8X7
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C01 | N02 | sing | 1.47Å | 1.49Å | |
N02 | C03 | sing | 1.47Å | 1.49Å | |
N02 | C07 | sing | 1.47Å | 1.49Å | |
C03 | C04 | sing | 1.53Å | 1.55Å | |
C07 | C06 | sing | 1.53Å | 1.54Å | |
C04 | N05 | sing | 1.47Å | 1.46Å | |
C06 | N05 | sing | 1.47Å | 1.45Å | |
N05 | C08 | sing | 1.40Å | 1.39Å | |
C08 | C37 | doub | 1.39Å | 1.42Å | Aromatic |
C08 | C09 | sing | 1.39Å | 1.42Å | Aromatic |
C37 | C36 | sing | 1.38Å | 1.40Å | Aromatic |
C09 | C10 | doub | 1.38Å | 1.40Å | Aromatic |
C36 | C11 | doub | 1.39Å | 1.41Å | Aromatic |
C10 | C11 | sing | 1.39Å | 1.41Å | Aromatic |
C11 | N12 | sing | 1.40Å | 1.37Å | |
N12 | C13 | sing | 1.38Å | 1.35Å | |
C30 | C29 | doub | 1.39Å | 1.41Å | Aromatic |
C30 | C31 | sing | 1.38Å | 1.41Å | Aromatic |
C29 | C28 | sing | 1.38Å | 1.41Å | Aromatic |
C33 | C32 | sing | 1.53Å | 1.55Å | |
C13 | N25 | doub | 1.33Å | 1.36Å | Aromatic |
C13 | N14 | sing | 1.33Å | 1.36Å | Aromatic |
C31 | C26 | doub | 1.39Å | 1.42Å | Aromatic |
N25 | C24 | sing | 1.32Å | 1.35Å | Aromatic |
C28 | C32 | sing | 1.51Å | 1.50Å | |
C28 | N27 | doub | 1.32Å | 1.36Å | Aromatic |
O35 | C32 | sing | 1.43Å | 1.43Å | |
C32 | C34 | sing | 1.53Å | 1.55Å | |
N14 | C15 | doub | 1.32Å | 1.36Å | Aromatic |
C26 | N27 | sing | 1.32Å | 1.36Å | Aromatic |
C26 | N23 | sing | 1.39Å | 1.36Å | |
C24 | N23 | sing | 1.38Å | 1.34Å | |
C24 | C16 | doub | 1.41Å | 1.37Å | Aromatic |
N23 | N19 | sing | 1.40Å | 1.33Å | |
C15 | C16 | sing | 1.39Å | 1.40Å | Aromatic |
C16 | C17 | sing | 1.47Å | 1.42Å | |
N19 | C17 | sing | 1.35Å | 1.35Å | |
N19 | C20 | sing | 1.46Å | 1.43Å | |
C17 | O18 | doub | 1.22Å | 1.27Å | |
C20 | C21 | sing | 1.51Å | 1.46Å | |
C21 | C22 | doub | 1.31Å | 1.35Å | |
C01 | H011 | sing | 1.09Å | 1.10Å | |
C01 | H013 | sing | 1.09Å | 1.10Å | |
C01 | H012 | sing | 1.09Å | 1.10Å | |
C03 | H031 | sing | 1.09Å | 1.10Å | |
C03 | H032 | sing | 1.09Å | 1.10Å | |
C04 | H041 | sing | 1.09Å | 1.10Å | |
C04 | H042 | sing | 1.09Å | 1.10Å | |
C06 | H061 | sing | 1.09Å | 1.10Å | |
C06 | H062 | sing | 1.09Å | 1.10Å | |
C07 | H072 | sing | 1.09Å | 1.10Å | |
C07 | H071 | sing | 1.09Å | 1.10Å | |
C09 | H091 | sing | 1.08Å | 1.08Å | |
C10 | H101 | sing | 1.08Å | 1.08Å | |
N12 | H121 | sing | 0.97Å | 1.00Å | |
C15 | H151 | sing | 1.08Å | 1.08Å | |
C20 | H202 | sing | 1.09Å | 1.10Å | |
C20 | H201 | sing | 1.09Å | 1.10Å | |
C21 | H211 | sing | 1.08Å | 1.08Å | |
C22 | H221 | sing | 1.08Å | 1.08Å | |
C22 | H222 | sing | 1.08Å | 1.08Å | |
C29 | H291 | sing | 1.08Å | 1.08Å | |
