 | C26 | H262 | 32.1° | 60.0° |
| C23 | O22 | C26 | H263 | 152.1° | 60.0° |
| C26 | O22 | C23 | H231 | 48.3° | 60.0° |
| C26 | O22 | C23 | H232 | 72.2° | 60.0° |
| O22 | C26 | H261 | H262 | 120.0° | 119.9° |
| O22 | C26 | H261 | H263 | 120.0° | 120.0° |
| O22 | C26 | H262 | H263 | 120.0° | 120.1° |
| H14 | C14 | C9 | H9 | 1.1° | 0.0° |
| H13 | C13 | C8 | H8 | 0.3° | 0.0° |
| H121 | C12 | C19 | H191 | 151.7° | 174.6° |
| H121 | C12 | C19 | H192 | 87.0° | 54.5° |
| H122 | C12 | C19 | H191 | 31.1° | 65.4° |
| H122 | C12 | C19 | H192 | 152.4° | 174.5° |
| H3 | C3 | C6 | H6C1 | 172.6° | 179.1° |
| H3 | C3 | C6 | H6C2 | 51.7° | 59.2° |
| H3 | C3 | C20 | H201 | 59.8° | 57.6° |
| H3 | C3 | C20 | H202 | 179.2° | 177.7° |
| H191 | C19 | C23 | H231 | 57.3° | 179.9° |
| H191 | C19 | C23 | H232 | 177.8° | 60.0° |
| H192 | C19 | C23 | H231 | 64.0° | 60.0° |
| H192 | C19 | C23 | H232 | 56.5° | 179.9° |
| H201 | C20 | C21 | H211 | 58.9° | 62.5° |
| H201 | C20 | C21 | H212 | 61.7° | 57.6° |
| H202 | C20 | C21 | H211 | 60.6° | 57.7° |
| H202 | C20 | C21 | H212 | 178.9° | 177.8° |
| H181 | C18 | C21 | H211 | 54.6° | 59.1° |
| H181 | C18 | C21 | H212 | 175.1° | 179.2° |
| H182 | C18 | C21 | H211 | 65.9° | 60.8° |
| H182 | C18 | C21 | H212 | 54.6° | 59.2° |
| H101 | C10 | C16 | H161 | 167.9° | 180.0° |
| H101 | C10 | C16 | H162 | 48.6° | 60.0° |
| H102 | C10 | C16 | H161 | 70.3° | 60.0° |
| H102 | C10 | C16 | H162 | 170.4° | 180.0° |
| H24 | C24 | C28 | H28 | 0.1° | 0.1° |
| H25 | C25 | C27 | H27 | 0.2° | 0.2° |
| H28 | C28 | C29 | H29 | 0.2° | 0.1° |
| H29 | C29 | C27 | H27 | 0.2° | 0.1° |
| H261 | C26 | H262 | H263 | 120.0° | 120.0° |
