Y1W
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F01 | C02 | sing | 1.35Å | 1.36Å | |
| C34 | C02 | doub | 1.40Å | 1.40Å | Aromatic |
| C34 | N33 | sing | 1.31Å | 1.35Å | Aromatic |
| C02 | C03 | sing | 1.37Å | 1.37Å | Aromatic |
| O05 | C04 | sing | 1.43Å | 1.40Å | |
| N33 | C32 | doub | 1.34Å | 1.39Å | Aromatic |
| C03 | C04 | sing | 1.51Å | 1.54Å | |
| C03 | C25 | doub | 1.41Å | 1.41Å | Aromatic |
| C04 | C06 | sing | 1.53Å | 1.53Å | |
| O08 | C09 | sing | 1.43Å | 1.40Å | |
| O08 | C07 | sing | 1.43Å | 1.47Å | |
| C09 | C10 | sing | 1.53Å | 1.48Å | |
| O16 | C17 | sing | 1.43Å | 1.42Å | |
| O16 | C15 | sing | 1.36Å | 1.43Å | |
| C17 | C18 | sing | 1.54Å | 1.53Å | |
| C06 | C07 | sing | 1.53Å | 1.47Å | |
| C32 | C25 | sing | 1.42Å | 1.36Å | Aromatic |
| C32 | C31 | sing | 1.41Å | 1.43Å | Aromatic |
| C25 | C26 | sing | 1.40Å | 1.43Å | Aromatic |
| C07 | O24 | sing | 1.43Å | 1.46Å | |
| C18 | O19 | sing | 1.43Å | 1.39Å | |
| C10 | N11 | sing | 1.47Å | 1.54Å | |
| C10 | C23 | sing | 1.53Å | 1.47Å | |
| C15 | C14 | doub | 1.39Å | 1.43Å | Aromatic |
| C15 | C20 | sing | 1.39Å | 1.36Å | Aromatic |
| N11 | C12 | sing | 1.47Å | 1.46Å | |
| C14 | C13 | sing | 1.38Å | 1.39Å | Aromatic |
| C31 | C30 | doub | 1.36Å | 1.39Å | Aromatic |
| O24 | C23 | sing | 1.43Å | 1.40Å | |
| C26 | C27 | doub | 1.37Å | 1.39Å | Aromatic |
| O19 | C20 | sing | 1.36Å | 1.41Å | |
| C20 | C21 | doub | 1.39Å | 1.43Å | Aromatic |
| C13 | C12 | sing | 1.51Å | 1.54Å | |
| C13 | C22 | doub | 1.38Å | 1.40Å | Aromatic |
| C30 | C27 | sing | 1.40Å | 1.40Å | Aromatic |
| C27 | O28 | sing | 1.36Å | 1.40Å | |
| C21 | C22 | sing | 1.38Å | 1.39Å | Aromatic |
| O28 | C29 | sing | 1.43Å | 1.40Å | |
| C04 | H041 | sing | 1.09Å | 1.10Å | |
| C06 | H062 | sing | 1.09Å | 1.10Å | |
| C06 | H061 | sing | 1.09Å | 1.10Å | |
| C07 | H071 | sing | 1.09Å | 1.10Å | |
| C09 | H091 | sing | 1.09Å | 1.10Å | |
| C09 | H092 | sing | 1.09Å | 1.10Å | |
| C10 | H101 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| C14 | H141 | sing | 1.08Å | 1.08Å | |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| C17 | H172 | sing | 1.09Å | 1.10Å | |
| C18 | H182 | sing | 1.09Å | 1.10Å | |
| C18 | H181 | sing | 1.09Å | 1.10Å | |
| C21 | H211 | sing | 1.08Å | 1.08Å | |
| C22 | H221 | sing | 1.08Å | 1.08Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.09Å | 1.10Å | |
| C26 | H261 | sing | 1.08Å | 1.08Å | |
