A1AWA
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O02 | C01 | sing | 1.43Å | 1.40Å | |
| C03 | O02 | sing | 1.36Å | 1.41Å | |
| C04 | C03 | doub | 1.38Å | 1.39Å | Aromatic |
| C05 | C04 | sing | 1.39Å | 1.40Å | Aromatic |
| C06 | C05 | doub | 1.38Å | 1.39Å | Aromatic |
| C07 | C06 | sing | 1.39Å | 1.42Å | Aromatic |
| N08 | C07 | sing | 1.37Å | 1.36Å | Aromatic |
| C09 | N08 | sing | 1.38Å | 1.33Å | Aromatic |
| O11 | C10 | doub | 1.22Å | 1.15Å | |
| N12 | C10 | sing | 1.35Å | 1.47Å | |
| C13 | N12 | sing | 1.47Å | 1.49Å | |
| C15 | C14 | sing | 1.53Å | 1.53Å | |
| C16 | C15 | sing | 1.53Å | 1.53Å | |
| C17 | C15 | sing | 1.53Å | 1.53Å | |
| C14 | C13 | sing | 1.53Å | 1.47Å | |
| C18 | C13 | sing | 1.51Å | 1.53Å | |
| O19 | C18 | doub | 1.21Å | 1.17Å | |
| N20 | C18 | sing | 1.35Å | 1.42Å | |
| C21 | N20 | sing | 1.47Å | 1.44Å | |
| C23 | C22 | sing | 1.51Å | 1.54Å | |
| C24 | C23 | doub | 1.39Å | 1.38Å | Aromatic |
| C25 | C24 | sing | 1.39Å | 1.38Å | Aromatic |
| C26 | C25 | doub | 1.38Å | 1.40Å | Aromatic |
| N27 | C26 | sing | 1.32Å | 1.32Å | Aromatic |
| C28 | N27 | doub | 1.32Å | 1.32Å | Aromatic |
| C22 | C21 | sing | 1.53Å | 1.52Å | |
| C29 | C21 | sing | 1.53Å | 1.59Å | |
| O30 | C29 | sing | 1.43Å | 1.36Å | |
| C10 | C09 | sing | 1.47Å | 1.53Å | |
| C31 | C09 | doub | 1.36Å | 1.38Å | Aromatic |
| C32 | C31 | sing | 1.41Å | 1.43Å | Aromatic |
| C03 | C32 | sing | 1.41Å | 1.43Å | Aromatic |
| C07 | C32 | doub | 1.41Å | 1.37Å | Aromatic |
| C23 | C28 | sing | 1.38Å | 1.39Å | Aromatic |
| N12 | H121 | sing | 0.97Å | 1.00Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C17 | H172 | sing | 1.09Å | 1.10Å | |
| C17 | H173 | sing | 1.09Å | 1.10Å | |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C22 | H222 | sing | 1.09Å | 1.10Å | |
| C22 | H221 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.08Å | 1.08Å | |
| C26 | H261 | sing | 1.08Å | 1.08Å | |
| C28 | H281 | sing | 1.08Å | 1.08Å | |
| C01 | H011 | sing | 1.09Å | 1.10Å | |
| C01 | H013 | sing | 1.09Å | 1.10Å | |
| C01 | H012 | sing | 1.09Å | 1.10Å | |
| C04 | H041 | sing | 1.08Å | 1.08Å | |
| C05 | H051 | sing | 1.08Å | 1.08Å | |
| C06 | H061 | sing | 1.08Å | 1.08Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C14 | H142 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H163 | sing | 1.09Å | 1.10Å | |
