PYN
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | C1 | doub | 1.47Å | 1.47Å | Aromatic |
| C | C2 | sing | 1.40Å | 1.38Å | Aromatic |
| C | C9 | sing | 1.41Å | 1.39Å | Aromatic |
| C1 | C12 | sing | 1.41Å | 1.43Å | Aromatic |
| C1 | N | sing | 1.33Å | 1.33Å | Aromatic |
| C2 | C3 | doub | 1.40Å | 1.38Å | Aromatic |
| C2 | H21 | sing | 1.08Å | 1.10Å | |
| C3 | C4 | sing | 1.47Å | 1.47Å | Aromatic |
| C3 | C8 | sing | 1.41Å | 1.39Å | Aromatic |
| C4 | C5 | sing | 1.41Å | 1.41Å | Aromatic |
| C4 | N | doub | 1.33Å | 1.33Å | Aromatic |
| C5 | C6 | doub | 1.37Å | 1.38Å | Aromatic |
| C5 | H51 | sing | 1.08Å | 1.10Å | |
| C6 | C7 | sing | 1.40Å | 1.44Å | Aromatic |
| C6 | N13 | sing | 1.40Å | 1.43Å | |
| C7 | C8 | doub | 1.36Å | 1.37Å | Aromatic |
| C7 | H71 | sing | 1.08Å | 1.10Å | |
| C8 | H81 | sing | 1.08Å | 1.10Å | |
| C9 | C10 | doub | 1.36Å | 1.38Å | Aromatic |
| C9 | H91 | sing | 1.08Å | 1.10Å | |
| C10 | C11 | sing | 1.40Å | 1.44Å | Aromatic |
| C10 | H101 | sing | 1.08Å | 1.10Å | |
| C11 | C12 | doub | 1.37Å | 1.38Å | Aromatic |
| C11 | N1 | sing | 1.40Å | 1.44Å | |
| C12 | H121 | sing | 1.08Å | 1.10Å | |
| N13 | C14 | sing | 1.35Å | 1.38Å | |
| N13 | HN1 | sing | 0.97Å | 1.02Å | |
| C14 | C15 | sing | 1.51Å | 1.54Å | |
| C14 | O14 | doub | 1.21Å | 1.22Å | |
| C15 | C16 | sing | 1.53Å | 1.51Å | |
| C15 | H151 | sing | 1.09Å | 1.11Å | |
| C15 | H152 | sing | 1.09Å | 1.12Å | |
| C16 | N22 | sing | 1.47Å | 1.46Å | |
| C16 | H161 | sing | 1.09Å | 1.11Å | |
| C16 | H162 | sing | 1.09Å | 1.11Å | |
| N1 | C17 | sing | 1.35Å | 1.37Å | |
| N1 | HN11 | sing | 0.97Å | 1.02Å | |
| C17 | C18 | sing | 1.51Å | 1.54Å | |
| C17 | O1 | doub | 1.21Å | 1.21Å | |
| C18 | C19 | sing | 1.53Å | 1.53Å | |
| C18 | H181 | sing | 1.09Å | 1.11Å | |
| C18 | H182 | sing | 1.09Å | 1.11Å | |
| C19 | N27 | sing | 1.47Å | 1.51Å | |
| C19 | H191 | sing | 1.09Å | 1.12Å | |
| C19 | H192 | sing | 1.09Å | 1.12Å | |
| C21 | N22 | sing | 1.47Å | 1.55Å | |
| C21 | C24 | sing | 1.54Å | 1.53Å | |
| C21 | H211 | sing | 1.09Å | 1.11Å | |
| C21 | H212 | sing | 1.09Å | 1.11Å | |
| N22 | C23 | sing | 1.48Å | 1.57Å | |
| C23 | C25 | sing | 1.55Å | 1.54Å | |
| C23 | H231 | sing | 1.09Å | 1.12Å | |
| C23 | H232 | sing | 1.09Å | 1.11Å | |
| C24 | C25 | sing | 1.55Å | 1.50Å | |
| C24 | H241 | sing | 1.09Å | 1.11Å | |
| C24 | H242 | sing | 1.09Å | 1.11Å | |
| C25 | H251 | sing | 1.09Å | 1.12Å | |
