ED8
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
N02 | C01 | sing | 1.47Å | 1.45Å | |
C01 | H01 | sing | 1.09Å | 1.10Å | |
C01 | H01A | sing | 1.09Å | 1.10Å | |
C01 | H01B | sing | 1.09Å | 1.10Å | |
C37 | N02 | sing | 1.47Å | 1.46Å | |
N02 | C03 | sing | 1.47Å | 1.47Å | |
C04 | C03 | sing | 1.53Å | 1.55Å | |
C03 | H03 | sing | 1.09Å | 1.10Å | |
C03 | H03A | sing | 1.09Å | 1.10Å | |
C05 | C04 | sing | 1.53Å | 1.54Å | |
C04 | H04 | sing | 1.09Å | 1.10Å | |
C04 | H04A | sing | 1.09Å | 1.10Å | |
O06 | C05 | sing | 1.43Å | 1.41Å | |
C05 | C36 | sing | 1.53Å | 1.54Å | |
C05 | H05 | sing | 1.09Å | 1.10Å | |
O06 | C07 | sing | 1.36Å | 1.40Å | |
C35 | C07 | doub | 1.38Å | 1.45Å | Aromatic |
C07 | C08 | sing | 1.39Å | 1.40Å | Aromatic |
C08 | C09 | doub | 1.37Å | 1.48Å | Aromatic |
C08 | H08 | sing | 1.08Å | 1.08Å | |
C10 | C09 | sing | 1.40Å | 1.45Å | Aromatic |
C09 | H09 | sing | 1.08Å | 1.08Å | |
C34 | C10 | doub | 1.41Å | 1.39Å | Aromatic |
N11 | C10 | sing | 1.36Å | 1.40Å | Aromatic |
C12 | N11 | doub | 1.30Å | 1.40Å | Aromatic |
N13 | C12 | sing | 1.36Å | 1.40Å | Aromatic |
C12 | H12 | sing | 1.08Å | 1.08Å | |
C14 | N13 | sing | 1.39Å | 1.36Å | Aromatic |
N13 | C34 | sing | 1.38Å | 1.39Å | Aromatic |
C15 | C14 | doub | 1.35Å | 1.59Å | Aromatic |
S33 | C14 | sing | 1.76Å | 1.67Å | Aromatic |
C16 | C15 | sing | 1.38Å | 1.77Å | Aromatic |
C15 | H15 | sing | 1.08Å | 1.08Å | |
O17 | C16 | sing | 1.36Å | 1.41Å | |
C16 | C29 | doub | 1.37Å | 1.55Å | Aromatic |
O17 | C18 | sing | 1.43Å | 1.41Å | |
C18 | C19 | sing | 1.51Å | 1.53Å | |
C18 | H18 | sing | 1.09Å | 1.10Å | |
C18 | H18A | sing | 1.09Å | 1.10Å | |
C19 | C20 | doub | 1.38Å | 1.42Å | Aromatic |
C19 | C24 | sing | 1.38Å | 1.52Å | Aromatic |
C20 | C21 | sing | 1.38Å | 1.45Å | Aromatic |
C20 | H20 | sing | 1.08Å | 1.08Å | |
C21 | C22 | doub | 1.38Å | 1.51Å | Aromatic |
C21 | H21 | sing | 1.08Å | 1.08Å | |
C23 | C22 | sing | 1.38Å | 1.41Å | Aromatic |
C22 | H22 | sing | 1.08Å | 1.08Å | |
C24 | C23 | doub | 1.38Å | 1.46Å | Aromatic |
C23 | H23 | sing | 1.08Å | 1.08Å | |
C25 | C24 | sing | 1.51Å | 1.50Å | |
F27 | C25 | sing | 1.40Å | 1.33Å | |
C25 | F28 | sing | 1.40Å | 1.34Å | |
C25 | F26 | sing | 1.40Å | 1.34Å | |
C30 | C29 | sing | 1.41Å | 1.51Å | |
