S35
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C35 | C30 | sing | 1.51Å | 1.54Å | |
| C30 | C31 | sing | 1.38Å | 1.40Å | Aromatic |
| C30 | C29 | doub | 1.38Å | 1.41Å | Aromatic |
| C31 | C32 | doub | 1.38Å | 1.40Å | Aromatic |
| C32 | C33 | sing | 1.38Å | 1.40Å | Aromatic |
| C33 | C34 | doub | 1.38Å | 1.40Å | Aromatic |
| C34 | C29 | sing | 1.38Å | 1.41Å | Aromatic |
| C29 | C24 | sing | 1.51Å | 1.56Å | |
| C24 | C25 | sing | 1.53Å | 1.55Å | |
| C24 | N23 | sing | 1.46Å | 1.47Å | |
| C25 | C26 | sing | 1.51Å | 1.54Å | |
| C26 | O28 | doub | 1.21Å | 1.25Å | |
| C26 | O27 | sing | 1.34Å | 1.25Å | |
| N23 | C21 | sing | 1.35Å | 1.34Å | |
| C21 | O22 | doub | 1.22Å | 1.23Å | |
| C21 | C10 | sing | 1.48Å | 1.53Å | |
| C10 | N9 | doub | 1.32Å | 1.33Å | Aromatic |
| C10 | C11 | sing | 1.41Å | 1.33Å | Aromatic |
| N9 | N8 | sing | 1.40Å | 1.23Å | Aromatic |
| C11 | C12 | doub | 1.36Å | 1.34Å | Aromatic |
| C12 | O13 | sing | 1.36Å | 1.37Å | |
| C12 | N8 | sing | 1.36Å | 1.33Å | Aromatic |
| O13 | C14 | sing | 1.43Å | 1.45Å | |
| C14 | C15 | sing | 1.53Å | 1.55Å | |
| C15 | C17 | sing | 1.53Å | 1.57Å | |
| C15 | O16 | sing | 1.43Å | 1.44Å | |
| C17 | C19 | sing | 1.53Å | 1.53Å | |
| C17 | C20 | sing | 1.53Å | 1.54Å | |
| C17 | C18 | sing | 1.53Å | 1.54Å | |
| N8 | C6 | sing | 1.40Å | 1.33Å | |
| C6 | C5 | sing | 1.39Å | 1.40Å | Aromatic |
| C6 | C1 | doub | 1.39Å | 1.40Å | Aromatic |
| C5 | C4 | doub | 1.38Å | 1.40Å | Aromatic |
| C4 | C3 | sing | 1.38Å | 1.40Å | Aromatic |
| C3 | C2 | doub | 1.38Å | 1.40Å | Aromatic |
| C2 | C1 | sing | 1.38Å | 1.40Å | Aromatic |
| C1 | F7 | sing | 1.35Å | 1.35Å | |
| C35 | H351 | sing | 1.09Å | 1.10Å | |
| C35 | H352 | sing | 1.09Å | 1.10Å | |
| C35 | H353 | sing | 1.09Å | 1.10Å | |
| C31 | H31 | sing | 1.08Å | 1.08Å | |
| C32 | H32 | sing | 1.08Å | 1.08Å | |
| C33 | H33 | sing | 1.08Å | 1.08Å | |
| C34 | H34 | sing | 1.08Å | 1.08Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C25 | H251 | sing | 1.09Å | 1.10Å | |
| C25 | H252 | sing | 1.09Å | 1.10Å | |
| N23 | H23 | sing | 0.97Å | 1.00Å | |
| O27 | H27 | sing | 0.97Å | 0.95Å | |
| C11 | H11 | sing | 1.08Å | 1.08Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C14 | H142 | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| O16 | H16 | sing | 0.97Å | 0.95Å | |
| C19 | H191 | sing | 1.09Å | 1.10Å | |
