CY6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C5 | C6 | sing | 1.51Å | 1.51Å | |
| C5 | H51 | sing | 1.09Å | 1.10Å | |
| C5 | H52 | sing | 1.09Å | 1.10Å | |
| C5 | H53 | sing | 1.09Å | 1.10Å | |
| C6 | O7 | sing | 1.34Å | 1.34Å | Aromatic |
| C6 | C10 | doub | 1.35Å | 1.31Å | Aromatic |
| O7 | N8 | sing | 1.21Å | 1.43Å | Aromatic |
| N8 | C9 | doub | 1.31Å | 1.28Å | Aromatic |
| C9 | C10 | sing | 1.42Å | 1.47Å | Aromatic |
| C9 | C11 | sing | 1.48Å | 1.47Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C11 | O12 | doub | 1.22Å | 1.26Å | |
| C11 | N13 | sing | 1.35Å | 1.37Å | |
| N13 | C14 | sing | 1.46Å | 1.48Å | |
| N13 | H13 | sing | 0.97Å | 1.00Å | |
| C14 | C15 | sing | 1.53Å | 1.63Å | |
| C14 | C18 | sing | 1.51Å | 1.56Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C15 | C16 | sing | 1.53Å | 1.57Å | |
| C15 | C17 | sing | 1.53Å | 1.57Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C16 | H163 | sing | 1.09Å | 1.10Å | |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| C17 | H172 | sing | 1.09Å | 1.10Å | |
| C17 | H173 | sing | 1.09Å | 1.10Å | |
| C18 | O19 | doub | 1.21Å | 1.26Å | |
| C18 | C20 | sing | 1.51Å | 1.53Å | |
| C20 | C21 | sing | 1.53Å | 1.58Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C20 | H202 | sing | 1.09Å | 1.10Å | |
| C21 | C22 | sing | 1.53Å | 1.58Å | |
| C21 | C29 | sing | 1.51Å | 1.55Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C22 | C23 | sing | 1.51Å | 1.52Å | |
| C22 | H221 | sing | 1.09Å | 1.10Å | |
| C22 | H222 | sing | 1.09Å | 1.10Å | |
| C23 | C24 | doub | 1.31Å | 1.45Å | |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| C24 | C25 | sing | 1.51Å | 1.49Å | |
| C24 | C26 | sing | 1.51Å | 1.51Å | |
| C25 | H251 | sing | 1.09Å | 1.10Å | |
| C25 | H252 | sing | 1.09Å | 1.10Å | |
| C25 | H253 | sing | 1.09Å | 1.10Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C26 | H262 | sing | 1.09Å | 1.10Å | |
| C26 | H263 | sing | 1.09Å | 1.10Å | |
| C29 | O30 | doub | 1.21Å | 1.30Å | |
| C29 | N31 | sing | 1.35Å | 1.37Å | |
| N31 | C32 | sing | 1.46Å | 1.47Å | |
| N31 | H31 | sing | 0.97Å | 1.00Å | |
| C32 | C33 | sing | 1.51Å | 1.51Å | |
| C32 | C40 | sing | 1.53Å | 1.57Å | |
| C32 | H32 | sing | 1.09Å | 1.10Å | |
| C33 | C34 | doub | 1.33Å | 1.58Å | |
| C33 | H33 | sing | 1.08Å | 1.08Å | |
| C34 | C35 | sing | 1.47Å | 1.54Å | |
| C34 | H34 | sing | 1.08Å | 1.08Å | |
| C35 | O36 | doub | 1.22Å | 1.25Å | |
| C35 | O37 | sing | 1.35Å | 1.39Å | |
| O37 | C38 | sing | 1.45Å | 1.46Å | |
| C38 | C39 | sing | 1.53Å | 1.55Å | |
| C38 | H381 | sing | 1.09Å | 1.10Å | |
| C38 | H382 | sing | 1.09Å | 1.10Å | |
| C39 | H391 | sing | 1.09Å | 1.10Å | |
| C39 | H392 | sing | 1.09Å | 1.10Å | |
| C39 | H393 | sing | 1.09Å | 1.10Å | |
