0  B7R0.1  CSCCCN=C=S Z104495408 [0,0,0,0,0,0|1,0,1]=2
1  B6R0.6  C=CCCCCN Z1198160046 [1,0,0,0,0,0|1,0,1]=3
2  B6R0.6  C=CCCN=C=S Z1255360772 [1,0,0,0,0,0|0,0,0]=1
3  B6R0.6  C=CCNCC=C Z104474454 [1,0,0,0,0,0|2,0,1]=4
4  B6R0.6  C=CCNCCO Z137800938 [1,0,0,0,0,0|1,1,1]=4
5  B6R0.6  C=CCOCCN Z976678988 [1,0,0,0,0,0|2,0,1]=4
6  B6R0.6  C=CCSCC=C Z1208219429 [1,0,0,0,0,0|2,0,1]=4
7  B6R0.6  C=CCSCCN Z1262237162 [1,0,0,0,0,0|2,0,1]=4
8  B6R0.6  CCCCN=C=S Z104473876 [1,0,0,0,0,0|0,0,1]=2
9  B6R0.6  COCCN=C=O Z1094719556 [1,0,0,0,0,0|1,1,1]=4
10  B6R0.6  O=CCCCC=O Z57127529 [1,0,0,0,0,0|1,1,1]=4
11  B8R0.4  C=CCCCCCCN Z1198263320 [0,1,0,0,0,0|2,0,1]=4
12  B8R0.6  COC(=O)CCN=C=S Z237517204 [0,1,0,0,0,0|1,0,2]=4
13  B8R0.7  CN(C)CCCN=C=S Z57046236 [0,1,0,0,0,0|1,0,1]=3
14  B8R1.2  C=CC1CCCCN1 Z2142036752 [0,0,0,1,0,0|2,0,1]=4
15  B8R1.2  C=CC1CCCNC1 Z2740400893 [0,0,0,1,0,0|3,0,0]=4
16  B8R1.2  C=CC1CCNCC1 Z1266933822 [0,0,0,1,0,0|1,0,2]=4
17  B8R1.8  O=C=NC1CCCC1 Z316172554 [0,0,0,1,0,0|0,1,2]=4
18  B8R1.11  C=C[C@@H]1CCC[C@H]1O Z3015056914 [0,0,0,1,0,0|1,1,1]=4
19  B5R0.2  C#CCN=C=S Z323038598 [2,0,0,0,0,0|0,0,2]=4
20  B5R0.2  C=CCCC#N Z1219746591 [2,0,0,0,0,0|0,0,2]=4
21  B5R0.2  C=CCCCN Z993058434 [2,0,0,0,0,0|0,0,1]=3
22  B5R0.2  C=CCN=C=S Z104472178 [2,0,0,0,0,0|0,0,0]=2
23  B5R0.2  C=CCNCC Z2044769224 [2,0,0,0,0,0|1,0,1]=4
24  B5R0.2  CCCCC=O Z104472992 [2,0,0,0,0,0|1,0,1]=4
25  B7R0.4  C=CCCCC(=O)O Z1205493561 [1,1,0,0,0,0|0,1,1]=4
26  B7R1.1  NCC1C=CCC1 Z2768196818 [1,0,0,1,0,0|1,0,1]=4
27  B7R1.3  NC1C=CCCC1 Z1203579654 [1,0,0,1,0,0|1,0,1]=4
28  B7R1.3  O=C1C=CCCC1 Z295197140 [1,0,0,1,0,0|0,1,1]=4
29  B7R1.7  C=CCCC1CO1 Z1255485443 [1,0,0,1,0,0|0,1,1]=4
30  B7R1.7  O=C=NCC1CC1 Z826525040 [1,0,0,1,0,0|0,1,1]=4
31  B9R1.12  S=C=NCC1=CC=CO1 Z56899048 [0,1,0,1,0,0|0,0,2]=4
32  B9R1.12  S=C=NCC1CCCO1 Z56845051 [0,1,0,1,0,0|0,0,2]=4