A1CMW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C01 | C02 | doub | 1.40Å | 1.40Å | Aromatic |
| C01 | C06 | sing | 1.39Å | 1.40Å | Aromatic |
| C01 | C07 | sing | 1.48Å | 1.51Å | |
| C02 | C03 | sing | 1.36Å | 1.39Å | Aromatic |
| C03 | C04 | doub | 1.41Å | 1.41Å | Aromatic |
| C04 | C05 | sing | 1.42Å | 1.43Å | Aromatic |
| C04 | N08 | sing | 1.34Å | 1.36Å | Aromatic |
| C05 | C06 | doub | 1.39Å | 1.42Å | Aromatic |
| C05 | C11 | sing | 1.46Å | 1.43Å | Aromatic |
| C07 | N13 | sing | 1.35Å | 1.37Å | |
| C07 | O14 | doub | 1.22Å | 1.23Å | |
| N08 | C09 | doub | 1.31Å | 1.35Å | Aromatic |
| C09 | C10 | sing | 1.46Å | 1.40Å | Aromatic |
| C09 | N12 | sing | 1.38Å | 1.39Å | |
| C10 | C11 | doub | 1.40Å | 1.41Å | Aromatic |
| C10 | C36 | sing | 1.41Å | 1.42Å | Aromatic |
| C11 | N34 | sing | 1.36Å | 1.39Å | Aromatic |
| N13 | C15 | sing | 1.46Å | 1.49Å | |
| N13 | C16 | sing | 1.46Å | 1.48Å | |
| C15 | C18 | sing | 1.51Å | 1.53Å | |
| C15 | C29 | sing | 1.53Å | 1.55Å | |
| C16 | C17 | sing | 1.51Å | 1.52Å | |
| C17 | C19 | doub | 1.38Å | 1.40Å | Aromatic |
| C17 | N23 | sing | 1.32Å | 1.36Å | Aromatic |
| C18 | N24 | doub | 1.32Å | 1.36Å | Aromatic |
| C18 | N28 | sing | 1.32Å | 1.36Å | Aromatic |
| C19 | C20 | sing | 1.39Å | 1.40Å | Aromatic |
| C20 | C21 | doub | 1.39Å | 1.40Å | Aromatic |
| C21 | C22 | sing | 1.38Å | 1.40Å | Aromatic |
| C21 | C30 | sing | 1.51Å | 1.53Å | |
| C22 | N23 | doub | 1.32Å | 1.36Å | Aromatic |
| N24 | C25 | sing | 1.32Å | 1.36Å | Aromatic |
| C25 | C26 | doub | 1.39Å | 1.40Å | Aromatic |
| C26 | C27 | sing | 1.39Å | 1.40Å | Aromatic |
| C27 | N28 | doub | 1.32Å | 1.36Å | Aromatic |
| C30 | F31 | sing | 1.40Å | 1.33Å | |
| C30 | F32 | sing | 1.40Å | 1.33Å | |
| C30 | F33 | sing | 1.40Å | 1.33Å | |
| N34 | N35 | sing | 1.40Å | 1.35Å | Aromatic |
| N34 | C37 | sing | 1.46Å | 1.45Å | |
| N35 | C36 | doub | 1.31Å | 1.31Å | Aromatic |
| N12 | H121 | sing | 0.97Å | 1.00Å | |
| N12 | H122 | sing | 0.97Å | 1.00Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C20 | H201 | sing | 1.08Å | 1.08Å | |
| C22 | H221 | sing | 1.08Å | 1.08Å | |
| C26 | H261 | sing | 1.08Å | 1.08Å | |
| C02 | H021 | sing | 1.08Å | 1.08Å | |
| C03 | H031 | sing | 1.08Å | 1.08Å | |
| C06 | H061 | sing | 1.08Å | 1.08Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C19 | H191 | sing | 1.08Å | 1.08Å | |
| C25 | H251 | sing | 1.08Å | 1.08Å | |
| C27 | H271 | 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 | |
