A1BYS
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C01 | C02 | sing | 1.53Å | 1.50Å | |
| C02 | C03 | sing | 1.51Å | 1.49Å | |
| C03 | N04 | sing | 1.35Å | 1.45Å | |
| C03 | O37 | doub | 1.21Å | 1.18Å | |
| N04 | C05 | sing | 1.40Å | 1.46Å | |
| C05 | C29 | doub | 1.39Å | 1.38Å | Aromatic |
| C05 | C06 | sing | 1.39Å | 1.38Å | Aromatic |
| C06 | C07 | doub | 1.39Å | 1.38Å | Aromatic |
| C07 | N08 | sing | 1.40Å | 1.45Å | |
| C07 | C25 | sing | 1.39Å | 1.37Å | Aromatic |
| N08 | C09 | sing | 1.38Å | 1.45Å | |
| C09 | N24 | doub | 1.32Å | 1.35Å | Aromatic |
| C09 | N10 | sing | 1.33Å | 1.34Å | Aromatic |
| N10 | C11 | doub | 1.33Å | 1.30Å | Aromatic |
| C11 | C12 | sing | 1.38Å | 1.34Å | Aromatic |
| C12 | C13 | doub | 1.40Å | 1.35Å | Aromatic |
| C13 | C14 | sing | 1.47Å | 1.53Å | |
| C13 | N24 | sing | 1.33Å | 1.32Å | Aromatic |
| C14 | N23 | sing | 1.38Å | 1.32Å | Aromatic |
| C14 | C15 | doub | 1.38Å | 1.29Å | Aromatic |
| C15 | N16 | sing | 1.33Å | 1.39Å | Aromatic |
| N16 | C17 | doub | 1.33Å | 1.45Å | Aromatic |
| C17 | C18 | sing | 1.41Å | 1.40Å | Aromatic |
| C17 | N23 | sing | 1.37Å | 1.42Å | Aromatic |
| C18 | C19 | sing | 1.51Å | 1.52Å | |
| C18 | C20 | doub | 1.36Å | 1.42Å | Aromatic |
| C20 | C21 | sing | 1.40Å | 1.41Å | Aromatic |
| C21 | C22 | doub | 1.35Å | 1.36Å | Aromatic |
| C22 | N23 | sing | 1.36Å | 1.41Å | Aromatic |
| C25 | O26 | sing | 1.36Å | 1.39Å | |
| C25 | C28 | doub | 1.38Å | 1.37Å | Aromatic |
| O26 | C27 | sing | 1.43Å | 1.39Å | |
| C28 | C29 | sing | 1.39Å | 1.38Å | Aromatic |
| C29 | N30 | sing | 1.40Å | 1.44Å | |
| N30 | C31 | sing | 1.47Å | 1.44Å | |
| N30 | C36 | sing | 1.47Å | 1.45Å | |
| C31 | C32 | sing | 1.53Å | 1.52Å | |
| C32 | N33 | sing | 1.47Å | 1.45Å | |
| N33 | C34 | sing | 1.47Å | 1.45Å | |
| N33 | C35 | sing | 1.47Å | 1.45Å | |
| C01 | H011 | sing | 1.09Å | 1.10Å | |
| C01 | H1 | sing | 1.09Å | 1.10Å | |
| C01 | H012 | sing | 1.09Å | 1.10Å | |
| C02 | H021 | sing | 1.09Å | 1.10Å | |
| C02 | H2 | sing | 1.09Å | 1.10Å | |
| C06 | H061 | sing | 1.08Å | 1.08Å | |
| C11 | H111 | sing | 1.08Å | 1.08Å | |
| C12 | H121 | sing | 1.08Å | 1.08Å | |
| C15 | H151 | sing | 1.08Å | 1.08Å | |
| C19 | H193 | sing | 1.09Å | 1.10Å | |
| C19 | H192 | sing | 1.09Å | 1.10Å | |
| C19 | H191 | sing | 1.09Å | 1.10Å | |
| C20 | H201 | sing | 1.08Å | 1.08Å | |
| C21 | H211 | sing | 1.08Å | 1.08Å | |
| C22 | H221 | sing | 1.08Å | 1.08Å | |
| N04 | H041 | sing | 0.97Å | 1.00Å | |
| N08 | H081 | sing | 0.97Å | 1.00Å | |
| C27 | H273 | sing | 1.09Å | 1.10Å | |
| C27 | H271 | sing | 1.09Å | 1.10Å | |