| C19 | H192 | sing | 1.09Å | 1.10Å | |
| C19 | H193 | sing | 1.09Å | 1.10Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C20 | H202 | sing | 1.09Å | 1.10Å | |
| C20 | H203 | 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 | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C35 | C30 | C31 | 117.0° | 120.0° |
| C35 | C30 | C29 | 122.8° | 120.0° |
| C30 | C35 | H351 | 109.5° | 109.4° |
| C30 | C35 | H352 | 109.5° | 109.5° |
| C30 | C35 | H353 | 109.4° | 109.5° |
| C31 | C30 | C29 | 120.2° | 120.0° |
| C30 | C31 | C32 | 120.8° | 120.0° |
| C30 | C31 | H31 | 119.6° | 120.0° |
| C30 | C29 | C34 | 118.1° | 120.0° |
| C30 | C29 | C24 | 121.4° | 120.0° |
| C31 | C32 | C33 | 119.6° | 120.0° |
| C32 | C31 | H31 | 119.6° | 120.0° |
| C31 | C32 | H32 | 120.2° | 120.0° |
| C32 | C33 | C34 | 119.8° | 120.0° |
| C33 | C32 | H32 | 120.2° | 120.0° |
| C32 | C33 | H33 | 120.1° | 120.1° |
| C33 | C34 | C29 | 121.5° | 120.0° |
| C34 | C33 | H33 | 120.1° | 120.0° |
| C33 | C34 | H34 | 119.2° | 120.0° |
| C34 | C29 | C24 | 120.5° | 120.0° |
| C29 | C34 | H34 | 119.2° | 120.0° |
| C29 | C24 | C25 | 114.1° | 109.5° |
| C29 | C24 | N23 | 109.4° | 109.5° |
| C29 | C24 | H24 | 108.0° | 109.5° |
| C25 | C24 | N23 | 107.8° | 109.4° |
| C24 | C25 | C26 | 114.4° | 109.5° |
| C25 | C24 | H24 | 108.2° | 109.5° |
| C24 | C25 | H251 | 108.2° | 109.5° |
| C24 | C25 | H252 | 108.2° | 109.4° |
| C24 | N23 | C21 | 125.4° | 120.0° |
| N23 | C24 | H24 | 109.2° | 109.5° |
| C24 | N23 | H23 | 117.3° | 120.1° |
| C25 | C26 | O28 | 117.8° | 120.0° |
| C25 | C26 | O27 | 116.6° | 120.0° |
| C26 | C25 | H251 | 108.2° | 109.5° |
| C26 | C25 | H252 | 108.2° | 109.5° |
| O28 | C26 | O27 | 125.6° | 120.0° |
| C26 | O27 | H27 | 109.5° | 117.0° |
| N23 | C21 | O22 | 125.3° | 120.0° |
| N23 | C21 | C10 | 113.4° | 120.0° |
| C21 | N23 | H23 | 117.3° | 119.9° |
| O22 | C21 | C10 | 121.2° | 120.0° |
| C21 | C10 | N9 | 123.3° | 125.9° |
| C21 | C10 | C11 | 126.6° | 126.0° |
| N9 | C10 | C11 | 110.0° | 108.1° |
| C10 | N9 | N8 | 107.7° | 108.2° |
| C10 | C11 | C12 | 103.8° | 107.9° |
| C10 | C11 | H11 | 128.1° | 126.1° |
| N9 | N8 | C12 | 110.4° | 108.1° |
| N9 | N8 | C6 | 122.8° | 125.9° |
| C11 | C12 | O13 | 127.5° | 126.1° |
| C11 | C12 | N8 | 107.9° | 107.8° |
| C12 | C11 | H11 | 128.1° | 126.0° |
| O13 | C12 | N8 | 124.3° | 126.1° |