| C25 | H252 | sing | 1.09Å | 1.12Å | |
| C26 | N27 | sing | 1.47Å | 1.57Å | |
| C26 | C29 | sing | 1.54Å | 1.54Å | |
| C26 | H261 | sing | 1.09Å | 1.11Å | |
| C26 | H262 | sing | 1.09Å | 1.11Å | |
| N27 | C28 | sing | 1.48Å | 1.58Å | |
| C28 | C30 | sing | 1.55Å | 1.60Å | |
| C28 | H281 | sing | 1.09Å | 1.12Å | |
| C28 | H282 | sing | 1.09Å | 1.11Å | |
| C29 | C30 | sing | 1.55Å | 1.53Å | |
| C29 | H291 | sing | 1.09Å | 1.12Å | |
| C29 | H292 | sing | 1.09Å | 1.12Å | |
| C30 | H301 | sing | 1.09Å | 1.11Å | |
| C30 | H302 | sing | 1.09Å | 1.11Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | C | C2 | 119.1° | 119.6° |
| C1 | C | C9 | 118.9° | 119.2° |
| C | C1 | C12 | 118.8° | 118.5° |
| C | C1 | N | 121.6° | 120.8° |
| C2 | C | C9 | 121.9° | 121.2° |
| C | C2 | C3 | 118.8° | 117.9° |
| C | C2 | H21 | 120.4° | 121.0° |
| C | C9 | C10 | 120.9° | 119.7° |
| C | C9 | H91 | 119.9° | 120.2° |
| C12 | C1 | N | 119.6° | 120.8° |
| C1 | C12 | C11 | 120.1° | 119.6° |
| C1 | C12 | H121 | 121.5° | 120.2° |
| C1 | N | C4 | 119.0° | 121.4° |
| C3 | C2 | H21 | 120.9° | 121.1° |
| C2 | C3 | C4 | 118.8° | 119.6° |
| C2 | C3 | C8 | 121.7° | 121.2° |
| C4 | C3 | C8 | 119.4° | 119.2° |
| C3 | C4 | C5 | 117.4° | 118.5° |
| C3 | C4 | N | 122.4° | 120.7° |
| C3 | C8 | C7 | 121.8° | 119.7° |
| C3 | C8 | H81 | 120.0° | 120.2° |
| C5 | C4 | N | 120.2° | 120.8° |
| C4 | C5 | C6 | 121.6° | 119.6° |
| C4 | C5 | H51 | 120.5° | 120.2° |
| C6 | C5 | H51 | 117.9° | 120.2° |
| C5 | C6 | C7 | 120.0° | 121.5° |
| C5 | C6 | N13 | 123.7° | 119.2° |
| C7 | C6 | N13 | 116.3° | 119.3° |
| C6 | C7 | C8 | 119.4° | 121.5° |
| C6 | C7 | H71 | 122.7° | 119.2° |
| C6 | N13 | C14 | 124.7° | 120.0° |
| C6 | N13 | HN1 | 119.7° | 120.0° |
| C8 | C7 | H71 | 117.9° | 119.3° |
| C7 | C8 | H81 | 118.3° | 120.1° |
| C10 | C9 | H91 | 119.2° | 120.1° |
| C9 | C10 | C11 | 120.6° | 121.4° |
| C9 | C10 | H101 | 117.7° | 119.3° |
| C11 | C10 | H101 | 121.7° | 119.3° |
| C10 | C11 | C12 | 119.7° | 121.6° |
| C10 | C11 | N1 | 118.5° | 119.2° |
| C12 | C11 | N1 | 121.7° | 119.2° |
| C11 | C12 | H121 | 118.5° | 120.2° |
| C11 | N1 | C17 | 128.9° | 120.0° |
| C11 | N1 | HN11 | 118.5° | 119.9° |
| C14 | N13 | HN1 | 115.7° | 120.0° |
| N13 | C14 | C15 | 112.4° | 119.9° |
| N13 | C14 | O14 | 124.9° | 120.0° |
| C15 | C14 | O14 | 122.7° | 120.1° |
| C14 | C15 | C16 | 109.5° | 109.4° |
| C14 | C15 | H151 | 112.2° | 109.5° |