C30 | H301 | sing | 1.08Å | 1.08Å | |
C31 | H311 | sing | 1.08Å | 1.08Å | |
C33 | H331 | sing | 1.09Å | 1.10Å | |
C33 | H333 | sing | 1.09Å | 1.10Å | |
C33 | H332 | sing | 1.09Å | 1.10Å | |
C34 | H342 | sing | 1.09Å | 1.10Å | |
C34 | H341 | sing | 1.09Å | 1.10Å | |
C34 | H343 | sing | 1.09Å | 1.10Å | |
O35 | H351 | sing | 0.97Å | 0.95Å | |
C36 | H361 | sing | 1.08Å | 1.08Å | |
C37 | H371 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C01 | N02 | C03 | 111.9° | 111.0° |
C01 | N02 | C07 | 112.2° | 111.0° |
N02 | C01 | H011 | 109.5° | 109.5° |
N02 | C01 | H013 | 109.4° | 109.4° |
N02 | C01 | H012 | 109.5° | 109.5° |
C03 | N02 | C07 | 113.0° | 110.9° |
N02 | C03 | C04 | 114.6° | 109.4° |
N02 | C03 | H031 | 108.2° | 109.5° |
N02 | C03 | H032 | 108.1° | 109.5° |
N02 | C07 | C06 | 110.7° | 109.4° |
N02 | C07 | H072 | 109.2° | 109.5° |
N02 | C07 | H071 | 109.1° | 109.5° |
C03 | C04 | N05 | 116.2° | 109.4° |
C04 | C03 | H031 | 108.2° | 109.5° |
C04 | C03 | H032 | 108.2° | 109.5° |
C03 | C04 | H041 | 107.8° | 109.5° |
C03 | C04 | H042 | 107.8° | 109.5° |
C07 | C06 | N05 | 112.6° | 109.4° |
C07 | C06 | H061 | 108.7° | 109.5° |
C07 | C06 | H062 | 108.7° | 109.5° |
C06 | C07 | H072 | 109.2° | 109.4° |
C06 | C07 | H071 | 109.2° | 109.5° |
C04 | N05 | C06 | 115.9° | 110.9° |
C04 | N05 | C08 | 117.7° | 111.0° |
N05 | C04 | H041 | 107.8° | 109.5° |
N05 | C04 | H042 | 107.8° | 109.5° |
C06 | N05 | C08 | 119.7° | 111.0° |
N05 | C06 | H061 | 108.7° | 109.5° |
N05 | C06 | H062 | 108.7° | 109.5° |
N05 | C08 | C37 | 121.9° | 120.1° |
N05 | C08 | C09 | 121.5° | 120.0° |
C37 | C08 | C09 | 116.5° | 120.0° |
C08 | C37 | C36 | 122.0° | 120.0° |
C08 | C37 | H371 | 118.9° | 120.0° |
C08 | C09 | C10 | 121.6° | 120.0° |
C08 | C09 | H091 | 119.2° | 120.0° |
C37 | C36 | C11 | 120.7° | 120.0° |
C37 | C36 | H361 | 119.6° | 120.0° |
C36 | C37 | H371 | 119.0° | 120.0° |
C09 | C10 | C11 | 121.1° | 120.0° |
C10 | C09 | H091 | 119.2° | 120.0° |
C09 | C10 | H101 | 119.5° | 120.0° |
C36 | C11 | C10 | 118.0° | 120.0° |
C36 | C11 | N12 | 116.0° | 120.0° |
C11 | C36 | H361 | 119.6° | 120.0° |
C10 | C11 | N12 | 126.0° | 120.0° |
C11 | C10 | H101 | 119.4° | 120.0° |
C11 | N12 | C13 | 128.0° | 120.0° |
C11 | N12 | H121 | 116.0° | 120.0° |
N12 | C13 | N25 | 122.7° | 118.9° |
N12 | C13 | N14 | 118.7° | 118.9° |
C13 | N12 | H121 | 116.0° | 120.0° |
C29 | C30 | C31 | 121.1° | 118.5° |
C30 | C29 | C28 | 119.6° | 119.3° |
C30 | C29 | H291 | 120.2° | 120.3° |
C29 | C30 | H301 | 119.5° | 120.8° |
C30 | C31 | C26 | 118.4° | 119.1° |