| C29 | H291 | sing | 1.09Å | 1.10Å | |
| C29 | H292 | sing | 1.09Å | 1.10Å | |
| C29 | H293 | sing | 1.09Å | 1.10Å | |
| C30 | H301 | sing | 1.08Å | 1.08Å | |
| C31 | H311 | sing | 1.08Å | 1.08Å | |
| C34 | H341 | sing | 1.08Å | 1.08Å | |
| N11 | H111 | sing | 1.01Å | 1.00Å | |
| O05 | H051 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F01 | C02 | C34 | 118.7° | 120.0° |
| F01 | C02 | C03 | 120.9° | 120.1° |
| C02 | C34 | N33 | 120.4° | 121.7° |
| C34 | C02 | C03 | 120.4° | 119.9° |
| C02 | C34 | H341 | 119.8° | 119.2° |
| C34 | N33 | C32 | 119.6° | 121.3° |
| N33 | C34 | H341 | 119.8° | 119.1° |
| C02 | C03 | C04 | 120.2° | 120.9° |
| C02 | C03 | C25 | 118.9° | 118.2° |
| O05 | C04 | C03 | 109.7° | 109.5° |
| O05 | C04 | C06 | 108.1° | 109.4° |
| O05 | C04 | H041 | 110.5° | 109.5° |
| C04 | O05 | H051 | 109.5° | 114.1° |
| N33 | C32 | C25 | 121.2° | 119.9° |
| N33 | C32 | C31 | 118.5° | 121.0° |
| C04 | C03 | C25 | 121.0° | 120.9° |
| C03 | C04 | C06 | 111.5° | 109.5° |
| C03 | C04 | H041 | 108.5° | 109.5° |
| C03 | C25 | C32 | 119.6° | 119.0° |
| C03 | C25 | C26 | 121.2° | 121.3° |
| C04 | C06 | C07 | 112.5° | 109.5° |
| C06 | C04 | H041 | 108.6° | 109.4° |
| C04 | C06 | H062 | 108.7° | 109.5° |
| C04 | C06 | H061 | 108.7° | 109.4° |
| C09 | O08 | C07 | 113.6° | 113.8° |
| O08 | C09 | C10 | 115.0° | 109.0° |
| O08 | C09 | H091 | 108.0° | 109.5° |
| O08 | C09 | H092 | 108.1° | 109.7° |
| O08 | C07 | C06 | 109.8° | 109.5° |
| O08 | C07 | O24 | 111.1° | 109.5° |
| O08 | C07 | H071 | 108.8° | 109.4° |
| C09 | C10 | N11 | 109.1° | 109.6° |
| C09 | C10 | C23 | 113.1° | 108.8° |
| C10 | C09 | H091 | 108.1° | 109.5° |
| C10 | C09 | H092 | 108.0° | 109.6° |
| C09 | C10 | H101 | 108.3° | 109.5° |
| C17 | O16 | C15 | 114.6° | 116.7° |
| O16 | C17 | C18 | 115.2° | 108.3° |
| O16 | C17 | H171 | 108.0° | 109.7° |
| O16 | C17 | H172 | 108.0° | 109.8° |
| O16 | C15 | C14 | 117.6° | 119.4° |
| O16 | C15 | C20 | 121.9° | 120.8° |
| C17 | C18 | O19 | 116.5° | 108.2° |
| C18 | C17 | H171 | 108.0° | 109.7° |
| C18 | C17 | H172 | 108.0° | 109.7° |
| C17 | C18 | H182 | 107.7° | 109.7° |
| C17 | C18 | H181 | 107.7° | 109.6° |
| C06 | C07 | O24 | 109.3° | 109.5° |
| C07 | C06 | H062 | 108.7° | 109.5° |
| C07 | C06 | H061 | 108.7° | 109.5° |
| C06 | C07 | H071 | 108.8° | 109.5° |
| C25 | C32 | C31 | 120.3° | 119.2° |
| C32 | C25 | C26 | 119.2° | 119.7° |