| C14 | C15 | H152 | 112.2° | 109.5° |
| C16 | C15 | H151 | 112.2° | 109.4° |
| C16 | C15 | H152 | 112.2° | 109.5° |
| C15 | C16 | N22 | 117.4° | 109.5° |
| C15 | C16 | H161 | 109.3° | 109.5° |
| C15 | C16 | H162 | 109.4° | 109.5° |
| H151 | C15 | H152 | 98.3° | 109.5° |
| N22 | C16 | H161 | 109.4° | 109.5° |
| N22 | C16 | H162 | 109.3° | 109.4° |
| C16 | N22 | C21 | 119.1° | 106.7° |
| C16 | N22 | C23 | 113.3° | 106.7° |
| H161 | C16 | H162 | 100.8° | 109.5° |
| C17 | N1 | HN11 | 112.6° | 120.1° |
| N1 | C17 | C18 | 115.6° | 120.0° |
| N1 | C17 | O1 | 123.8° | 120.0° |
| C18 | C17 | O1 | 120.7° | 120.0° |
| C17 | C18 | C19 | 108.1° | 109.5° |
| C17 | C18 | H181 | 112.7° | 109.4° |
| C17 | C18 | H182 | 112.7° | 109.4° |
| C19 | C18 | H181 | 112.7° | 109.5° |
| C19 | C18 | H182 | 112.7° | 109.5° |
| C18 | C19 | N27 | 111.0° | 109.4° |
| C18 | C19 | H191 | 111.6° | 109.5° |
| C18 | C19 | H192 | 111.7° | 109.4° |
| H181 | C18 | H182 | 97.7° | 109.5° |
| N27 | C19 | H191 | 111.7° | 109.4° |
| N27 | C19 | H192 | 111.6° | 109.5° |
| C19 | N27 | C26 | 109.1° | 106.7° |
| C19 | N27 | C28 | 109.9° | 106.7° |
| H191 | C19 | H192 | 98.7° | 109.5° |
| N22 | C21 | C24 | 104.2° | 107.2° |
| N22 | C21 | H211 | 114.2° | 109.8° |
| N22 | C21 | H212 | 114.2° | 109.9° |
| C21 | N22 | C23 | 105.6° | 108.6° |
| C24 | C21 | H211 | 114.2° | 109.9° |
| C24 | C21 | H212 | 114.2° | 110.0° |
| C21 | C24 | C25 | 109.8° | 103.0° |
| C21 | C24 | H241 | 112.1° | 110.7° |
| C21 | C24 | H242 | 112.1° | 110.7° |
| H211 | C21 | H212 | 96.2° | 110.0° |
| N22 | C23 | C25 | 102.7° | 104.8° |
| N22 | C23 | H231 | 114.8° | 110.4° |
| N22 | C23 | H232 | 114.8° | 110.4° |
| C25 | C23 | H231 | 114.8° | 110.3° |
| C25 | C23 | H232 | 114.8° | 110.4° |
| C23 | C25 | C24 | 106.9° | 101.7° |
| C23 | C25 | H251 | 113.1° | 111.0° |
| C23 | C25 | H252 | 113.2° | 111.0° |
| H231 | C23 | H232 | 95.7° | 110.5° |
| C25 | C24 | H241 | 112.1° | 110.8° |
| C25 | C24 | H242 | 112.1° | 110.7° |
| C24 | C25 | H251 | 113.2° | 111.0° |
| C24 | C25 | H252 | 113.2° | 111.0° |
| H241 | C24 | H242 | 98.3° | 110.8° |
| H251 | C25 | H252 | 97.3° | 110.9° |
| N27 | C26 | C29 | 103.7° | 107.2° |
| N27 | C26 | H261 | 114.4° | 110.0° |
| N27 | C26 | H262 | 114.4° | 109.9° |
| C26 | N27 | C28 | 104.7° | 108.6° |
| C29 | C26 | H261 | 114.4° | 109.8° |
| C29 | C26 | H262 | 114.4° | 109.9° |
| C26 | C29 | C30 | 107.5° | 103.0° |