C31 | C30 | H301 | 119.5° | 120.8° |
C30 | C31 | H311 | 120.8° | 120.4° |
C29 | C28 | C32 | 124.4° | 119.6° |
C29 | C28 | N27 | 116.4° | 120.8° |
C28 | C29 | H291 | 120.2° | 120.3° |
C33 | C32 | C28 | 114.3° | 109.5° |
C33 | C32 | O35 | 105.5° | 109.5° |
C33 | C32 | C34 | 110.2° | 109.5° |
C32 | C33 | H331 | 109.5° | 109.5° |
C32 | C33 | H333 | 109.5° | 109.5° |
C32 | C33 | H332 | 109.4° | 109.5° |
N25 | C13 | N14 | 118.7° | 122.3° |
C13 | N25 | C24 | 121.3° | 120.5° |
C13 | N14 | C15 | 122.4° | 121.1° |
C31 | C26 | N27 | 117.4° | 120.6° |
C31 | C26 | N23 | 128.4° | 119.7° |
C26 | C31 | H311 | 120.8° | 120.5° |
N25 | C24 | N23 | 130.9° | 134.0° |
N25 | C24 | C16 | 119.9° | 118.7° |
C32 | C28 | N27 | 119.1° | 119.6° |
C28 | C32 | O35 | 109.4° | 109.5° |
C28 | C32 | C34 | 110.4° | 109.4° |
C28 | N27 | C26 | 127.0° | 121.6° |
O35 | C32 | C34 | 106.6° | 109.5° |
C32 | O35 | H351 | 109.5° | 114.0° |
C32 | C34 | H342 | 109.5° | 109.5° |
C32 | C34 | H341 | 109.4° | 109.5° |
C32 | C34 | H343 | 109.5° | 109.5° |
N14 | C15 | C16 | 117.9° | 118.6° |
N14 | C15 | H151 | 121.1° | 120.7° |
N27 | C26 | N23 | 113.5° | 119.7° |
C26 | N23 | C24 | 121.4° | 125.2° |
C26 | N23 | N19 | 129.8° | 125.2° |
N23 | C24 | C16 | 109.1° | 107.3° |
C24 | N23 | N19 | 107.6° | 109.6° |
C24 | C16 | C15 | 119.8° | 118.9° |
C24 | C16 | C17 | 106.6° | 106.6° |
N23 | N19 | C17 | 111.6° | 109.4° |
N23 | N19 | C20 | 127.5° | 125.3° |
C15 | C16 | C17 | 133.6° | 134.5° |
C16 | C15 | H151 | 121.1° | 120.8° |
C16 | C17 | N19 | 104.9° | 107.0° |
C16 | C17 | O18 | 132.6° | 126.5° |
C17 | N19 | C20 | 120.4° | 125.3° |
N19 | C17 | O18 | 122.4° | 126.5° |
N19 | C20 | C21 | 100.4° | 109.5° |
N19 | C20 | H202 | 111.7° | 109.5° |
N19 | C20 | H201 | 111.7° | 109.5° |
C20 | C21 | C22 | 124.9° | 120.0° |
C21 | C20 | H202 | 111.7° | 109.5° |
C21 | C20 | H201 | 111.7° | 109.4° |
C20 | C21 | H211 | 117.6° | 120.0° |
C22 | C21 | H211 | 117.5° | 120.0° |
C21 | C22 | H221 | 120.0° | 120.0° |
C21 | C22 | H222 | 120.0° | 120.0° |
H011 | C01 | H013 | 109.5° | 109.5° |
H011 | C01 | H012 | 109.4° | 109.5° |
H013 | C01 | H012 | 109.5° | 109.5° |
H031 | C03 | H032 | 109.5° | 109.5° |
H041 | C04 | H042 | 109.5° | 109.5° |
H061 | C06 | H062 | 109.5° | 109.5° |
H072 | C07 | H071 | 109.5° | 109.5° |
H202 | C20 | H201 | 109.5° | 109.4° |
H221 | C22 | H222 | 120.0° | 120.0° |
H331 | C33 | H333 | 109.4° | 109.5° |
H331 | C33 | H332 | 109.5° | 109.5° |
H333 | C33 | H332 | 109.5° | 109.4° |
H342 | C34 | H341 | 109.5° | 109.4° |
H342 | C34 | H343 | 109.5° | 109.4° |
