YXT
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
N31 | C30 | sing | 1.38Å | 1.45Å | |
C03 | C02 | sing | 1.53Å | 1.53Å | |
C01 | C02 | sing | 1.53Å | 1.53Å | |
C02 | C05 | sing | 1.53Å | 1.54Å | |
C02 | C04 | sing | 1.53Å | 1.53Å | |
C30 | N06 | sing | 1.37Å | 1.34Å | Aromatic |
C30 | N29 | doub | 1.31Å | 1.35Å | Aromatic |
C05 | N06 | sing | 1.47Å | 1.46Å | |
N06 | C07 | sing | 1.38Å | 1.35Å | Aromatic |
N29 | C08 | sing | 1.36Å | 1.37Å | Aromatic |
C07 | C08 | doub | 1.41Å | 1.36Å | Aromatic |
C07 | N12 | sing | 1.32Å | 1.35Å | Aromatic |
C08 | C09 | sing | 1.40Å | 1.44Å | Aromatic |
N12 | C11 | doub | 1.33Å | 1.33Å | Aromatic |
C09 | C10 | doub | 1.37Å | 1.41Å | Aromatic |
C11 | C10 | sing | 1.40Å | 1.40Å | Aromatic |
C11 | C13 | sing | 1.47Å | 1.54Å | |
N17 | C13 | sing | 1.38Å | 1.31Å | Aromatic |
N17 | C16 | sing | 1.35Å | 1.33Å | Aromatic |
C13 | C14 | doub | 1.38Å | 1.38Å | Aromatic |
C21 | C18 | sing | 1.53Å | 1.53Å | |
C19 | C18 | sing | 1.53Å | 1.52Å | |
C16 | C18 | sing | 1.51Å | 1.51Å | |
C16 | N15 | doub | 1.30Å | 1.33Å | Aromatic |
C18 | C20 | sing | 1.53Å | 1.53Å | |
C14 | N15 | sing | 1.35Å | 1.32Å | Aromatic |
C14 | C22 | sing | 1.48Å | 1.52Å | |
C27 | C22 | doub | 1.39Å | 1.39Å | Aromatic |
C27 | C26 | sing | 1.38Å | 1.39Å | Aromatic |
C22 | C23 | sing | 1.39Å | 1.39Å | Aromatic |
C26 | C25 | doub | 1.39Å | 1.40Å | Aromatic |
C23 | C24 | doub | 1.38Å | 1.38Å | Aromatic |
C25 | C24 | sing | 1.39Å | 1.38Å | Aromatic |
C25 | F28 | sing | 1.35Å | 1.37Å | |
C10 | H101 | sing | 1.08Å | 1.08Å | |
C20 | H202 | sing | 1.09Å | 1.10Å | |
C20 | H201 | sing | 1.09Å | 1.10Å | |
C20 | H203 | sing | 1.09Å | 1.10Å | |
C21 | H213 | sing | 1.09Å | 1.10Å | |
C21 | H212 | sing | 1.09Å | 1.10Å | |
C21 | H211 | sing | 1.09Å | 1.10Å | |
C24 | H241 | sing | 1.08Å | 1.08Å | |
C26 | H261 | sing | 1.08Å | 1.08Å | |
C01 | H012 | sing | 1.09Å | 1.10Å | |
C01 | H013 | sing | 1.09Å | 1.10Å | |
C01 | H011 | sing | 1.09Å | 1.10Å | |
C03 | H032 | sing | 1.09Å | 1.10Å | |
C03 | H033 | sing | 1.09Å | 1.10Å | |
C03 | H031 | sing | 1.09Å | 1.10Å | |
C04 | H042 | sing | 1.09Å | 1.10Å | |
C04 | H043 | sing | 1.09Å | 1.10Å | |
C04 | H041 | sing | 1.09Å | 1.10Å | |
C05 | H052 | sing | 1.09Å | 1.10Å | |