| C32 | C31 | C30 | 120.1° | 119.8° |
| C32 | C31 | H311 | 120.0° | 120.1° |
| C25 | C26 | C27 | 120.6° | 119.5° |
| C25 | C26 | H261 | 119.7° | 120.2° |
| C07 | O24 | C23 | 110.4° | 113.8° |
| O24 | C07 | H071 | 109.0° | 109.5° |
| C18 | O19 | C20 | 117.9° | 116.7° |
| O19 | C18 | H182 | 107.7° | 109.8° |
| O19 | C18 | H181 | 107.7° | 109.7° |
| N11 | C10 | C23 | 110.2° | 109.6° |
| C10 | N11 | C12 | 110.4° | 111.0° |
| N11 | C10 | H101 | 107.6° | 109.6° |
| C10 | N11 | H111 | 109.3° | 111.0° |
| C10 | C23 | O24 | 111.9° | 108.9° |
| C23 | C10 | H101 | 108.4° | 109.7° |
| C10 | C23 | H231 | 108.9° | 109.5° |
| C10 | C23 | H232 | 108.8° | 109.6° |
| C14 | C15 | C20 | 120.5° | 119.8° |
| C15 | C14 | C13 | 120.0° | 120.1° |
| C15 | C14 | H141 | 120.0° | 119.9° |
| C15 | C20 | O19 | 122.8° | 120.7° |
| C15 | C20 | C21 | 119.3° | 119.8° |
| N11 | C12 | C13 | 112.1° | 109.5° |
| N11 | C12 | H121 | 108.8° | 109.5° |
| N11 | C12 | H122 | 108.8° | 109.5° |
| C12 | N11 | H111 | 109.2° | 111.0° |
| C14 | C13 | C12 | 120.5° | 119.9° |
| C14 | C13 | C22 | 119.7° | 120.1° |
| C13 | C14 | H141 | 120.0° | 120.0° |
| C31 | C30 | C27 | 119.9° | 121.0° |
| C31 | C30 | H301 | 120.0° | 119.5° |
| C30 | C31 | H311 | 119.9° | 120.1° |
| O24 | C23 | H231 | 108.8° | 109.6° |
| O24 | C23 | H232 | 108.8° | 109.7° |
| C26 | C27 | C30 | 119.9° | 120.8° |
| C26 | C27 | O28 | 121.0° | 119.6° |
| C27 | C26 | H261 | 119.7° | 120.2° |
| O19 | C20 | C21 | 117.9° | 119.4° |
| C20 | C21 | C22 | 120.4° | 120.1° |
| C20 | C21 | H211 | 119.8° | 119.9° |
| C12 | C13 | C22 | 119.8° | 119.9° |
| C13 | C12 | H121 | 108.8° | 109.5° |
| C13 | C12 | H122 | 108.8° | 109.5° |
| C13 | C22 | C21 | 120.1° | 120.1° |
| C13 | C22 | H221 | 119.9° | 119.9° |
| C30 | C27 | O28 | 119.1° | 119.6° |
| C27 | C30 | H301 | 120.1° | 119.5° |
| C27 | O28 | C29 | 117.0° | 117.0° |
| C22 | C21 | H211 | 119.8° | 120.0° |
| C21 | C22 | H221 | 120.0° | 120.0° |
| O28 | C29 | H291 | 109.5° | 109.5° |
| O28 | C29 | H292 | 109.5° | 109.5° |
| O28 | C29 | H293 | 109.5° | 109.4° |
| H062 | C06 | H061 | 109.5° | 109.4° |
| H091 | C09 | H092 | 109.5° | 109.5° |
| H121 | C12 | H122 | 109.5° | 109.4° |
| H171 | C17 | H172 | 109.5° | 109.7° |
| H182 | C18 | H181 | 109.5° | 109.8° |
| H231 | C23 | H232 | 109.5° | 109.6° |
| H291 | C29 | H292 | 109.5° | 109.5° |
| H291 | C29 | H293 | 109.5° | 109.5° |