| C25 | H251 | sing | 1.08Å | 1.08Å | |
| C29 | H1 | sing | 1.09Å | 1.10Å | |
| C29 | H291 | sing | 1.09Å | 1.10Å | |
| C31 | H311 | sing | 1.08Å | 1.08Å | |
| N08 | H081 | sing | 0.97Å | 1.00Å | |
| N20 | H201 | sing | 0.97Å | 1.00Å | |
| O30 | H301 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C01 | O02 | C03 | 110.7° | 117.0° |
| O02 | C01 | H011 | 109.5° | 109.5° |
| O02 | C01 | H013 | 109.4° | 109.5° |
| O02 | C01 | H012 | 109.5° | 109.5° |
| O02 | C03 | C04 | 119.6° | 120.2° |
| O02 | C03 | C32 | 121.6° | 120.2° |
| C03 | C04 | C05 | 120.5° | 120.4° |
| C04 | C03 | C32 | 118.8° | 119.6° |
| C03 | C04 | H041 | 119.7° | 119.9° |
| C04 | C05 | C06 | 120.5° | 120.8° |
| C05 | C04 | H041 | 119.8° | 119.8° |
| C04 | C05 | H051 | 119.8° | 119.6° |
| C05 | C06 | C07 | 119.4° | 120.0° |
| C06 | C05 | H051 | 119.7° | 119.6° |
| C05 | C06 | H061 | 120.3° | 120.0° |
| C06 | C07 | N08 | 130.4° | 133.0° |
| C06 | C07 | C32 | 120.3° | 119.6° |
| C07 | C06 | H061 | 120.3° | 120.0° |
| C07 | N08 | C09 | 110.2° | 108.8° |
| N08 | C07 | C32 | 109.3° | 107.4° |
| C07 | N08 | H081 | 124.9° | 125.7° |
| N08 | C09 | C10 | 123.5° | 125.5° |
| N08 | C09 | C31 | 107.4° | 109.1° |
| C09 | N08 | H081 | 124.9° | 125.6° |
| O11 | C10 | N12 | 115.2° | 120.0° |
| O11 | C10 | C09 | 120.2° | 120.0° |
| C10 | N12 | C13 | 121.4° | 120.0° |
| N12 | C10 | C09 | 124.6° | 120.0° |
| C10 | N12 | H121 | 119.3° | 120.0° |
| N12 | C13 | C14 | 112.6° | 109.5° |
| N12 | C13 | C18 | 95.4° | 109.5° |
| C13 | N12 | H121 | 119.3° | 120.0° |
| N12 | C13 | H131 | 112.8° | 109.4° |
| C14 | C15 | C16 | 114.9° | 109.5° |
| C14 | C15 | C17 | 102.3° | 109.4° |
| C15 | C14 | C13 | 112.6° | 109.5° |
| C14 | C15 | H151 | 108.0° | 109.5° |
| C15 | C14 | H141 | 108.7° | 109.4° |
| C15 | C14 | H142 | 108.7° | 109.5° |
| C16 | C15 | C17 | 115.3° | 109.5° |
| C16 | C15 | H151 | 108.0° | 109.5° |
| C15 | C16 | H162 | 109.5° | 109.4° |
| C15 | C16 | H161 | 109.4° | 109.4° |
| C15 | C16 | H163 | 109.5° | 109.5° |
| C17 | C15 | H151 | 108.0° | 109.5° |
| C15 | C17 | H172 | 109.5° | 109.5° |
| C15 | C17 | H173 | 109.5° | 109.4° |
| C15 | C17 | H171 | 109.4° | 109.5° |
| C14 | C13 | C18 | 109.5° | 109.5° |
| C14 | C13 | H131 | 113.1° | 109.4° |
| C13 | C14 | H141 | 108.7° | 109.4° |
| C13 | C14 | H142 | 108.7° | 109.5° |
