OY6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C01 | O03 | sing | 1.43Å | 1.40Å | |
| C08 | C11 | doub | 1.38Å | 1.52Å | Aromatic |
| C08 | C05 | sing | 1.39Å | 1.54Å | Aromatic |
| O03 | C05 | sing | 1.36Å | 1.43Å | |
| C11 | C14 | sing | 1.38Å | 1.52Å | Aromatic |
| C05 | C17 | doub | 1.39Å | 1.53Å | Aromatic |
| C37 | C38 | doub | 1.33Å | 1.48Å | Aromatic |
| C37 | C36 | sing | 1.38Å | 1.61Å | Aromatic |
| C38 | S04 | sing | 1.76Å | 1.58Å | Aromatic |
| C14 | C16 | doub | 1.38Å | 1.53Å | Aromatic |
| C36 | C35 | doub | 1.33Å | 1.48Å | Aromatic |
| C17 | C16 | sing | 1.39Å | 1.51Å | Aromatic |
| C17 | N02 | sing | 1.40Å | 1.45Å | |
| N02 | C18 | sing | 1.35Å | 1.40Å | |
| S04 | C35 | sing | 1.76Å | 1.58Å | Aromatic |
| C35 | C34 | sing | 1.51Å | 1.55Å | |
| C20 | C21 | doub | 1.38Å | 1.49Å | Aromatic |
| C20 | C19 | sing | 1.40Å | 1.52Å | Aromatic |
| C18 | C19 | sing | 1.48Å | 1.49Å | |
| C18 | O07 | doub | 1.22Å | 1.16Å | |
| C21 | C22 | sing | 1.39Å | 1.51Å | Aromatic |
| C19 | C40 | doub | 1.40Å | 1.52Å | Aromatic |
| C34 | N09 | sing | 1.46Å | 1.51Å | |
| C22 | N06 | sing | 1.39Å | 1.37Å | |
| C22 | C39 | doub | 1.39Å | 1.50Å | Aromatic |
| N06 | C23 | sing | 1.35Å | 1.42Å | |
| C40 | C39 | sing | 1.38Å | 1.51Å | Aromatic |
| N09 | C23 | sing | 1.35Å | 1.46Å | |
| N09 | C24 | sing | 1.47Å | 1.34Å | |
| C23 | O10 | doub | 1.22Å | 1.29Å | |
| C24 | C25 | sing | 1.53Å | 1.59Å | |
| C25 | C26 | sing | 1.51Å | 1.49Å | |
| C26 | N12 | doub | 1.30Å | 1.41Å | |
| C26 | N15 | sing | 1.36Å | 1.47Å | |
| N12 | C27 | sing | 1.36Å | 1.41Å | |
| N15 | C33 | sing | 1.35Å | 1.43Å | |
| C27 | C28 | doub | 1.40Å | 1.51Å | Aromatic |
| C27 | C32 | sing | 1.41Å | 1.48Å | Aromatic |
| C28 | C29 | sing | 1.38Å | 1.48Å | Aromatic |
| C33 | C32 | sing | 1.47Å | 1.46Å | |
| C33 | O13 | doub | 1.22Å | 1.19Å | |
| C32 | C31 | doub | 1.39Å | 1.46Å | Aromatic |
| C29 | C30 | doub | 1.39Å | 1.50Å | Aromatic |
| C31 | C30 | sing | 1.38Å | 1.49Å | Aromatic |
| C20 | H201 | sing | 1.08Å | 1.08Å | |
| C21 | H211 | sing | 1.08Å | 1.08Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C24 | H242 | sing | 1.09Å | 1.10Å | |
| C28 | H281 | sing | 1.08Å | 1.08Å | |
| C01 | H013 | sing | 1.09Å | 1.10Å | |
| C01 | H011 | sing | 1.09Å | 1.10Å | |
| C01 | H012 | sing | 1.09Å | 1.10Å | |
| N02 | H021 | sing | 0.97Å | 1.00Å | |
| N06 | H061 | sing | 0.97Å | 1.00Å | |