C29 | S33 | sing | 1.76Å | 1.78Å | Aromatic |
N31 | C30 | sing | 1.35Å | 1.43Å | |
C30 | O32 | doub | 1.22Å | 1.22Å | |
N31 | HN31 | sing | 0.97Å | 1.00Å | |
N31 | HN3A | sing | 0.97Å | 1.00Å | |
C35 | C34 | sing | 1.39Å | 1.46Å | Aromatic |
C35 | H35 | sing | 1.08Å | 1.08Å | |
C37 | C36 | sing | 1.53Å | 1.55Å | |
C36 | H36 | sing | 1.09Å | 1.10Å | |
C36 | H36A | sing | 1.09Å | 1.10Å | |
C37 | H37 | sing | 1.09Å | 1.10Å | |
C37 | H37A | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
N02 | C01 | H01 | 109.5° | 109.4° |
N02 | C01 | H01A | 109.4° | 109.5° |
N02 | C01 | H01B | 109.5° | 109.5° |
C01 | N02 | C37 | 112.6° | 111.0° |
C01 | N02 | C03 | 111.6° | 111.0° |
H01 | C01 | H01A | 109.4° | 109.4° |
H01 | C01 | H01B | 109.4° | 109.5° |
H01A | C01 | H01B | 109.5° | 109.4° |
C37 | N02 | C03 | 114.7° | 111.2° |
N02 | C37 | C36 | 112.7° | 109.5° |
N02 | C37 | H37 | 108.4° | 109.5° |
N02 | C37 | H37A | 108.4° | 109.4° |
N02 | C03 | C04 | 115.3° | 109.5° |
N02 | C03 | H03 | 107.6° | 109.5° |
N02 | C03 | H03A | 107.6° | 109.5° |
C04 | C03 | H03 | 107.6° | 109.5° |
C04 | C03 | H03A | 107.6° | 109.4° |
C03 | C04 | C05 | 112.4° | 109.3° |
C03 | C04 | H04 | 108.5° | 109.5° |
C03 | C04 | H04A | 108.5° | 109.5° |
H03 | C03 | H03A | 111.3° | 109.5° |
C05 | C04 | H04 | 108.5° | 109.5° |
C05 | C04 | H04A | 108.5° | 109.5° |
C04 | C05 | O06 | 119.0° | 109.6° |
C04 | C05 | C36 | 112.5° | 109.1° |
C04 | C05 | H05 | 105.4° | 109.5° |
H04 | C04 | H04A | 110.4° | 109.4° |
O06 | C05 | C36 | 120.6° | 109.5° |
O06 | C05 | H05 | 90.6° | 109.6° |
C05 | O06 | C07 | 113.8° | 117.0° |
C36 | C05 | H05 | 102.6° | 109.5° |
C05 | C36 | C37 | 110.8° | 109.3° |
C05 | C36 | H36 | 109.0° | 109.5° |
C05 | C36 | H36A | 109.1° | 109.5° |
O06 | C07 | C35 | 116.2° | 119.9° |
O06 | C07 | C08 | 123.2° | 119.9° |
C35 | C07 | C08 | 120.6° | 120.3° |
C07 | C35 | C34 | 119.7° | 119.7° |
C07 | C35 | H35 | 120.2° | 120.2° |
C07 | C08 | C09 | 119.1° | 120.6° |
C07 | C08 | H08 | 120.4° | 119.7° |
C09 | C08 | H08 | 120.5° | 119.7° |
C08 | C09 | C10 | 120.1° | 120.0° |
C08 | C09 | H09 | 120.0° | 120.0° |
C10 | C09 | H09 | 119.9° | 120.0° |
C09 | C10 | C34 | 120.2° | 119.5° |
C09 | C10 | N11 | 132.9° | 133.5° |
C34 | C10 | N11 | 107.0° | 107.0° |
C10 | C34 | N13 | 108.5° | 106.0° |