| C13 | C18 | O19 | 119.3° | 119.9° |
| C13 | C18 | N20 | 131.1° | 120.0° |
| C18 | C13 | H131 | 112.2° | 109.5° |
| O19 | C18 | N20 | 109.1° | 120.0° |
| C18 | N20 | C21 | 127.4° | 120.0° |
| C18 | N20 | H201 | 116.3° | 120.0° |
| N20 | C21 | C22 | 126.2° | 109.4° |
| N20 | C21 | C29 | 87.6° | 109.5° |
| N20 | C21 | H211 | 113.5° | 109.4° |
| C21 | N20 | H201 | 116.3° | 120.0° |
| C22 | C23 | C24 | 122.6° | 120.4° |
| C23 | C22 | C21 | 107.9° | 109.5° |
| C22 | C23 | C28 | 118.1° | 120.4° |
| C23 | C22 | H222 | 109.9° | 109.5° |
| C23 | C22 | H221 | 109.9° | 109.5° |
| C23 | C24 | C25 | 117.2° | 118.4° |
| C24 | C23 | C28 | 119.3° | 119.2° |
| C23 | C24 | H241 | 121.4° | 120.8° |
| C24 | C25 | C26 | 120.3° | 119.2° |
| C25 | C24 | H241 | 121.4° | 120.8° |
| C24 | C25 | H251 | 119.9° | 120.4° |
| C25 | C26 | N27 | 120.8° | 120.8° |
| C25 | C26 | H261 | 119.6° | 119.7° |
| C26 | C25 | H251 | 119.8° | 120.4° |
| C26 | N27 | C28 | 120.4° | 121.7° |
| N27 | C26 | H261 | 119.6° | 119.6° |
| N27 | C28 | C23 | 122.0° | 120.8° |
| N27 | C28 | H281 | 119.0° | 119.6° |
| C22 | C21 | C29 | 101.3° | 109.5° |
| C22 | C21 | H211 | 112.1° | 109.5° |
| C21 | C22 | H222 | 109.9° | 109.5° |
| C21 | C22 | H221 | 109.9° | 109.5° |
| C21 | C29 | O30 | 107.6° | 109.5° |
| C29 | C21 | H211 | 111.1° | 109.5° |
| C21 | C29 | H1 | 109.9° | 109.4° |
| C21 | C29 | H291 | 109.9° | 109.5° |
| O30 | C29 | H1 | 109.9° | 109.5° |
| O30 | C29 | H291 | 109.9° | 109.6° |
| C29 | O30 | H301 | 109.5° | 114.0° |
| C10 | C09 | C31 | 129.0° | 125.4° |
| C09 | C31 | C32 | 108.3° | 107.7° |
| C09 | C31 | H311 | 125.8° | 126.1° |
| C31 | C32 | C03 | 134.8° | 133.3° |
| C31 | C32 | C07 | 104.7° | 107.1° |
| C32 | C31 | H311 | 125.8° | 126.1° |
| C03 | C32 | C07 | 120.5° | 119.6° |
| C23 | C28 | H281 | 119.0° | 119.6° |
| H172 | C17 | H173 | 109.5° | 109.4° |
| H172 | C17 | H171 | 109.4° | 109.5° |
| H173 | C17 | H171 | 109.5° | 109.5° |
| H222 | C22 | H221 | 109.5° | 109.4° |
| H011 | C01 | H013 | 109.5° | 109.5° |
| H011 | C01 | H012 | 109.5° | 109.4° |
| H013 | C01 | H012 | 109.5° | 109.5° |
| H141 | C14 | H142 | 109.4° | 109.5° |
| H162 | C16 | H161 | 109.5° | 109.4° |
| H162 | C16 | H163 | 109.5° | 109.5° |
| H161 | C16 | H163 | 109.4° | 109.5° |
| H1 | C29 | H291 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C01 | O02 | C03 | C04 | 116.0° | 0.2° |