| H292 | C29 | H293 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F01 | C02 | C34 | C03 | 179.8° | 179.7° |
| F01 | C02 | C34 | N33 | 180.0° | 179.7° |
| F01 | C02 | C03 | C04 | 0.4° | 0.3° |
| F01 | C02 | C03 | C25 | 179.8° | 179.7° |
| F01 | C02 | C34 | H341 | 0.0° | 0.3° |
| C02 | C34 | N33 | H341 | 180.0° | 180.0° |
| C02 | C34 | N33 | C32 | 0.0° | 0.1° |
| C34 | C02 | C03 | C04 | 179.8° | 180.0° |
| C34 | C02 | C03 | C25 | 0.4° | 0.1° |
| N33 | C34 | C02 | C03 | 0.2° | 0.0° |
| C34 | N33 | C32 | C25 | 0.1° | 0.1° |
| C34 | N33 | C32 | C31 | 180.0° | 180.0° |
| C02 | C03 | C04 | O05 | 11.1° | 44.9° |
| C02 | C03 | C04 | C25 | 179.4° | 179.9° |
| C02 | C03 | C04 | C06 | 108.6° | 75.0° |
| C02 | C03 | C25 | C32 | 0.4° | 0.1° |
| C02 | C03 | C25 | C26 | 179.7° | 179.9° |
| C02 | C03 | C04 | H041 | 131.9° | 165.0° |
| C03 | C02 | C34 | H341 | 179.8° | 180.0° |
| O05 | C04 | C03 | C06 | 119.7° | 119.9° |
| O05 | C04 | C03 | H041 | 120.8° | 120.1° |
| O05 | C04 | C03 | C25 | 168.3° | 135.0° |
| O05 | C04 | C06 | H041 | 119.9° | 120.0° |
| O05 | C04 | C06 | C07 | 71.8° | 65.0° |
| O05 | C04 | C06 | H062 | 48.6° | 55.0° |
| O05 | C04 | C06 | H061 | 167.7° | 174.9° |
| N33 | C32 | C25 | C03 | 0.2° | 0.0° |
| N33 | C32 | C25 | C31 | 180.0° | 180.0° |
| N33 | C32 | C25 | C26 | 179.8° | 179.9° |
| N33 | C32 | C31 | C30 | 179.9° | 179.9° |
| N33 | C32 | C31 | H311 | 0.1° | 0.1° |
| C32 | N33 | C34 | H341 | 180.0° | 179.9° |
| C03 | C04 | C06 | H041 | 119.5° | 120.0° |
| C03 | C04 | C06 | C07 | 167.5° | 175.0° |
| C04 | C03 | C25 | C32 | 179.8° | 180.0° |
| C04 | C03 | C25 | C26 | 0.3° | 0.1° |
| C03 | C04 | C06 | H062 | 72.0° | 65.0° |
| C03 | C04 | C06 | H061 | 47.1° | 55.0° |
| C03 | C04 | O05 | H051 | 180.0° | 59.9° |
| C25 | C03 | C04 | C06 | 72.0° | 105.0° |
| C03 | C25 | C32 | C26 | 179.9° | 179.9° |
| C03 | C25 | C32 | C31 | 179.8° | 180.0° |
| C03 | C25 | C26 | C27 | 179.6° | 180.0° |
| C25 | C03 | C04 | H041 | 47.5° | 14.9° |
| C03 | C25 | C26 | H261 | 0.4° | 0.1° |
| C04 | C06 | C07 | O08 | 59.4° | 65.0° |
| C04 | C06 | C07 | H062 | 120.4° | 120.0° |
| C04 | C06 | C07 | H061 | 120.4° | 120.0° |
| C04 | C06 | C07 | O24 | 62.6° | 175.0° |
| C04 | C06 | H062 | H061 | 118.6° | 119.9° |
| C04 | C06 | C07 | H071 | 178.4° | 55.0° |
| C06 | C04 | O05 | H051 | 58.3° | 60.0° |
| O08 | C09 | C10 | H091 | 120.8° | 119.8° |
| O08 | C09 | C10 | H092 | 120.8° | 120.0° |
| C09 | O08 | C07 | C06 | 134.6° | 178.8° |