C05 | H051 | sing | 1.09Å | 1.10Å | |
C09 | H091 | sing | 1.08Å | 1.08Å | |
C19 | H192 | sing | 1.09Å | 1.10Å | |
C19 | H193 | sing | 1.09Å | 1.10Å | |
C19 | H191 | sing | 1.09Å | 1.10Å | |
C23 | H231 | sing | 1.08Å | 1.08Å | |
C27 | H271 | sing | 1.08Å | 1.08Å | |
N17 | H171 | sing | 0.97Å | 1.00Å | |
N31 | H311 | sing | 0.97Å | 1.00Å | |
N31 | H312 | sing | 0.97Å | 1.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
N31 | C30 | N06 | 124.6° | 125.1° |
N31 | C30 | N29 | 126.5° | 125.0° |
C30 | N31 | H311 | 109.5° | 120.0° |
C30 | N31 | H312 | 109.5° | 120.0° |
C03 | C02 | C01 | 109.4° | 109.5° |
C03 | C02 | C05 | 109.4° | 109.5° |
C03 | C02 | C04 | 107.6° | 109.5° |
C02 | C03 | H032 | 109.5° | 109.5° |
C02 | C03 | H033 | 109.5° | 109.4° |
C02 | C03 | H031 | 109.5° | 109.5° |
C01 | C02 | C05 | 110.8° | 109.4° |
C01 | C02 | C04 | 109.6° | 109.4° |
C02 | C01 | H012 | 109.5° | 109.5° |
C02 | C01 | H013 | 109.4° | 109.5° |
C02 | C01 | H011 | 109.5° | 109.5° |
C05 | C02 | C04 | 109.9° | 109.4° |
C02 | C05 | N06 | 113.8° | 109.4° |
C02 | C05 | H052 | 108.4° | 109.4° |
C02 | C05 | H051 | 108.4° | 109.5° |
C02 | C04 | H042 | 109.5° | 109.5° |
C02 | C04 | H043 | 109.5° | 109.4° |
C02 | C04 | H041 | 109.5° | 109.5° |
N06 | C30 | N29 | 108.9° | 109.9° |
C30 | N06 | C05 | 127.9° | 126.3° |
C30 | N06 | C07 | 108.3° | 107.4° |
C30 | N29 | C08 | 107.5° | 109.4° |
C05 | N06 | C07 | 123.7° | 126.3° |
N06 | C05 | H052 | 108.4° | 109.5° |
N06 | C05 | H051 | 108.4° | 109.5° |
N06 | C07 | C08 | 108.0° | 106.0° |
N06 | C07 | N12 | 129.2° | 133.6° |
N29 | C08 | C07 | 107.4° | 107.3° |
N29 | C08 | C09 | 134.8° | 133.5° |
C08 | C07 | N12 | 122.8° | 120.5° |
C07 | C08 | C09 | 117.8° | 119.1° |
C07 | N12 | C11 | 121.5° | 121.4° |
C08 | C09 | C10 | 117.9° | 118.5° |
C08 | C09 | H091 | 121.0° | 120.8° |
N12 | C11 | C10 | 119.7° | 121.0° |
N12 | C11 | C13 | 115.7° | 119.5° |
C09 | C10 | C11 | 120.2° | 119.6° |
C09 | C10 | H101 | 119.9° | 120.2° |
C10 | C09 | H091 | 121.0° | 120.8° |
C10 | C11 | C13 | 124.5° | 119.5° |
C11 | C10 | H101 | 119.9° | 120.2° |
C11 | C13 | N17 | 121.2° | 126.9° |
C11 | C13 | C14 | 131.4° | 127.0° |
C13 | N17 | C16 | 108.6° | 107.3° |
N17 | C13 | C14 | 107.3° | 106.1° |
C13 | N17 | H171 | 125.7° | 126.3° |