| C01 | O02 | C03 | C32 | 62.7° | 180.0° |
| O02 | C01 | H011 | H013 | 120.0° | 120.0° |
| O02 | C01 | H011 | H012 | 120.0° | 120.0° |
| O02 | C01 | H013 | H012 | 120.0° | 120.0° |
| O02 | C03 | C04 | C32 | 178.7° | 179.8° |
| O02 | C03 | C04 | C05 | 179.7° | 180.0° |
| O02 | C03 | C32 | C31 | 1.5° | 0.1° |
| O02 | C03 | C32 | C07 | 179.4° | 179.8° |
| C03 | O02 | C01 | H011 | 180.0° | 180.0° |
| C03 | O02 | C01 | H013 | 60.0° | 60.0° |
| C03 | O02 | C01 | H012 | 60.0° | 60.0° |
| O02 | C03 | C04 | H041 | 0.2° | 0.0° |
| C03 | C04 | C05 | H041 | 180.0° | 180.0° |
| C03 | C04 | C05 | C06 | 0.8° | 0.0° |
| C04 | C03 | C32 | C31 | 179.8° | 179.7° |
| C04 | C03 | C32 | C07 | 0.7° | 0.4° |
| C03 | C04 | C05 | H051 | 179.2° | 180.0° |
| C04 | C05 | C06 | H051 | 180.0° | 179.9° |
| C04 | C05 | C06 | C07 | 0.3° | 0.1° |
| C05 | C04 | C03 | C32 | 1.0° | 0.2° |
| C04 | C05 | C06 | H061 | 179.7° | 179.9° |
| C05 | C06 | C07 | H061 | 180.0° | 180.0° |
| C05 | C06 | C07 | N08 | 180.0° | 180.0° |
| C05 | C06 | C07 | C32 | 0.0° | 0.2° |
| C06 | C05 | C04 | H041 | 179.1° | 180.0° |
| C06 | C07 | N08 | C32 | 180.0° | 179.8° |
| C06 | C07 | N08 | C09 | 179.1° | 180.0° |
| C06 | C07 | C32 | C31 | 179.6° | 179.7° |
| C06 | C07 | C32 | C03 | 0.2° | 0.4° |
| C07 | C06 | C05 | H051 | 179.7° | 180.0° |
| C06 | C07 | N08 | H081 | 0.9° | 0.6° |
| C07 | N08 | C09 | H081 | 180.0° | 179.4° |
| C07 | N08 | C09 | C10 | 177.8° | 179.9° |
| C07 | N08 | C09 | C31 | 1.9° | 0.6° |
| N08 | C07 | C32 | C31 | 0.4° | 0.2° |
| N08 | C07 | C32 | C03 | 179.8° | 179.7° |
| N08 | C07 | C06 | H061 | 0.1° | 0.1° |
| N08 | C09 | C10 | O11 | 55.0° | 179.8° |
| N08 | C09 | C10 | N12 | 123.8° | 0.1° |
| N08 | C09 | C10 | C31 | 174.9° | 179.2° |
| N08 | C09 | C31 | C32 | 2.2° | 0.7° |
| C09 | N08 | C07 | C32 | 0.9° | 0.2° |
| N08 | C09 | C31 | H311 | 177.8° | 179.6° |
| O11 | C10 | N12 | C09 | 178.8° | 179.6° |
| O11 | C10 | N12 | C13 | 3.6° | 0.3° |
| O11 | C10 | C09 | C31 | 130.1° | 1.0° |
| O11 | C10 | N12 | H121 | 176.4° | 179.7° |
| C10 | N12 | C13 | H121 | 180.0° | 179.9° |
| C10 | N12 | C13 | C14 | 48.4° | 85.0° |
| C10 | N12 | C13 | C18 | 65.3° | 155.0° |
| N12 | C10 | C09 | C31 | 51.2° | 179.4° |
| C10 | N12 | C13 | H131 | 177.9° | 34.9° |
| N12 | C13 | C14 | C15 | 50.3° | 64.9° |