| C40 | C41 | sing | 1.53Å | 1.56Å | |
| C40 | H401 | sing | 1.09Å | 1.10Å | |
| C40 | H402 | sing | 1.09Å | 1.10Å | |
| C41 | C42 | sing | 1.55Å | 1.55Å | |
| C41 | C45 | sing | 1.51Å | 1.50Å | |
| C41 | H41 | sing | 1.09Å | 1.10Å | |
| C42 | C43 | sing | 1.55Å | 1.55Å | |
| C42 | H421 | sing | 1.09Å | 1.10Å | |
| C42 | H422 | sing | 1.09Å | 1.10Å | |
| C43 | N44 | sing | 1.47Å | 1.47Å | |
| C43 | H431 | sing | 1.09Å | 1.10Å | |
| C43 | H432 | sing | 1.09Å | 1.10Å | |
| N44 | C45 | sing | 1.35Å | 1.35Å | |
| N44 | H44 | sing | 0.97Å | 1.00Å | |
| C45 | O46 | doub | 1.21Å | 1.26Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C6 | C5 | H51 | 109.5° | 109.5° |
| C6 | C5 | H52 | 109.5° | 109.5° |
| C6 | C5 | H53 | 109.5° | 109.5° |
| C5 | C6 | O7 | 119.0° | 126.6° |
| C5 | C6 | C10 | 125.7° | 126.7° |
| H51 | C5 | H52 | 109.5° | 109.4° |
| H51 | C5 | H53 | 109.5° | 109.4° |
| H52 | C5 | H53 | 109.5° | 109.4° |
| O7 | C6 | C10 | 115.3° | 106.7° |
| C6 | O7 | N8 | 106.0° | 111.8° |
| C6 | C10 | C9 | 100.0° | 103.9° |
| C6 | C10 | H10 | 130.0° | 128.0° |
| O7 | N8 | C9 | 105.0° | 111.4° |
| N8 | C9 | C10 | 113.6° | 106.2° |
| N8 | C9 | C11 | 125.6° | 127.0° |
| C10 | C9 | C11 | 120.7° | 126.9° |
| C9 | C10 | H10 | 130.0° | 128.1° |
| C9 | C11 | O12 | 114.3° | 120.0° |
| C9 | C11 | N13 | 123.6° | 120.0° |
| O12 | C11 | N13 | 122.2° | 120.0° |
| C11 | N13 | C14 | 129.3° | 120.0° |
| C11 | N13 | H13 | 115.4° | 119.9° |
| C14 | N13 | H13 | 115.3° | 120.0° |
| N13 | C14 | C15 | 114.0° | 109.5° |
| N13 | C14 | C18 | 109.7° | 109.5° |
| N13 | C14 | H14 | 107.4° | 109.5° |
| C15 | C14 | C18 | 112.8° | 109.5° |
| C15 | C14 | H14 | 103.8° | 109.4° |
| C14 | C15 | C16 | 116.6° | 109.4° |
| C14 | C15 | C17 | 111.5° | 109.5° |
| C14 | C15 | H15 | 102.2° | 109.4° |
| C18 | C14 | H14 | 108.7° | 109.5° |
| C14 | C18 | O19 | 122.5° | 120.0° |
| C14 | C18 | C20 | 115.0° | 120.0° |
| C16 | C15 | C17 | 107.4° | 109.5° |
| C16 | C15 | H15 | 106.7° | 109.5° |
| C15 | C16 | H161 | 109.4° | 109.5° |
| C15 | C16 | H162 | 109.5° | 109.5° |
| C15 | C16 | H163 | 109.5° | 109.6° |
| C17 | C15 | H15 | 112.4° | 109.5° |
| C15 | C17 | H171 | 109.4° | 109.5° |
| C15 | C17 | H172 | 109.5° | 109.4° |
| C15 | C17 | H173 | 109.5° | 109.5° |
| H161 | C16 | H162 | 109.5° | 109.4° |
| H161 | C16 | H163 | 109.5° | 109.5° |
| H162 | C16 | H163 | 109.4° | 109.4° |
| H171 | C17 | H172 | 109.5° | 109.5° |
| H171 | C17 | H173 | 109.5° | 109.4° |
| H172 | C17 | H173 | 109.4° | 109.5° |
| O19 | C18 | C20 | 122.5° | 120.0° |
| C18 | C20 | C21 | 120.8° | 109.4° |
| C18 | C20 | H201 | 103.2° | 109.5° |
| C18 | C20 | H202 | 105.9° | 109.5° |
| C21 | C20 | H201 | 103.2° | 109.5° |
| C21 | C20 | H202 | 105.9° | 109.5° |