N17 | C16 | C18 | 126.0° | 125.2° |
N17 | C16 | N15 | 108.8° | 109.6° |
C16 | N17 | H171 | 125.7° | 126.4° |
C13 | C14 | N15 | 107.4° | 107.4° |
C13 | C14 | C22 | 131.7° | 126.3° |
C21 | C18 | C19 | 109.1° | 109.5° |
C21 | C18 | C16 | 109.3° | 109.5° |
C21 | C18 | C20 | 111.4° | 109.5° |
C18 | C21 | H213 | 109.5° | 109.5° |
C18 | C21 | H212 | 109.5° | 109.5° |
C18 | C21 | H211 | 109.5° | 109.4° |
C19 | C18 | C16 | 109.6° | 109.4° |
C19 | C18 | C20 | 112.4° | 109.4° |
C18 | C19 | H192 | 109.5° | 109.5° |
C18 | C19 | H193 | 109.5° | 109.5° |
C18 | C19 | H191 | 109.5° | 109.5° |
C18 | C16 | N15 | 125.2° | 125.2° |
C16 | C18 | C20 | 104.9° | 109.5° |
C16 | N15 | C14 | 107.7° | 109.6° |
C18 | C20 | H202 | 109.5° | 109.4° |
C18 | C20 | H201 | 109.5° | 109.5° |
C18 | C20 | H203 | 109.4° | 109.4° |
N15 | C14 | C22 | 120.8° | 126.3° |
C14 | C22 | C27 | 123.4° | 120.1° |
C14 | C22 | C23 | 116.0° | 120.1° |
C22 | C27 | C26 | 118.8° | 119.9° |
C27 | C22 | C23 | 120.6° | 119.8° |
C22 | C27 | H271 | 120.6° | 120.0° |
C27 | C26 | C25 | 120.5° | 120.1° |
C27 | C26 | H261 | 119.8° | 120.0° |
C26 | C27 | H271 | 120.6° | 120.1° |
C22 | C23 | C24 | 120.6° | 119.9° |
C22 | C23 | H231 | 119.7° | 120.1° |
C26 | C25 | C24 | 120.4° | 120.2° |
C26 | C25 | F28 | 120.9° | 119.9° |
C25 | C26 | H261 | 119.8° | 119.9° |
C23 | C24 | C25 | 119.2° | 120.1° |
C23 | C24 | H241 | 120.4° | 119.9° |
C24 | C23 | H231 | 119.7° | 120.0° |
C24 | C25 | F28 | 118.8° | 119.9° |
C25 | C24 | H241 | 120.4° | 119.9° |
H202 | C20 | H201 | 109.4° | 109.5° |
H202 | C20 | H203 | 109.5° | 109.5° |
H201 | C20 | H203 | 109.5° | 109.5° |
H213 | C21 | H212 | 109.5° | 109.5° |
H213 | C21 | H211 | 109.4° | 109.5° |
H212 | C21 | H211 | 109.5° | 109.4° |
H012 | C01 | H013 | 109.5° | 109.4° |
H012 | C01 | H011 | 109.5° | 109.5° |
H013 | C01 | H011 | 109.5° | 109.4° |
H032 | C03 | H033 | 109.5° | 109.5° |
H032 | C03 | H031 | 109.4° | 109.5° |
H033 | C03 | H031 | 109.5° | 109.5° |
H042 | C04 | H043 | 109.5° | 109.5° |
H042 | C04 | H041 | 109.4° | 109.5° |
H043 | C04 | H041 | 109.5° | 109.4° |
H052 | C05 | H051 | 109.4° | 109.5° |
H192 | C19 | H193 | 109.4° | 109.5° |
H192 | C19 | H191 | 109.4° | 109.4° |
H193 | C19 | H191 | 109.5° | 109.4° |