| N12 | C13 | C14 | C18 | 104.8° | 120.1° |
| N12 | C13 | C14 | H131 | 129.3° | 119.9° |
| N12 | C13 | C18 | H131 | 117.3° | 120.0° |
| N12 | C13 | C18 | O19 | 73.4° | 0.0° |
| N12 | C13 | C18 | N20 | 97.1° | 180.0° |
| C13 | N12 | C10 | C09 | 175.3° | 180.0° |
| N12 | C13 | C14 | H141 | 170.8° | 55.0° |
| N12 | C13 | C14 | H142 | 70.1° | 175.0° |
| C14 | C15 | C16 | C17 | 118.6° | 120.0° |
| C14 | C15 | C16 | H151 | 120.6° | 120.0° |
| C14 | C15 | C17 | H151 | 113.8° | 120.0° |
| C15 | C14 | C13 | H141 | 120.5° | 119.9° |
| C15 | C14 | C13 | H142 | 120.5° | 120.0° |
| C15 | C14 | C13 | C18 | 155.2° | 175.0° |
| C15 | C14 | C13 | H131 | 79.0° | 55.0° |
| C14 | C15 | C17 | H172 | 180.0° | 60.1° |
| C14 | C15 | C17 | H173 | 60.0° | 180.0° |
| C14 | C15 | C17 | H171 | 60.0° | 60.0° |
| C15 | C14 | H141 | H142 | 118.6° | 120.0° |
| C14 | C15 | C16 | H162 | 180.0° | 60.0° |
| C14 | C15 | C16 | H161 | 60.0° | 179.9° |
| C14 | C15 | C16 | H163 | 60.0° | 60.0° |
| C16 | C15 | C17 | H151 | 120.8° | 120.0° |
| C16 | C15 | C14 | C13 | 55.7° | 175.0° |
| C16 | C15 | C17 | H172 | 54.6° | 180.0° |
| C16 | C15 | C17 | H173 | 174.6° | 60.1° |
| C16 | C15 | C17 | H171 | 65.4° | 60.0° |
| C16 | C15 | C14 | H141 | 64.8° | 55.0° |
| C16 | C15 | C14 | H142 | 176.2° | 65.0° |
| C15 | C16 | H162 | H161 | 120.0° | 119.9° |
| C15 | C16 | H162 | H163 | 120.0° | 120.0° |
| C15 | C16 | H161 | H163 | 120.0° | 120.1° |
| C17 | C15 | C14 | C13 | 178.6° | 65.1° |
| C15 | C17 | H172 | H173 | 120.0° | 119.9° |
| C15 | C17 | H172 | H171 | 120.0° | 120.0° |
| C15 | C17 | H173 | H171 | 120.0° | 120.0° |
| C17 | C15 | C14 | H141 | 60.9° | 175.0° |
| C17 | C15 | C14 | H142 | 58.1° | 55.0° |
| C17 | C15 | C16 | H162 | 61.4° | 59.9° |
| C17 | C15 | C16 | H161 | 58.6° | 60.0° |
| C17 | C15 | C16 | H163 | 178.6° | 179.9° |
| C14 | C13 | C18 | H131 | 126.3° | 120.0° |
| C14 | C13 | C18 | O19 | 43.0° | 120.1° |
| C14 | C13 | C18 | N20 | 146.5° | 60.0° |
| C14 | C13 | N12 | H121 | 131.5° | 95.1° |
| C13 | C14 | C15 | H151 | 64.8° | 55.0° |
| C13 | C14 | H141 | H142 | 118.6° | 120.0° |
| C13 | C18 | O19 | N20 | 172.5° | 179.9° |
| C13 | C18 | N20 | C21 | 9.8° | 180.0° |
| C18 | C13 | N12 | H121 | 114.7° | 25.0° |
| C18 | C13 | C14 | H141 | 84.4° | 65.1° |
| C18 | C13 | C14 | H142 | 34.7° | 55.0° |