H341 | C34 | H343 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C01 | N02 | C03 | C07 | 127.9° | 123.9° |
C01 | N02 | C03 | C04 | 172.2° | 176.8° |
C01 | N02 | C07 | C06 | 178.0° | 176.8° |
N02 | C01 | H011 | H013 | 120.0° | 120.0° |
N02 | C01 | H011 | H012 | 120.0° | 120.0° |
N02 | C01 | H013 | H012 | 120.0° | 120.0° |
C01 | N02 | C03 | H031 | 67.1° | 56.8° |
C01 | N02 | C03 | H032 | 51.4° | 63.2° |
C01 | N02 | C07 | H072 | 61.8° | 63.3° |
C01 | N02 | C07 | H071 | 57.8° | 56.8° |
N02 | C03 | C04 | H031 | 120.7° | 120.0° |
N02 | C03 | C04 | H032 | 120.7° | 120.0° |
C03 | N02 | C07 | C06 | 54.3° | 59.2° |
N02 | C03 | C04 | N05 | 35.5° | 58.4° |
C03 | N02 | C01 | H011 | 180.0° | 60.0° |
C03 | N02 | C01 | H013 | 60.0° | 180.0° |
C03 | N02 | C01 | H012 | 60.0° | 60.0° |
N02 | C03 | H031 | H032 | 117.7° | 120.0° |
N02 | C03 | C04 | H041 | 85.5° | 61.6° |
N02 | C03 | C04 | H042 | 156.5° | 178.3° |
C03 | N02 | C07 | H072 | 65.9° | 60.7° |
C03 | N02 | C07 | H071 | 174.5° | 179.3° |
C07 | N02 | C03 | C04 | 44.3° | 59.3° |
N02 | C07 | C06 | H072 | 120.2° | 119.9° |
N02 | C07 | C06 | H071 | 120.2° | 120.0° |
N02 | C07 | C06 | N05 | 56.2° | 58.3° |
C07 | N02 | C01 | H011 | 51.7° | 176.2° |
C07 | N02 | C01 | H013 | 68.3° | 56.2° |
C07 | N02 | C01 | H012 | 171.7° | 63.8° |
C07 | N02 | C03 | H031 | 165.0° | 179.3° |
C07 | N02 | C03 | H032 | 76.4° | 60.7° |
N02 | C07 | C06 | H061 | 176.7° | 61.6° |
N02 | C07 | C06 | H062 | 64.3° | 178.3° |
N02 | C07 | H072 | H071 | 119.4° | 120.1° |
C03 | C04 | N05 | H041 | 121.0° | 120.0° |
C03 | C04 | N05 | H042 | 121.0° | 119.9° |
C03 | C04 | N05 | C06 | 37.9° | 59.3° |
C03 | C04 | N05 | C08 | 170.6° | 176.8° |
C04 | C03 | H031 | H032 | 117.7° | 120.1° |
C03 | C04 | H041 | H042 | 117.0° | 120.0° |
C07 | C06 | N05 | C04 | 48.3° | 59.3° |
C07 | C06 | N05 | H061 | 120.5° | 119.9° |
C07 | C06 | N05 | H062 | 120.5° | 120.0° |
C07 | C06 | N05 | C08 | 160.9° | 176.8° |
C07 | C06 | H061 | H062 | 118.6° | 120.1° |
C06 | C07 | H072 | H071 | 119.4° | 120.1° |
C04 | N05 | C06 | C08 | 150.9° | 123.9° |
C04 | N05 | C08 | C37 | 162.9° | 180.0° |
C04 | N05 | C08 | C09 | 17.6° | 0.3° |
N05 | C04 | C03 | H031 | 156.2° | 178.4° |
N05 | C04 | C03 | H032 | 85.2° | 61.6° |
N05 | C04 | H041 | H042 | 116.9° | 120.1° |
C04 | N05 | C06 | H061 | 168.7° | 60.7° |
C04 | N05 | C06 | H062 | 72.2° | 179.3° |
C06 | N05 | C08 | C37 | 46.8° | 56.2° |
C06 | N05 | C08 | C09 | 132.8° | 124.1° |
C06 | N05 | C04 | H041 | 83.1° | 60.7° |
C06 | N05 | C04 | H042 | 158.9° | 179.2° |
