0  B25R3.32188871  CC1(CCSC2=CC=C(C=C12)C#CC3=NC=C(C=C3)C(=O)O)C MCULE-3788596370 [0,0,0,0,0,0|0,0,0]=0
1  B26R3.248866376  CC1(CCS(=O)C2=CC=C(C=C12)C#CC3=NC=C(C=N3)C(=O)O)C MCULE-4672569453 [0,1,0,0,0,0|1,0,1]=3
2  B27R3.52606788  CCOC(=O)C1=CN=C(C=C1)C#CC2=CC3=C(C=C2)SCCC3(C)C MCULE-8750174253 [0,2,0,0,0,0|0,0,0]=2
3  B27R3.1508760074  CC1(CCC(C2=CC(=CC=C12)C#CC3=CC=C(C=C3)C(=O)O)(C)C)C MCULE-8693379849 [0,2,0,0,0,0|2,0,0]=4