| C08 | H081 | sing | 1.08Å | 1.08Å | |
| C11 | H111 | sing | 1.08Å | 1.08Å | |
| C14 | H141 | sing | 1.08Å | 1.08Å | |
| N15 | H151 | sing | 0.97Å | 1.00Å | |
| C16 | H161 | sing | 1.08Å | 1.08Å | |
| C25 | H251 | sing | 1.09Å | 1.10Å | |
| C25 | H252 | sing | 1.09Å | 1.10Å | |
| C29 | H291 | sing | 1.08Å | 1.08Å | |
| C30 | H301 | sing | 1.08Å | 1.08Å | |
| C31 | H311 | sing | 1.08Å | 1.08Å | |
| C34 | H342 | sing | 1.09Å | 1.10Å | |
| C34 | H341 | sing | 1.09Å | 1.10Å | |
| C36 | H361 | sing | 1.08Å | 1.08Å | |
| C37 | H371 | sing | 1.08Å | 1.08Å | |
| C38 | H381 | sing | 1.08Å | 1.08Å | |
| C39 | H391 | sing | 1.08Å | 1.08Å | |
| C40 | H401 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C01 | O03 | C05 | 117.1° | 117.1° |
| O03 | C01 | H013 | 109.5° | 109.5° |
| O03 | C01 | H011 | 109.5° | 109.4° |
| O03 | C01 | H012 | 109.4° | 109.5° |
| C11 | C08 | C05 | 120.4° | 120.0° |
| C08 | C11 | C14 | 120.5° | 120.2° |
| C11 | C08 | H081 | 119.8° | 120.0° |
| C08 | C11 | H111 | 119.7° | 119.9° |
| C08 | C05 | O03 | 123.2° | 120.1° |
| C08 | C05 | C17 | 119.0° | 119.8° |
| C05 | C08 | H081 | 119.8° | 120.0° |
| O03 | C05 | C17 | 117.7° | 120.1° |
| C11 | C14 | C16 | 118.5° | 120.1° |
| C14 | C11 | H111 | 119.8° | 119.9° |
| C11 | C14 | H141 | 120.8° | 119.9° |
| C05 | C17 | C16 | 119.5° | 119.8° |
| C05 | C17 | N02 | 114.2° | 120.1° |
| C38 | C37 | C36 | 108.6° | 114.9° |
| C37 | C38 | S04 | 107.4° | 109.6° |
| C38 | C37 | H371 | 125.7° | 122.5° |
| C37 | C38 | H381 | 126.3° | 125.2° |
| C37 | C36 | C35 | 108.2° | 114.9° |
| C37 | C36 | H361 | 125.9° | 122.6° |
| C36 | C37 | H371 | 125.7° | 122.6° |
| C38 | S04 | C35 | 107.8° | 91.0° |
| S04 | C38 | H381 | 126.3° | 125.2° |
| C14 | C16 | C17 | 121.9° | 120.0° |
| C16 | C14 | H141 | 120.7° | 120.0° |
| C14 | C16 | H161 | 119.0° | 119.9° |
| C36 | C35 | S04 | 107.7° | 109.6° |
| C36 | C35 | C34 | 126.0° | 125.2° |
| C35 | C36 | H361 | 125.9° | 122.5° |
| C16 | C17 | N02 | 125.6° | 120.1° |
| C17 | C16 | H161 | 119.1° | 120.1° |
| C17 | N02 | C18 | 123.3° | 120.0° |
| C17 | N02 | H021 | 118.4° | 120.0° |
| N02 | C18 | C19 | 112.5° | 120.0° |
| N02 | C18 | O07 | 126.5° | 120.0° |
| C18 | N02 | H021 | 118.3° | 120.0° |
| S04 | C35 | C34 | 124.9° | 125.2° |
| C35 | C34 | N09 | 144.1° | 109.5° |
| C35 | C34 | H342 | 100.3° | 109.5° |
| C35 | C34 | H341 | 100.3° | 109.5° |
| C21 | C20 | C19 | 117.2° | 119.9° |
| C20 | C21 | C22 | 116.3° | 120.1° |