N05 | C06 | H061 | H062 | 118.6° | 120.0° |
N05 | C06 | C07 | H072 | 64.0° | 61.6° |
N05 | C06 | C07 | H071 | 176.4° | 178.3° |
N05 | C08 | C37 | C09 | 179.5° | 179.7° |
N05 | C08 | C37 | C36 | 179.8° | 179.8° |
N05 | C08 | C09 | C10 | 179.8° | 180.0° |
C08 | N05 | C04 | H041 | 68.4° | 63.2° |
C08 | N05 | C04 | H042 | 49.6° | 56.9° |
C08 | N05 | C06 | H061 | 40.4° | 63.2° |
C08 | N05 | C06 | H062 | 78.6° | 56.8° |
N05 | C08 | C09 | H091 | 0.3° | 0.1° |
N05 | C08 | C37 | H371 | 0.2° | 0.0° |
C08 | C37 | C36 | H371 | 180.0° | 179.7° |
C37 | C08 | C09 | C10 | 0.2° | 0.3° |
C08 | C37 | C36 | C11 | 0.2° | 0.5° |
C37 | C08 | C09 | H091 | 179.8° | 179.7° |
C08 | C37 | C36 | H361 | 179.8° | 179.7° |
C09 | C08 | C37 | C36 | 0.3° | 0.6° |
C08 | C09 | C10 | H091 | 180.0° | 179.9° |
C08 | C09 | C10 | C11 | 0.0° | 0.0° |
C08 | C09 | C10 | H101 | 180.0° | 180.0° |
C09 | C08 | C37 | H371 | 179.7° | 179.7° |
C37 | C36 | C11 | H361 | 180.0° | 179.8° |
C37 | C36 | C11 | C10 | 0.1° | 0.2° |
C37 | C36 | C11 | N12 | 179.5° | 179.7° |
C09 | C10 | C11 | C36 | 0.2° | 0.0° |
C09 | C10 | C11 | H101 | 180.0° | 180.0° |
C09 | C10 | C11 | N12 | 179.4° | 180.0° |
C36 | C11 | C10 | N12 | 179.6° | 179.9° |
C36 | C11 | N12 | C13 | 165.3° | 147.4° |
C36 | C11 | C10 | H101 | 179.8° | 180.0° |
C36 | C11 | N12 | H121 | 14.7° | 32.7° |
C11 | C36 | C37 | H371 | 179.9° | 179.8° |
C10 | C11 | N12 | C13 | 15.2° | 32.5° |
C11 | C10 | C09 | H091 | 180.0° | 179.9° |
C10 | C11 | N12 | H121 | 164.9° | 147.4° |
C10 | C11 | C36 | H361 | 179.9° | 180.0° |
C11 | N12 | C13 | H121 | 180.0° | 179.9° |
C11 | N12 | C13 | N25 | 8.3° | 176.2° |
C11 | N12 | C13 | N14 | 171.9° | 4.2° |
N12 | C11 | C10 | H101 | 0.6° | 0.0° |
N12 | C11 | C36 | H361 | 0.5° | 0.1° |
N12 | C13 | N25 | N14 | 179.8° | 179.7° |
N12 | C13 | N25 | C24 | 179.9° | 179.8° |
N12 | C13 | N14 | C15 | 179.7° | 180.0° |
C29 | C30 | C31 | H301 | 180.0° | 179.8° |
C30 | C29 | C28 | H291 | 180.0° | 180.0° |
C29 | C30 | C31 | C26 | 2.8° | 0.5° |
C30 | C29 | C28 | C32 | 179.8° | 180.0° |
C30 | C29 | C28 | N27 | 0.3° | 0.0° |
C29 | C30 | C31 | H311 | 177.2° | 180.0° |
C31 | C30 | C29 | C28 | 0.3° | 0.3° |
C30 | C31 | C26 | H311 | 180.0° | 179.5° |
C30 | C31 | C26 | N27 | 5.3° | 0.5° |
C30 | C31 | C26 | N23 | 174.6° | 179.7° |
C31 | C30 | C29 | H291 | 179.7° | 179.8° |
C29 | C28 | C32 | C33 | 6.9° | 65.0° |
C29 | C28 | C32 | N27 | 179.5° | 180.0° |
C29 | C28 | C32 | O35 | 124.9° | 55.0° |
C29 | C28 | C32 | C34 | 118.0° | 175.0° |
C29 | C28 | N27 | C26 | 3.2° | 0.0° |
C28 | C29 | C30 | H301 | 179.7° | 180.0° |
