0  B21R1.183439  CCCOC1=C(C=C(C=C1)C(=O)OCCN(CC)CC)N MCULE-9291072201 [0,0,0,0,0,0|0,0,0]=0
1  B21R1.183439  CCCOC1=CC=C(C=C1N)C(=O)OCC[NH+](CC)CC MCULE-8418206804 [0,0,0,0,0,0|0,0,1]=1
2  B19R1.3742  CCOC1=CC=C(C=C1)C(=O)OCCN(CC)CC MCULE-3384521043 [2,0,0,0,0,0|0,0,0]=2
3  B19R1.3742  CCOC1=CC=C(C=C1)C(=O)OCCN(CC)CC MCULE-8009544048 [2,0,0,0,0,0|0,0,0]=2
4  B19R1.78347  CCN(CC)CCNC(=O)C1=CC=C(C(=C1)Br)OC MCULE-5504327277 [2,0,0,0,0,0|2,0,0]=4
5  B19R1.78347  CCN(CC)CCOC(=O)C1=CC=C(C(=C1)O)OC MCULE-2234307976 [2,0,0,0,0,0|1,0,0]=3
6  B19R1.78347  CCN(CC)CCOC(=O)C1=CC=C(C(=C1)O)OC MCULE-7691068616 [2,0,0,0,0,0|1,0,0]=3
7  B21R1.3790  CCCCOC1=CC=C(C=C1)C(=O)OCCN(CC)CC MCULE-3038836363 [1,1,0,0,0,0|0,0,0]=2
8  B21R1.3790  CCCCOC1=CC=C(C=C1)C(=O)OCCN(CC)CC MCULE-3847920757 [1,1,0,0,0,0|0,0,0]=2
9  B21R1.1026978  CCCOC1=CC(=C(C=C1)C(=O)OCCN(CC)CC)O MCULE-4772528494 [1,1,0,0,0,0|0,0,0]=2
10  B21R1.1026978  CCCOC1=CC(=C(C=C1)C(=O)OCCN(CC)CC)O MCULE-8953910353 [1,1,0,0,0,0|0,0,0]=2
11  B21R2.50062  CCCCC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC MCULE-4751036265 [1,0,0,1,0,0|2,0,0]=4
12  B21R2.245541  CCN(CC)CCOC(=O)C1=CC2=C(C=C1)OCCO2 MCULE-7514970445 [1,0,0,1,0,0|1,0,0]=3
13  B21R2.245541  CCN(CC)CCOC(=O)C1=CC2=C(C=C1)OCCO2 MCULE-8071937644 [1,0,0,1,0,0|1,0,0]=3
14  B21R2.21975031  CC[NH+](CC)CCC(=O)C1=CC2=C(C=C1)OCCCO2 MCULE-4648124357 [0,0,0,1,1,0|1,0,1]=4
15  B21R2.21975031  CC[NH+](CC)CCC(=O)C1=CC2=C(C=C1)OCCCO2 MCULE-4822655525 [0,0,0,1,1,0|1,0,1]=4