H311 | N31 | H312 | 109.4° | 120.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
N31 | C30 | N06 | N29 | 178.8° | 179.8° |
N31 | C30 | N06 | C05 | 1.5° | 0.1° |
N31 | C30 | N06 | C07 | 179.6° | 179.9° |
N31 | C30 | N29 | C08 | 179.4° | 179.8° |
C30 | N31 | H311 | H312 | 120.0° | 179.9° |
C03 | C02 | C01 | C05 | 120.8° | 120.0° |
C03 | C02 | C01 | C04 | 117.7° | 120.1° |
C03 | C02 | C05 | C04 | 118.0° | 120.1° |
C03 | C02 | C05 | N06 | 148.8° | 60.0° |
C03 | C02 | C01 | H012 | 180.0° | 180.0° |
C03 | C02 | C01 | H013 | 60.0° | 60.0° |
C03 | C02 | C01 | H011 | 60.0° | 60.0° |
C02 | C03 | H032 | H033 | 120.0° | 120.0° |
C02 | C03 | H032 | H031 | 120.0° | 120.0° |
C02 | C03 | H033 | H031 | 120.0° | 120.0° |
C03 | C02 | C04 | H042 | 180.0° | 180.0° |
C03 | C02 | C04 | H043 | 60.0° | 59.9° |
C03 | C02 | C04 | H041 | 60.0° | 60.0° |
C03 | C02 | C05 | H052 | 28.2° | 60.0° |
C03 | C02 | C05 | H051 | 90.5° | 180.0° |
C01 | C02 | C05 | C04 | 121.3° | 119.9° |
C01 | C02 | C05 | N06 | 28.1° | 60.0° |
C02 | C01 | H012 | H013 | 120.0° | 120.0° |
C02 | C01 | H012 | H011 | 120.0° | 120.1° |
C02 | C01 | H013 | H011 | 120.0° | 120.0° |
C01 | C02 | C03 | H032 | 180.0° | 60.0° |
C01 | C02 | C03 | H033 | 60.0° | 180.0° |
C01 | C02 | C03 | H031 | 60.0° | 60.0° |
C01 | C02 | C04 | H042 | 61.1° | 60.0° |
C01 | C02 | C04 | H043 | 178.8° | 180.0° |
C01 | C02 | C04 | H041 | 58.8° | 60.1° |
C01 | C02 | C05 | H052 | 92.6° | 180.0° |
C01 | C02 | C05 | H051 | 148.7° | 60.0° |
C02 | C05 | N06 | C30 | 95.2° | 90.0° |
C02 | C05 | N06 | H052 | 120.6° | 120.0° |
C02 | C05 | N06 | H051 | 120.7° | 120.0° |
C02 | C05 | N06 | C07 | 86.1° | 90.1° |
C05 | C02 | C01 | H012 | 59.2° | 60.0° |
C05 | C02 | C01 | H013 | 179.3° | 180.0° |
C05 | C02 | C01 | H011 | 60.8° | 60.0° |
C05 | C02 | C03 | H032 | 58.4° | 180.0° |
C05 | C02 | C03 | H033 | 61.6° | 60.0° |
C05 | C02 | C03 | H031 | 178.4° | 60.0° |
C05 | C02 | C04 | H042 | 60.9° | 60.0° |
C05 | C02 | C04 | H043 | 59.1° | 60.1° |
C05 | C02 | C04 | H041 | 179.1° | 180.0° |
C02 | C05 | H052 | H051 | 118.0° | 120.0° |
C04 | C02 | C05 | N06 | 93.2° | 179.9° |
C04 | C02 | C01 | H012 | 62.3° | 59.9° |
C04 | C02 | C01 | H013 | 57.8° | 60.0° |
C04 | C02 | C01 | H011 | 177.7° | 180.0° |