| C12 | O13 | C14 | 118.3° | 117.0° |
| C12 | N8 | C6 | 126.6° | 126.0° |
| O13 | C14 | C15 | 110.7° | 109.5° |
| O13 | C14 | H141 | 109.2° | 109.4° |
| O13 | C14 | H142 | 109.2° | 109.5° |
| C14 | C15 | C17 | 117.2° | 109.5° |
| C14 | C15 | O16 | 110.3° | 109.5° |
| C15 | C14 | H141 | 109.2° | 109.5° |
| C15 | C14 | H142 | 109.2° | 109.5° |
| C14 | C15 | H15 | 105.2° | 109.5° |
| C17 | C15 | O16 | 111.9° | 109.4° |
| C15 | C17 | C19 | 108.5° | 109.5° |
| C15 | C17 | C20 | 112.5° | 109.5° |
| C15 | C17 | C18 | 111.9° | 109.4° |
| C17 | C15 | H15 | 105.0° | 109.5° |
| O16 | C15 | H15 | 106.3° | 109.4° |
| C15 | O16 | H16 | 109.5° | 114.0° |
| C19 | C17 | C20 | 107.2° | 109.5° |
| C19 | C17 | C18 | 108.1° | 109.5° |
| C17 | C19 | H191 | 109.5° | 109.5° |
| C17 | C19 | H192 | 109.5° | 109.5° |
| C17 | C19 | H193 | 109.5° | 109.5° |
| C20 | C17 | C18 | 108.4° | 109.5° |
| C17 | C20 | H201 | 109.5° | 109.5° |
| C17 | C20 | H202 | 109.5° | 109.5° |
| C17 | C20 | H203 | 109.4° | 109.5° |
| C17 | C18 | H181 | 109.5° | 109.5° |
| C17 | C18 | H182 | 109.4° | 109.4° |
| C17 | C18 | H183 | 109.5° | 109.5° |
| N8 | C6 | C5 | 120.3° | 120.0° |
| N8 | C6 | C1 | 119.7° | 120.1° |
| C5 | C6 | C1 | 119.9° | 119.8° |
| C6 | C5 | C4 | 119.9° | 120.0° |
| C6 | C5 | H5 | 120.0° | 120.0° |
| C6 | C1 | C2 | 120.1° | 119.9° |
| C6 | C1 | F7 | 120.0° | 120.0° |
| C5 | C4 | C3 | 120.3° | 120.1° |
| C4 | C5 | H5 | 120.0° | 120.0° |
| C5 | C4 | H4 | 119.9° | 120.0° |
| C4 | C3 | C2 | 119.8° | 120.1° |
| C3 | C4 | H4 | 119.9° | 119.9° |
| C4 | C3 | H3 | 120.1° | 120.0° |
| C3 | C2 | C1 | 120.1° | 120.1° |
| C2 | C3 | H3 | 120.1° | 119.9° |
| C3 | C2 | H2 | 120.0° | 120.0° |
| C2 | C1 | F7 | 119.9° | 120.1° |
| C1 | C2 | H2 | 120.0° | 120.0° |
| H351 | C35 | H352 | 109.5° | 109.4° |
| H351 | C35 | H353 | 109.4° | 109.5° |
| H352 | C35 | H353 | 109.5° | 109.5° |
| H251 | C25 | H252 | 109.5° | 109.5° |
| H141 | C14 | H142 | 109.5° | 109.5° |
| H191 | C19 | H192 | 109.4° | 109.4° |
| H191 | C19 | H193 | 109.4° | 109.4° |
| H192 | C19 | H193 | 109.5° | 109.4° |
| H201 | C20 | H202 | 109.5° | 109.4° |
| H201 | C20 | H203 | 109.5° | 109.5° |
| H202 | C20 | H203 | 109.5° | 109.4° |
| H181 | C18 | H182 | 109.5° | 109.5° |
| H181 | C18 | H183 | 109.5° | 109.5° |