| C09 | O08 | C07 | O24 | 13.6° | 58.8° |
| O08 | C09 | C10 | N11 | 76.9° | 174.3° |
| O08 | C09 | C10 | C23 | 46.2° | 54.5° |
| C09 | O08 | C07 | H071 | 106.4° | 61.2° |
| O08 | C09 | H091 | H092 | 117.5° | 120.3° |
| O08 | C09 | C10 | H101 | 166.3° | 65.4° |
| C07 | O08 | C09 | C10 | 38.8° | 57.9° |
| O08 | C07 | C06 | O24 | 122.1° | 120.0° |
| O08 | C07 | C06 | H071 | 119.0° | 120.0° |
| O08 | C07 | O24 | H071 | 119.9° | 120.0° |
| O08 | C07 | O24 | C23 | 62.6° | 58.8° |
| O08 | C07 | C06 | H062 | 61.0° | 175.0° |
| O08 | C07 | C06 | H061 | 179.9° | 55.0° |
| C07 | O08 | C09 | H091 | 82.0° | 61.9° |
| C07 | O08 | C09 | H092 | 159.6° | 177.9° |
| C09 | C10 | N11 | C23 | 124.7° | 119.3° |
| C09 | C10 | N11 | H101 | 117.3° | 120.2° |
| C09 | C10 | C23 | H101 | 120.1° | 119.8° |
| C09 | C10 | N11 | C12 | 174.9° | 155.0° |
| C09 | C10 | C23 | O24 | 2.3° | 54.5° |
| C10 | C09 | H091 | H092 | 117.5° | 120.2° |
| C09 | C10 | C23 | H231 | 122.7° | 174.4° |
| C09 | C10 | C23 | H232 | 118.0° | 65.4° |
| C09 | C10 | N11 | H111 | 54.8° | 31.0° |
| O16 | C17 | C18 | H171 | 120.8° | 119.7° |
| O16 | C17 | C18 | H172 | 120.8° | 119.8° |
| O16 | C17 | C18 | O19 | 37.4° | 59.7° |
| C17 | O16 | C15 | C14 | 160.9° | 162.9° |
| C17 | O16 | C15 | C20 | 19.4° | 17.4° |
| O16 | C17 | H171 | H172 | 117.4° | 120.6° |
| O16 | C17 | C18 | H182 | 158.4° | 60.0° |
| O16 | C17 | C18 | H181 | 83.6° | 179.4° |
| C15 | O16 | C17 | C18 | 36.5° | 46.2° |
| O16 | C15 | C14 | C20 | 179.7° | 179.8° |
| O16 | C15 | C14 | C13 | 179.7° | 179.6° |
| O16 | C15 | C20 | O19 | 0.2° | 0.7° |
| O16 | C15 | C20 | C21 | 179.8° | 179.6° |
| O16 | C15 | C14 | H141 | 0.3° | 0.3° |
| C15 | O16 | C17 | H171 | 84.3° | 73.5° |
| C15 | O16 | C17 | H172 | 157.4° | 165.9° |
| C17 | C18 | O19 | H182 | 121.0° | 119.7° |
| C17 | C18 | O19 | H181 | 121.0° | 119.6° |
| C17 | C18 | O19 | C20 | 18.4° | 46.4° |
| C18 | C17 | H171 | H172 | 117.4° | 120.5° |
| C17 | C18 | H182 | H181 | 116.8° | 120.5° |
| C06 | C07 | O24 | H071 | 118.8° | 120.0° |
| C06 | C07 | O24 | C23 | 176.1° | 178.8° |
| C07 | C06 | C04 | H041 | 48.1° | 55.0° |
| C07 | C06 | H062 | H061 | 118.6° | 120.0° |
| C25 | C32 | C31 | C30 | 0.1° | 0.1° |
| C32 | C25 | C26 | C27 | 0.3° | 0.1° |
| C32 | C25 | C26 | H261 | 179.7° | 180.0° |
| C25 | C32 | C31 | H311 | 179.9° | 179.9° |
| C31 | C32 | C25 | C26 | 0.2° | 0.1° |
| C32 | C31 | C30 | H311 | 180.0° | 180.0° |