| C21 | C20 | H201 | 121.4° | 120.0° |
| C20 | C21 | H211 | 121.9° | 120.0° |
| C20 | C19 | C18 | 114.8° | 120.1° |
| C20 | C19 | C40 | 125.5° | 119.9° |
| C19 | C20 | H201 | 121.4° | 120.1° |
| C19 | C18 | O07 | 121.1° | 120.0° |
| C18 | C19 | C40 | 119.4° | 120.1° |
| C21 | C22 | N06 | 104.3° | 120.0° |
| C21 | C22 | C39 | 128.0° | 120.1° |
| C22 | C21 | H211 | 121.9° | 119.9° |
| C19 | C40 | C39 | 117.6° | 119.9° |
| C19 | C40 | H401 | 121.2° | 120.1° |
| C34 | N09 | C23 | 137.0° | 120.0° |
| C34 | N09 | C24 | 106.4° | 120.0° |
| N09 | C34 | H342 | 100.2° | 109.6° |
| N09 | C34 | H341 | 100.2° | 109.5° |
| N06 | C22 | C39 | 127.3° | 119.9° |
| C22 | N06 | C23 | 119.9° | 120.0° |
| C22 | N06 | H061 | 120.0° | 120.1° |
| C22 | C39 | C40 | 115.3° | 120.1° |
| C22 | C39 | H391 | 122.4° | 119.9° |
| N06 | C23 | N09 | 96.7° | 120.0° |
| N06 | C23 | O10 | 129.0° | 120.0° |
| C23 | N06 | H061 | 120.0° | 120.0° |
| C40 | C39 | H391 | 122.3° | 120.0° |
| C39 | C40 | H401 | 121.2° | 120.0° |
| C23 | N09 | C24 | 116.3° | 120.0° |
| N09 | C23 | O10 | 133.9° | 120.0° |
| N09 | C24 | C25 | 91.6° | 109.4° |
| N09 | C24 | H241 | 113.7° | 109.4° |
| N09 | C24 | H242 | 113.7° | 109.4° |
| C24 | C25 | C26 | 101.3° | 109.4° |
| C25 | C24 | H241 | 113.7° | 109.5° |
| C25 | C24 | H242 | 113.7° | 109.5° |
| C24 | C25 | H251 | 111.5° | 109.5° |
| C24 | C25 | H252 | 111.4° | 109.4° |
| C25 | C26 | N12 | 110.6° | 118.3° |
| C25 | C26 | N15 | 125.5° | 118.3° |
| C26 | C25 | H251 | 111.5° | 109.5° |
| C26 | C25 | H252 | 111.5° | 109.4° |
| N12 | C26 | N15 | 123.9° | 123.4° |
| C26 | N12 | C27 | 114.3° | 121.6° |
| C26 | N15 | C33 | 122.5° | 120.6° |
| C26 | N15 | H151 | 118.7° | 119.7° |
| N12 | C27 | C28 | 115.4° | 121.6° |
| N12 | C27 | C32 | 123.4° | 119.1° |
| N15 | C33 | C32 | 113.4° | 117.4° |
| N15 | C33 | O13 | 121.0° | 121.3° |
| C33 | N15 | H151 | 118.7° | 119.7° |
| C28 | C27 | C32 | 121.1° | 119.4° |
| C27 | C28 | C29 | 119.7° | 119.6° |
| C27 | C28 | H281 | 120.2° | 120.2° |
| C27 | C32 | C33 | 121.9° | 118.0° |
| C27 | C32 | C31 | 119.2° | 120.1° |
| C28 | C29 | C30 | 118.0° | 120.8° |
| C29 | C28 | H281 | 120.2° | 120.2° |
| C28 | C29 | H291 | 121.0° | 119.6° |
| C32 | C33 | O13 | 125.2° | 121.3° |
| C33 | C32 | C31 | 118.5° | 121.9° |
| C32 | C31 | C30 | 120.4° | 119.5° |
| C32 | C31 | H311 | 119.8° | 120.3° |
| C29 | C30 | C31 | 121.5° | 120.6° |