| H182 | C18 | H183 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C35 | C30 | C31 | C29 | 179.6° | 179.7° |
| C35 | C30 | C31 | C32 | 179.8° | 180.0° |
| C35 | C30 | C29 | C34 | 179.3° | 179.8° |
| C35 | C30 | C29 | C24 | 1.1° | 0.0° |
| C30 | C35 | H351 | H352 | 120.0° | 120.0° |
| C30 | C35 | H351 | H353 | 120.0° | 120.0° |
| C30 | C35 | H352 | H353 | 120.0° | 120.0° |
| C35 | C30 | C31 | H31 | 0.2° | 0.1° |
| C30 | C31 | C32 | H31 | 180.0° | 179.9° |
| C30 | C31 | C32 | C33 | 0.1° | 0.1° |
| C31 | C30 | C29 | C34 | 1.1° | 0.5° |
| C31 | C30 | C29 | C24 | 179.3° | 179.7° |
| C31 | C30 | C35 | H351 | 90.2° | 90.0° |
| C31 | C30 | C35 | H352 | 149.8° | 150.0° |
| C31 | C30 | C35 | H353 | 29.8° | 29.9° |
| C30 | C31 | C32 | H32 | 179.9° | 179.9° |
| C29 | C30 | C31 | C32 | 0.6° | 0.3° |
| C30 | C29 | C34 | C33 | 1.0° | 0.4° |
| C30 | C29 | C34 | C24 | 178.2° | 179.8° |
| C30 | C29 | C24 | C25 | 157.3° | 86.2° |
| C30 | C29 | C24 | N23 | 81.8° | 153.9° |
| C29 | C30 | C35 | H351 | 90.3° | 90.3° |
| C29 | C30 | C35 | H352 | 29.8° | 29.7° |
| C29 | C30 | C35 | H353 | 149.8° | 149.7° |
| C29 | C30 | C31 | H31 | 179.4° | 179.8° |
| C30 | C29 | C34 | H34 | 179.0° | 179.7° |
| C30 | C29 | C24 | H24 | 36.9° | 33.8° |
| C31 | C32 | C33 | H32 | 180.0° | 180.0° |
| C31 | C32 | C33 | C34 | 0.2° | 0.0° |
| C31 | C32 | C33 | H33 | 179.8° | 180.0° |
| C32 | C33 | C34 | H33 | 180.0° | 180.0° |
| C32 | C33 | C34 | C29 | 0.3° | 0.2° |
| C33 | C32 | C31 | H31 | 179.9° | 180.0° |
| C32 | C33 | C34 | H34 | 179.7° | 179.9° |
| C33 | C34 | C29 | H34 | 180.0° | 179.9° |
| C33 | C34 | C29 | C24 | 179.2° | 179.8° |
| C34 | C33 | C32 | H32 | 179.8° | 180.0° |
| C34 | C29 | C24 | C25 | 24.6° | 94.0° |
| C34 | C29 | C24 | N23 | 96.3° | 25.9° |
| C29 | C34 | C33 | H33 | 179.7° | 179.9° |
| C34 | C29 | C24 | H24 | 145.0° | 146.0° |
| C29 | C24 | C25 | N23 | 121.7° | 120.0° |
| C29 | C24 | C25 | H24 | 120.3° | 120.0° |
| C29 | C24 | N23 | H24 | 118.0° | 120.0° |
| C29 | C24 | C25 | C26 | 68.3° | 174.6° |
| C29 | C24 | N23 | C21 | 139.6° | 83.6° |
| C24 | C29 | C34 | H34 | 0.8° | 0.1° |
| C29 | C24 | C25 | H251 | 171.0° | 65.4° |
| C29 | C24 | C25 | H252 | 52.4° | 54.6° |
| C29 | C24 | N23 | H23 | 40.3° | 96.5° |
| C25 | C24 | N23 | H24 | 117.4° | 120.0° |
| C24 | C25 | C26 | H251 | 120.7° | 120.0° |
| C24 | C25 | C26 | H252 | 120.7° | 119.9° |
| C24 | C25 | C26 | O28 | 41.0° | 5.5° |