| C27 | H272 | sing | 1.09Å | 1.10Å | |
| C28 | H281 | sing | 1.08Å | 1.08Å | |
| C31 | H312 | sing | 1.09Å | 1.10Å | |
| C31 | H311 | sing | 1.09Å | 1.10Å | |
| C32 | H321 | sing | 1.09Å | 1.10Å | |
| C32 | H322 | sing | 1.09Å | 1.10Å | |
| C34 | H342 | sing | 1.09Å | 1.10Å | |
| C34 | H343 | sing | 1.09Å | 1.10Å | |
| C34 | H341 | sing | 1.09Å | 1.10Å | |
| C35 | H353 | sing | 1.09Å | 1.10Å | |
| C35 | H351 | sing | 1.09Å | 1.10Å | |
| C35 | H352 | sing | 1.09Å | 1.10Å | |
| C36 | H363 | sing | 1.09Å | 1.10Å | |
| C36 | H361 | sing | 1.09Å | 1.10Å | |
| C36 | H362 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C01 | C02 | C03 | 139.8° | 109.5° |
| C02 | C01 | H011 | 109.5° | 109.5° |
| C02 | C01 | H1 | 109.5° | 109.4° |
| C02 | C01 | H012 | 109.5° | 109.5° |
| C01 | C02 | H021 | 101.4° | 109.5° |
| C01 | C02 | H2 | 101.4° | 109.4° |
| C02 | C03 | N04 | 130.2° | 120.0° |
| C02 | C03 | O37 | 106.1° | 120.0° |
| C03 | C02 | H021 | 101.5° | 109.5° |
| C03 | C02 | H2 | 101.5° | 109.5° |
| N04 | C03 | O37 | 122.8° | 120.0° |
| C03 | N04 | C05 | 126.8° | 120.0° |
| C03 | N04 | H041 | 116.6° | 120.0° |
| N04 | C05 | C29 | 118.9° | 120.1° |
| N04 | C05 | C06 | 123.0° | 120.0° |
| C05 | N04 | H041 | 116.6° | 120.0° |
| C29 | C05 | C06 | 118.1° | 119.9° |
| C05 | C29 | C28 | 120.5° | 120.0° |
| C05 | C29 | N30 | 121.8° | 120.0° |
| C05 | C06 | C07 | 121.3° | 120.0° |
| C05 | C06 | H061 | 119.3° | 120.0° |
| C06 | C07 | N08 | 122.5° | 120.0° |
| C06 | C07 | C25 | 119.9° | 120.0° |
| C07 | C06 | H061 | 119.3° | 120.0° |
| N08 | C07 | C25 | 117.5° | 120.0° |
| C07 | N08 | C09 | 123.7° | 120.0° |
| C07 | N08 | H081 | 118.2° | 120.0° |
| C07 | C25 | O26 | 120.4° | 120.0° |
| C07 | C25 | C28 | 119.6° | 120.1° |
| N08 | C09 | N24 | 120.0° | 119.1° |
| N08 | C09 | N10 | 119.9° | 119.1° |
| C09 | N08 | H081 | 118.1° | 120.0° |
| N24 | C09 | N10 | 120.1° | 121.7° |
| C09 | N24 | C13 | 119.3° | 120.5° |
| C09 | N10 | C11 | 120.1° | 121.1° |
| N10 | C11 | C12 | 120.6° | 119.3° |
| N10 | C11 | H111 | 119.7° | 120.4° |
| C11 | C12 | C13 | 120.1° | 118.4° |
| C12 | C11 | H111 | 119.7° | 120.3° |
| C11 | C12 | H121 | 120.0° | 120.8° |
| C12 | C13 | C14 | 120.6° | 120.5° |
| C12 | C13 | N24 | 119.8° | 118.9° |
| C13 | C12 | H121 | 119.9° | 120.8° |
| C14 | C13 | N24 | 119.6° | 120.5° |
| C13 | C14 | N23 | 124.7° | 126.7° |
| C13 | C14 | C15 | 120.5° | 126.7° |
| N23 | C14 | C15 | 114.8° | 106.6° |
| C14 | N23 | C17 | 105.6° | 107.0° |
| C14 | N23 | C22 | 134.0° | 132.4° |
| C14 | C15 | N16 | 108.5° | 108.3° |