| C32 | C31 | C30 | C27 | 0.2° | 0.0° |
| C32 | C31 | C30 | H301 | 179.9° | 180.0° |
| C25 | C26 | C27 | H261 | 180.0° | 179.9° |
| C25 | C26 | C27 | C30 | 0.3° | 0.0° |
| C25 | C26 | C27 | O28 | 179.7° | 179.9° |
| C07 | O24 | C23 | C10 | 54.9° | 58.0° |
| O24 | C07 | C06 | H062 | 176.9° | 55.0° |
| O24 | C07 | C06 | H061 | 57.8° | 65.0° |
| C07 | O24 | C23 | H231 | 175.3° | 177.8° |
| C07 | O24 | C23 | H232 | 65.4° | 61.9° |
| C18 | O19 | C20 | C15 | 0.3° | 17.6° |
| C18 | O19 | C20 | C21 | 179.8° | 162.7° |
| O19 | C18 | C17 | H171 | 83.4° | 60.0° |
| O19 | C18 | C17 | H172 | 158.2° | 179.5° |
| O19 | C18 | H182 | H181 | 116.8° | 120.7° |
| N11 | C10 | C23 | H101 | 117.5° | 120.4° |
| C10 | N11 | C12 | H111 | 120.1° | 124.0° |
| N11 | C10 | C23 | O24 | 124.7° | 174.4° |
| C10 | N11 | C12 | C13 | 143.8° | 180.0° |
| N11 | C10 | C09 | H091 | 162.3° | 54.5° |
| N11 | C10 | C09 | H092 | 43.9° | 65.7° |
| C10 | N11 | C12 | H121 | 95.8° | 60.0° |
| C10 | N11 | C12 | H122 | 23.4° | 60.0° |
| N11 | C10 | C23 | H231 | 114.9° | 65.8° |
| N11 | C10 | C23 | H232 | 4.4° | 54.4° |
| C23 | C10 | N11 | C12 | 60.3° | 85.7° |
| C10 | C23 | O24 | H231 | 120.4° | 119.8° |
| C10 | C23 | O24 | H232 | 120.3° | 119.9° |
| C23 | C10 | C09 | H091 | 74.6° | 65.3° |
| C23 | C10 | C09 | H092 | 167.0° | 174.5° |
| C10 | C23 | H231 | H232 | 118.9° | 120.2° |
| C23 | C10 | N11 | H111 | 179.6° | 150.4° |
| C15 | C14 | C13 | H141 | 180.0° | 179.9° |
| C14 | C15 | C20 | O19 | 179.9° | 179.6° |
| C14 | C15 | C20 | C21 | 0.1° | 0.2° |
| C15 | C14 | C13 | C12 | 179.7° | 180.0° |
| C15 | C14 | C13 | C22 | 0.3° | 0.3° |
| C20 | C15 | C14 | C13 | 0.0° | 0.2° |
| C15 | C20 | O19 | C21 | 179.9° | 179.7° |
| C15 | C20 | C21 | C22 | 0.0° | 0.3° |
| C20 | C15 | C14 | H141 | 180.0° | 179.9° |
| C15 | C20 | C21 | H211 | 180.0° | 179.9° |
| N11 | C12 | C13 | C14 | 46.1° | 89.7° |
| N11 | C12 | C13 | H121 | 120.4° | 120.1° |
| N11 | C12 | C13 | H122 | 120.4° | 120.0° |
| N11 | C12 | C13 | C22 | 134.6° | 90.0° |
| C12 | N11 | C10 | H101 | 57.7° | 34.7° |
| N11 | C12 | H121 | H122 | 118.8° | 120.0° |
| C14 | C13 | C12 | C22 | 179.4° | 179.7° |
| C14 | C13 | C22 | C21 | 0.4° | 0.5° |
| C14 | C13 | C12 | H121 | 166.5° | 30.3° |
| C14 | C13 | C12 | H122 | 74.3° | 150.3° |
| C14 | C13 | C22 | H221 | 179.6° | 179.8° |
| C31 | C30 | C27 | C26 | 0.3° | 0.0° |
| C31 | C30 | C27 | H301 | 180.0° | 179.9° |
