0  B4R0.2  C(CBr)CBr A2Z00093585 [0,0,0,0,0,0|3,0,1]=4
1  B4R0.2  C(CON)O A2Z00048270 [0,0,0,0,0,0|4,0,0]=4
2  B4R0.2  C(CS)C#N A2Z00070143 [0,0,0,0,0,0|3,0,1]=4
3  B4R0.2  CCCCBr A2Z00093542 [0,0,0,0,0,0|2,0,1]=3
4  B4R0.2  CCCCN A2Z00093484 [0,0,0,0,0,0|2,0,1]=3
5  B4R0.2  CNCCCl A2Z00094137 [0,0,0,0,0,0|3,0,1]=4
6  B4R0.2  COCON A2Z00070421 [0,0,0,0,0,0|4,0,0]=4
7  B3R0.1  C#CCO A2Z00096413 [1,0,0,0,0,0|2,0,1]=4
8  B3R0.1  C(=N\O)/N A2Z00096515 [1,0,0,0,0,0|1,1,1]=4
9  B3R0.1  C(C#N)Cl A2Z00093485 [1,0,0,0,0,0|2,0,1]=4
10  B3R0.1  C(CS)N A2Z00095999 [1,0,0,0,0,0|1,0,2]=4
11  B3R0.1  C=CCBr A2Z00093514 [1,0,0,0,0,0|2,0,1]=4
12  B3R0.1  CCCBr A2Z00093521 [1,0,0,0,0,0|1,0,1]=3
13  B3R0.1  CCCN A2Z00093482 [1,0,0,0,0,0|1,0,1]=3
14  B5R0.1  CC(C)CCBr A2Z00093551 [0,1,0,0,0,0|2,0,1]=4
15  B5R0.1  CC(C)C[N+]#[C-] A2Z00050390 [0,1,0,0,0,0|3,0,0]=4
16  B5R0.1  CC(CNN)O A2Z00062183 [0,1,0,0,0,0|3,0,0]=4
17  B5R0.1  CCCC(=O)O A2Z00093490 [0,1,0,0,0,0|1,1,1]=4
18  B5R0.2  C(CCN)CN A2Z00070215 [0,1,0,0,0,0|2,0,1]=4
19  B5R0.2  C(CO)N=[N+]=[N-] A2Z00096040 [0,1,0,0,0,0|2,0,0]=3
20  B5R0.2  CCCCCBr A2Z00093550 [0,1,0,0,0,0|2,0,1]=4
21  B5R0.2  CCCCNC A2Z00093457 [0,1,0,0,0,0|2,0,1]=4
22  B5R0.2  CCNCC=C A2Z00070010 [0,1,0,0,0,0|1,0,2]=4
23  B5R0.2  COCN=C=O A2Z00048845 [0,1,0,0,0,0|0,1,0]=2
24  B5R0.3  CCN(CC)N A2Z00049169 [0,1,0,0,0,0|1,0,2]=4
25  B5R1.1  C1CCNC1 A2Z00093483 [0,0,0,1,0,0|1,0,2]=4
26  B5R1.1  C1COC=C1 A2Z00050496 [0,0,0,1,0,0|1,1,1]=4
27  B2R0.1  C(Br)Br A2Z00093572 [2,0,0,0,0,0|2,0,0]=4
28  B2R0.1  CC=O A2Z00093597 [2,0,0,0,0,0|0,1,1]=4
29  B2R0.1  CON A2Z00047974 [2,0,0,0,0,0|1,0,1]=4
30  B4R0.1  CC(C)CBr A2Z00038648 [1,1,0,0,0,0|1,0,1]=4
31  B4R0.1  CCC(=O)N A2Z00097941 [1,1,0,0,0,0|0,1,1]=4
32  B4R0.1  C[C@@H](CO)N A2Z00045067 [1,1,0,0,0,0|0,1,1]=4
33  B6R0.1  CCC(C)N=C=O A2Z00046535 [0,2,0,0,0,0|0,1,0]=3
34  B6R0.4  CC(C)CN=C=O A2Z00046534 [0,2,0,0,0,0|0,1,0]=3
35  B6R0.5  CS(=O)(=O)N=C=O A2Z00049173 [0,2,0,0,0,0|1,1,0]=4
36  B6R0.6  COCCN=C=O A2Z00046536 [0,2,0,0,0,0|0,1,0]=3
37  B6R1.2  C1CSC(=N1)N A2Z00096171 [0,1,0,1,0,0|0,0,2]=4
38  B6R1.3  C1CC1N=C=O A2Z00046533 [0,1,0,1,0,0|0,1,0]=3