| C24 | C25 | C26 | O27 | 141.7° | 174.5° |
| C25 | C24 | N23 | C21 | 95.8° | 156.5° |
| C24 | C25 | H251 | H252 | 117.7° | 120.0° |
| C25 | C24 | N23 | H23 | 84.3° | 23.5° |
| N23 | C24 | C25 | C26 | 169.9° | 65.4° |
| C24 | N23 | C21 | H23 | 180.0° | 180.0° |
| C24 | N23 | C21 | O22 | 0.6° | 5.1° |
| C24 | N23 | C21 | C10 | 178.4° | 175.0° |
| N23 | C24 | C25 | H251 | 49.2° | 54.6° |
| N23 | C24 | C25 | H252 | 69.3° | 174.6° |
| C25 | C26 | O28 | O27 | 177.0° | 180.0° |
| C26 | C25 | C24 | H24 | 52.0° | 54.6° |
| C26 | C25 | H251 | H252 | 117.7° | 120.0° |
| C25 | C26 | O27 | H27 | 177.1° | 180.0° |
| O28 | C26 | C25 | H251 | 79.8° | 125.6° |
| O28 | C26 | C25 | H252 | 161.7° | 114.4° |
| O28 | C26 | O27 | H27 | 0.0° | 0.0° |
| O27 | C26 | C25 | H251 | 97.5° | 54.5° |
| O27 | C26 | C25 | H252 | 21.0° | 65.6° |
| N23 | C21 | O22 | C10 | 178.9° | 179.9° |
| N23 | C21 | C10 | N9 | 19.2° | 0.1° |
| N23 | C21 | C10 | C11 | 158.4° | 179.7° |
| C21 | N23 | C24 | H24 | 21.6° | 36.5° |
| O22 | C21 | C10 | N9 | 161.7° | 180.0° |
| O22 | C21 | C10 | C11 | 20.6° | 0.4° |
| O22 | C21 | N23 | H23 | 179.4° | 175.0° |
| C21 | C10 | N9 | C11 | 178.0° | 179.7° |
| C21 | C10 | N9 | N8 | 177.5° | 179.9° |
| C21 | C10 | C11 | C12 | 179.8° | 180.0° |
| C10 | C21 | N23 | H23 | 1.6° | 5.0° |
| C21 | C10 | C11 | H11 | 0.2° | 0.0° |
| N9 | C10 | C11 | C12 | 1.9° | 0.3° |
| C10 | N9 | N8 | C12 | 2.8° | 0.1° |
| C10 | N9 | N8 | C6 | 177.7° | 179.9° |
| N9 | C10 | C11 | H11 | 178.1° | 179.7° |
| C11 | C10 | N9 | N8 | 0.5° | 0.2° |
| C10 | C11 | C12 | H11 | 180.0° | 180.0° |
| C10 | C11 | C12 | O13 | 177.1° | 180.0° |
| C10 | C11 | C12 | N8 | 3.5° | 0.2° |
| N9 | N8 | C12 | C11 | 4.1° | 0.1° |
| N9 | N8 | C12 | O13 | 178.0° | 179.9° |
| N9 | N8 | C12 | C6 | 174.7° | 180.0° |
| N9 | N8 | C6 | C5 | 86.3° | 132.3° |
| N9 | N8 | C6 | C1 | 90.0° | 47.9° |
| C11 | C12 | O13 | N8 | 172.6° | 179.8° |
| C11 | C12 | O13 | C14 | 43.7° | 5.2° |
| C11 | C12 | N8 | C6 | 178.8° | 179.9° |
| C12 | O13 | C14 | C15 | 122.4° | 175.5° |
| O13 | C12 | N8 | C6 | 7.4° | 0.1° |
| O13 | C12 | C11 | H11 | 2.9° | 0.0° |
| C12 | O13 | C14 | H141 | 2.2° | 55.5° |
| C12 | O13 | C14 | H142 | 117.5° | 64.5° |
| N8 | C12 | O13 | C14 | 143.7° | 175.0° |
| C12 | N8 | C6 | C5 | 99.6° | 47.7° |
| C12 | N8 | C6 | C1 | 84.0° | 132.1° |