| C26 | C29 | H291 | 112.9° | 110.7° |
| C26 | C29 | H292 | 112.9° | 110.7° |
| H261 | C26 | H262 | 96.1° | 110.0° |
| N27 | C28 | C30 | 96.8° | 104.8° |
| N27 | C28 | H281 | 117.2° | 110.4° |
| N27 | C28 | H282 | 117.2° | 110.4° |
| C30 | C28 | H281 | 117.2° | 110.4° |
| C30 | C28 | H282 | 117.2° | 110.4° |
| C28 | C30 | C29 | 101.2° | 101.7° |
| C28 | C30 | H301 | 115.4° | 111.0° |
| C28 | C30 | H302 | 115.4° | 111.0° |
| H281 | C28 | H282 | 93.2° | 110.4° |
| C30 | C29 | H291 | 113.0° | 110.7° |
| C30 | C29 | H292 | 112.9° | 110.7° |
| C29 | C30 | H301 | 115.4° | 111.0° |
| C29 | C30 | H302 | 115.4° | 111.0° |
| H291 | C29 | H292 | 97.5° | 110.8° |
| H301 | C30 | H302 | 95.0° | 110.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | C | C2 | C9 | 178.9° | 180.0° |
| C | C1 | C12 | N | 180.0° | 180.0° |
| C1 | C | C2 | C3 | 1.1° | 0.0° |
| C1 | C | C2 | H21 | 178.9° | 180.0° |
| C | C1 | N | C4 | 6.5° | 0.0° |
| C1 | C | C9 | C10 | 1.1° | 0.0° |
| C1 | C | C9 | H91 | 178.9° | 180.0° |
| C | C1 | C12 | C11 | 2.6° | 0.0° |
| C | C1 | C12 | H121 | 177.4° | 179.9° |
| C2 | C | C1 | C12 | 176.1° | 180.0° |
| C2 | C | C1 | N | 3.9° | 0.0° |
| C | C2 | C3 | H21 | 180.0° | 180.0° |
| C | C2 | C3 | C4 | 3.2° | 0.0° |
| C | C2 | C3 | C8 | 179.5° | 179.9° |
| C2 | C | C9 | C10 | 177.9° | 180.0° |
| C2 | C | C9 | H91 | 2.1° | 0.0° |
| C9 | C | C1 | C12 | 4.9° | 0.0° |
| C9 | C | C1 | N | 175.1° | 180.0° |
| C9 | C | C2 | C3 | 180.0° | 180.0° |
| C9 | C | C2 | H21 | 0.0° | 0.0° |
| C | C9 | C10 | H91 | 180.0° | 180.0° |
| C | C9 | C10 | C11 | 9.2° | 0.0° |
| C | C9 | C10 | H101 | 170.8° | 180.0° |
| C12 | C1 | N | C4 | 173.5° | 180.0° |
| C1 | C12 | C11 | C10 | 5.4° | 0.1° |
| C1 | C12 | C11 | H121 | 180.0° | 179.9° |
| C1 | C12 | C11 | N1 | 174.4° | 180.0° |
| C1 | N | C4 | C3 | 4.3° | 0.0° |
| C1 | N | C4 | C5 | 171.9° | 179.8° |
| N | C1 | C12 | C11 | 177.4° | 180.0° |
| N | C1 | C12 | H121 | 2.6° | 0.1° |
| C2 | C3 | C4 | C8 | 176.4° | 179.9° |
| C2 | C3 | C4 | C5 | 176.9° | 179.8° |
| C2 | C3 | C4 | N | 0.6° | 0.1° |
| C2 | C3 | C8 | C7 | 177.9° | 180.0° |
| C2 | C3 | C8 | H81 | 2.1° | 0.1° |
| H21 | C2 | C3 | C4 | 176.8° | 180.0° |
| H21 | C2 | C3 | C8 | 0.5° | 0.1° |
| C3 | C4 | C5 | N | 176.4° | 179.7° |
| C3 | C4 | C5 | C6 | 1.5° | 0.6° |
| C3 | C4 | C5 | H51 | 178.5° | 179.7° |
| C4 | C3 | C8 | C7 | 5.8° | 0.1° |
| C4 | C3 | C8 | H81 | 174.2° | 180.0° |
