0  B8R1.7  CC(=O)c1cc[nH]c1 EB60661 [0,0,0,0,0,0|2,0,0]=2
1  B8R1.7  CC(c1ccco1)N EB60178 [0,0,0,0,0,0|1,0,1]=2
2  B8R1.7  CC(c1cccs1)N EB60327 [0,0,0,0,0,0|1,1,1]=3
3  B8R1.7  c1cc(sc1)C(=N)N EB12026 [0,0,0,0,0,0|2,1,0]=3
4  B8R1.7  c1csc(n1)C(=N)N EB11599 [0,0,0,0,0,0|3,1,0]=4
5  B9R1.11  CC(c1ccco1)NO EB60357 [0,1,0,0,0,0|0,0,2]=3
6  B9R1.11  CC(c1cccs1)NO EB60358 [0,1,0,0,0,0|0,1,2]=4
7  B9R1.11  CNC(=O)c1cccs1 EB60998 [0,1,0,0,0,0|0,1,0]=2
8  B9R1.11  c1cc(sc1)C(=O)C[NH3+] EB61215 [0,1,0,0,0,0|0,1,0]=2
9  B9R1.6  CC(c1ccccn1)N EB60111 [0,0,0,0,0,1|2,0,1]=4
10  B9R1.6  CC(c1ccccn1)O EB60161 [0,0,0,0,0,1|1,0,2]=4
11  B9R1.6  CC(c1cccnc1)N EB60112 [0,0,0,0,0,1|2,0,1]=4
12  B9R1.6  CC(c1cccnc1)O EB60160 [0,0,0,0,0,1|1,0,2]=4
13  B9R1.6  CC(c1ccncc1)N EB60113 [0,0,0,0,0,1|2,0,1]=4
14  B9R1.6  CC(c1ccncc1)O EB60159 [0,0,0,0,0,1|1,0,2]=4
15  B9R1.6  c1cc(cnc1)C(=N)N EB12024 [0,0,0,0,0,1|3,0,0]=4
16  B9R1.6  c1ccnc(c1)C(=N)N EB12023 [0,0,0,0,0,1|3,0,0]=4
17  B9R1.6  c1cnc(cn1)C(=N)N EB12079 [0,0,0,0,0,1|3,0,0]=4
18  B9R1.6  c1cnc(cn1)C(=O)Cl EB15016 [0,0,0,0,0,1|2,0,0]=3
19  B9R1.6  c1cnccc1C(=N)N EB12025 [0,0,0,0,0,1|3,0,0]=4
20  B8R1.1  c1cc(oc1C=O)Br KEMAR006 [1,1,0,0,0,0|0,0,0]=2
21  B10R1.13  Cc1cnc(cn1)C(=O)Cl EB15017 [0,1,0,0,0,1|2,0,0]=4
22  B10R1.15  C\C(=N\O)\c1ccccn1 EB60142 [0,1,0,0,0,1|1,0,1]=4
23  B10R1.15  C\C(=N\O)\c1cccnc1 EB60141 [0,1,0,0,0,1|1,0,1]=4
24  B10R1.15  C\C(=N\O)\c1ccncc1 EB60140 [0,1,0,0,0,1|1,0,1]=4
25  B10R1.15  c1ccc(cc1)C(=O)CN EB60794 [0,1,0,0,0,1|1,0,0]=3
26  B10R1.15  c1ccc(cc1)C(=O)CS EB61534 [0,1,0,0,0,1|1,0,0]=3
27  B10R1.11  CCOC(=N)c1cccs1 EB12158 [0,2,0,0,0,0|1,1,0]=4
28  B10R1.66  CC(C)NCc1ccco1 EB16317 [0,0,0,0,0,2|1,0,1]=4
29  B10R1.66  CC(C)NCc1ccco1 EB16395 [0,0,0,0,0,2|1,0,1]=4
30  B10R1.66  c1cc(oc1)C#CC(=O)O EB11258 [0,0,0,0,0,2|1,0,0]=3
31  B10R1.66  c1cc(sc1)C#CC(=O)O EB11257 [0,0,0,0,0,2|1,1,0]=4