0  B4R0.1  CC(=S)SC un288 [0,0,0,0,0,0|1,1,1]=3
1  B4R0.1  CC(CF)N bclit001de5lit22 [0,0,0,0,0,0|2,0,0]=2
2  B5R0.1  C(CO)C(=O)N a009de1 [0,1,0,0,0,0|1,0,2]=4
3  B5R0.1  C(CS)C(=O)N jmc099 [0,1,0,0,0,0|1,0,2]=4
4  B5R0.1  N=C(\N)/OCC a132vp1 [0,1,0,0,0,0|2,0,1]=4
5  B5R0.3  C(C(=O)NO)Cl bio034 [0,1,0,0,0,0|2,0,1]=4
6  B5R0.3  CC(C=O)C=O un212vp1de2 [0,1,0,0,0,0|1,0,2]=4
7  B5R1.2  C1C(=O)CO1 hw010 [0,0,0,1,0,0|1,0,2]=4
8  B5R1.3  C1C(O1)CI cic056 [0,0,0,1,0,0|1,0,0]=2
9  B5R1.3  C1CC1CI cic048 [0,0,0,1,0,0|2,0,0]=3
10  B5R1.3  C1CN1CO az009 [0,0,0,1,0,0|3,0,0]=4
11  B6R0.1  CC(CC=O)C#N a142de1 [0,2,0,0,0,0|1,0,1]=4
12  B6R0.1  CC\C(=C\CBr)\C bclit001de5lit7 [0,2,0,0,0,0|1,0,1]=4
13  B6R0.1  CC\C(=C\CO)\C bclit001de5lit6 [0,2,0,0,0,0|0,0,1]=3
14  B6R0.4  CNCCC(=O)O tv011 [0,2,0,0,0,0|1,0,1]=4
15  B6R0.8  CC(C)(CO)OC che003 [0,2,0,0,0,0|1,0,0]=3
16  B6R0.9  CCC(C#N)C#N un212vp1de10 [0,2,0,0,0,0|1,0,1]=4
17  B6R0.9  CCC(C=O)C=O un212vp1de6 [0,2,0,0,0,0|0,0,2]=4
18  B6R0.9  CC\C(=C/C)\C=O fpzz0080fp3 [0,2,0,0,0,0|0,0,2]=4
19  B4R1.2  C1CN1Cl az010 [1,0,0,1,0,0|2,0,0]=4
20  B6R1.11  CC(=O)N1CC1 az013 [0,1,0,1,0,0|0,0,2]=4
21  B6R1.6  C1CC(C1)CI cic053 [0,1,0,1,0,0|1,0,0]=3
22  B6R1.6  C1CC(C1)CN a076de1 [0,1,0,1,0,0|1,0,0]=3