| C20 | C21 | C22 | 106.9° | 109.5° |
| C20 | C21 | C29 | 104.2° | 109.4° |
| C20 | C21 | H21 | 114.9° | 109.5° |
| H201 | C20 | H202 | 118.8° | 109.5° |
| C22 | C21 | C29 | 110.9° | 109.4° |
| C22 | C21 | H21 | 108.7° | 109.4° |
| C21 | C22 | C23 | 110.8° | 109.5° |
| C21 | C22 | H221 | 108.7° | 109.4° |
| C21 | C22 | H222 | 109.0° | 109.4° |
| C29 | C21 | H21 | 111.2° | 109.5° |
| C21 | C29 | O30 | 117.4° | 120.0° |
| C21 | C29 | N31 | 122.4° | 120.0° |
| C23 | C22 | H221 | 108.7° | 109.5° |
| C23 | C22 | H222 | 109.0° | 109.5° |
| C22 | C23 | C24 | 122.0° | 120.0° |
| C22 | C23 | H23 | 119.0° | 120.0° |
| H221 | C22 | H222 | 110.5° | 109.4° |
| C24 | C23 | H23 | 119.0° | 120.0° |
| C23 | C24 | C25 | 119.6° | 120.0° |
| C23 | C24 | C26 | 121.1° | 120.0° |
| C25 | C24 | C26 | 119.3° | 120.0° |
| C24 | C25 | H251 | 109.4° | 109.5° |
| C24 | C25 | H252 | 109.4° | 109.5° |
| C24 | C25 | H253 | 109.5° | 109.5° |
| C24 | C26 | H261 | 109.5° | 109.5° |
| C24 | C26 | H262 | 109.5° | 109.5° |
| C24 | C26 | H263 | 109.5° | 109.5° |
| H251 | C25 | H252 | 109.5° | 109.4° |
| H251 | C25 | H253 | 109.5° | 109.5° |
| H252 | C25 | H253 | 109.5° | 109.4° |
| H261 | C26 | H262 | 109.5° | 109.4° |
| H261 | C26 | H263 | 109.4° | 109.5° |
| H262 | C26 | H263 | 109.5° | 109.5° |
| O30 | C29 | N31 | 120.2° | 120.0° |
| C29 | N31 | C32 | 119.1° | 120.0° |
| C29 | N31 | H31 | 120.5° | 120.0° |
| C32 | N31 | H31 | 120.4° | 120.0° |
| N31 | C32 | C33 | 122.8° | 109.5° |
| N31 | C32 | C40 | 110.1° | 109.5° |
| N31 | C32 | H32 | 98.4° | 109.6° |
| C33 | C32 | C40 | 108.1° | 109.4° |
| C33 | C32 | H32 | 100.9° | 109.5° |
| C32 | C33 | C34 | 105.8° | 120.0° |
| C32 | C33 | H33 | 127.1° | 120.0° |
| C40 | C32 | H32 | 116.3° | 109.4° |
| C32 | C40 | C41 | 116.8° | 109.5° |
| C32 | C40 | H401 | 105.4° | 109.5° |
| C32 | C40 | H402 | 107.1° | 109.5° |
| C34 | C33 | H33 | 127.1° | 120.0° |
| C33 | C34 | C35 | 115.4° | 120.0° |
| C33 | C34 | H34 | 122.3° | 120.0° |
| C35 | C34 | H34 | 122.3° | 120.0° |
| C34 | C35 | O36 | 120.3° | 120.0° |
| C34 | C35 | O37 | 124.1° | 120.0° |
| O36 | C35 | O37 | 115.6° | 120.0° |
| C35 | O37 | C38 | 120.4° | 120.0° |
| O37 | C38 | C39 | 112.8° | 109.5° |
| O37 | C38 | H381 | 107.6° | 109.5° |
| O37 | C38 | H382 | 108.4° | 109.5° |
| C39 | C38 | H381 | 107.6° | 109.5° |
| C39 | C38 | H382 | 108.4° | 109.4° |
| C38 | C39 | H391 | 109.4° | 109.5° |
| C38 | C39 | H392 | 109.4° | 109.4° |
| C38 | C39 | H393 | 109.5° | 109.5° |
| H381 | C38 | H382 | 112.2° | 109.4° |
| H391 | C39 | H392 | 109.5° | 109.4° |
| H391 | C39 | H393 | 109.4° | 109.6° |
| H392 | C39 | H393 | 109.5° | 109.5° |
| C41 | C40 | H401 | 105.4° | 109.5° |
| C41 | C40 | H402 | 107.1° | 109.4° |