| C36 | H361 | sing | 1.08Å | 1.08Å | |
| C37 | H371 | sing | 1.09Å | 1.10Å | |
| C37 | H372 | sing | 1.09Å | 1.10Å | |
| C37 | H373 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C02 | C01 | C06 | 119.7° | 120.2° |
| C02 | C01 | C07 | 118.2° | 119.9° |
| C01 | C02 | C03 | 121.0° | 120.8° |
| C01 | C02 | H021 | 119.5° | 119.6° |
| C06 | C01 | C07 | 122.1° | 119.9° |
| C01 | C06 | C05 | 120.9° | 119.5° |
| C01 | C06 | H061 | 119.5° | 120.2° |
| C01 | C07 | N13 | 118.5° | 120.0° |
| C01 | C07 | O14 | 118.3° | 120.0° |
| C02 | C03 | C04 | 120.3° | 120.3° |
| C03 | C02 | H021 | 119.5° | 119.6° |
| C02 | C03 | H031 | 119.8° | 119.8° |
| C03 | C04 | C05 | 120.0° | 119.2° |
| C03 | C04 | N08 | 117.8° | 120.1° |
| C04 | C03 | H031 | 119.9° | 119.9° |
| C05 | C04 | N08 | 122.2° | 120.7° |
| C04 | C05 | C06 | 118.2° | 119.9° |
| C04 | C05 | C11 | 116.2° | 118.9° |
| C04 | N08 | C09 | 120.7° | 123.0° |
| C06 | C05 | C11 | 125.6° | 121.2° |
| C05 | C06 | H061 | 119.6° | 120.2° |
| C05 | C11 | C10 | 120.4° | 117.8° |
| C05 | C11 | N34 | 134.1° | 135.2° |
| N13 | C07 | O14 | 123.2° | 120.0° |
| C07 | N13 | C15 | 124.1° | 120.0° |
| C07 | N13 | C16 | 122.7° | 120.0° |
| N08 | C09 | C10 | 121.8° | 121.0° |
| N08 | C09 | N12 | 117.1° | 119.5° |
| C10 | C09 | N12 | 121.0° | 119.5° |
| C09 | C10 | C11 | 118.6° | 118.6° |
| C09 | C10 | C36 | 136.7° | 134.5° |
| C09 | N12 | H121 | 109.5° | 120.0° |
| C09 | N12 | H122 | 109.4° | 119.9° |
| C11 | C10 | C36 | 104.7° | 106.9° |
| C10 | C11 | N34 | 105.4° | 107.0° |
| C10 | C36 | N35 | 111.2° | 108.5° |
| C10 | C36 | H361 | 124.4° | 125.8° |
| C11 | N34 | N35 | 111.0° | 108.1° |
| C11 | N34 | C37 | 131.8° | 125.9° |
| C15 | N13 | C16 | 113.1° | 120.0° |
| N13 | C15 | C18 | 111.8° | 109.5° |
| N13 | C15 | C29 | 118.1° | 109.5° |
| N13 | C15 | H151 | 105.1° | 109.5° |
| N13 | C16 | C17 | 118.0° | 109.5° |
| N13 | C16 | H161 | 107.3° | 109.5° |
| N13 | C16 | H162 | 107.3° | 109.5° |
| C18 | C15 | C29 | 111.4° | 109.5° |
| C15 | C18 | N24 | 114.9° | 119.1° |
| C15 | C18 | N28 | 118.9° | 119.1° |
| C18 | C15 | H151 | 104.7° | 109.5° |
| C29 | C15 | H151 | 104.5° | 109.4° |
| C15 | C29 | H291 | 109.5° | 109.4° |
| C15 | C29 | H292 | 109.5° | 109.5° |
| C15 | C29 | H293 | 109.4° | 109.5° |
| C16 | C17 | C19 | 120.9° | 119.6° |
| C16 | C17 | N23 | 116.1° | 119.6° |
| C17 | C16 | H161 | 107.3° | 109.5° |
| C17 | C16 | H162 | 107.3° | 109.4° |
| C19 | C17 | N23 | 122.9° | 120.8° |
| C17 | C19 | C20 | 118.3° | 119.1° |