C10 | C34 | C35 | 120.4° | 119.9° |
C10 | N11 | C12 | 109.0° | 109.7° |
N11 | C12 | N13 | 106.8° | 110.0° |
N11 | C12 | H12 | 126.6° | 125.0° |
N13 | C12 | H12 | 126.6° | 125.0° |
C12 | N13 | C14 | 129.0° | 126.4° |
C12 | N13 | C34 | 108.5° | 107.2° |
C14 | N13 | C34 | 121.5° | 126.4° |
N13 | C14 | C15 | 118.6° | 124.9° |
N13 | C14 | S33 | 130.4° | 125.0° |
N13 | C34 | C35 | 131.0° | 134.1° |
C15 | C14 | S33 | 110.9° | 110.1° |
C14 | C15 | C16 | 107.8° | 115.0° |
C14 | C15 | H15 | 126.1° | 122.5° |
C14 | S33 | C29 | 104.0° | 91.1° |
C16 | C15 | H15 | 126.1° | 122.5° |
C15 | C16 | O17 | 119.9° | 122.8° |
C15 | C16 | C29 | 107.5° | 114.3° |
O17 | C16 | C29 | 132.4° | 122.9° |
C16 | O17 | C18 | 117.8° | 117.0° |
C16 | C29 | C30 | 127.3° | 125.3° |
C16 | C29 | S33 | 109.8° | 109.4° |
O17 | C18 | C19 | 119.5° | 109.5° |
O17 | C18 | H18 | 106.2° | 109.5° |
O17 | C18 | H18A | 106.3° | 109.5° |
C19 | C18 | H18 | 106.3° | 109.5° |
C19 | C18 | H18A | 106.3° | 109.4° |
C18 | C19 | C20 | 117.9° | 120.0° |
C18 | C19 | C24 | 123.1° | 120.0° |
H18 | C18 | H18A | 112.5° | 109.5° |
C20 | C19 | C24 | 119.0° | 120.0° |
C19 | C20 | C21 | 121.9° | 120.0° |
C19 | C20 | H20 | 119.0° | 120.0° |
C19 | C24 | C23 | 118.9° | 120.0° |
C19 | C24 | C25 | 124.2° | 120.0° |
C21 | C20 | H20 | 119.1° | 120.0° |
C20 | C21 | C22 | 118.8° | 120.0° |
C20 | C21 | H21 | 120.6° | 120.0° |
C22 | C21 | H21 | 120.6° | 120.1° |
C21 | C22 | C23 | 120.1° | 120.0° |
C21 | C22 | H22 | 119.9° | 120.0° |
C23 | C22 | H22 | 119.9° | 120.0° |
C22 | C23 | C24 | 121.3° | 120.0° |
C22 | C23 | H23 | 119.3° | 120.0° |
C24 | C23 | H23 | 119.4° | 120.0° |
C23 | C24 | C25 | 116.8° | 120.0° |
C24 | C25 | F27 | 112.2° | 109.5° |
C24 | C25 | F28 | 108.9° | 109.5° |
C24 | C25 | F26 | 110.2° | 109.4° |
F27 | C25 | F28 | 110.0° | 109.5° |
F27 | C25 | F26 | 107.6° | 109.5° |
F28 | C25 | F26 | 108.0° | 109.5° |
C30 | C29 | S33 | 122.8° | 125.3° |
C29 | C30 | N31 | 119.4° | 120.0° |
C29 | C30 | O32 | 118.6° | 120.0° |
N31 | C30 | O32 | 120.0° | 120.0° |
C30 | N31 | HN31 | 120.0° | 120.0° |
C30 | N31 | HN3A | 120.0° | 120.0° |
HN31 | N31 | HN3A | 120.0° | 120.0° |
C34 | C35 | H35 | 120.2° | 120.1° |
C37 | C36 | H36 | 109.1° | 109.5° |
C37 | C36 | H36A | 109.0° | 109.5° |
C36 | C37 | H37 | 108.4° | 109.5° |