| C40 | C41 | C42 | 120.7° | 110.5° |
| C40 | C41 | C45 | 115.1° | 110.4° |
| C40 | C41 | H41 | 94.2° | 110.5° |
| H401 | C40 | H402 | 115.4° | 109.4° |
| C42 | C41 | C45 | 100.1° | 104.3° |
| C42 | C41 | H41 | 110.8° | 110.5° |
| C41 | C42 | C43 | 101.3° | 101.7° |
| C41 | C42 | H421 | 114.0° | 111.0° |
| C41 | C42 | H422 | 112.3° | 110.9° |
| C45 | C41 | H41 | 117.0° | 110.5° |
| C41 | C45 | N44 | 108.5° | 110.0° |
| C41 | C45 | O46 | 123.6° | 125.1° |
| C43 | C42 | H421 | 114.0° | 111.0° |
| C43 | C42 | H422 | 112.3° | 111.0° |
| C42 | C43 | N44 | 99.3° | 105.5° |
| C42 | C43 | H431 | 115.1° | 110.2° |
| C42 | C43 | H432 | 113.0° | 110.3° |
| H421 | C42 | H422 | 103.4° | 110.9° |
| N44 | C43 | H431 | 115.1° | 110.2° |
| N44 | C43 | H432 | 113.0° | 110.2° |
| C43 | N44 | C45 | 113.0° | 111.3° |
| C43 | N44 | H44 | 123.5° | 124.3° |
| H431 | C43 | H432 | 101.9° | 110.3° |
| C45 | N44 | H44 | 123.5° | 124.4° |
| N44 | C45 | O46 | 127.9° | 124.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C6 | C5 | H51 | H52 | 120.0° | 120.1° |
| C6 | C5 | H51 | H53 | 120.0° | 120.0° |
| C6 | C5 | H52 | H53 | 120.0° | 120.1° |
| C5 | C6 | O7 | C10 | 179.9° | 179.9° |
| C5 | C6 | O7 | N8 | 179.8° | 179.7° |
| C5 | C6 | C10 | C9 | 179.8° | 179.9° |
| C5 | C6 | C10 | H10 | 0.2° | 0.1° |
| H51 | C5 | H52 | H53 | 120.0° | 119.9° |
| H51 | C5 | C6 | O7 | 19.3° | 90.0° |
| H51 | C5 | C6 | C10 | 160.6° | 89.9° |
| H52 | C5 | C6 | O7 | 100.7° | 30.1° |
| H52 | C5 | C6 | C10 | 79.4° | 150.0° |
| H53 | C5 | C6 | O7 | 139.3° | 150.1° |
| H53 | C5 | C6 | C10 | 40.6° | 30.0° |
| C6 | O7 | N8 | C9 | 0.0° | 0.5° |
| O7 | C6 | C10 | C9 | 0.1° | 0.0° |
| O7 | C6 | C10 | H10 | 179.9° | 180.0° |
| C10 | C6 | O7 | N8 | 0.1° | 0.3° |
| C6 | C10 | C9 | N8 | 0.0° | 0.3° |
| C6 | C10 | C9 | H10 | 180.0° | 179.9° |
| C6 | C10 | C9 | C11 | 180.0° | 179.9° |
| O7 | N8 | C9 | C10 | 0.0° | 0.4° |
| O7 | N8 | C9 | C11 | 179.9° | 179.8° |
| N8 | C9 | C10 | C11 | 179.9° | 179.8° |
| N8 | C9 | C10 | H10 | 180.0° | 179.8° |
| N8 | C9 | C11 | O12 | 67.6° | 179.7° |
| N8 | C9 | C11 | N13 | 114.3° | 0.2° |
| C10 | C9 | C11 | O12 | 112.4° | 0.1° |
| C10 | C9 | C11 | N13 | 65.8° | 180.0° |
| C11 | C9 | C10 | H10 | 0.0° | 0.0° |
| C9 | C11 | O12 | N13 | 178.2° | 179.9° |
| C9 | C11 | N13 | C14 | 177.5° | 180.0° |
| C9 | C11 | N13 | H13 | 2.5° | 0.1° |
| O12 | C11 | N13 | C14 | 0.5° | 0.0° |
| O12 | C11 | N13 | H13 | 179.5° | 180.0° |
| C11 | N13 | C14 | H13 | 180.0° | 180.0° |
| C11 | N13 | C14 | C15 | 165.6° | 85.0° |
| C11 | N13 | C14 | C18 | 66.8° | 155.0° |
| C11 | N13 | C14 | H14 | 51.1° | 35.0° |
| N13 | C14 | C15 | C18 | 126.0° | 120.0° |
| N13 | C14 | C15 | H14 | 116.5° | 120.0° |
| N13 | C14 | C18 | H14 | 117.1° | 120.1° |