| C31 | C30 | C27 | O28 | 179.7° | 179.9° |
| C23 | O24 | C07 | H071 | 57.3° | 61.1° |
| O24 | C23 | C10 | H101 | 117.8° | 65.3° |
| O24 | C23 | H231 | H232 | 118.9° | 120.4° |
| C26 | C27 | C30 | O28 | 179.4° | 180.0° |
| C26 | C27 | O28 | C29 | 22.9° | 180.0° |
| C26 | C27 | C30 | H301 | 179.7° | 180.0° |
| O19 | C20 | C21 | C22 | 180.0° | 179.4° |
| C20 | O19 | C18 | H182 | 139.4° | 73.3° |
| C20 | O19 | C18 | H181 | 102.6° | 166.0° |
| O19 | C20 | C21 | H211 | 0.0° | 0.3° |
| C20 | C21 | C22 | C13 | 0.3° | 0.5° |
| C20 | C21 | C22 | H211 | 180.0° | 179.7° |
| C20 | C21 | C22 | H221 | 179.7° | 179.8° |
| C12 | C13 | C22 | C21 | 179.8° | 179.8° |
| C13 | C12 | H121 | H122 | 118.8° | 120.0° |
| C12 | C13 | C14 | H141 | 0.3° | 0.1° |
| C12 | C13 | C22 | H221 | 0.2° | 0.0° |
| C13 | C12 | N11 | H111 | 23.7° | 56.0° |
| C13 | C22 | C21 | H221 | 180.0° | 179.7° |
| C22 | C13 | C12 | H121 | 14.2° | 150.0° |
| C22 | C13 | C12 | H122 | 105.0° | 30.0° |
| C22 | C13 | C14 | H141 | 179.7° | 179.8° |
| C13 | C22 | C21 | H211 | 179.7° | 179.8° |
| C30 | C27 | O28 | C29 | 157.7° | 0.1° |
| C30 | C27 | C26 | H261 | 179.7° | 179.9° |
| C27 | C30 | C31 | H311 | 179.8° | 180.0° |
| O28 | C27 | C26 | H261 | 0.3° | 0.0° |
| C27 | O28 | C29 | H291 | 180.0° | 180.0° |
| C27 | O28 | C29 | H292 | 60.0° | 60.0° |
| C27 | O28 | C29 | H293 | 60.0° | 60.0° |
| O28 | C27 | C30 | H301 | 0.3° | 0.0° |
| O28 | C29 | H291 | H292 | 120.0° | 120.0° |
| O28 | C29 | H291 | H293 | 120.0° | 120.0° |
| O28 | C29 | H292 | H293 | 120.0° | 119.9° |
| H041 | C04 | C06 | H062 | 168.5° | 175.0° |
| H041 | C04 | C06 | H061 | 72.4° | 65.0° |
| H041 | C04 | O05 | H051 | 60.4° | 180.0° |
| H062 | C06 | C07 | H071 | 58.0° | 65.0° |
| H061 | C06 | C07 | H071 | 61.1° | 175.0° |
| H091 | C09 | C10 | H101 | 45.5° | 174.8° |
| H092 | C09 | C10 | H101 | 72.9° | 54.6° |
| H101 | C10 | C23 | H231 | 2.6° | 54.5° |
| H101 | C10 | C23 | H232 | 121.9° | 174.7° |
| H101 | C10 | N11 | H111 | 62.5° | 89.2° |
| H121 | C12 | N11 | H111 | 144.1° | 64.0° |
| H122 | C12 | N11 | H111 | 96.7° | 176.0° |
| H171 | C17 | C18 | H182 | 37.6° | 179.7° |
| H171 | C17 | C18 | H181 | 155.5° | 59.7° |
| H172 | C17 | C18 | H182 | 80.8° | 59.8° |
| H172 | C17 | C18 | H181 | 37.2° | 60.8° |
| H211 | C21 | C22 | H221 | 0.3° | 0.0° |
| H291 | C29 | H292 | H293 | 120.0° | 120.1° |
| H301 | C30 | C31 | H311 | 0.2° | 0.0° |