| C8 | C3 | C4 | C5 | 6.7° | 0.3° |
| C8 | C3 | C4 | N | 177.0° | 180.0° |
| C3 | C8 | C7 | C6 | 0.4° | 0.1° |
| C3 | C8 | C7 | H81 | 180.0° | 179.9° |
| C3 | C8 | C7 | H71 | 179.6° | 180.0° |
| C4 | C5 | C6 | H51 | 180.0° | 179.7° |
| C4 | C5 | C6 | C7 | 4.7° | 0.6° |
| C4 | C5 | C6 | N13 | 174.4° | 179.7° |
| N | C4 | C5 | C6 | 177.8° | 179.7° |
| N | C4 | C5 | H51 | 2.2° | 0.0° |
| C5 | C6 | C7 | N13 | 179.2° | 179.7° |
| C5 | C6 | C7 | C8 | 5.8° | 0.3° |
| C5 | C6 | C7 | H71 | 174.2° | 179.7° |
| C5 | C6 | N13 | C14 | 6.2° | 35.2° |
| C5 | C6 | N13 | HN1 | 173.8° | 144.9° |
| H51 | C5 | C6 | C7 | 175.3° | 179.7° |
| H51 | C5 | C6 | N13 | 5.6° | 0.0° |
| C6 | C7 | C8 | H71 | 180.0° | 179.9° |
| C6 | C7 | C8 | H81 | 179.6° | 180.0° |
| C7 | C6 | N13 | C14 | 174.7° | 145.1° |
| C7 | C6 | N13 | HN1 | 5.3° | 34.8° |
| N13 | C6 | C7 | C8 | 173.4° | 180.0° |
| N13 | C6 | C7 | H71 | 6.6° | 0.1° |
| C6 | N13 | C14 | HN1 | 180.0° | 179.9° |
| C6 | N13 | C14 | C15 | 179.5° | 174.6° |
| C6 | N13 | C14 | O14 | 0.5° | 5.0° |
| H71 | C7 | C8 | H81 | 0.4° | 0.1° |
| C9 | C10 | C11 | H101 | 180.0° | 179.9° |
| C9 | C10 | C11 | C12 | 11.5° | 0.1° |
| C9 | C10 | C11 | N1 | 168.3° | 180.0° |
| H91 | C9 | C10 | C11 | 170.8° | 179.9° |
| H91 | C9 | C10 | H101 | 9.2° | 0.0° |
| C10 | C11 | C12 | N1 | 179.8° | 180.0° |
| C10 | C11 | C12 | H121 | 174.6° | 180.0° |
| C10 | C11 | N1 | C17 | 179.1° | 34.3° |
| C10 | C11 | N1 | HN11 | 0.9° | 145.7° |
| H101 | C10 | C11 | C12 | 168.5° | 180.0° |
| H101 | C10 | C11 | N1 | 11.7° | 0.0° |
| C12 | C11 | N1 | C17 | 0.7° | 145.7° |
| C12 | C11 | N1 | HN11 | 179.3° | 34.4° |
| N1 | C11 | C12 | H121 | 5.6° | 0.1° |
| C11 | N1 | C17 | HN11 | 180.0° | 180.0° |
| C11 | N1 | C17 | C18 | 148.5° | 174.5° |
| C11 | N1 | C17 | O1 | 30.7° | 5.5° |
| N13 | C14 | C15 | O14 | 180.0° | 179.7° |
| N13 | C14 | C15 | C16 | 174.7° | 179.7° |
| N13 | C14 | C15 | H151 | 60.0° | 59.8° |
| N13 | C14 | C15 | H152 | 49.5° | 60.3° |
| HN1 | N13 | C14 | C15 | 0.6° | 5.5° |
| HN1 | N13 | C14 | O14 | 179.5° | 174.9° |
| C14 | C15 | C16 | H151 | 125.2° | 119.9° |
| C14 | C15 | C16 | H152 | 125.3° | 120.0° |
| C14 | C15 | H151 | H152 | 118.2° | 120.1° |
| C14 | C15 | C16 | N22 | 147.8° | 179.9° |
| C14 | C15 | C16 | H161 | 86.9° | 60.1° |
| C14 | C15 | C16 | H162 | 22.6° | 60.0° |
| O14 | C14 | C15 | C16 | 5.3° | 0.0° |
| O14 | C14 | C15 | H151 | 119.9° | 119.9° |