| N13 | C14 | C15 | C16 | 177.4° | 173.7° |
| N13 | C14 | C15 | C17 | 58.8° | 53.6° |
| N13 | C14 | C15 | H15 | 61.4° | 66.4° |
| N13 | C14 | C18 | O19 | 56.3° | 103.7° |
| N13 | C14 | C18 | C20 | 126.0° | 76.3° |
| H13 | N13 | C14 | C15 | 14.5° | 95.0° |
| H13 | N13 | C14 | C18 | 113.2° | 25.0° |
| H13 | N13 | C14 | H14 | 128.9° | 145.1° |
| C15 | C14 | C18 | H14 | 114.6° | 119.9° |
| C14 | C15 | C16 | C17 | 125.9° | 120.0° |
| C14 | C15 | C16 | H15 | 113.4° | 119.9° |
| C14 | C15 | C17 | H15 | 114.1° | 120.0° |
| C14 | C15 | C16 | H161 | 130.6° | 63.7° |
| C14 | C15 | C16 | H162 | 109.4° | 176.4° |
| C14 | C15 | C16 | H163 | 10.6° | 56.3° |
| C14 | C15 | C17 | H171 | 55.2° | 60.0° |
| C14 | C15 | C17 | H172 | 64.8° | 180.0° |
| C14 | C15 | C17 | H173 | 175.2° | 60.0° |
| C15 | C14 | C18 | O19 | 72.0° | 16.3° |
| C15 | C14 | C18 | C20 | 105.7° | 163.7° |
| C18 | C14 | C15 | C16 | 56.6° | 66.3° |
| C18 | C14 | C15 | C17 | 67.2° | 173.6° |
| C18 | C14 | C15 | H15 | 172.6° | 53.6° |
| C14 | C18 | O19 | C20 | 177.5° | 180.0° |
| C14 | C18 | C20 | C21 | 176.0° | 174.2° |
| C14 | C18 | C20 | H201 | 61.5° | 65.8° |
| C14 | C18 | C20 | H202 | 64.0° | 54.2° |
| H14 | C14 | C15 | C16 | 60.9° | 53.7° |
| H14 | C14 | C15 | C17 | 175.3° | 66.4° |
| H14 | C14 | C15 | H15 | 55.0° | 173.6° |
| H14 | C14 | C18 | O19 | 173.4° | 136.2° |
| H14 | C14 | C18 | C20 | 8.9° | 43.8° |
| C16 | C15 | C17 | H15 | 117.0° | 120.0° |
| C15 | C16 | H161 | H162 | 120.0° | 120.0° |
| C15 | C16 | H161 | H163 | 120.0° | 120.1° |
| C15 | C16 | H162 | H163 | 120.0° | 120.1° |
| C16 | C15 | C17 | H171 | 73.7° | 180.0° |
| C16 | C15 | C17 | H172 | 166.3° | 60.0° |
| C16 | C15 | C17 | H173 | 46.3° | 60.0° |
| C17 | C15 | C16 | H161 | 4.7° | 56.3° |
| C17 | C15 | C16 | H162 | 124.7° | 63.6° |
| C17 | C15 | C16 | H163 | 115.3° | 176.4° |
| C15 | C17 | H171 | H172 | 120.0° | 120.0° |
| C15 | C17 | H171 | H173 | 120.0° | 120.0° |
| C15 | C17 | H172 | H173 | 120.0° | 120.0° |
| H15 | C15 | C16 | H161 | 116.0° | 176.4° |
| H15 | C15 | C16 | H162 | 4.0° | 56.4° |
| H15 | C15 | C16 | H163 | 124.0° | 63.6° |
| H15 | C15 | C17 | H171 | 169.2° | 60.0° |
| H15 | C15 | C17 | H172 | 49.2° | 60.1° |
| H15 | C15 | C17 | H173 | 70.7° | 179.9° |
| H161 | C16 | H162 | H163 | 120.0° | 119.9° |
| H171 | C17 | H172 | H173 | 120.0° | 120.0° |
| O19 | C18 | C20 | C21 | 1.7° | 5.8° |
| O19 | C18 | C20 | H201 | 116.1° | 114.1° |
| O19 | C18 | C20 | H202 | 118.3° | 125.8° |
| C18 | C20 | C21 | H201 | 114.4° | 119.9° |
| C18 | C20 | C21 | H202 | 120.0° | 120.0° |
| C18 | C20 | H201 | H202 | 116.7° | 120.0° |
| C18 | C20 | C21 | C22 | 178.5° | 65.0° |
| C18 | C20 | C21 | C29 | 64.1° | 175.0° |
| C18 | C20 | C21 | H21 | 57.8° | 55.0° |