| C30 | C29 | H291 | 121.0° | 119.6° |
| C29 | C30 | H301 | 119.3° | 119.7° |
| C31 | C30 | H301 | 119.3° | 119.7° |
| C30 | C31 | H311 | 119.8° | 120.2° |
| H241 | C24 | H242 | 109.5° | 109.5° |
| H013 | C01 | H011 | 109.5° | 109.5° |
| H013 | C01 | H012 | 109.5° | 109.4° |
| H011 | C01 | H012 | 109.5° | 109.5° |
| H251 | C25 | H252 | 109.5° | 109.5° |
| H342 | C34 | H341 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C01 | O03 | C05 | C08 | 27.1° | 0.1° |
| C01 | O03 | C05 | C17 | 148.7° | 179.9° |
| O03 | C01 | H013 | H011 | 120.0° | 120.0° |
| O03 | C01 | H013 | H012 | 120.0° | 120.0° |
| O03 | C01 | H011 | H012 | 120.0° | 120.0° |
| C11 | C08 | C05 | H081 | 180.0° | 180.0° |
| C11 | C08 | C05 | O03 | 180.0° | 179.9° |
| C08 | C11 | C14 | H111 | 180.0° | 180.0° |
| C11 | C08 | C05 | C17 | 4.3° | 0.1° |
| C08 | C11 | C14 | C16 | 0.4° | 0.0° |
| C08 | C11 | C14 | H141 | 179.6° | 179.9° |
| C08 | C05 | O03 | C17 | 175.8° | 179.9° |
| C05 | C08 | C11 | C14 | 1.9° | 0.0° |
| C08 | C05 | C17 | C16 | 5.2° | 0.1° |
| C08 | C05 | C17 | N02 | 176.1° | 179.7° |
| C05 | C08 | C11 | H111 | 178.1° | 180.0° |
| O03 | C05 | C17 | C16 | 178.8° | 180.0° |
| O03 | C05 | C17 | N02 | 8.0° | 0.1° |
| C05 | O03 | C01 | H013 | 180.0° | 180.0° |
| C05 | O03 | C01 | H011 | 60.0° | 60.0° |
| C05 | O03 | C01 | H012 | 60.0° | 60.0° |
| O03 | C05 | C08 | H081 | 0.1° | 0.1° |
| C11 | C14 | C16 | H141 | 180.0° | 179.9° |
| C11 | C14 | C16 | C17 | 1.4° | 0.1° |
| C14 | C11 | C08 | H081 | 178.0° | 180.0° |
| C11 | C14 | C16 | H161 | 178.6° | 179.7° |
| C05 | C17 | C16 | C14 | 3.8° | 0.1° |
| C05 | C17 | C16 | N02 | 169.8° | 179.8° |
| C05 | C17 | N02 | C18 | 155.6° | 145.5° |
| C05 | C17 | N02 | H021 | 24.4° | 34.5° |
| C17 | C05 | C08 | H081 | 175.7° | 179.9° |
| C05 | C17 | C16 | H161 | 176.2° | 179.8° |
| C38 | C37 | C36 | H371 | 180.0° | 180.0° |
| C37 | C38 | S04 | H381 | 180.0° | 180.0° |
| C38 | C37 | C36 | C35 | 3.4° | 0.0° |
| C37 | C38 | S04 | C35 | 3.1° | 0.0° |
| C38 | C37 | C36 | H361 | 176.6° | 180.0° |
| C36 | C37 | C38 | S04 | 0.0° | 0.0° |
| C37 | C36 | C35 | H361 | 180.0° | 180.0° |
| C37 | C36 | C35 | S04 | 5.2° | 0.1° |
| C37 | C36 | C35 | C34 | 172.0° | 180.0° |
| C36 | C37 | C38 | H381 | 180.0° | 180.0° |
| C38 | S04 | C35 | C36 | 5.2° | 0.1° |
| C38 | S04 | C35 | C34 | 172.2° | 180.0° |
| S04 | C38 | C37 | H371 | 179.9° | 180.0° |
| C14 | C16 | C17 | H161 | 180.0° | 179.7° |