C04 | C02 | C03 | H032 | 61.0° | 60.0° |
C04 | C02 | C03 | H033 | 179.0° | 60.0° |
C04 | C02 | C03 | H031 | 58.9° | 180.0° |
C02 | C04 | H042 | H043 | 120.0° | 120.0° |
C02 | C04 | H042 | H041 | 120.0° | 120.0° |
C02 | C04 | H043 | H041 | 120.0° | 119.9° |
C04 | C02 | C05 | H052 | 146.2° | 60.1° |
C04 | C02 | C05 | H051 | 27.5° | 60.0° |
C30 | N06 | C05 | C07 | 178.7° | 179.9° |
N06 | C30 | N29 | C08 | 0.6° | 0.4° |
C30 | N06 | C07 | C08 | 0.7° | 0.0° |
C30 | N06 | C07 | N12 | 180.0° | 179.7° |
C30 | N06 | C05 | H052 | 25.4° | 29.9° |
C30 | N06 | C05 | H051 | 144.1° | 150.0° |
N06 | C30 | N31 | H311 | 178.6° | 0.0° |
N06 | C30 | N31 | H312 | 58.6° | 180.0° |
N29 | C30 | N06 | C05 | 179.7° | 179.7° |
N29 | C30 | N06 | C07 | 0.8° | 0.2° |
C30 | N29 | C08 | C07 | 0.1° | 0.4° |
C30 | N29 | C08 | C09 | 179.9° | 180.0° |
N29 | C30 | N31 | H311 | 0.0° | 179.8° |
N29 | C30 | N31 | H312 | 120.0° | 0.2° |
C05 | N06 | C07 | C08 | 179.7° | 180.0° |
C05 | N06 | C07 | N12 | 1.0° | 0.3° |
N06 | C05 | H052 | H051 | 118.0° | 120.0° |
N06 | C07 | C08 | N29 | 0.4° | 0.3° |
N06 | C07 | C08 | N12 | 179.3° | 179.7° |
N06 | C07 | C08 | C09 | 179.4° | 180.0° |
N06 | C07 | N12 | C11 | 179.7° | 179.9° |
C07 | N06 | C05 | H052 | 153.3° | 150.0° |
C07 | N06 | C05 | H051 | 34.6° | 29.9° |
N29 | C08 | C07 | C09 | 179.8° | 179.7° |
N29 | C08 | C07 | N12 | 179.7° | 180.0° |
N29 | C08 | C09 | C10 | 179.9° | 179.7° |
N29 | C08 | C09 | H091 | 0.1° | 0.4° |
C08 | C07 | N12 | C11 | 0.5° | 0.3° |
C07 | C08 | C09 | C10 | 0.1° | 0.1° |
C07 | C08 | C09 | H091 | 179.9° | 180.0° |
N12 | C07 | C08 | C09 | 0.1° | 0.3° |
C07 | N12 | C11 | C10 | 0.6° | 0.0° |
C07 | N12 | C11 | C13 | 179.7° | 180.0° |
C08 | C09 | C10 | H091 | 180.0° | 179.9° |
C08 | C09 | C10 | C11 | 0.0° | 0.2° |
C08 | C09 | C10 | H101 | 179.9° | 180.0° |
N12 | C11 | C10 | C09 | 0.3° | 0.2° |
N12 | C11 | C10 | C13 | 179.7° | 180.0° |
N12 | C11 | C13 | N17 | 32.9° | 154.7° |
N12 | C11 | C13 | C14 | 143.5° | 25.0° |
N12 | C11 | C10 | H101 | 179.7° | 180.0° |
C09 | C10 | C11 | H101 | 180.0° | 179.8° |
C09 | C10 | C11 | C13 | 180.0° | 179.7° |
C10 | C11 | C13 | N17 | 146.9° | 25.3° |
C10 | C11 | C13 | C14 | 36.7° | 155.0° |
C11 | C10 | C09 | H091 | 180.0° | 179.7° |
C11 | C13 | N17 | C14 | 177.2° | 179.8° |