| C21 | C20 | H201 | H202 | 116.8° | 120.0° |
| C20 | C21 | C22 | C29 | 112.9° | 120.0° |
| C20 | C21 | C22 | H21 | 124.5° | 120.0° |
| C20 | C21 | C29 | H21 | 124.3° | 120.1° |
| C20 | C21 | C22 | C23 | 65.9° | 174.2° |
| C20 | C21 | C22 | H221 | 174.7° | 54.1° |
| C20 | C21 | C22 | H222 | 54.1° | 65.8° |
| C20 | C21 | C29 | O30 | 35.4° | 20.2° |
| C20 | C21 | C29 | N31 | 143.6° | 159.7° |
| H201 | C20 | C21 | C22 | 67.1° | 175.0° |
| H201 | C20 | C21 | C29 | 50.3° | 55.1° |
| H201 | C20 | C21 | H21 | 172.2° | 65.0° |
| H202 | C20 | C21 | C22 | 58.5° | 55.0° |
| H202 | C20 | C21 | C29 | 175.9° | 65.0° |
| H202 | C20 | C21 | H21 | 62.2° | 174.9° |
| C22 | C21 | C29 | H21 | 121.0° | 119.9° |
| C21 | C22 | C23 | H221 | 119.4° | 120.0° |
| C21 | C22 | C23 | H222 | 120.0° | 120.0° |
| C21 | C22 | H221 | H222 | 119.7° | 119.9° |
| C21 | C22 | C23 | C24 | 178.1° | 115.9° |
| C21 | C22 | C23 | H23 | 1.9° | 64.2° |
| C22 | C21 | C29 | O30 | 79.2° | 99.8° |
| C22 | C21 | C29 | N31 | 101.8° | 80.3° |
| C29 | C21 | C22 | C23 | 178.8° | 65.9° |
| C29 | C21 | C22 | H221 | 61.7° | 174.1° |
| C29 | C21 | C22 | H222 | 58.9° | 54.2° |
| C21 | C29 | O30 | N31 | 179.0° | 180.0° |
| C21 | C29 | N31 | C32 | 179.1° | 176.1° |
| C21 | C29 | N31 | H31 | 0.9° | 3.9° |
| H21 | C21 | C22 | C23 | 58.6° | 54.1° |
| H21 | C21 | C22 | H221 | 60.8° | 65.9° |
| H21 | C21 | C22 | H222 | 178.6° | 174.1° |
| H21 | C21 | C29 | O30 | 159.7° | 140.3° |
| H21 | C21 | C29 | N31 | 19.3° | 39.7° |
| C23 | C22 | H221 | H222 | 119.6° | 120.0° |
| C22 | C23 | C24 | H23 | 180.0° | 180.0° |
| C22 | C23 | C24 | C25 | 159.9° | 7.5° |
| C22 | C23 | C24 | C26 | 21.3° | 172.5° |
| H221 | C22 | C23 | C24 | 62.5° | 124.1° |
| H221 | C22 | C23 | H23 | 117.5° | 55.9° |
| H222 | C22 | C23 | C24 | 58.1° | 4.1° |
| H222 | C22 | C23 | H23 | 121.9° | 175.8° |
| C23 | C24 | C25 | C26 | 178.8° | 180.0° |
| C23 | C24 | C25 | H251 | 169.1° | 5.5° |
| C23 | C24 | C25 | H252 | 70.9° | 125.5° |
| C23 | C24 | C25 | H253 | 49.1° | 114.5° |
| C23 | C24 | C26 | H261 | 18.1° | 0.0° |
| C23 | C24 | C26 | H262 | 101.9° | 120.0° |
| C23 | C24 | C26 | H263 | 138.1° | 120.0° |
| H23 | C23 | C24 | C25 | 20.1° | 172.5° |
| H23 | C23 | C24 | C26 | 158.7° | 7.5° |
| C24 | C25 | H251 | H252 | 120.0° | 120.0° |
| C24 | C25 | H251 | H253 | 120.0° | 120.0° |
| C24 | C25 | H252 | H253 | 120.0° | 120.0° |
| C25 | C24 | C26 | H261 | 163.1° | 180.0° |
| C25 | C24 | C26 | H262 | 76.9° | 60.0° |
| C25 | C24 | C26 | H263 | 43.1° | 60.0° |
| C26 | C24 | C25 | H251 | 12.1° | 174.5° |
| C26 | C24 | C25 | H252 | 107.9° | 54.5° |
| C26 | C24 | C25 | H253 | 132.1° | 65.5° |
| C24 | C26 | H261 | H262 | 120.0° | 120.0° |
| C24 | C26 | H261 | H263 | 120.0° | 120.0° |