| O14 | C14 | C15 | H152 | 130.5° | 120.0° |
| C16 | C15 | H151 | H152 | 118.1° | 120.0° |
| C15 | C16 | N22 | H161 | 125.3° | 120.0° |
| C15 | C16 | N22 | H162 | 125.3° | 120.0° |
| C15 | C16 | H161 | H162 | 115.1° | 120.0° |
| C15 | C16 | N22 | C21 | 9.0° | 180.0° |
| C15 | C16 | N22 | C23 | 134.2° | 64.1° |
| H151 | C15 | C16 | N22 | 22.6° | 60.0° |
| H151 | C15 | C16 | H161 | 147.9° | 180.0° |
| H151 | C15 | C16 | H162 | 102.6° | 59.9° |
| H152 | C15 | C16 | N22 | 86.9° | 60.0° |
| H152 | C15 | C16 | H161 | 38.4° | 60.0° |
| H152 | C15 | C16 | H162 | 147.9° | 180.0° |
| N22 | C16 | H161 | H162 | 115.1° | 120.0° |
| C16 | N22 | C21 | C23 | 128.8° | 114.7° |
| C16 | N22 | C21 | C24 | 155.3° | 115.7° |
| C16 | N22 | C21 | H211 | 79.4° | 124.9° |
| C16 | N22 | C21 | H212 | 30.0° | 3.8° |
| C16 | N22 | C23 | C25 | 165.5° | 138.8° |
| C16 | N22 | C23 | H231 | 40.3° | 20.0° |
| C16 | N22 | C23 | H232 | 69.2° | 102.4° |
| H161 | C16 | N22 | C21 | 116.2° | 60.0° |
| H161 | C16 | N22 | C23 | 8.9° | 175.9° |
| H162 | C16 | N22 | C21 | 134.3° | 60.0° |
| H162 | C16 | N22 | C23 | 100.5° | 55.9° |
| N1 | C17 | C18 | O1 | 179.2° | 180.0° |
| N1 | C17 | C18 | C19 | 162.4° | 180.0° |
| N1 | C17 | C18 | H181 | 72.3° | 60.0° |
| N1 | C17 | C18 | H182 | 37.1° | 60.0° |
| HN11 | N1 | C17 | C18 | 31.5° | 5.4° |
| HN11 | N1 | C17 | O1 | 149.4° | 174.5° |
| C17 | C18 | C19 | H181 | 125.3° | 120.0° |
| C17 | C18 | C19 | H182 | 125.2° | 119.9° |
| C17 | C18 | H181 | H182 | 118.6° | 119.9° |
| C17 | C18 | C19 | N27 | 160.5° | 180.0° |
| C17 | C18 | C19 | H191 | 35.2° | 60.0° |
| C17 | C18 | C19 | H192 | 74.2° | 60.1° |
| O1 | C17 | C18 | C19 | 18.4° | 0.0° |
| O1 | C17 | C18 | H181 | 106.9° | 120.0° |
| O1 | C17 | C18 | H182 | 143.7° | 120.0° |
| C19 | C18 | H181 | H182 | 118.7° | 120.1° |
| C18 | C19 | N27 | H191 | 125.3° | 120.0° |
| C18 | C19 | N27 | H192 | 125.3° | 119.9° |
| C18 | C19 | H191 | H192 | 117.5° | 120.0° |
| C18 | C19 | N27 | C26 | 151.2° | 180.0° |
| C18 | C19 | N27 | C28 | 36.9° | 64.1° |
| H181 | C18 | C19 | N27 | 74.2° | 60.0° |
| H181 | C18 | C19 | H191 | 160.5° | 180.0° |
| H181 | C18 | C19 | H192 | 51.1° | 59.9° |
| H182 | C18 | C19 | N27 | 35.3° | 60.1° |
| H182 | C18 | C19 | H191 | 90.0° | 59.9° |
| H182 | C18 | C19 | H192 | 160.6° | 180.0° |
| N27 | C19 | H191 | H192 | 117.5° | 120.0° |
| C19 | N27 | C26 | C28 | 117.6° | 114.7° |
