0  B5R0.2  CC\C=C\CC BBC/270 [0,0,0,0,0,0|2,0,1]=3
1  B5R0.2  CNCCOC BBB/960 [0,0,0,0,0,0|4,0,0]=4
2  B6R0.1  CCNC(=O)CBr BBB/922 [0,1,0,0,0,0|2,0,1]=4
3  B6R0.1  CCNC(C)CC BBB/926 [0,1,0,0,0,0|2,0,0]=3
4  B6R0.1  CCOC(C)CN BBB/989 [0,1,0,0,0,0|1,1,0]=3
5  B6R0.1  CCOC(C)CN BBC/008 [0,1,0,0,0,0|1,1,0]=3
6  B6R0.6  CCNCCCN BBC/176 [0,1,0,0,0,0|2,0,0]=3
7  B6R0.6  CCOCCNC BBC/039 [0,1,0,0,0,0|1,1,0]=3
8  B6R1.1  C1CNCCN1 BBC/189 [0,0,0,1,0,0|2,0,0]=3
9  B5R0.1  CC(=O)NCO BBC/282 [1,1,0,0,0,0|1,0,1]=4
10  B5R0.1  O=C(O)CCBr BBC/178 [1,1,0,0,0,0|1,0,1]=4
11  B7R0.3  CCC(Cl)CCCCl BBC/272 [0,2,0,0,0,0|2,0,0]=4
12  B7R0.5  CCOC(=O)[C@H](C)O BBC/170 [0,2,0,0,0,0|0,1,1]=4
13  B7R0.7  CCOC(C)CNC BBB/937 [0,2,0,0,0,0|1,1,0]=4
14  B7R0.12  COCC(CO)OC BBC/764 [0,2,0,0,0,0|2,0,0]=4
15  B7R0.4  CC(C)OCCC#N BBB/970 [0,2,0,0,0,0|1,1,0]=4
16  B7R0.4  CC(C)OCCCO BBB/1011 [0,2,0,0,0,0|0,1,0]=3
17  B7R0.6  CC(C)OCC(=O)O BBC/788 [0,2,0,0,0,0|0,1,1]=4
18  B7R0.8  CCNCC(C)(C)C BBB/909 [0,2,0,0,0,0|2,0,0]=4
19  B7R0.8  CS(=O)(=O)CCCO BBB/974 [0,2,0,0,0,0|2,0,0]=4
20  B7R0.1  N#CCCNCCO BBC/757 [0,2,0,0,0,0|1,0,0]=3
21  B7R0.1  NCCSSCCN BBC/119 [0,2,0,0,0,0|1,0,0]=3
22  B5R1.2  OC1CNC1 BBC/642 [1,0,0,1,0,0|1,0,0]=3