C11 | C13 | N17 | C16 | 178.4° | 179.8° |
C11 | C13 | C14 | N15 | 178.3° | 180.0° |
C11 | C13 | C14 | C22 | 4.4° | 0.0° |
C13 | C11 | C10 | H101 | 0.0° | 0.0° |
C11 | C13 | N17 | H171 | 1.6° | 0.2° |
C13 | N17 | C16 | H171 | 180.0° | 179.6° |
C13 | N17 | C16 | C18 | 178.2° | 179.8° |
C13 | N17 | C16 | N15 | 0.4° | 0.4° |
N17 | C13 | C14 | N15 | 1.6° | 0.3° |
N17 | C13 | C14 | C22 | 178.8° | 179.7° |
C16 | N17 | C13 | C14 | 1.2° | 0.4° |
N17 | C16 | C18 | C21 | 36.2° | 75.4° |
N17 | C16 | C18 | C19 | 83.3° | 164.6° |
N17 | C16 | C18 | N15 | 178.5° | 179.7° |
N17 | C16 | C18 | C20 | 155.8° | 44.7° |
N17 | C16 | N15 | C14 | 0.6° | 0.2° |
C13 | C14 | N15 | C16 | 1.3° | 0.0° |
C13 | C14 | N15 | C22 | 177.6° | 180.0° |
C13 | C14 | C22 | C27 | 64.6° | 35.3° |
C13 | C14 | C22 | C23 | 116.7° | 145.0° |
C14 | C13 | N17 | H171 | 178.8° | 180.0° |
C21 | C18 | C19 | C16 | 119.7° | 120.0° |
C21 | C18 | C19 | C20 | 124.1° | 120.0° |
C21 | C18 | C16 | C20 | 119.6° | 120.1° |
C21 | C18 | C16 | N15 | 142.2° | 104.9° |
C21 | C18 | C20 | H202 | 180.0° | 60.0° |
C21 | C18 | C20 | H201 | 60.0° | 180.0° |
C21 | C18 | C20 | H203 | 60.0° | 60.0° |
C18 | C21 | H213 | H212 | 120.0° | 120.1° |
C18 | C21 | H213 | H211 | 120.0° | 120.0° |
C18 | C21 | H212 | H211 | 120.0° | 119.9° |
C21 | C18 | C19 | H192 | 180.0° | 60.0° |
C21 | C18 | C19 | H193 | 60.0° | 180.0° |
C21 | C18 | C19 | H191 | 60.0° | 60.0° |
C19 | C18 | C16 | C20 | 120.9° | 119.9° |
C19 | C18 | C16 | N15 | 98.2° | 15.1° |
C19 | C18 | C20 | H202 | 57.2° | 60.0° |
C19 | C18 | C20 | H201 | 62.8° | 60.0° |
C19 | C18 | C20 | H203 | 177.2° | 180.0° |
C19 | C18 | C21 | H213 | 180.0° | 60.0° |
C19 | C18 | C21 | H212 | 60.0° | 60.0° |
C19 | C18 | C21 | H211 | 60.0° | 180.0° |
C18 | C19 | H192 | H193 | 120.0° | 120.1° |
C18 | C19 | H192 | H191 | 120.0° | 120.0° |
C18 | C19 | H193 | H191 | 120.0° | 120.0° |
C18 | C16 | N15 | C14 | 179.2° | 180.0° |
C16 | C18 | C20 | H202 | 61.9° | 180.0° |
C16 | C18 | C20 | H201 | 178.1° | 60.0° |
C16 | C18 | C20 | H203 | 58.1° | 60.1° |
C16 | C18 | C21 | H213 | 60.1° | 60.0° |
C16 | C18 | C21 | H212 | 179.9° | 180.0° |
C16 | C18 | C21 | H211 | 59.9° | 60.1° |
C16 | C18 | C19 | H192 | 60.3° | 60.0° |
C16 | C18 | C19 | H193 | 59.7° | 60.0° |