| C13 | C18 | N20 | H201 | 170.2° | 0.1° |
| O19 | C18 | N20 | C21 | 178.9° | 0.1° |
| O19 | C18 | C13 | H131 | 169.3° | 120.0° |
| O19 | C18 | N20 | H201 | 1.1° | 180.0° |
| C18 | N20 | C21 | H201 | 180.0° | 179.9° |
| C18 | N20 | C21 | C22 | 27.7° | 155.0° |
| C18 | N20 | C21 | C29 | 129.9° | 85.0° |
| N20 | C18 | C13 | H131 | 20.2° | 60.0° |
| C18 | N20 | C21 | H211 | 118.1° | 35.1° |
| N20 | C21 | C22 | C23 | 130.7° | 65.0° |
| N20 | C21 | C22 | C29 | 95.3° | 120.0° |
| N20 | C21 | C22 | H211 | 146.2° | 119.9° |
| N20 | C21 | C29 | H211 | 114.3° | 120.0° |
| N20 | C21 | C29 | O30 | 59.9° | 65.0° |
| N20 | C21 | C22 | H222 | 109.6° | 55.0° |
| N20 | C21 | C22 | H221 | 11.0° | 175.0° |
| N20 | C21 | C29 | H1 | 179.7° | 55.0° |
| N20 | C21 | C29 | H291 | 59.8° | 175.0° |
| C22 | C23 | C24 | C28 | 177.5° | 180.0° |
| C22 | C23 | C24 | C25 | 177.5° | 179.8° |
| C22 | C23 | C28 | N27 | 177.8° | 179.5° |
| C23 | C22 | C21 | H222 | 119.7° | 120.0° |
| C23 | C22 | C21 | H221 | 119.7° | 120.0° |
| C23 | C22 | C21 | C29 | 134.0° | 175.0° |
| C23 | C22 | C21 | H211 | 15.5° | 54.9° |
| C23 | C22 | H222 | H221 | 120.8° | 120.0° |
| C22 | C23 | C24 | H241 | 2.5° | 0.0° |
| C22 | C23 | C28 | H281 | 2.2° | 0.0° |
| C23 | C24 | C25 | H241 | 180.0° | 179.7° |
| C23 | C24 | C25 | C26 | 0.3° | 0.0° |
| C24 | C23 | C28 | N27 | 0.2° | 0.6° |
| C24 | C23 | C22 | C21 | 113.3° | 90.0° |
| C24 | C23 | C22 | H222 | 6.4° | 30.0° |
| C24 | C23 | C22 | H221 | 126.9° | 150.0° |
| C24 | C23 | C28 | H281 | 179.8° | 180.0° |
| C23 | C24 | C25 | H251 | 179.7° | 180.0° |
| C24 | C25 | C26 | H251 | 180.0° | 180.0° |
| C24 | C25 | C26 | N27 | 0.5° | 0.0° |
| C25 | C24 | C23 | C28 | 0.0° | 0.2° |
| C24 | C25 | C26 | H261 | 179.5° | 180.0° |
| C25 | C26 | N27 | H261 | 180.0° | 179.9° |
| C25 | C26 | N27 | C28 | 0.3° | 0.3° |
| C26 | C25 | C24 | H241 | 179.7° | 179.7° |
| C26 | N27 | C28 | C23 | 0.0° | 0.6° |
| C26 | N27 | C28 | H281 | 180.0° | 180.0° |
| N27 | C26 | C25 | H251 | 179.5° | 179.9° |
| N27 | C28 | C23 | H281 | 180.0° | 179.4° |
| C28 | N27 | C26 | H261 | 179.6° | 179.7° |
| C22 | C21 | C29 | H211 | 119.3° | 120.0° |
| C22 | C21 | C29 | O30 | 173.6° | 55.0° |
| C21 | C22 | C23 | C28 | 69.2° | 90.0° |
| C21 | C22 | H222 | H221 | 120.7° | 120.0° |
| C22 | C21 | C29 | H1 | 53.9° | 175.0° |