C33 | C32 | C28 | O35 | 118.0° | 120.0° |
C33 | C32 | C28 | C34 | 124.9° | 120.0° |
C33 | C32 | C28 | N27 | 172.6° | 115.0° |
C33 | C32 | O35 | C34 | 117.2° | 120.0° |
C32 | C33 | H331 | H333 | 120.0° | 120.0° |
C32 | C33 | H331 | H332 | 120.0° | 120.0° |
C32 | C33 | H333 | H332 | 120.0° | 120.0° |
C33 | C32 | C34 | H342 | 180.0° | 180.0° |
C33 | C32 | C34 | H341 | 60.0° | 60.1° |
C33 | C32 | C34 | H343 | 60.0° | 60.0° |
C33 | C32 | O35 | H351 | 180.0° | 60.0° |
N25 | C13 | N14 | C15 | 0.5° | 0.3° |
C13 | N25 | C24 | N23 | 177.6° | 179.8° |
C13 | N25 | C24 | C16 | 0.2° | 0.5° |
N25 | C13 | N12 | H121 | 171.7° | 3.8° |
N14 | C13 | N25 | C24 | 0.3° | 0.5° |
C13 | N14 | C15 | C16 | 0.2° | 0.0° |
N14 | C13 | N12 | H121 | 8.1° | 175.9° |
C13 | N14 | C15 | H151 | 179.9° | 179.9° |
C31 | C26 | N27 | C28 | 5.7° | 0.2° |
C31 | C26 | N27 | N23 | 170.9° | 179.8° |
C31 | C26 | N23 | C24 | 28.5° | 5.4° |
C31 | C26 | N23 | N19 | 165.8° | 174.6° |
C26 | C31 | C30 | H301 | 177.2° | 179.7° |
N25 | C24 | N23 | C26 | 9.1° | 0.3° |
N25 | C24 | N23 | C16 | 178.0° | 179.7° |
N25 | C24 | N23 | N19 | 177.6° | 179.7° |
N25 | C24 | C16 | C15 | 0.6° | 0.3° |
N25 | C24 | C16 | C17 | 179.5° | 179.8° |
C28 | C32 | O35 | C34 | 119.4° | 120.0° |
C32 | C28 | N27 | C26 | 177.3° | 180.0° |
C32 | C28 | C29 | H291 | 0.3° | 0.0° |
C28 | C32 | C33 | H331 | 180.0° | 60.0° |
C28 | C32 | C33 | H333 | 60.0° | 180.0° |
C28 | C32 | C33 | H332 | 60.0° | 60.1° |
C28 | C32 | C34 | H342 | 52.8° | 60.0° |
C28 | C32 | C34 | H341 | 67.2° | 180.0° |
C28 | C32 | C34 | H343 | 172.8° | 60.0° |
C28 | C32 | O35 | H351 | 56.6° | 180.0° |
N27 | C28 | C32 | O35 | 54.6° | 125.0° |
N27 | C28 | C32 | C34 | 62.5° | 5.0° |
C28 | N27 | C26 | N23 | 176.7° | 180.0° |
N27 | C28 | C29 | H291 | 179.8° | 180.0° |
O35 | C32 | C33 | H331 | 59.8° | 180.0° |
O35 | C32 | C33 | H333 | 179.8° | 60.0° |
O35 | C32 | C33 | H332 | 60.2° | 60.0° |
O35 | C32 | C34 | H342 | 66.0° | 60.0° |
O35 | C32 | C34 | H341 | 174.0° | 60.0° |
O35 | C32 | C34 | H343 | 54.0° | 180.0° |
C34 | C32 | C33 | H331 | 55.0° | 60.0° |
C34 | C32 | C33 | H333 | 65.0° | 60.0° |
C34 | C32 | C33 | H332 | 175.0° | 180.0° |
C32 | C34 | H342 | H341 | 120.0° | 120.0° |
C32 | C34 | H342 | H343 | 120.0° | 120.0° |
C32 | C34 | H341 | H343 | 120.0° | 120.1° |
C34 | C32 | O35 | H351 | 62.8° | 60.0° |
N14 | C15 | C16 | C24 | 0.4° | 0.0° |
N14 | C15 | C16 | H151 | 180.0° | 180.0° |
N14 | C15 | C16 | C17 | 179.7° | 180.0° |
N27 | C26 | N23 | C24 | 141.2° | 174.8° |
N27 | C26 | N23 | N19 | 24.5° | 5.2° |
