0  B15R3.3  c1ccc2c(c1)C3=CC=CCC3=N2 CHEBI:36423 [0,0,0,0,0,0|1,0,3]=4
1  B15R3.3  c1ccc2c(c1)c3ccccc3[nH]2 CHEBI:27543 [0,0,0,0,0,0|1,0,3]=4
2  B15R3.3  c1ccc2c(c1)c3ccncc3[nH]2 CHEBI:109895 [0,0,0,0,0,0|2,0,2]=4
3  B14R2.3  CNCCc1c[nH]c2c1cccc2 CHEBI:28136 [0,0,1,0,0,0|2,0,0]=3
4  B14R2.3  c1ccc2c(c1)c(c[nH]2)C\C=N/O CHEBI:48577 [0,0,1,0,0,0|3,0,0]=4
5  B14R2.3  c1ccc2c(c1)c(c[nH]2)C\C=N\O CHEBI:17545 [0,0,1,0,0,0|3,0,0]=4
6  B14R2.3  c1ccc2c(c1)c(c[nH]2)C\C=N\O CHEBI:28311 [0,0,1,0,0,0|3,0,0]=4
7  B14R2.6  c1ccc(cc1)CN2CCNCC2 CHEBI:83537 [0,0,1,0,0,0|2,0,1]=4
8  B13R2.1  c1ccc2c(c1)c(c[nH]2)CC#N CHEBI:17566 [1,0,1,0,0,0|1,0,1]=4
9  B13R2.1  c1ccc2c(c1)c(c[nH]2)CC=O CHEBI:18086 [1,0,1,0,0,0|1,0,1]=4
10  B13R2.1  c1ccc2c(c1)c(c[nH]2)CCN CHEBI:16765 [1,0,1,0,0,0|1,0,0]=3
11  B13R2.1  c1ccc2c(c1)c(c[nH]2)CCO CHEBI:17890 [1,0,1,0,0,0|1,0,0]=3
12  B13R2.1  c1ccc2c(c1)c(c[nH]2)CC[NH3+] CHEBI:57887 [1,0,1,0,0,0|1,0,0]=3
13  B15R2.4  CC(Cc1c[nH]c2c1cccc2)NC CHEBI:59024 [0,1,1,0,0,0|2,0,0]=4
14  B15R2.4  COC(=O)Cc1c[nH]c2c1cccc2 CHEBI:72782 [0,1,1,0,0,0|2,0,0]=4
15  B15R2.6  CN(C)CCc1c[nH]c2c1cccc2 CHEBI:28969 [0,1,1,0,0,0|2,0,0]=4
16  B15R2.17719  CNCCc1c[nH]c2c1cc(cc2)O CHEBI:48294 [0,1,1,0,0,0|2,0,0]=4
17  B15R2.56717  Cc1c(c2cc(ccc2[nH]1)O)CCN CHEBI:31085 [0,1,1,0,0,0|2,0,0]=4
18  B17R3.35227  c1ccc2c(c1)c(c3c(n2)CCCC3)N CHEBI:45980 [0,1,0,0,0,1|1,0,1]=4