C36 | C37 | H37A | 108.4° | 109.5° |
H36 | C36 | H36A | 109.9° | 109.5° |
H37 | C37 | H37A | 110.5° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
N02 | C01 | H01 | H01A | 120.0° | 120.0° |
N02 | C01 | H01 | H01B | 120.0° | 120.1° |
N02 | C01 | H01A | H01B | 120.0° | 120.0° |
C01 | N02 | C37 | C03 | 129.2° | 124.0° |
C01 | N02 | C03 | C04 | 163.0° | 174.2° |
C01 | N02 | C03 | H03 | 77.1° | 54.2° |
C01 | N02 | C03 | H03A | 43.0° | 65.8° |
C01 | N02 | C37 | C36 | 106.7° | 174.2° |
C01 | N02 | C37 | H37 | 13.4° | 65.8° |
C01 | N02 | C37 | H37A | 133.3° | 54.2° |
H01 | C01 | H01A | H01B | 120.0° | 120.0° |
H01 | C01 | N02 | C37 | 180.0° | 175.7° |
H01 | C01 | N02 | C03 | 49.3° | 60.1° |
H01A | C01 | N02 | C37 | 60.0° | 55.8° |
H01A | C01 | N02 | C03 | 169.3° | 180.0° |
H01B | C01 | N02 | C37 | 60.0° | 64.2° |
H01B | C01 | N02 | C03 | 70.7° | 60.0° |
C37 | N02 | C03 | C04 | 33.3° | 61.7° |
C37 | N02 | C03 | H03 | 153.3° | 178.3° |
C37 | N02 | C03 | H03A | 86.7° | 58.2° |
N02 | C37 | C36 | C05 | 61.5° | 59.2° |
N02 | C37 | C36 | H37 | 120.0° | 120.0° |
N02 | C37 | C36 | H37A | 120.0° | 120.0° |
N02 | C37 | C36 | H36 | 178.5° | 60.8° |
N02 | C37 | C36 | H36A | 58.5° | 179.1° |
N02 | C37 | H37 | H37A | 118.6° | 119.9° |
N02 | C03 | C04 | H03 | 120.0° | 120.0° |
N02 | C03 | C04 | H03A | 120.0° | 120.1° |
N02 | C03 | H03 | H03A | 117.6° | 120.1° |
N02 | C03 | C04 | C05 | 52.4° | 59.2° |
N02 | C03 | C04 | H04 | 67.6° | 60.8° |
N02 | C03 | C04 | H04A | 172.4° | 179.2° |
C03 | N02 | C37 | C36 | 22.5° | 61.7° |
C03 | N02 | C37 | H37 | 142.5° | 58.3° |
C03 | N02 | C37 | H37A | 97.5° | 178.2° |
C04 | C03 | H03 | H03A | 117.6° | 119.9° |
C03 | C04 | C05 | H04 | 120.0° | 120.0° |
C03 | C04 | C05 | H04A | 120.0° | 120.0° |
C03 | C04 | H04 | H04A | 118.8° | 120.1° |
C03 | C04 | C05 | O06 | 161.6° | 177.5° |
C03 | C04 | C05 | C36 | 12.3° | 57.6° |
C03 | C04 | C05 | H05 | 98.8° | 62.3° |
H03 | C03 | C04 | C05 | 172.4° | 179.2° |
H03 | C03 | C04 | H04 | 52.4° | 59.3° |
H03 | C03 | C04 | H04A | 67.6° | 60.8° |
H03A | C03 | C04 | C05 | 67.6° | 60.9° |
H03A | C03 | C04 | H04 | 172.4° | 179.2° |
H03A | C03 | C04 | H04A | 52.4° | 59.1° |
C05 | C04 | H04 | H04A | 118.8° | 120.1° |
C04 | C05 | O06 | C36 | 146.8° | 119.7° |
C04 | C05 | O06 | H05 | 108.1° | 120.2° |
