0  B5R0.1  CS(=O)CCN E-004174 [0,0,0,0,0,0|3,0,0]=3
1  B5R0.1  NC(=O)CCCl F-399354 [0,0,0,0,0,0|3,0,1]=4
2  B6R0.1  CCS(=O)CCN F-396992 [0,1,0,0,0,0|3,0,0]=4
3  B6R0.1  CNC(=O)CCCl F-399352 [0,1,0,0,0,0|2,0,1]=4
4  B6R0.1  COCC(O)CN F-396283 [0,1,0,0,0,0|3,0,0]=4
5  B6R0.4  CNCCS(C)=O F-396988 [0,1,0,0,0,0|3,0,0]=4
6  B6R0.4  O=C([O-])CCCO F-434693 [0,1,0,0,0,0|2,0,1]=4
7  B6R1.2  BrC1CCSC1 F-399969 [0,0,0,1,0,0|1,1,0]=3
8  B6R1.2  NC1CCSC1 F-399967 [0,0,0,1,0,0|1,1,0]=3
9  B6R1.2  OC1CCSC1 F-399966 [0,0,0,1,0,0|1,1,0]=3
10  B5R0.4  CCC(C)(C)N F-361342 [1,1,0,0,0,0|0,0,0]=2
11  B5R0.2  CNCCSC F-396987 [1,1,0,0,0,0|1,1,0]=4
12  B7R0.5  CN(C)C(=O)CCCl F-399369 [0,2,0,0,0,0|2,0,0]=4
13  B7R0.9  CC(O)CS(C)(=O)=O F-369010 [0,2,0,0,0,0|2,0,0]=4
14  B7R0.13  CN(C)C(C)(C)CN F-415555 [0,2,0,0,0,0|2,0,0]=4
15  B7R0.4  CC(=O)CSCCO F-369089 [0,2,0,0,0,0|1,0,1]=4
16  B7R0.4  CNCCSC(C)C F-396993 [0,2,0,0,0,0|1,0,0]=3
17  B7R1.3  ClC1CCOCC1 F-332464 [0,1,0,1,0,0|1,0,0]=3
18  B7R1.3  NC1CCOCC1 F-368940 [0,1,0,1,0,0|1,0,0]=3
19  B7R1.3  NC1CCSCC1 F-369047 [0,1,0,1,0,0|1,1,0]=4
20  B7R1.4  O=C1OCCC1Br F-333022 [0,1,0,1,0,0|1,0,1]=4
21  B7R1.22  CNC(C)C1CC1 F-405904 [0,1,0,1,0,0|1,0,0]=3
22  B7R1.14  CC1(N)CCCC1 F-361345 [0,1,0,1,0,0|1,0,0]=3