| C14 | C15 | H151 | 125.7° | 125.9° |
| C15 | N16 | C17 | 105.2° | 109.6° |
| N16 | C15 | H151 | 125.7° | 125.8° |
| N16 | C17 | C18 | 133.9° | 131.9° |
| N16 | C17 | N23 | 105.8° | 108.5° |
| C18 | C17 | N23 | 120.3° | 119.6° |
| C17 | C18 | C19 | 121.3° | 120.4° |
| C17 | C18 | C20 | 117.4° | 119.4° |
| C17 | N23 | C22 | 120.3° | 120.6° |
| C19 | C18 | C20 | 121.3° | 120.3° |
| C18 | C19 | H193 | 109.5° | 109.5° |
| C18 | C19 | H192 | 109.5° | 109.5° |
| C18 | C19 | H191 | 109.5° | 109.4° |
| C18 | C20 | C21 | 122.1° | 119.6° |
| C18 | C20 | H201 | 119.0° | 120.2° |
| C20 | C21 | C22 | 119.6° | 120.2° |
| C21 | C20 | H201 | 118.9° | 120.2° |
| C20 | C21 | H211 | 120.2° | 119.9° |
| C21 | C22 | N23 | 120.4° | 120.6° |
| C22 | C21 | H211 | 120.2° | 119.9° |
| C21 | C22 | H221 | 119.8° | 119.7° |
| N23 | C22 | H221 | 119.8° | 119.7° |
| O26 | C25 | C28 | 120.0° | 119.9° |
| C25 | O26 | C27 | 113.1° | 117.0° |
| C25 | C28 | C29 | 120.5° | 120.0° |
| C25 | C28 | H281 | 119.7° | 120.0° |
| O26 | C27 | H273 | 109.5° | 109.5° |
| O26 | C27 | H271 | 109.5° | 109.5° |
| O26 | C27 | H272 | 109.5° | 109.5° |
| C28 | C29 | N30 | 117.7° | 120.0° |
| C29 | C28 | H281 | 119.7° | 120.0° |
| C29 | N30 | C31 | 122.3° | 111.0° |
| C29 | N30 | C36 | 117.1° | 111.0° |
| C31 | N30 | C36 | 120.6° | 111.0° |
| N30 | C31 | C32 | 107.2° | 109.5° |
| N30 | C31 | H312 | 110.0° | 109.4° |
| N30 | C31 | H311 | 110.1° | 109.5° |
| N30 | C36 | H363 | 109.5° | 109.5° |
| N30 | C36 | H361 | 109.5° | 109.5° |
| N30 | C36 | H362 | 109.5° | 109.5° |
| C31 | C32 | N33 | 109.8° | 109.5° |
| C32 | C31 | H312 | 110.0° | 109.4° |
| C32 | C31 | H311 | 110.0° | 109.5° |
| C31 | C32 | H321 | 109.4° | 109.4° |
| C31 | C32 | H322 | 109.4° | 109.5° |
| C32 | N33 | C34 | 109.0° | 111.0° |
| C32 | N33 | C35 | 108.8° | 111.0° |
| N33 | C32 | H321 | 109.4° | 109.5° |
| N33 | C32 | H322 | 109.4° | 109.5° |
| C34 | N33 | C35 | 110.2° | 111.0° |
| N33 | C34 | H342 | 109.5° | 109.4° |
| N33 | C34 | H343 | 109.5° | 109.4° |
| N33 | C34 | H341 | 109.4° | 109.5° |
| N33 | C35 | H353 | 109.5° | 109.4° |
| N33 | C35 | H351 | 109.5° | 109.4° |
| N33 | C35 | H352 | 109.4° | 109.4° |
| H011 | C01 | H1 | 109.5° | 109.5° |
| H011 | C01 | H012 | 109.4° | 109.5° |
| H1 | C01 | H012 | 109.4° | 109.4° |
| H021 | C02 | H2 | 109.5° | 109.4° |
| H193 | C19 | H192 | 109.5° | 109.5° |
| H193 | C19 | H191 | 109.4° | 109.4° |
| H192 | C19 | H191 | 109.5° | 109.5° |
| H273 | C27 | H271 | 109.5° | 109.4° |
| H273 | C27 | H272 | 109.4° | 109.5° |
| H271 | C27 | H272 | 109.5° | 109.4° |