| C24 | C26 | H262 | H263 | 120.0° | 120.0° |
| H251 | C25 | H252 | H253 | 120.0° | 120.0° |
| H261 | C26 | H262 | H263 | 120.0° | 120.0° |
| O30 | C29 | N31 | C32 | 0.1° | 4.0° |
| O30 | C29 | N31 | H31 | 179.9° | 176.1° |
| C29 | N31 | C32 | H31 | 180.0° | 180.0° |
| C29 | N31 | C32 | C33 | 115.1° | 154.5° |
| C29 | N31 | C32 | C40 | 115.8° | 85.6° |
| C29 | N31 | C32 | H32 | 6.3° | 34.4° |
| N31 | C32 | C33 | C40 | 129.9° | 120.0° |
| N31 | C32 | C33 | H32 | 107.6° | 120.1° |
| N31 | C32 | C40 | H32 | 110.8° | 120.1° |
| N31 | C32 | C33 | C34 | 66.7° | 120.0° |
| N31 | C32 | C33 | H33 | 113.3° | 59.9° |
| N31 | C32 | C40 | C41 | 112.3° | 175.1° |
| N31 | C32 | C40 | H401 | 131.1° | 55.1° |
| N31 | C32 | C40 | H402 | 7.7° | 64.9° |
| H31 | N31 | C32 | C33 | 64.9° | 25.5° |
| H31 | N31 | C32 | C40 | 64.2° | 94.4° |
| H31 | N31 | C32 | H32 | 173.7° | 145.6° |
| C33 | C32 | C40 | H32 | 112.6° | 119.9° |
| C32 | C33 | C34 | H33 | 180.0° | 179.9° |
| C32 | C33 | C34 | C35 | 174.3° | 179.9° |
| C32 | C33 | C34 | H34 | 5.6° | 0.0° |
| C33 | C32 | C40 | C41 | 111.0° | 64.9° |
| C33 | C32 | C40 | H401 | 5.6° | 175.0° |
| C33 | C32 | C40 | H402 | 129.0° | 55.1° |
| C40 | C32 | C33 | C34 | 163.4° | 120.0° |
| C40 | C32 | C33 | H33 | 16.6° | 60.1° |
| C32 | C40 | C41 | H401 | 116.6° | 120.0° |
| C32 | C40 | C41 | H402 | 120.0° | 120.0° |
| C32 | C40 | H401 | H402 | 118.0° | 120.0° |
| C32 | C40 | C41 | C42 | 49.0° | 173.9° |
| C32 | C40 | C41 | C45 | 169.4° | 71.2° |
| C32 | C40 | C41 | H41 | 68.2° | 51.3° |
| H32 | C32 | C33 | C34 | 40.8° | 0.1° |
| H32 | C32 | C33 | H33 | 139.2° | 180.0° |
| H32 | C32 | C40 | C41 | 1.5° | 55.0° |
| H32 | C32 | C40 | H401 | 118.1° | 65.0° |
| H32 | C32 | C40 | H402 | 118.5° | 175.0° |
| C33 | C34 | C35 | H34 | 180.0° | 179.9° |
| C33 | C34 | C35 | O36 | 1.8° | 0.1° |
| C33 | C34 | C35 | O37 | 179.7° | 180.0° |
| H33 | C33 | C34 | C35 | 5.7° | 0.0° |
| H33 | C33 | C34 | H34 | 174.3° | 180.0° |
| C34 | C35 | O36 | O37 | 178.7° | 179.9° |
| C34 | C35 | O37 | C38 | 67.7° | 179.9° |
| H34 | C34 | C35 | O36 | 178.2° | 180.0° |
| H34 | C34 | C35 | O37 | 0.3° | 0.1° |
| O36 | C35 | O37 | C38 | 110.9° | 0.0° |
| C35 | O37 | C38 | C39 | 94.3° | 180.0° |
| C35 | O37 | C38 | H381 | 24.3° | 60.0° |
| C35 | O37 | C38 | H382 | 145.7° | 60.0° |
| O37 | C38 | C39 | H381 | 118.5° | 120.0° |
| O37 | C38 | C39 | H382 | 120.0° | 120.1° |
| O37 | C38 | H381 | H382 | 119.1° | 120.0° |
| O37 | C38 | C39 | H391 | 64.1° | 179.9° |
| O37 | C38 | C39 | H392 | 175.8° | 60.0° |
| O37 | C38 | C39 | H393 | 55.8° | 60.0° |
| C39 | C38 | H381 | H382 | 119.1° | 119.9° |
| C38 | C39 | H391 | H392 | 120.0° | 119.9° |
| C38 | C39 | H391 | H393 | 120.0° | 120.1° |
| C38 | C39 | H392 | H393 | 120.0° | 120.0° |