| C19 | N27 | C26 | C29 | 141.9° | 115.6° |
| C19 | N27 | C26 | H261 | 92.8° | 125.0° |
| C19 | N27 | C26 | H262 | 16.7° | 3.7° |
| C19 | N27 | C28 | C30 | 162.0° | 138.7° |
| C19 | N27 | C28 | H281 | 36.7° | 19.9° |
| C19 | N27 | C28 | H282 | 72.7° | 102.4° |
| H191 | C19 | N27 | C26 | 83.6° | 60.0° |
| H191 | C19 | N27 | C28 | 162.2° | 175.9° |
| H192 | C19 | N27 | C26 | 25.9° | 60.1° |
| H192 | C19 | N27 | C28 | 88.4° | 55.9° |
| N22 | C21 | C24 | H211 | 125.3° | 119.3° |
| N22 | C21 | C24 | H212 | 125.3° | 119.4° |
| N22 | C21 | H211 | H212 | 120.1° | 121.1° |
| C21 | N22 | C23 | C25 | 33.3° | 24.1° |
| C21 | N22 | C23 | H231 | 91.9° | 94.7° |
| C21 | N22 | C23 | H232 | 158.6° | 142.9° |
| N22 | C21 | C24 | C25 | 9.4° | 22.3° |
| N22 | C21 | C24 | H241 | 115.8° | 140.7° |
| N22 | C21 | C24 | H242 | 134.7° | 96.1° |
| C24 | C21 | H211 | H212 | 120.1° | 121.2° |
| C24 | C21 | N22 | C23 | 26.5° | 1.0° |
| C21 | C24 | C25 | C23 | 11.7° | 35.6° |
| C21 | C24 | C25 | H241 | 125.3° | 118.4° |
| C21 | C24 | C25 | H242 | 125.3° | 118.3° |
| C21 | C24 | H241 | H242 | 118.0° | 123.2° |
| C21 | C24 | C25 | H251 | 136.9° | 82.5° |
| C21 | C24 | C25 | H252 | 113.6° | 153.7° |
| H211 | C21 | N22 | C23 | 151.7° | 120.4° |
| H211 | C21 | C24 | C25 | 134.7° | 97.1° |
| H211 | C21 | C24 | H241 | 9.4° | 21.4° |
| H211 | C21 | C24 | H242 | 100.0° | 144.6° |
| H212 | C21 | N22 | C23 | 98.8° | 118.5° |
| H212 | C21 | C24 | C25 | 115.8° | 141.7° |
| H212 | C21 | C24 | H241 | 118.9° | 99.9° |
| H212 | C21 | C24 | H242 | 9.4° | 23.3° |
| N22 | C23 | C25 | H231 | 125.3° | 118.8° |
| N22 | C23 | C25 | H232 | 125.3° | 118.8° |
| N22 | C23 | H231 | H232 | 120.7° | 122.3° |
| N22 | C23 | C25 | C24 | 27.4° | 37.1° |
| N22 | C23 | C25 | H251 | 152.7° | 81.1° |
| N22 | C23 | C25 | H252 | 97.9° | 155.2° |
| C25 | C23 | H231 | H232 | 120.6° | 122.3° |
| C23 | C25 | C24 | H251 | 125.2° | 118.1° |
| C23 | C25 | C24 | H252 | 125.3° | 118.1° |
| C23 | C25 | C24 | H241 | 137.0° | 154.0° |
| C23 | C25 | C24 | H242 | 113.6° | 82.7° |
| C23 | C25 | H251 | H252 | 119.1° | 123.8° |
| H231 | C23 | C25 | C24 | 97.9° | 81.7° |
| H231 | C23 | C25 | H251 | 27.4° | 160.1° |
| H231 | C23 | C25 | H252 | 136.9° | 36.4° |
| H232 | C23 | C25 | C24 | 152.7° | 155.9° |
| H232 | C23 | C25 | H251 | 82.0° | 37.8° |
| H232 | C23 | C25 | H252 | 27.4° | 86.0° |
| C25 | C24 | H241 | H242 | 118.0° | 123.2° |