| H312 | C31 | H311 | 109.4° | 109.5° |
| H321 | C32 | H322 | 109.5° | 109.5° |
| H342 | C34 | H343 | 109.5° | 109.5° |
| H342 | C34 | H341 | 109.5° | 109.5° |
| H343 | C34 | H341 | 109.5° | 109.4° |
| H353 | C35 | H351 | 109.5° | 109.5° |
| H353 | C35 | H352 | 109.5° | 109.5° |
| H351 | C35 | H352 | 109.5° | 109.5° |
| H363 | C36 | H361 | 109.4° | 109.5° |
| H363 | C36 | H362 | 109.5° | 109.5° |
| H361 | C36 | H362 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C01 | C02 | C03 | H021 | 123.6° | 120.1° |
| C01 | C02 | C03 | H2 | 123.6° | 120.0° |
| C01 | C02 | C03 | N04 | 137.4° | 180.0° |
| C01 | C02 | C03 | O37 | 31.7° | 0.0° |
| C02 | C01 | H011 | H1 | 120.0° | 120.0° |
| C02 | C01 | H011 | H012 | 120.0° | 120.0° |
| C02 | C01 | H1 | H012 | 120.0° | 119.9° |
| C01 | C02 | H021 | H2 | 106.6° | 119.9° |
| C02 | C03 | N04 | O37 | 167.6° | 179.9° |
| C02 | C03 | N04 | C05 | 166.7° | 175.5° |
| C03 | C02 | C01 | H011 | 180.0° | 180.0° |
| C03 | C02 | C01 | H1 | 60.0° | 60.0° |
| C03 | C02 | C01 | H012 | 60.0° | 59.9° |
| C03 | C02 | H021 | H2 | 106.7° | 120.0° |
| C02 | C03 | N04 | H041 | 13.3° | 4.4° |
| C03 | N04 | C05 | H041 | 180.0° | 179.9° |
| C03 | N04 | C05 | C29 | 158.7° | 151.2° |
| C03 | N04 | C05 | C06 | 21.2° | 28.6° |
| N04 | C03 | C02 | H021 | 13.8° | 59.9° |
| N04 | C03 | C02 | H2 | 99.0° | 60.1° |
| O37 | C03 | N04 | C05 | 0.9° | 4.5° |
| O37 | C03 | C02 | H021 | 155.3° | 120.0° |
| O37 | C03 | C02 | H2 | 91.9° | 120.0° |
| O37 | C03 | N04 | H041 | 179.1° | 175.6° |
| N04 | C05 | C29 | C06 | 180.0° | 179.8° |
| N04 | C05 | C06 | C07 | 179.7° | 179.7° |
| N04 | C05 | C29 | C28 | 179.7° | 179.8° |
| N04 | C05 | C29 | N30 | 1.5° | 0.3° |
| N04 | C05 | C06 | H061 | 0.3° | 0.2° |
| C29 | C05 | C06 | C07 | 0.3° | 0.0° |
| C05 | C29 | C28 | C25 | 0.5° | 0.0° |
| C05 | C29 | C28 | N30 | 178.2° | 179.9° |
| C05 | C29 | N30 | C31 | 78.2° | 120.0° |
| C05 | C29 | N30 | C36 | 102.4° | 116.0° |
| C29 | C05 | C06 | H061 | 179.7° | 179.9° |
| C29 | C05 | N04 | H041 | 21.3° | 28.7° |
| C05 | C29 | C28 | H281 | 179.5° | 179.9° |
| C05 | C06 | C07 | H061 | 180.0° | 179.9° |
| C05 | C06 | C07 | N08 | 179.2° | 180.0° |
| C05 | C06 | C07 | C25 | 0.5° | 0.0° |
| C06 | C05 | C29 | C28 | 0.4° | 0.0° |
| C06 | C05 | C29 | N30 | 178.5° | 179.9° |
| C06 | C05 | N04 | H041 | 158.8° | 151.5° |
| C06 | C07 | N08 | C25 | 178.8° | 180.0° |
| C06 | C07 | N08 | C09 | 46.4° | 31.0° |
| C06 | C07 | C25 | O26 | 179.8° | 179.9° |
| C06 | C07 | C25 | C28 | 0.6° | 0.0° |
| C06 | C07 | N08 | H081 | 133.6° | 149.0° |
