0  B17R2.23458  O=c1[nH]c(CN2CCCC2=N)c(c(=O)[nH]1)Cl 1P0027VJ [0,0,0,0,0,0|0,0,0]=0
1  B17R2.23458  O=c1[nH]c(CN2CCCC2=N)c(c(=O)[nH]1)Cl 1P00AP1L [0,0,0,0,0,0|0,0,0]=0
2  B16R2.128471  O=c1cc([nH]c(=O)[nH]1)CN2CCCC2=N 1P01XGJH [1,0,0,0,0,0|0,0,0]=1