| N8 | C12 | C11 | H11 | 176.5° | 179.8° |
| O13 | C14 | C15 | H141 | 120.2° | 120.0° |
| O13 | C14 | C15 | H142 | 120.2° | 120.0° |
| O13 | C14 | C15 | C17 | 156.5° | 175.3° |
| O13 | C14 | C15 | O16 | 27.0° | 64.7° |
| O13 | C14 | H141 | H142 | 119.5° | 120.0° |
| O13 | C14 | C15 | H15 | 87.3° | 55.3° |
| C14 | C15 | C17 | O16 | 128.8° | 120.0° |
| C14 | C15 | C17 | H15 | 116.3° | 120.1° |
| C14 | C15 | O16 | H15 | 113.5° | 120.1° |
| C14 | C15 | C17 | C19 | 157.9° | 61.0° |
| C14 | C15 | C17 | C20 | 39.4° | 179.0° |
| C14 | C15 | C17 | C18 | 82.9° | 59.0° |
| C15 | C14 | H141 | H142 | 119.5° | 120.1° |
| C14 | C15 | O16 | H16 | 180.0° | 60.0° |
| C17 | C15 | O16 | H15 | 114.2° | 120.0° |
| C15 | C17 | C19 | C20 | 121.7° | 120.0° |
| C15 | C17 | C19 | C18 | 121.6° | 120.0° |
| C15 | C17 | C20 | C18 | 124.3° | 120.0° |
| C17 | C15 | C14 | H141 | 83.3° | 55.4° |
| C17 | C15 | C14 | H142 | 36.3° | 64.7° |
| C17 | C15 | O16 | H16 | 47.6° | 60.0° |
| C15 | C17 | C19 | H191 | 180.0° | 64.6° |
| C15 | C17 | C19 | H192 | 60.0° | 175.4° |
| C15 | C17 | C19 | H193 | 60.0° | 55.5° |
| C15 | C17 | C20 | H201 | 180.0° | 60.0° |
| C15 | C17 | C20 | H202 | 60.0° | 180.0° |
| C15 | C17 | C20 | H203 | 60.0° | 60.1° |
| C15 | C17 | C18 | H181 | 180.0° | 60.0° |
| C15 | C17 | C18 | H182 | 60.0° | 180.0° |
| C15 | C17 | C18 | H183 | 60.0° | 60.1° |
| O16 | C15 | C17 | C19 | 73.4° | 59.0° |
| O16 | C15 | C17 | C20 | 168.2° | 61.1° |
| O16 | C15 | C17 | C18 | 45.8° | 178.9° |
| O16 | C15 | C14 | H141 | 147.1° | 175.3° |
| O16 | C15 | C14 | H142 | 93.2° | 55.3° |
| C19 | C17 | C20 | C18 | 116.5° | 120.0° |
| C19 | C17 | C15 | H15 | 41.6° | 178.9° |
| C17 | C19 | H191 | H192 | 120.0° | 120.1° |
| C17 | C19 | H191 | H193 | 120.0° | 120.1° |
| C17 | C19 | H192 | H193 | 120.0° | 120.1° |
| C19 | C17 | C20 | H201 | 60.8° | 180.0° |
| C19 | C17 | C20 | H202 | 59.2° | 60.0° |
| C19 | C17 | C20 | H203 | 179.2° | 60.0° |
| C19 | C17 | C18 | H181 | 60.6° | 60.0° |
| C19 | C17 | C18 | H182 | 179.4° | 60.0° |
| C19 | C17 | C18 | H183 | 59.4° | 179.9° |
| C20 | C17 | C15 | H15 | 76.8° | 58.9° |
| C20 | C17 | C19 | H191 | 58.3° | 55.5° |
| C20 | C17 | C19 | H192 | 178.3° | 64.5° |
| C20 | C17 | C19 | H193 | 61.7° | 175.5° |
| C17 | C20 | H201 | H202 | 120.0° | 120.1° |
| C17 | C20 | H201 | H203 | 120.0° | 120.0° |