| C07 | N08 | C09 | H081 | 180.0° | 180.0° |
| C07 | N08 | C09 | N24 | 13.4° | 173.8° |
| C07 | N08 | C09 | N10 | 167.4° | 6.4° |
| N08 | C07 | C25 | O26 | 1.0° | 0.0° |
| N08 | C07 | C25 | C28 | 179.4° | 180.0° |
| N08 | C07 | C06 | H061 | 0.8° | 0.1° |
| C25 | C07 | N08 | C09 | 134.8° | 149.0° |
| C07 | C25 | O26 | C28 | 179.6° | 180.0° |
| C07 | C25 | O26 | C27 | 161.5° | 180.0° |
| C07 | C25 | C28 | C29 | 0.6° | 0.0° |
| C25 | C07 | C06 | H061 | 179.6° | 179.9° |
| C25 | C07 | N08 | H081 | 45.2° | 31.0° |
| C07 | C25 | C28 | H281 | 179.4° | 180.0° |
| N08 | C09 | N24 | N10 | 179.2° | 179.7° |
| N08 | C09 | N10 | C11 | 179.5° | 179.7° |
| N08 | C09 | N24 | C13 | 179.8° | 179.7° |
| N24 | C09 | N10 | C11 | 0.3° | 0.0° |
| C09 | N24 | C13 | C12 | 1.4° | 0.0° |
| C09 | N24 | C13 | C14 | 179.6° | 180.0° |
| N24 | C09 | N08 | H081 | 166.6° | 6.1° |
| C09 | N10 | C11 | C12 | 0.0° | 0.0° |
| N10 | C09 | N24 | C13 | 1.0° | 0.0° |
| C09 | N10 | C11 | H111 | 180.0° | 180.0° |
| N10 | C09 | N08 | H081 | 12.6° | 173.6° |
| N10 | C11 | C12 | H111 | 180.0° | 180.0° |
| N10 | C11 | C12 | C13 | 0.4° | 0.1° |
| N10 | C11 | C12 | H121 | 179.6° | 179.9° |
| C11 | C12 | C13 | H121 | 180.0° | 179.9° |
| C11 | C12 | C13 | C14 | 179.3° | 180.0° |
| C11 | C12 | C13 | N24 | 1.1° | 0.1° |
| C12 | C13 | C14 | N24 | 178.2° | 179.9° |
| C12 | C13 | C14 | N23 | 163.4° | 6.9° |
| C12 | C13 | C14 | C15 | 17.9° | 172.8° |
| C13 | C12 | C11 | H111 | 179.7° | 179.9° |
| C13 | C14 | N23 | C15 | 178.7° | 179.7° |
| C13 | C14 | C15 | N16 | 179.3° | 180.0° |
| C13 | C14 | N23 | C17 | 179.3° | 179.9° |
| C13 | C14 | N23 | C22 | 1.3° | 0.0° |
| C14 | C13 | C12 | H121 | 0.7° | 0.1° |
| C13 | C14 | C15 | H151 | 0.7° | 0.0° |
| N24 | C13 | C14 | N23 | 18.3° | 173.0° |
| N24 | C13 | C14 | C15 | 160.3° | 7.3° |
| N24 | C13 | C12 | H121 | 178.9° | 179.9° |
| N23 | C14 | C15 | N16 | 0.5° | 0.3° |
| C14 | N23 | C17 | N16 | 0.3° | 0.5° |
| C14 | N23 | C17 | C18 | 179.8° | 180.0° |
| C14 | N23 | C17 | C22 | 179.6° | 179.9° |
| C14 | N23 | C22 | C21 | 179.7° | 179.9° |
| N23 | C14 | C15 | H151 | 179.5° | 179.7° |
| C14 | N23 | C22 | H221 | 0.3° | 0.2° |
| C14 | C15 | N16 | H151 | 180.0° | 180.0° |
| C14 | C15 | N16 | C17 | 0.3° | 0.0° |
| C15 | C14 | N23 | C17 | 0.5° | 0.4° |
| C15 | C14 | N23 | C22 | 180.0° | 179.7° |
| C15 | N16 | C17 | C18 | 179.9° | 179.8° |
| C15 | N16 | C17 | N23 | 0.0° | 0.3° |
| N16 | C17 | C18 | N23 | 179.9° | 179.4° |
| N16 | C17 | C18 | C19 | 0.1° | 0.5° |
| N16 | C17 | C18 | C20 | 179.9° | 179.4° |
| N16 | C17 | N23 | C22 | 179.9° | 179.7° |