| C14 | C16 | C17 | N02 | 173.6° | 179.7° |
| C16 | C14 | C11 | H111 | 179.6° | 180.0° |
| C36 | C35 | S04 | C34 | 167.0° | 179.9° |
| C36 | C35 | C34 | N09 | 100.0° | 90.1° |
| C36 | C35 | C34 | H342 | 24.0° | 30.0° |
| C36 | C35 | C34 | H341 | 136.1° | 149.9° |
| C35 | C36 | C37 | H371 | 176.6° | 179.9° |
| C16 | C17 | N02 | C18 | 14.6° | 34.6° |
| C16 | C17 | N02 | H021 | 165.4° | 145.3° |
| C17 | C16 | C14 | H141 | 178.7° | 180.0° |
| C17 | N02 | C18 | H021 | 180.0° | 180.0° |
| C17 | N02 | C18 | C19 | 171.9° | 175.5° |
| C17 | N02 | C18 | O07 | 8.5° | 4.5° |
| N02 | C17 | C16 | H161 | 6.4° | 0.1° |
| N02 | C18 | C19 | C20 | 23.2° | 180.0° |
| N02 | C18 | C19 | O07 | 179.7° | 180.0° |
| N02 | C18 | C19 | C40 | 150.0° | 0.0° |
| S04 | C35 | C34 | N09 | 95.3° | 90.0° |
| S04 | C35 | C34 | H342 | 140.7° | 149.9° |
| S04 | C35 | C34 | H341 | 28.6° | 29.9° |
| S04 | C35 | C36 | H361 | 174.8° | 180.0° |
| C35 | S04 | C38 | H381 | 176.9° | 180.0° |
| C35 | C34 | N09 | H342 | 124.0° | 120.0° |
| C35 | C34 | N09 | H341 | 123.9° | 120.0° |
| C35 | C34 | N09 | C23 | 26.7° | 90.0° |
| C35 | C34 | N09 | C24 | 146.2° | 90.0° |
| C35 | C34 | H342 | H341 | 104.8° | 119.9° |
| C34 | C35 | C36 | H361 | 8.0° | 0.1° |
| C21 | C20 | C19 | H201 | 180.0° | 179.7° |
| C21 | C20 | C19 | C18 | 175.9° | 180.0° |
| C20 | C21 | C22 | H211 | 180.0° | 179.9° |
| C21 | C20 | C19 | C40 | 3.1° | 0.0° |
| C20 | C21 | C22 | N06 | 176.7° | 179.9° |
| C20 | C21 | C22 | C39 | 3.9° | 0.1° |
| C20 | C19 | C18 | C40 | 173.2° | 180.0° |
| C20 | C19 | C18 | O07 | 156.5° | 0.0° |
| C19 | C20 | C21 | C22 | 2.9° | 0.1° |
| C20 | C19 | C40 | C39 | 3.5° | 0.0° |
| C19 | C20 | C21 | H211 | 177.1° | 180.0° |
| C20 | C19 | C40 | H401 | 176.5° | 180.0° |
| C18 | C19 | C40 | C39 | 176.0° | 179.9° |
| C18 | C19 | C20 | H201 | 4.2° | 0.3° |
| C19 | C18 | N02 | H021 | 8.2° | 4.6° |
| C18 | C19 | C40 | H401 | 4.0° | 0.1° |
| O07 | C18 | C19 | C40 | 30.3° | 180.0° |
| O07 | C18 | N02 | H021 | 171.5° | 175.4° |
| C21 | C22 | N06 | C39 | 172.9° | 180.0° |
| C21 | C22 | N06 | C23 | 133.0° | 35.2° |
| C21 | C22 | C39 | C40 | 4.2° | 0.0° |
| C22 | C21 | C20 | H201 | 177.1° | 179.8° |
| C21 | C22 | N06 | H061 | 47.0° | 144.8° |
| C21 | C22 | C39 | H391 | 175.8° | 180.0° |
| C19 | C40 | C39 | C22 | 3.7° | 0.0° |
| C19 | C40 | C39 | H401 | 180.0° | 180.0° |
| C40 | C19 | C20 | H201 | 176.9° | 179.7° |
