0  B8R1.7  CC(=O)C1=CNC=C1 EB60661 [0,0,0,0,0,0|2,0,0]=2
1  B8R1.7  CC(N)C1=CC=CO1 EB60178 [0,0,0,0,0,0|1,0,1]=2
2  B8R1.7  CC(N)C1=CC=CS1 EB60327 [0,0,0,0,0,0|1,1,1]=3
3  B8R1.7  N=C(N)C1=CC=CS1 EB12026 [0,0,0,0,0,0|2,1,0]=3
4  B8R1.7  N=C(N)C1=NC=CS1 EB11599 [0,0,0,0,0,0|3,1,0]=4
5  B9R1.11  CC(NO)C1=CC=CO1 EB60357 [0,1,0,0,0,0|0,0,2]=3
6  B9R1.11  CC(NO)C1=CC=CS1 EB60358 [0,1,0,0,0,0|0,1,2]=4
7  B9R1.11  CNC(=O)C1=CC=CS1 EB60998 [0,1,0,0,0,0|0,1,0]=2
8  B9R1.11  [NH3+]CC(=O)C1=CC=CS1 EB61215 [0,1,0,0,0,0|0,1,0]=2
9  B9R1.6  CC(N)C1=CC=NC=C1 EB60113 [0,0,0,0,0,1|2,0,1]=4
10  B9R1.6  CC(N)C1=CN=CC=C1 EB60112 [0,0,0,0,0,1|2,0,1]=4
11  B9R1.6  CC(N)C1=NC=CC=C1 EB60111 [0,0,0,0,0,1|2,0,1]=4
12  B9R1.6  CC(O)C1=CC=CC=N1 EB60161 [0,0,0,0,0,1|1,0,2]=4
13  B9R1.6  CC(O)C1=CC=CN=C1 EB60160 [0,0,0,0,0,1|1,0,2]=4
14  B9R1.6  CC(O)C1=CC=NC=C1 EB60159 [0,0,0,0,0,1|1,0,2]=4
15  B9R1.6  N=C(N)C1=CC=CN=C1 EB12024 [0,0,0,0,0,1|3,0,0]=4
16  B9R1.6  N=C(N)C1=CC=NC=C1 EB12025 [0,0,0,0,0,1|3,0,0]=4
17  B9R1.6  N=C(N)C1=NC=CC=C1 EB12023 [0,0,0,0,0,1|3,0,0]=4
18  B9R1.6  N=C(N)C1=NC=CN=C1 EB12079 [0,0,0,0,0,1|3,0,0]=4
19  B9R1.6  O=C(Cl)C1=NC=CN=C1 EB15016 [0,0,0,0,0,1|2,0,0]=3
20  B8R1.1  O=CC1=CC=C(Br)O1 KEMAR006 [1,1,0,0,0,0|0,0,0]=2
21  B10R1.15  C\C(=N\O)C1=CC=CC=N1 EB60142 [0,1,0,0,0,1|1,0,1]=4
22  B10R1.15  C\C(=N\O)C1=CC=CN=C1 EB60141 [0,1,0,0,0,1|1,0,1]=4
23  B10R1.15  C\C(=N\O)C1=CC=NC=C1 EB60140 [0,1,0,0,0,1|1,0,1]=4
24  B10R1.15  NCC(=O)C1=CC=CC=C1 EB60794 [0,1,0,0,0,1|1,0,0]=3
25  B10R1.15  O=C(CS)C1=CC=CC=C1 EB61534 [0,1,0,0,0,1|1,0,0]=3
26  B10R1.11  CCOC(=N)C1=CC=CS1 EB12158 [0,2,0,0,0,0|1,1,0]=4
27  B10R1.66  CC(C)NCC1=CC=CO1 EB16317 [0,0,0,0,0,2|1,0,1]=4
28  B10R1.66  CC(C)NCC1=CC=CO1 EB16395 [0,0,0,0,0,2|1,0,1]=4
29  B10R1.66  O=C(O)C#CC1=CC=CO1 EB11258 [0,0,0,0,0,2|1,0,0]=3
30  B10R1.66  O=C(O)C#CC1=CC=CS1 EB11257 [0,0,0,0,0,2|1,1,0]=4