| C17 | N16 | C15 | H151 | 179.7° | 180.0° |
| C17 | C18 | C19 | C20 | 180.0° | 180.0° |
| C17 | C18 | C20 | C21 | 0.1° | 0.0° |
| C18 | C17 | N23 | C22 | 0.2° | 0.1° |
| C17 | C18 | C19 | H193 | 90.0° | 90.0° |
| C17 | C18 | C19 | H192 | 150.0° | 150.0° |
| C17 | C18 | C19 | H191 | 30.0° | 30.0° |
| C17 | C18 | C20 | H201 | 179.9° | 180.0° |
| N23 | C17 | C18 | C19 | 180.0° | 180.0° |
| N23 | C17 | C18 | C20 | 0.0° | 0.0° |
| C17 | N23 | C22 | C21 | 0.3° | 0.2° |
| C17 | N23 | C22 | H221 | 179.7° | 180.0° |
| C19 | C18 | C20 | C21 | 179.9° | 180.0° |
| C18 | C19 | H193 | H192 | 120.0° | 120.0° |
| C18 | C19 | H193 | H191 | 120.0° | 119.9° |
| C18 | C19 | H192 | H191 | 120.0° | 120.0° |
| C19 | C18 | C20 | H201 | 0.1° | 0.0° |
| C18 | C20 | C21 | H201 | 180.0° | 180.0° |
| C18 | C20 | C21 | C22 | 0.1° | 0.1° |
| C20 | C18 | C19 | H193 | 90.0° | 90.0° |
| C20 | C18 | C19 | H192 | 30.0° | 30.0° |
| C20 | C18 | C19 | H191 | 150.0° | 150.1° |
| C18 | C20 | C21 | H211 | 179.9° | 180.0° |
| C20 | C21 | C22 | H211 | 180.0° | 179.9° |
| C20 | C21 | C22 | N23 | 0.2° | 0.2° |
| C20 | C21 | C22 | H221 | 179.7° | 180.0° |
| C21 | C22 | N23 | H221 | 180.0° | 179.8° |
| C22 | C21 | C20 | H201 | 180.0° | 179.9° |
| N23 | C22 | C21 | H211 | 179.8° | 179.9° |
| O26 | C25 | C28 | C29 | 179.8° | 179.9° |
| C25 | O26 | C27 | H273 | 180.0° | 59.9° |
| C25 | O26 | C27 | H271 | 60.0° | 60.1° |
| C25 | O26 | C27 | H272 | 60.0° | 180.0° |
| O26 | C25 | C28 | H281 | 0.2° | 0.0° |
| C28 | C25 | O26 | C27 | 19.0° | 0.1° |
| C25 | C28 | C29 | H281 | 180.0° | 179.9° |
| C25 | C28 | C29 | N30 | 178.7° | 179.9° |
| O26 | C27 | H273 | H271 | 120.0° | 120.0° |
| O26 | C27 | H273 | H272 | 120.0° | 120.1° |
| O26 | C27 | H271 | H272 | 120.0° | 120.0° |
| C28 | C29 | N30 | C31 | 103.6° | 60.1° |
| C28 | C29 | N30 | C36 | 75.8° | 63.9° |
| C29 | N30 | C31 | C36 | 179.4° | 124.0° |
| C29 | N30 | C31 | C32 | 123.3° | 170.0° |
| N30 | C29 | C28 | H281 | 1.3° | 0.1° |
| C29 | N30 | C31 | H312 | 117.1° | 70.1° |
| C29 | N30 | C31 | H311 | 3.6° | 49.9° |
| C29 | N30 | C36 | H363 | 180.0° | 60.0° |
| C29 | N30 | C36 | H361 | 60.0° | 180.0° |
| C29 | N30 | C36 | H362 | 60.0° | 60.0° |
| N30 | C31 | C32 | H312 | 119.6° | 119.9° |
| N30 | C31 | C32 | H311 | 119.7° | 120.1° |
| N30 | C31 | C32 | N33 | 100.2° | 180.0° |
| N30 | C31 | H312 | H311 | 121.0° | 120.1° |
| N30 | C31 | C32 | H321 | 139.7° | 60.0° |
| N30 | C31 | C32 | H322 | 19.8° | 60.0° |
| C31 | N30 | C36 | H363 | 0.6° | 176.0° |
| C31 | N30 | C36 | H361 | 120.6° | 56.0° |