| C17 | C19 | H191 | 120.9° | 120.5° |
| C17 | N23 | C22 | 118.0° | 121.7° |
| N24 | C18 | N28 | 126.3° | 121.8° |
| C18 | N24 | C25 | 116.0° | 120.9° |
| C18 | N28 | C27 | 115.8° | 120.8° |
| C19 | C20 | C21 | 119.9° | 118.4° |
| C19 | C20 | H201 | 120.1° | 120.8° |
| C20 | C19 | H191 | 120.9° | 120.4° |
| C20 | C21 | C22 | 118.1° | 119.2° |
| C20 | C21 | C30 | 120.3° | 120.4° |
| C21 | C20 | H201 | 120.1° | 120.8° |
| C22 | C21 | C30 | 121.6° | 120.4° |
| C21 | C22 | N23 | 122.9° | 120.7° |
| C21 | C22 | H221 | 118.6° | 119.7° |
| C21 | C30 | F31 | 112.8° | 109.5° |
| C21 | C30 | F32 | 108.8° | 109.5° |
| C21 | C30 | F33 | 109.3° | 109.4° |
| N23 | C22 | H221 | 118.6° | 119.6° |
| N24 | C25 | C26 | 122.3° | 119.1° |
| N24 | C25 | H251 | 118.9° | 120.4° |
| C25 | C26 | C27 | 117.1° | 118.4° |
| C25 | C26 | H261 | 121.5° | 120.8° |
| C26 | C25 | H251 | 118.8° | 120.5° |
| C26 | C27 | N28 | 122.5° | 119.1° |
| C27 | C26 | H261 | 121.5° | 120.8° |
| C26 | C27 | H271 | 118.7° | 120.4° |
| N28 | C27 | H271 | 118.8° | 120.5° |
| F31 | C30 | F32 | 108.3° | 109.5° |
| F31 | C30 | F33 | 108.5° | 109.4° |
| F32 | C30 | F33 | 109.1° | 109.5° |
| N35 | N34 | C37 | 117.2° | 125.9° |
| N34 | N35 | C36 | 107.7° | 109.5° |
| N34 | C37 | H371 | 109.5° | 109.5° |
| N34 | C37 | H372 | 109.5° | 109.5° |
| N34 | C37 | H373 | 109.5° | 109.5° |
| N35 | C36 | H361 | 124.4° | 125.8° |
| H121 | N12 | H122 | 109.5° | 120.0° |
| H161 | C16 | H162 | 109.5° | 109.5° |
| H291 | C29 | H292 | 109.5° | 109.5° |
| H291 | C29 | H293 | 109.5° | 109.5° |
| H292 | C29 | H293 | 109.5° | 109.5° |
| H371 | C37 | H372 | 109.4° | 109.5° |
| H371 | C37 | H373 | 109.5° | 109.4° |
| H372 | C37 | H373 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C02 | C01 | C06 | C07 | 180.0° | 179.9° |
| C01 | C02 | C03 | H021 | 180.0° | 179.9° |
| C01 | C02 | C03 | C04 | 0.3° | 0.1° |
| C02 | C01 | C06 | C05 | 0.1° | 0.0° |
| C02 | C01 | C07 | N13 | 88.3° | 39.8° |
| C02 | C01 | C07 | O14 | 91.7° | 140.1° |
| C01 | C02 | C03 | H031 | 179.7° | 180.0° |
| C02 | C01 | C06 | H061 | 179.9° | 179.9° |
| C06 | C01 | C02 | C03 | 0.2° | 0.1° |
| C01 | C06 | C05 | C04 | 0.1° | 0.0° |
| C01 | C06 | C05 | H061 | 180.0° | 180.0° |
| C01 | C06 | C05 | C11 | 179.9° | 180.0° |
| C06 | C01 | C07 | N13 | 91.7° | 140.1° |
| C06 | C01 | C07 | O14 | 88.3° | 39.9° |
| C06 | C01 | C02 | H021 | 179.8° | 180.0° |
| C07 | C01 | C02 | C03 | 179.8° | 179.9° |
| C07 | C01 | C06 | C05 | 179.9° | 180.0° |