| C19 | C40 | C39 | H391 | 176.3° | 180.0° |
| C34 | N09 | C23 | N06 | 1.5° | 0.0° |
| C34 | N09 | C23 | C24 | 172.5° | 180.0° |
| C34 | N09 | C23 | O10 | 175.0° | 180.0° |
| C34 | N09 | C24 | C25 | 74.4° | 90.0° |
| C34 | N09 | C24 | H241 | 168.7° | 29.9° |
| C34 | N09 | C24 | H242 | 42.5° | 150.0° |
| N09 | C34 | H342 | H341 | 104.8° | 120.0° |
| C22 | N06 | C23 | H061 | 180.0° | 180.0° |
| N06 | C22 | C39 | C40 | 175.5° | 180.0° |
| C22 | N06 | C23 | N09 | 176.2° | 175.4° |
| C22 | N06 | C23 | O10 | 9.8° | 4.6° |
| N06 | C22 | C21 | H211 | 3.3° | 0.1° |
| N06 | C22 | C39 | H391 | 4.5° | 0.0° |
| C39 | C22 | N06 | C23 | 39.9° | 144.8° |
| C22 | C39 | C40 | H391 | 180.0° | 180.0° |
| C39 | C22 | C21 | H211 | 176.2° | 180.0° |
| C39 | C22 | N06 | H061 | 140.1° | 35.2° |
| C22 | C39 | C40 | H401 | 176.3° | 180.0° |
| N06 | C23 | N09 | O10 | 173.5° | 180.0° |
| N06 | C23 | N09 | C24 | 174.0° | 180.0° |
| C23 | N09 | C24 | C25 | 100.3° | 90.0° |
| C23 | N09 | C24 | H241 | 16.6° | 150.0° |
| C23 | N09 | C24 | H242 | 142.8° | 30.0° |
| N09 | C23 | N06 | H061 | 3.8° | 4.6° |
| C23 | N09 | C34 | H342 | 97.2° | 150.0° |
| C23 | N09 | C34 | H341 | 150.7° | 30.0° |
| C24 | N09 | C23 | O10 | 12.6° | 0.0° |
| N09 | C24 | C25 | H241 | 116.9° | 119.9° |
| N09 | C24 | C25 | H242 | 116.9° | 120.0° |
| N09 | C24 | C25 | C26 | 145.3° | 180.0° |
| N09 | C24 | H241 | H242 | 128.4° | 120.0° |
| N09 | C24 | C25 | H251 | 96.0° | 60.0° |
| N09 | C24 | C25 | H252 | 26.7° | 60.0° |
| C24 | N09 | C34 | H342 | 89.8° | 30.1° |
| C24 | N09 | C34 | H341 | 22.3° | 150.0° |
| O10 | C23 | N06 | H061 | 170.1° | 175.4° |
| C24 | C25 | C26 | H251 | 118.7° | 120.0° |
| C24 | C25 | C26 | H252 | 118.6° | 119.9° |
| C24 | C25 | C26 | N12 | 39.3° | 0.0° |
| C24 | C25 | C26 | N15 | 139.0° | 180.0° |
| C25 | C24 | H241 | H242 | 128.4° | 120.1° |
| C24 | C25 | H251 | H252 | 123.8° | 120.0° |
| C25 | C26 | N12 | N15 | 178.4° | 179.9° |
| C25 | C26 | N12 | C27 | 178.5° | 180.0° |
| C25 | C26 | N15 | C33 | 180.0° | 180.0° |
| C26 | C25 | C24 | H241 | 28.4° | 60.1° |
| C26 | C25 | C24 | H242 | 97.8° | 60.1° |
| C25 | C26 | N15 | H151 | 0.0° | 0.0° |
| C26 | C25 | H251 | H252 | 123.8° | 120.0° |
| N12 | C26 | N15 | C33 | 1.9° | 0.0° |
| C26 | N12 | C27 | C28 | 180.0° | 180.0° |
| C26 | N12 | C27 | C32 | 3.3° | 0.0° |
| N12 | C26 | N15 | H151 | 178.1° | 179.9° |
| N12 | C26 | C25 | H251 | 79.4° | 120.0° |