| C24 | C25 | H251 | H252 | 119.1° | 123.8° |
| H241 | C24 | C25 | H251 | 97.8° | 35.9° |
| H241 | C24 | C25 | H252 | 11.7° | 87.8° |
| H242 | C24 | C25 | H251 | 11.7° | 159.2° |
| H242 | C24 | C25 | H252 | 121.2° | 35.4° |
| N27 | C26 | C29 | H261 | 125.3° | 119.5° |
| N27 | C26 | C29 | H262 | 125.3° | 119.4° |
| N27 | C26 | H261 | H262 | 120.3° | 121.2° |
| C26 | N27 | C28 | C30 | 44.9° | 24.1° |
| C26 | N27 | C28 | H281 | 80.3° | 94.8° |
| C26 | N27 | C28 | H282 | 170.2° | 142.9° |
| N27 | C26 | C29 | C30 | 8.1° | 22.3° |
| N27 | C26 | C29 | H291 | 133.4° | 140.7° |
| N27 | C26 | C29 | H292 | 117.2° | 96.1° |
| C29 | C26 | H261 | H262 | 120.3° | 121.1° |
| C29 | C26 | N27 | C28 | 24.3° | 1.0° |
| C26 | C29 | C30 | C28 | 36.5° | 35.6° |
| C26 | C29 | C30 | H291 | 125.3° | 118.4° |
| C26 | C29 | C30 | H292 | 125.2° | 118.4° |
| C26 | C29 | H291 | H292 | 118.8° | 123.2° |
| C26 | C29 | C30 | H301 | 161.8° | 82.5° |
| C26 | C29 | C30 | H302 | 88.7° | 153.8° |
| H261 | C26 | N27 | C28 | 149.6° | 120.4° |
| H261 | C26 | C29 | C30 | 117.2° | 97.2° |
| H261 | C26 | C29 | H291 | 8.1° | 21.2° |
| H261 | C26 | C29 | H292 | 117.5° | 144.5° |
| H262 | C26 | N27 | C28 | 100.9° | 118.4° |
| H262 | C26 | C29 | C30 | 133.3° | 141.7° |
| H262 | C26 | C29 | H291 | 101.4° | 99.9° |
| H262 | C26 | C29 | H292 | 8.1° | 23.3° |
| N27 | C28 | C30 | H281 | 125.3° | 118.9° |
| N27 | C28 | C30 | H282 | 125.3° | 118.9° |
| N27 | C28 | H281 | H282 | 122.8° | 122.3° |
| N27 | C28 | C30 | C29 | 49.0° | 37.0° |
| N27 | C28 | C30 | H301 | 174.3° | 81.0° |
| N27 | C28 | C30 | H302 | 76.3° | 155.2° |
| C30 | C28 | H281 | H282 | 122.8° | 122.2° |
| C28 | C30 | C29 | H301 | 125.3° | 118.1° |
| C28 | C30 | C29 | H302 | 125.3° | 118.2° |
| C28 | C30 | C29 | H291 | 161.8° | 154.0° |
| C28 | C30 | C29 | H292 | 88.7° | 82.8° |
| C28 | C30 | H301 | H302 | 121.2° | 123.9° |
| H281 | C28 | C30 | C29 | 76.3° | 81.8° |
| H281 | C28 | C30 | H301 | 49.0° | 160.1° |
| H281 | C28 | C30 | H302 | 158.5° | 36.3° |
| H282 | C28 | C30 | C29 | 174.3° | 155.9° |
| H282 | C28 | C30 | H301 | 60.4° | 37.9° |
| H282 | C28 | C30 | H302 | 49.0° | 85.9° |
| C30 | C29 | H291 | H292 | 118.9° | 123.2° |
| C29 | C30 | H301 | H302 | 121.2° | 123.9° |
| H291 | C29 | C30 | H301 | 72.9° | 35.9° |
| H291 | C29 | C30 | H302 | 36.5° | 87.8° |
| H292 | C29 | C30 | H301 | 36.6° | 159.2° |
| H292 | C29 | C30 | H302 | 146.0° | 35.4° |