| C01 | C07 | N13 | O14 | 180.0° | 180.0° |
| C01 | C07 | N13 | C15 | 1.1° | 6.0° |
| C01 | C07 | N13 | C16 | 178.6° | 174.0° |
| C07 | C01 | C02 | H021 | 0.2° | 0.0° |
| C07 | C01 | C06 | H061 | 0.1° | 0.0° |
| C02 | C03 | C04 | H031 | 180.0° | 179.8° |
| C02 | C03 | C04 | C05 | 0.3° | 0.1° |
| C02 | C03 | C04 | N08 | 179.8° | 179.4° |
| C03 | C04 | C05 | N08 | 179.9° | 179.5° |
| C03 | C04 | C05 | C06 | 0.2° | 0.0° |
| C03 | C04 | C05 | C11 | 180.0° | 180.0° |
| C03 | C04 | N08 | C09 | 179.8° | 179.8° |
| C04 | C03 | C02 | H021 | 179.8° | 179.9° |
| C04 | C05 | C06 | C11 | 179.8° | 180.0° |
| C05 | C04 | N08 | C09 | 0.1° | 0.3° |
| C04 | C05 | C11 | C10 | 0.2° | 0.5° |
| C04 | C05 | C11 | N34 | 180.0° | 179.6° |
| C05 | C04 | C03 | H031 | 179.7° | 179.9° |
| C04 | C05 | C06 | H061 | 179.9° | 180.0° |
| N08 | C04 | C05 | C06 | 179.9° | 179.5° |
| N08 | C04 | C05 | C11 | 0.1° | 0.5° |
| C04 | N08 | C09 | C10 | 0.2° | 0.0° |
| C04 | N08 | C09 | N12 | 180.0° | 180.0° |
| N08 | C04 | C03 | H031 | 0.2° | 0.4° |
| C06 | C05 | C11 | C10 | 180.0° | 179.5° |
| C06 | C05 | C11 | N34 | 0.2° | 0.4° |
| C05 | C11 | C10 | C09 | 0.0° | 0.3° |
| C05 | C11 | C10 | N34 | 179.9° | 179.9° |
| C05 | C11 | C10 | C36 | 179.9° | 179.9° |
| C05 | C11 | N34 | N35 | 179.9° | 179.9° |
| C05 | C11 | N34 | C37 | 0.1° | 0.1° |
| C11 | C05 | C06 | H061 | 0.1° | 0.0° |
| C07 | N13 | C15 | C16 | 177.7° | 180.0° |
| C07 | N13 | C15 | C18 | 115.3° | 113.6° |
| C07 | N13 | C15 | C29 | 113.6° | 126.4° |
| C07 | N13 | C16 | C17 | 97.7° | 83.5° |
| C07 | N13 | C15 | H151 | 2.3° | 6.4° |
| C07 | N13 | C16 | H161 | 141.1° | 36.5° |
| C07 | N13 | C16 | H162 | 23.5° | 156.5° |
| O14 | C07 | N13 | C15 | 178.8° | 174.0° |
| O14 | C07 | N13 | C16 | 1.4° | 6.0° |
| N08 | C09 | C10 | N12 | 179.8° | 180.0° |
| N08 | C09 | C10 | C11 | 0.2° | 0.0° |
| N08 | C09 | C10 | C36 | 179.9° | 179.7° |
| N08 | C09 | N12 | H121 | 0.0° | 180.0° |
| N08 | C09 | N12 | H122 | 120.0° | 0.0° |
| C09 | C10 | C11 | C36 | 179.9° | 179.8° |
| C09 | C10 | C11 | N34 | 179.9° | 179.8° |
| C09 | C10 | C36 | N35 | 180.0° | 179.7° |
| C10 | C09 | N12 | H121 | 179.8° | 0.0° |
| C10 | C09 | N12 | H122 | 60.2° | 180.0° |
| C09 | C10 | C36 | H361 | 0.1° | 0.3° |
| N12 | C09 | C10 | C11 | 180.0° | 180.0° |
| N12 | C09 | C10 | C36 | 0.1° | 0.3° |
| C09 | N12 | H121 | H122 | 120.0° | 180.0° |
| C10 | C11 | N34 | N35 | 0.0° | 0.1° |
| C10 | C11 | N34 | C37 | 180.0° | 179.9° |
| C11 | C10 | C36 | N35 | 0.0° | 0.0° |