| H381 | C38 | C39 | H391 | 54.4° | 59.9° |
| H381 | C38 | C39 | H392 | 65.6° | 60.1° |
| H381 | C38 | C39 | H393 | 174.4° | 180.0° |
| H382 | C38 | C39 | H391 | 175.9° | 60.0° |
| H382 | C38 | C39 | H392 | 55.9° | 179.9° |
| H382 | C38 | C39 | H393 | 64.1° | 60.1° |
| H391 | C39 | H392 | H393 | 120.0° | 120.1° |
| C41 | C40 | H401 | H402 | 117.9° | 120.0° |
| C40 | C41 | C42 | C45 | 127.5° | 118.7° |
| C40 | C41 | C42 | H41 | 108.4° | 122.6° |
| C40 | C41 | C45 | H41 | 109.2° | 122.5° |
| C40 | C41 | C42 | C43 | 166.8° | 143.5° |
| C40 | C41 | C42 | H421 | 70.3° | 25.3° |
| C40 | C41 | C42 | H422 | 46.8° | 98.5° |
| C40 | C41 | C45 | N44 | 156.9° | 134.9° |
| C40 | C41 | C45 | O46 | 23.8° | 45.0° |
| H401 | C40 | C41 | C42 | 67.6° | 66.1° |
| H401 | C40 | C41 | C45 | 52.7° | 48.8° |
| H401 | C40 | C41 | H41 | 175.2° | 171.3° |
| H402 | C40 | C41 | C42 | 169.0° | 53.9° |
| H402 | C40 | C41 | C45 | 70.6° | 168.8° |
| H402 | C40 | C41 | H41 | 51.8° | 68.8° |
| C42 | C41 | C45 | H41 | 119.7° | 118.8° |
| C41 | C42 | C43 | H421 | 122.9° | 118.1° |
| C41 | C42 | C43 | H422 | 120.0° | 118.1° |
| C41 | C42 | H421 | H422 | 122.2° | 123.8° |
| C41 | C42 | C43 | N44 | 38.6° | 25.4° |
| C41 | C42 | C43 | H431 | 84.8° | 144.4° |
| C41 | C42 | C43 | H432 | 158.7° | 93.6° |
| C42 | C41 | C45 | N44 | 25.8° | 16.1° |
| C42 | C41 | C45 | O46 | 154.9° | 163.7° |
| C45 | C41 | C42 | C43 | 39.4° | 24.8° |
| C45 | C41 | C42 | H421 | 162.3° | 93.4° |
| C45 | C41 | C42 | H422 | 80.6° | 142.8° |
| C41 | C45 | N44 | C43 | 0.6° | 0.6° |
| C41 | C45 | N44 | O46 | 179.3° | 179.9° |
| C41 | C45 | N44 | H44 | 179.4° | 179.5° |
| H41 | C41 | C42 | C43 | 84.7° | 94.0° |
| H41 | C41 | C42 | H421 | 38.1° | 147.9° |
| H41 | C41 | C42 | H422 | 155.3° | 24.1° |
| H41 | C41 | C45 | N44 | 94.0° | 102.6° |
| H41 | C41 | C45 | O46 | 85.4° | 77.5° |
| C43 | C42 | H421 | H422 | 122.2° | 123.8° |
| C42 | C43 | N44 | H431 | 123.5° | 119.0° |
| C42 | C43 | N44 | H432 | 120.0° | 119.1° |
| C42 | C43 | H431 | H432 | 122.7° | 122.0° |
| C42 | C43 | N44 | C45 | 24.7° | 17.1° |
| C42 | C43 | N44 | H44 | 155.2° | 162.9° |
| H421 | C42 | C43 | N44 | 161.5° | 92.7° |
| H421 | C42 | C43 | H431 | 38.0° | 26.3° |
| H421 | C42 | C43 | H432 | 78.5° | 148.3° |
| H422 | C42 | C43 | N44 | 81.4° | 143.5° |
| H422 | C42 | C43 | H431 | 155.2° | 97.5° |
| H422 | C42 | C43 | H432 | 38.6° | 24.5° |
| N44 | C43 | H431 | H432 | 122.7° | 121.9° |
| C43 | N44 | C45 | H44 | 180.0° | 179.9° |
| C43 | N44 | C45 | O46 | 180.0° | 179.6° |
| H431 | C43 | N44 | C45 | 98.7° | 136.1° |
| H431 | C43 | N44 | H44 | 81.3° | 44.0° |
| H432 | C43 | N44 | C45 | 144.8° | 101.9° |
| H432 | C43 | N44 | H44 | 35.2° | 78.0° |
| H44 | N44 | C45 | O46 | 0.1° | 0.4° |