N27 | C26 | C31 | H311 | 174.8° | 180.0° |
C26 | N23 | C24 | N19 | 168.5° | 180.0° |
C26 | N23 | C24 | C16 | 172.9° | 180.0° |
C26 | N23 | N19 | C17 | 172.3° | 180.0° |
C26 | N23 | N19 | C20 | 15.4° | 0.0° |
N23 | C26 | C31 | H311 | 5.4° | 0.2° |
N23 | C24 | C16 | C15 | 177.7° | 180.0° |
N23 | C24 | C16 | C17 | 2.2° | 0.0° |
C24 | N23 | N19 | C17 | 5.1° | 0.0° |
C24 | N23 | N19 | C20 | 177.3° | 180.0° |
C16 | C24 | N23 | N19 | 4.4° | 0.0° |
C24 | C16 | C15 | C17 | 179.9° | 179.9° |
C24 | C16 | C17 | N19 | 0.8° | 0.0° |
C24 | C16 | C17 | O18 | 179.9° | 180.0° |
C24 | C16 | C15 | H151 | 179.6° | 179.9° |
N23 | N19 | C17 | C16 | 3.6° | 0.0° |
N23 | N19 | C17 | C20 | 172.9° | 180.0° |
N23 | N19 | C17 | O18 | 177.0° | 180.0° |
N23 | N19 | C20 | C21 | 76.0° | 91.5° |
N23 | N19 | C20 | H202 | 42.5° | 148.4° |
N23 | N19 | C20 | H201 | 165.4° | 28.5° |
C15 | C16 | C17 | N19 | 179.3° | 180.0° |
C15 | C16 | C17 | O18 | 0.0° | 0.0° |
C16 | C17 | N19 | O18 | 179.4° | 180.0° |
C16 | C17 | N19 | C20 | 176.5° | 180.0° |
C17 | C16 | C15 | H151 | 0.3° | 0.0° |
C17 | N19 | C20 | C21 | 95.6° | 88.5° |
C17 | N19 | C20 | H202 | 145.9° | 31.5° |
C17 | N19 | C20 | H201 | 22.9° | 151.5° |
C20 | N19 | C17 | O18 | 4.1° | 0.0° |
N19 | C20 | C21 | H202 | 118.5° | 120.0° |
N19 | C20 | C21 | H201 | 118.5° | 120.0° |
N19 | C20 | C21 | C22 | 78.1° | 125.0° |
N19 | C20 | H202 | H201 | 124.2° | 120.0° |
N19 | C20 | C21 | H211 | 101.9° | 54.9° |
C20 | C21 | C22 | H211 | 180.0° | 179.9° |
C21 | C20 | H202 | H201 | 124.2° | 120.0° |
C20 | C21 | C22 | H221 | 180.0° | 0.1° |
C20 | C21 | C22 | H222 | 0.0° | 179.9° |
C22 | C21 | C20 | H202 | 163.4° | 4.9° |
C22 | C21 | C20 | H201 | 40.4° | 115.0° |
C21 | C22 | H221 | H222 | 180.0° | 180.0° |
H011 | C01 | H013 | H012 | 120.0° | 120.0° |
H031 | C03 | C04 | H041 | 35.3° | 58.4° |
H031 | C03 | C04 | H042 | 82.8° | 61.7° |
H032 | C03 | C04 | H041 | 153.8° | 178.4° |
H032 | C03 | C04 | H042 | 35.7° | 58.4° |
H061 | C06 | C07 | H072 | 56.4° | 178.5° |
H061 | C06 | C07 | H071 | 63.2° | 58.4° |
H062 | C06 | C07 | H072 | 175.5° | 58.4° |
H062 | C06 | C07 | H071 | 55.9° | 61.6° |
H091 | C09 | C10 | H101 | 0.0° | 0.0° |
H202 | C20 | C21 | H211 | 16.6° | 174.9° |
H201 | C20 | C21 | H211 | 139.6° | 65.1° |
H211 | C21 | C22 | H221 | 0.1° | 179.9° |
H211 | C21 | C22 | H222 | 180.0° | 0.1° |
H291 | C29 | C30 | H301 | 0.3° | 0.0° |
H301 | C30 | C31 | H311 | 2.8° | 0.2° |
H331 | C33 | H333 | H332 | 120.0° | 120.0° |
H342 | C34 | H341 | H343 | 120.0° | 119.9° |
H361 | C36 | C37 | H371 | 0.2° | 0.1° |