| C17 | C20 | H202 | H203 | 120.0° | 120.0° |
| C20 | C17 | C18 | H181 | 55.4° | 180.0° |
| C20 | C17 | C18 | H182 | 64.7° | 60.0° |
| C20 | C17 | C18 | H183 | 175.4° | 59.9° |
| C18 | C17 | C15 | H15 | 160.8° | 61.1° |
| C18 | C17 | C19 | H191 | 58.4° | 175.5° |
| C18 | C17 | C19 | H192 | 61.6° | 55.5° |
| C18 | C17 | C19 | H193 | 178.4° | 64.5° |
| C18 | C17 | C20 | H201 | 55.7° | 60.0° |
| C18 | C17 | C20 | H202 | 175.7° | 60.0° |
| C18 | C17 | C20 | H203 | 64.3° | 180.0° |
| C17 | C18 | H181 | H182 | 120.0° | 120.0° |
| C17 | C18 | H181 | H183 | 120.0° | 120.0° |
| C17 | C18 | H182 | H183 | 120.0° | 119.9° |
| N8 | C6 | C5 | C1 | 176.4° | 179.8° |
| N8 | C6 | C5 | C4 | 178.0° | 180.0° |
| N8 | C6 | C1 | C2 | 178.2° | 179.7° |
| N8 | C6 | C1 | F7 | 2.5° | 0.1° |
| N8 | C6 | C5 | H5 | 2.0° | 0.0° |
| C6 | C5 | C4 | H5 | 180.0° | 180.0° |
| C6 | C5 | C4 | C3 | 0.7° | 0.0° |
| C5 | C6 | C1 | C2 | 1.8° | 0.5° |
| C5 | C6 | C1 | F7 | 178.9° | 179.7° |
| C6 | C5 | C4 | H4 | 179.3° | 180.0° |
| C1 | C6 | C5 | C4 | 1.6° | 0.3° |
| C6 | C1 | C2 | C3 | 1.0° | 0.6° |
| C6 | C1 | C2 | F7 | 179.3° | 179.7° |
| C1 | C6 | C5 | H5 | 178.4° | 179.8° |
| C6 | C1 | C2 | H2 | 179.0° | 179.7° |
| C5 | C4 | C3 | H4 | 180.0° | 180.0° |
| C5 | C4 | C3 | C2 | 0.1° | 0.0° |
| C5 | C4 | C3 | H3 | 179.9° | 179.9° |
| C4 | C3 | C2 | H3 | 180.0° | 179.9° |
| C4 | C3 | C2 | C1 | 0.1° | 0.3° |
| C3 | C4 | C5 | H5 | 179.3° | 180.0° |
| C4 | C3 | C2 | H2 | 179.9° | 179.9° |
| C3 | C2 | C1 | H2 | 180.0° | 179.8° |
| C3 | C2 | C1 | F7 | 179.7° | 179.7° |
| C2 | C3 | C4 | H4 | 179.9° | 180.0° |
| C1 | C2 | C3 | H3 | 179.9° | 179.8° |
| F7 | C1 | C2 | H2 | 0.3° | 0.1° |
| H351 | C35 | H352 | H353 | 120.0° | 120.0° |
| H31 | C31 | C32 | H32 | 0.1° | 0.0° |
| H32 | C32 | C33 | H33 | 0.3° | 0.0° |
| H33 | C33 | C34 | H34 | 0.3° | 0.0° |
| H24 | C24 | C25 | H251 | 68.8° | 174.6° |
| H24 | C24 | C25 | H252 | 172.7° | 65.4° |
| H24 | C24 | N23 | H23 | 158.4° | 143.5° |
| H141 | C14 | C15 | H15 | 32.9° | 64.7° |
| H142 | C14 | C15 | H15 | 152.5° | 175.3° |
| H15 | C15 | O16 | H16 | 66.5° | 180.0° |
| H191 | C19 | H192 | H193 | 119.9° | 119.9° |
| H201 | C20 | H202 | H203 | 120.0° | 119.9° |
| H181 | C18 | H182 | H183 | 120.0° | 120.0° |
| H5 | C5 | C4 | H4 | 0.7° | 0.0° |
| H4 | C4 | C3 | H3 | 0.0° | 0.1° |
| H3 | C3 | C2 | H2 | 0.1° | 0.0° |