| C22 | C21 | C29 | H291 | 66.7° | 65.1° |
| C22 | C21 | N20 | H201 | 152.3° | 25.1° |
| C21 | C29 | O30 | H1 | 119.7° | 120.0° |
| C21 | C29 | O30 | H291 | 119.7° | 120.0° |
| C29 | C21 | C22 | H222 | 14.3° | 65.0° |
| C29 | C21 | C22 | H221 | 106.3° | 55.0° |
| C21 | C29 | H1 | H291 | 120.9° | 119.9° |
| C29 | C21 | N20 | H201 | 50.0° | 95.0° |
| C21 | C29 | O30 | H301 | 180.0° | 180.0° |
| O30 | C29 | C21 | H211 | 54.3° | 175.1° |
| O30 | C29 | H1 | H291 | 120.8° | 120.1° |
| C10 | C09 | C31 | C32 | 177.8° | 180.0° |
| C09 | C10 | N12 | H121 | 4.8° | 0.1° |
| C10 | C09 | C31 | H311 | 2.2° | 0.2° |
| C10 | C09 | N08 | H081 | 2.2° | 0.7° |
| C09 | C31 | C32 | H311 | 180.0° | 179.8° |
| C09 | C31 | C32 | C03 | 179.2° | 179.4° |
| C09 | C31 | C32 | C07 | 1.6° | 0.5° |
| C31 | C09 | N08 | H081 | 178.0° | 180.0° |
| C31 | C32 | C03 | C07 | 179.1° | 179.9° |
| C32 | C03 | C04 | H041 | 179.0° | 179.8° |
| C03 | C32 | C31 | H311 | 0.8° | 0.4° |
| C32 | C07 | C06 | H061 | 180.0° | 179.8° |
| C07 | C32 | C31 | H311 | 178.4° | 179.7° |
| C32 | C07 | N08 | H081 | 179.0° | 179.7° |
| C28 | C23 | C22 | H222 | 171.1° | 149.9° |
| C28 | C23 | C22 | H221 | 50.6° | 30.0° |
| C28 | C23 | C24 | H241 | 180.0° | 180.0° |
| H121 | N12 | C13 | H131 | 2.1° | 145.0° |
| H131 | C13 | C14 | H141 | 41.5° | 174.9° |
| H131 | C13 | C14 | H142 | 160.5° | 65.0° |
| H151 | C15 | C17 | H172 | 66.2° | 59.9° |
| H151 | C15 | C17 | H173 | 53.8° | 60.0° |
| H151 | C15 | C17 | H171 | 173.8° | 180.0° |
| H151 | C15 | C14 | H141 | 174.7° | 64.9° |
| H151 | C15 | C14 | H142 | 55.6° | 175.0° |
| H151 | C15 | C16 | H162 | 59.4° | 180.0° |
| H151 | C15 | C16 | H161 | 179.4° | 60.1° |
| H151 | C15 | C16 | H163 | 60.6° | 60.0° |
| H172 | C17 | H173 | H171 | 120.0° | 120.0° |
| H211 | C21 | C22 | H222 | 104.3° | 174.9° |
| H211 | C21 | C22 | H221 | 135.2° | 65.1° |
| H211 | C21 | C29 | H1 | 65.4° | 64.9° |
| H211 | C21 | C29 | H291 | 174.0° | 55.0° |
| H211 | C21 | N20 | H201 | 62.0° | 145.0° |
| H241 | C24 | C25 | H251 | 0.3° | 0.2° |
| H261 | C26 | C25 | H251 | 0.5° | 0.0° |
| H011 | C01 | H013 | H012 | 120.0° | 119.9° |
| H041 | C04 | C05 | H051 | 0.8° | 0.1° |
| H051 | C05 | C06 | H061 | 0.3° | 0.0° |
| H162 | C16 | H161 | H163 | 120.0° | 120.0° |
| H1 | C29 | O30 | H301 | 60.3° | 60.1° |
| H291 | C29 | O30 | H301 | 60.2° | 60.0° |