| C11 | C10 | C36 | H361 | 180.0° | 180.0° |
| C36 | C10 | C11 | N34 | 0.0° | 0.0° |
| C10 | C36 | N35 | N34 | 0.1° | 0.0° |
| C10 | C36 | N35 | H361 | 180.0° | 180.0° |
| C11 | N34 | N35 | C37 | 180.0° | 180.0° |
| C11 | N34 | N35 | C36 | 0.1° | 0.1° |
| C11 | N34 | C37 | H371 | 180.0° | 84.0° |
| C11 | N34 | C37 | H372 | 60.0° | 155.9° |
| C11 | N34 | C37 | H373 | 59.9° | 36.0° |
| N13 | C15 | C18 | C29 | 134.5° | 120.0° |
| N13 | C15 | C18 | H151 | 113.2° | 120.0° |
| N13 | C15 | C29 | H151 | 116.2° | 120.0° |
| C15 | N13 | C16 | C17 | 84.6° | 96.4° |
| N13 | C15 | C18 | N24 | 51.0° | 135.0° |
| N13 | C15 | C18 | N28 | 128.1° | 44.7° |
| C15 | N13 | C16 | H161 | 36.6° | 143.5° |
| C15 | N13 | C16 | H162 | 154.2° | 23.5° |
| N13 | C15 | C29 | H291 | 180.0° | 69.3° |
| N13 | C15 | C29 | H292 | 60.0° | 50.7° |
| N13 | C15 | C29 | H293 | 60.0° | 170.7° |
| C16 | N13 | C15 | C18 | 62.4° | 66.4° |
| C16 | N13 | C15 | C29 | 68.7° | 53.6° |
| N13 | C16 | C17 | H161 | 121.2° | 120.0° |
| N13 | C16 | C17 | H162 | 121.2° | 120.0° |
| N13 | C16 | C17 | C19 | 55.6° | 98.5° |
| N13 | C16 | C17 | N23 | 124.8° | 81.8° |
| C16 | N13 | C15 | H151 | 175.3° | 173.5° |
| N13 | C16 | H161 | H162 | 116.2° | 120.0° |
| C18 | C15 | C29 | H151 | 112.5° | 120.0° |
| C15 | C18 | N24 | N28 | 179.0° | 179.7° |
| C15 | C18 | N24 | C25 | 179.6° | 180.0° |
| C15 | C18 | N28 | C27 | 179.6° | 179.7° |
| C18 | C15 | C29 | H291 | 48.7° | 50.7° |
| C18 | C15 | C29 | H292 | 71.3° | 170.7° |
| C18 | C15 | C29 | H293 | 168.7° | 69.3° |
| C29 | C15 | C18 | N24 | 174.5° | 105.0° |
| C29 | C15 | C18 | N28 | 6.4° | 75.3° |
| C15 | C29 | H291 | H292 | 120.0° | 120.0° |
| C15 | C29 | H291 | H293 | 120.0° | 119.9° |
| C15 | C29 | H292 | H293 | 119.9° | 120.0° |
| C16 | C17 | C19 | N23 | 179.5° | 179.7° |
| C16 | C17 | C19 | C20 | 179.8° | 179.7° |
| C16 | C17 | N23 | C22 | 179.8° | 179.7° |
| C17 | C16 | H161 | H162 | 116.1° | 120.0° |
| C16 | C17 | C19 | H191 | 0.1° | 0.3° |
| C17 | C19 | C20 | H191 | 180.0° | 180.0° |
| C17 | C19 | C20 | C21 | 0.2° | 0.0° |
| C19 | C17 | N23 | C22 | 0.2° | 0.0° |
| C17 | C19 | C20 | H201 | 179.8° | 180.0° |
| C19 | C17 | C16 | H161 | 176.9° | 141.5° |
| C19 | C17 | C16 | H162 | 65.6° | 21.5° |
| N23 | C17 | C19 | C20 | 0.3° | 0.0° |
| C17 | N23 | C22 | C21 | 0.0° | 0.0° |
| C17 | N23 | C22 | H221 | 180.0° | 180.0° |
| N23 | C17 | C16 | H161 | 3.6° | 38.2° |
| N23 | C17 | C16 | H162 | 114.0° | 158.2° |