C04 | C05 | C36 | H05 | 112.8° | 119.9° |
C04 | C05 | O06 | C07 | 120.1° | 155.5° |
C04 | C05 | C36 | C37 | 40.6° | 57.6° |
C04 | C05 | C36 | H36 | 160.6° | 62.3° |
C04 | C05 | C36 | H36A | 79.4° | 177.6° |
H04 | C04 | C05 | O06 | 41.6° | 57.6° |
H04 | C04 | C05 | C36 | 107.7° | 62.3° |
H04 | C04 | C05 | H05 | 141.2° | 177.8° |
H04A | C04 | C05 | O06 | 78.3° | 62.4° |
H04A | C04 | C05 | C36 | 132.3° | 177.6° |
H04A | C04 | C05 | H05 | 21.2° | 57.8° |
O06 | C05 | C36 | H05 | 98.4° | 120.1° |
C05 | O06 | C07 | C35 | 157.3° | 5.1° |
C05 | O06 | C07 | C08 | 25.3° | 174.6° |
O06 | C05 | C36 | C37 | 108.2° | 177.6° |
O06 | C05 | C36 | H36 | 11.8° | 57.6° |
O06 | C05 | C36 | H36A | 131.8° | 62.4° |
C36 | C05 | O06 | C07 | 93.0° | 84.9° |
C05 | C36 | C37 | H36 | 120.0° | 120.0° |
C05 | C36 | C37 | H36A | 120.0° | 119.9° |
C05 | C36 | H36 | H36A | 119.5° | 120.0° |
C05 | C36 | C37 | H37 | 178.5° | 60.8° |
C05 | C36 | C37 | H37A | 58.5° | 179.2° |
H05 | C05 | O06 | C07 | 12.0° | 35.2° |
H05 | C05 | C36 | C37 | 153.4° | 62.3° |
H05 | C05 | C36 | H36 | 86.6° | 177.8° |
H05 | C05 | C36 | H36A | 33.4° | 57.7° |
O06 | C07 | C35 | C08 | 177.4° | 179.7° |
O06 | C07 | C08 | C09 | 177.5° | 180.0° |
O06 | C07 | C08 | H08 | 2.5° | 0.0° |
O06 | C07 | C35 | C34 | 177.9° | 179.8° |
O06 | C07 | C35 | H35 | 2.1° | 0.0° |
C35 | C07 | C08 | C09 | 0.3° | 0.3° |
C35 | C07 | C08 | H08 | 179.7° | 179.8° |
C07 | C35 | C34 | C10 | 0.1° | 0.5° |
C07 | C35 | C34 | N13 | 176.5° | 179.8° |
C07 | C35 | C34 | H35 | 180.0° | 179.7° |
C07 | C08 | C09 | H08 | 180.0° | 179.9° |
C07 | C08 | C09 | C10 | 0.3° | 0.0° |
C07 | C08 | C09 | H09 | 179.7° | 180.0° |
C08 | C07 | C35 | C34 | 0.5° | 0.5° |
C08 | C07 | C35 | H35 | 179.5° | 179.8° |
C08 | C09 | C10 | H09 | 180.0° | 180.0° |
C08 | C09 | C10 | C34 | 0.6° | 0.0° |
C08 | C09 | C10 | N11 | 179.6° | 180.0° |
H08 | C08 | C09 | C10 | 179.7° | 180.0° |
H08 | C08 | C09 | H09 | 0.3° | 0.0° |
C09 | C10 | C34 | N11 | 179.8° | 179.9° |
C09 | C10 | N11 | C12 | 179.9° | 180.0° |
C09 | C10 | C34 | N13 | 176.7° | 180.0° |
C09 | C10 | C34 | C35 | 0.4° | 0.3° |
H09 | C09 | C10 | C34 | 179.4° | 180.0° |
H09 | C09 | C10 | N11 | 0.4° | 0.0° |
C34 | C10 | N11 | C12 | 0.1° | 0.1° |
C10 | C34 | N13 | C12 | 5.2° | 0.0° |