| N12 | C26 | C25 | H252 | 158.0° | 120.0° |
| N15 | C26 | N12 | C27 | 0.2° | 0.0° |
| C26 | N15 | C33 | H151 | 180.0° | 180.0° |
| C26 | N15 | C33 | C32 | 6.2° | 0.0° |
| C26 | N15 | C33 | O13 | 179.2° | 180.0° |
| N15 | C26 | C25 | H251 | 102.3° | 59.9° |
| N15 | C26 | C25 | H252 | 20.4° | 60.1° |
| N12 | C27 | C28 | C32 | 176.8° | 180.0° |
| N12 | C27 | C28 | C29 | 176.6° | 180.0° |
| N12 | C27 | C32 | C33 | 8.3° | 0.0° |
| N12 | C27 | C32 | C31 | 179.8° | 180.0° |
| N12 | C27 | C28 | H281 | 3.4° | 0.1° |
| N15 | C33 | C32 | C27 | 9.1° | 0.0° |
| N15 | C33 | C32 | O13 | 172.7° | 180.0° |
| N15 | C33 | C32 | C31 | 178.9° | 180.0° |
| C27 | C28 | C29 | H281 | 180.0° | 179.9° |
| C28 | C27 | C32 | C33 | 175.2° | 180.0° |
| C28 | C27 | C32 | C31 | 3.3° | 0.0° |
| C27 | C28 | C29 | C30 | 1.4° | 0.0° |
| C27 | C28 | C29 | H291 | 178.6° | 180.0° |
| C32 | C27 | C28 | C29 | 0.2° | 0.0° |
| C27 | C32 | C33 | C31 | 172.0° | 179.9° |
| C27 | C32 | C33 | O13 | 178.2° | 180.0° |
| C27 | C32 | C31 | C30 | 5.5° | 0.1° |
| C32 | C27 | C28 | H281 | 179.8° | 179.9° |
| C27 | C32 | C31 | H311 | 174.5° | 180.0° |
| C28 | C29 | C30 | H291 | 180.0° | 179.9° |
| C28 | C29 | C30 | C31 | 0.9° | 0.0° |
| C28 | C29 | C30 | H301 | 179.1° | 180.0° |
| C33 | C32 | C31 | C30 | 177.7° | 180.0° |
| C32 | C33 | N15 | H151 | 173.9° | 180.0° |
| C33 | C32 | C31 | H311 | 2.3° | 0.1° |
| O13 | C33 | C32 | C31 | 6.2° | 0.1° |
| O13 | C33 | N15 | H151 | 0.8° | 0.0° |
| C32 | C31 | C30 | C29 | 4.4° | 0.1° |
| C32 | C31 | C30 | H311 | 180.0° | 179.9° |
| C32 | C31 | C30 | H301 | 175.6° | 180.0° |
| C29 | C30 | C31 | H301 | 180.0° | 179.9° |
| C30 | C29 | C28 | H281 | 178.6° | 179.9° |
| C29 | C30 | C31 | H311 | 175.6° | 180.0° |
| C31 | C30 | C29 | H291 | 179.2° | 179.9° |
| H201 | C20 | C21 | H211 | 2.9° | 0.4° |
| H241 | C24 | C25 | H251 | 147.1° | 179.9° |
| H241 | C24 | C25 | H252 | 90.2° | 59.9° |
| H242 | C24 | C25 | H251 | 20.9° | 60.0° |
| H242 | C24 | C25 | H252 | 143.6° | 180.0° |
| H281 | C28 | C29 | H291 | 1.4° | 0.1° |
| H013 | C01 | H011 | H012 | 120.0° | 120.0° |
| H081 | C08 | C11 | H111 | 1.9° | 0.0° |
| H111 | C11 | C14 | H141 | 0.4° | 0.1° |
| H141 | C14 | C16 | H161 | 1.4° | 0.4° |
| H291 | C29 | C30 | H301 | 0.9° | 0.0° |
| H301 | C30 | C31 | H311 | 4.4° | 0.1° |
| H361 | C36 | C37 | H371 | 3.4° | 0.0° |
| H371 | C37 | C38 | H381 | 0.0° | 0.0° |
| H391 | C39 | C40 | H401 | 3.7° | 0.0° |