| N23 | C17 | C19 | H191 | 179.7° | 180.0° |
| C18 | N24 | C25 | C26 | 0.2° | 0.0° |
| N24 | C18 | N28 | C27 | 0.7° | 0.6° |
| N24 | C18 | C15 | H151 | 62.2° | 15.0° |
| C18 | N24 | C25 | H251 | 179.8° | 179.9° |
| N28 | C18 | N24 | C25 | 0.6° | 0.3° |
| C18 | N28 | C27 | C26 | 0.4° | 0.5° |
| N28 | C18 | C15 | H151 | 118.8° | 164.7° |
| C18 | N28 | C27 | H271 | 179.7° | 179.4° |
| C19 | C20 | C21 | H201 | 180.0° | 180.0° |
| C19 | C20 | C21 | C22 | 0.0° | 0.0° |
| C19 | C20 | C21 | C30 | 179.7° | 180.0° |
| C20 | C21 | C22 | C30 | 179.7° | 180.0° |
| C20 | C21 | C22 | N23 | 0.1° | 0.0° |
| C20 | C21 | C30 | F31 | 92.6° | 90.0° |
| C20 | C21 | C30 | F32 | 147.2° | 150.0° |
| C20 | C21 | C30 | F33 | 28.1° | 30.0° |
| C20 | C21 | C22 | H221 | 179.8° | 180.0° |
| C21 | C20 | C19 | H191 | 179.8° | 180.0° |
| C21 | C22 | N23 | H221 | 180.0° | 179.9° |
| C22 | C21 | C30 | F31 | 87.7° | 90.1° |
| C22 | C21 | C30 | F32 | 32.5° | 30.0° |
| C22 | C21 | C30 | F33 | 151.5° | 150.0° |
| C22 | C21 | C20 | H201 | 180.0° | 180.0° |
| C30 | C21 | C22 | N23 | 179.8° | 180.0° |
| C21 | C30 | F31 | F32 | 120.4° | 120.1° |
| C21 | C30 | F31 | F33 | 121.3° | 119.9° |
| C21 | C30 | F32 | F33 | 119.2° | 120.0° |
| C30 | C21 | C20 | H201 | 0.3° | 0.0° |
| C30 | C21 | C22 | H221 | 0.2° | 0.1° |
| N24 | C25 | C26 | H251 | 180.0° | 180.0° |
| N24 | C25 | C26 | C27 | 0.0° | 0.0° |
| N24 | C25 | C26 | H261 | 180.0° | 179.7° |
| C25 | C26 | C27 | H261 | 180.0° | 179.8° |
| C25 | C26 | C27 | N28 | 0.1° | 0.2° |
| C25 | C26 | C27 | H271 | 180.0° | 179.7° |
| C26 | C27 | N28 | H271 | 180.0° | 180.0° |
| C27 | C26 | C25 | H251 | 180.0° | 179.9° |
| N28 | C27 | C26 | H261 | 179.9° | 180.0° |
| F31 | C30 | F32 | F33 | 117.9° | 120.0° |
| N34 | N35 | C36 | H361 | 180.0° | 180.0° |
| N35 | N34 | C37 | H371 | 0.0° | 96.0° |
| N35 | N34 | C37 | H372 | 120.0° | 24.1° |
| N35 | N34 | C37 | H373 | 120.0° | 144.0° |
| C37 | N34 | N35 | C36 | 180.0° | 180.0° |
| N34 | C37 | H371 | H372 | 120.0° | 120.1° |
| N34 | C37 | H371 | H373 | 120.0° | 120.0° |
| N34 | C37 | H372 | H373 | 120.0° | 120.0° |
| H151 | C15 | C29 | H291 | 63.8° | 170.6° |
| H151 | C15 | C29 | H292 | 176.2° | 69.4° |
| H151 | C15 | C29 | H293 | 56.3° | 50.7° |
| H201 | C20 | C19 | H191 | 0.2° | 0.0° |
| H261 | C26 | C25 | H251 | 0.0° | 0.3° |
| H261 | C26 | C27 | H271 | 0.1° | 0.1° |
| H021 | C02 | C03 | H031 | 0.2° | 0.1° |
| H291 | C29 | H292 | H293 | 120.0° | 120.0° |
| H371 | C37 | H372 | H373 | 120.0° | 120.0° |