C10 | C34 | N13 | C14 | 174.4° | 180.0° |
C10 | C34 | N13 | C35 | 176.7° | 179.7° |
C10 | C34 | C35 | H35 | 179.8° | 179.8° |
C10 | N11 | C12 | N13 | 3.2° | 0.1° |
C10 | N11 | C12 | H12 | 176.8° | 180.0° |
N11 | C10 | C34 | N13 | 3.1° | 0.0° |
N11 | C10 | C34 | C35 | 179.8° | 179.8° |
N11 | C12 | N13 | H12 | 180.0° | 179.9° |
N11 | C12 | N13 | C14 | 173.4° | 180.0° |
N11 | C12 | N13 | C34 | 5.2° | 0.0° |
C12 | N13 | C14 | C34 | 166.8° | 180.0° |
C12 | N13 | C14 | C15 | 159.8° | 50.0° |
C12 | N13 | C14 | S33 | 24.9° | 129.6° |
C12 | N13 | C34 | C35 | 178.1° | 179.7° |
H12 | C12 | N13 | C14 | 6.6° | 0.1° |
H12 | C12 | N13 | C34 | 174.8° | 179.9° |
N13 | C14 | C15 | S33 | 176.1° | 179.7° |
N13 | C14 | C15 | C16 | 177.5° | 180.0° |
N13 | C14 | C15 | H15 | 2.4° | 0.0° |
N13 | C14 | S33 | C29 | 177.0° | 179.9° |
C14 | N13 | C34 | C35 | 8.9° | 0.3° |
C34 | N13 | C14 | C15 | 33.3° | 130.0° |
C34 | N13 | C14 | S33 | 141.9° | 50.3° |
N13 | C34 | C35 | H35 | 3.5° | 0.1° |
C14 | C15 | C16 | H15 | 180.0° | 180.0° |
C14 | C15 | C16 | O17 | 177.4° | 180.0° |
C14 | C15 | C16 | C29 | 0.7° | 0.0° |
C15 | C14 | S33 | C29 | 1.5° | 0.4° |
S33 | C14 | C15 | C16 | 1.4° | 0.3° |
S33 | C14 | C15 | H15 | 178.6° | 179.7° |
C14 | S33 | C29 | C16 | 1.0° | 0.4° |
C14 | S33 | C29 | C30 | 175.7° | 179.9° |
C15 | C16 | O17 | C29 | 175.7° | 180.0° |
C15 | C16 | O17 | C18 | 3.8° | 0.0° |
C15 | C16 | C29 | C30 | 176.4° | 180.0° |
C15 | C16 | C29 | S33 | 0.2° | 0.3° |
H15 | C15 | C16 | O17 | 2.6° | 0.0° |
H15 | C15 | C16 | C29 | 179.2° | 180.0° |
C16 | O17 | C18 | C19 | 77.3° | 180.0° |
C16 | O17 | C18 | H18 | 162.6° | 60.0° |
C16 | O17 | C18 | H18A | 42.7° | 60.0° |
O17 | C16 | C29 | C30 | 7.6° | 0.0° |
O17 | C16 | C29 | S33 | 175.9° | 179.7° |
C29 | C16 | O17 | C18 | 171.9° | 180.0° |
C16 | C29 | C30 | S33 | 176.1° | 179.7° |
C16 | C29 | C30 | N31 | 8.2° | 180.0° |
C16 | C29 | C30 | O32 | 172.2° | 0.0° |
O17 | C18 | C19 | H18 | 120.0° | 120.0° |
O17 | C18 | C19 | H18A | 120.0° | 120.0° |
O17 | C18 | H18 | H18A | 115.9° | 120.0° |
O17 | C18 | C19 | C20 | 23.9° | 0.0° |
O17 | C18 | C19 | C24 | 156.0° | 179.7° |
C19 | C18 | H18 | H18A | 115.9° | 120.0° |
C18 | C19 | C20 | C24 | 180.0° | 179.7° |
C18 | C19 | C20 | C21 | 179.3° | 180.0° |
C18 | C19 | C20 | H20 | 0.7° | 0.1° |