| C31 | N30 | C36 | H362 | 119.4° | 63.9° |
| C36 | N30 | C31 | C32 | 57.4° | 66.0° |
| C36 | N30 | C31 | H312 | 62.3° | 53.9° |
| C36 | N30 | C31 | H311 | 177.0° | 173.9° |
| N30 | C36 | H363 | H361 | 120.0° | 120.0° |
| N30 | C36 | H363 | H362 | 120.0° | 120.1° |
| N30 | C36 | H361 | H362 | 120.0° | 120.0° |
| C31 | C32 | N33 | H321 | 120.0° | 120.0° |
| C31 | C32 | N33 | H322 | 120.1° | 120.0° |
| C31 | C32 | N33 | C34 | 152.7° | 170.0° |
| C31 | C32 | N33 | C35 | 87.1° | 66.0° |
| C32 | C31 | H312 | H311 | 121.0° | 120.0° |
| C31 | C32 | H321 | H322 | 119.9° | 120.0° |
| C32 | N33 | C34 | C35 | 119.3° | 124.0° |
| N33 | C32 | C31 | H312 | 19.4° | 60.0° |
| N33 | C32 | C31 | H311 | 140.1° | 60.0° |
| N33 | C32 | H321 | H322 | 119.8° | 120.0° |
| C32 | N33 | C34 | H342 | 180.0° | 60.0° |
| C32 | N33 | C34 | H343 | 60.0° | 180.0° |
| C32 | N33 | C34 | H341 | 60.0° | 60.0° |
| C32 | N33 | C35 | H353 | 180.0° | 60.0° |
| C32 | N33 | C35 | H351 | 60.0° | 180.0° |
| C32 | N33 | C35 | H352 | 60.0° | 60.0° |
| C34 | N33 | C32 | H321 | 87.2° | 50.0° |
| C34 | N33 | C32 | H322 | 32.7° | 70.0° |
| N33 | C34 | H342 | H343 | 120.0° | 120.0° |
| N33 | C34 | H342 | H341 | 120.0° | 120.0° |
| N33 | C34 | H343 | H341 | 120.0° | 120.0° |
| C34 | N33 | C35 | H353 | 60.6° | 176.0° |
| C34 | N33 | C35 | H351 | 179.4° | 56.0° |
| C34 | N33 | C35 | H352 | 59.4° | 64.0° |
| C35 | N33 | C32 | H321 | 33.0° | 174.0° |
| C35 | N33 | C32 | H322 | 152.9° | 54.0° |
| C35 | N33 | C34 | H342 | 60.7° | 64.0° |
| C35 | N33 | C34 | H343 | 59.3° | 56.1° |
| C35 | N33 | C34 | H341 | 179.3° | 176.0° |
| N33 | C35 | H353 | H351 | 120.0° | 119.9° |
| N33 | C35 | H353 | H352 | 120.0° | 119.9° |
| N33 | C35 | H351 | H352 | 120.0° | 119.9° |
| H011 | C01 | H1 | H012 | 120.0° | 120.0° |
| H011 | C01 | C02 | H021 | 56.4° | 60.0° |
| H011 | C01 | C02 | H2 | 56.4° | 60.0° |
| H1 | C01 | C02 | H021 | 63.6° | 60.1° |
| H1 | C01 | C02 | H2 | 176.5° | 180.0° |
| H012 | C01 | C02 | H021 | 176.4° | 180.0° |
| H012 | C01 | C02 | H2 | 63.6° | 60.1° |
| H111 | C11 | C12 | H121 | 0.3° | 0.1° |
| H193 | C19 | H192 | H191 | 120.0° | 120.0° |
| H201 | C20 | C21 | H211 | 0.0° | 0.1° |
| H211 | C21 | C22 | H221 | 0.3° | 0.1° |
| H273 | C27 | H271 | H272 | 119.9° | 120.0° |
| H312 | C31 | C32 | H321 | 100.6° | 60.0° |
| H312 | C31 | C32 | H322 | 139.5° | 179.9° |
| H311 | C31 | C32 | H321 | 20.1° | 180.0° |
| H311 | C31 | C32 | H322 | 99.9° | 60.1° |
| H342 | C34 | H343 | H341 | 120.0° | 120.0° |
| H353 | C35 | H351 | H352 | 120.0° | 120.1° |
| H363 | C36 | H361 | H362 | 120.0° | 119.9° |