C16 | C18 | C19 | H191 | 179.7° | 180.0° |
C18 | C16 | N17 | H171 | 1.8° | 0.2° |
N15 | C16 | C18 | C20 | 22.7° | 135.0° |
C16 | N15 | C14 | C22 | 178.9° | 180.0° |
N15 | C16 | N17 | H171 | 179.6° | 180.0° |
C18 | C20 | H202 | H201 | 120.0° | 120.0° |
C18 | C20 | H202 | H203 | 120.0° | 119.9° |
C18 | C20 | H201 | H203 | 120.0° | 120.0° |
C20 | C18 | C21 | H213 | 55.3° | 180.0° |
C20 | C18 | C21 | H212 | 64.7° | 59.9° |
C20 | C18 | C21 | H211 | 175.3° | 60.0° |
C20 | C18 | C19 | H192 | 55.9° | 180.0° |
C20 | C18 | C19 | H193 | 175.9° | 59.9° |
C20 | C18 | C19 | H191 | 64.1° | 60.0° |
N15 | C14 | C22 | C27 | 118.5° | 144.7° |
N15 | C14 | C22 | C23 | 60.2° | 35.0° |
C14 | C22 | C27 | C23 | 178.7° | 179.6° |
C14 | C22 | C27 | C26 | 179.1° | 179.7° |
C14 | C22 | C23 | C24 | 178.9° | 180.0° |
C14 | C22 | C23 | H231 | 1.1° | 0.1° |
C14 | C22 | C27 | H271 | 0.9° | 0.3° |
C22 | C27 | C26 | H271 | 180.0° | 180.0° |
C22 | C27 | C26 | C25 | 0.5° | 0.5° |
C27 | C22 | C23 | C24 | 0.1° | 0.3° |
C22 | C27 | C26 | H261 | 179.5° | 179.7° |
C27 | C22 | C23 | H231 | 179.9° | 179.7° |
C26 | C27 | C22 | C23 | 0.4° | 0.1° |
C27 | C26 | C25 | H261 | 180.0° | 179.2° |
C27 | C26 | C25 | C24 | 0.3° | 0.7° |
C27 | C26 | C25 | F28 | 179.8° | 179.2° |
C22 | C23 | C24 | H231 | 180.0° | 180.0° |
C22 | C23 | C24 | C25 | 0.1° | 0.1° |
C22 | C23 | C24 | H241 | 179.9° | 180.0° |
C23 | C22 | C27 | H271 | 179.6° | 180.0° |
C26 | C25 | C24 | C23 | 0.0° | 0.5° |
C26 | C25 | C24 | F28 | 179.5° | 180.0° |
C26 | C25 | C24 | H241 | 180.0° | 179.5° |
C25 | C26 | C27 | H271 | 179.5° | 179.5° |
C23 | C24 | C25 | H241 | 180.0° | 179.9° |
C23 | C24 | C25 | F28 | 179.5° | 179.5° |
C24 | C25 | C26 | H261 | 179.7° | 179.9° |
C25 | C24 | C23 | H231 | 179.8° | 180.0° |
F28 | C25 | C24 | H241 | 0.5° | 0.5° |
F28 | C25 | C26 | H261 | 0.2° | 0.0° |
H101 | C10 | C09 | H091 | 0.1° | 0.1° |
H202 | C20 | H201 | H203 | 120.0° | 120.0° |
H213 | C21 | H212 | H211 | 120.0° | 120.0° |
H241 | C24 | C23 | H231 | 0.1° | 0.0° |
H261 | C26 | C27 | H271 | 0.5° | 0.3° |
H012 | C01 | H013 | H011 | 120.0° | 119.9° |
H032 | C03 | H033 | H031 | 119.9° | 120.0° |
H042 | C04 | H043 | H041 | 120.0° | 120.0° |
H192 | C19 | H193 | H191 | 119.9° | 119.9° |