C18 | C19 | C24 | C23 | 179.2° | 179.8° |
C18 | C19 | C24 | C25 | 0.3° | 0.1° |
H18 | C18 | C19 | C20 | 96.0° | 119.9° |
H18 | C18 | C19 | C24 | 84.0° | 59.7° |
H18A | C18 | C19 | C20 | 144.0° | 120.0° |
H18A | C18 | C19 | C24 | 36.0° | 60.3° |
C19 | C20 | C21 | H20 | 180.0° | 179.9° |
C19 | C20 | C21 | C22 | 0.4° | 0.1° |
C19 | C20 | C21 | H21 | 179.7° | 179.9° |
C20 | C19 | C24 | C23 | 0.8° | 0.6° |
C20 | C19 | C24 | C25 | 179.8° | 179.7° |
C24 | C19 | C20 | C21 | 0.7° | 0.3° |
C24 | C19 | C20 | H20 | 179.3° | 179.7° |
C19 | C24 | C23 | C22 | 0.6° | 0.5° |
C19 | C24 | C23 | C25 | 179.5° | 179.7° |
C19 | C24 | C23 | H23 | 179.4° | 179.7° |
C19 | C24 | C25 | F27 | 50.1° | 59.9° |
C19 | C24 | C25 | F28 | 71.9° | 180.0° |
C19 | C24 | C25 | F26 | 169.9° | 60.0° |
C20 | C21 | C22 | H21 | 180.0° | 180.0° |
C20 | C21 | C22 | C23 | 0.2° | 0.0° |
C20 | C21 | C22 | H22 | 179.9° | 180.0° |
H20 | C20 | C21 | C22 | 179.6° | 180.0° |
H20 | C20 | C21 | H21 | 0.3° | 0.0° |
C21 | C22 | C23 | H22 | 180.0° | 180.0° |
C21 | C22 | C23 | C24 | 0.3° | 0.3° |
C21 | C22 | C23 | H23 | 179.7° | 179.9° |
H21 | C21 | C22 | C23 | 179.9° | 180.0° |
H21 | C21 | C22 | H22 | 0.1° | 0.0° |
C22 | C23 | C24 | H23 | 180.0° | 179.8° |
C22 | C23 | C24 | C25 | 179.9° | 179.8° |
H22 | C22 | C23 | C24 | 179.7° | 179.8° |
H22 | C22 | C23 | H23 | 0.3° | 0.0° |
C23 | C24 | C25 | F27 | 130.5° | 119.8° |
C23 | C24 | C25 | F28 | 107.6° | 0.3° |
C23 | C24 | C25 | F26 | 10.6° | 120.2° |
H23 | C23 | C24 | C25 | 0.1° | 0.0° |
C24 | C25 | F27 | F28 | 121.3° | 120.0° |
C24 | C25 | F27 | F26 | 121.3° | 120.0° |
C24 | C25 | F28 | F26 | 119.6° | 120.0° |
F27 | C25 | F28 | F26 | 117.1° | 120.0° |
C29 | C30 | N31 | O32 | 163.7° | 180.0° |
C29 | C30 | N31 | HN31 | 163.7° | 0.0° |
C29 | C30 | N31 | HN3A | 16.2° | 180.0° |
S33 | C29 | C30 | N31 | 167.9° | 0.3° |
S33 | C29 | C30 | O32 | 4.0° | 179.7° |
C30 | N31 | HN31 | HN3A | 179.9° | 180.0° |
O32 | C30 | N31 | HN31 | 0.0° | 180.0° |
O32 | C30 | N31 | HN3A | 180.0° | 0.0° |
C37 | C36 | H36 | H36A | 119.5° | 120.1° |
C36 | C37 | H37 | H37A | 118.7° | 120.0° |
H36 | C36 | C37 | H37 | 58.5° | 179.2° |
H36 | C36 | C37 | H37A | 61.5° | 59.2° |
H36A | C36 | C37 | H37 | 61.5° | 59.1° |
H36A | C36 | C37 | H37A | 178.5° | 60.9° |