0  B12R2.18  C1=CC=C2C(=C1)C(=O)C(=O)N2 S4717 [0,0,0,0,0,0|1,0,1]=2
1  B12R2.18  C1=CC=C2C(=C1)C(=O)C(=O)N2 S4717 [0,0,0,0,0,0|1,0,1]=2
2  B11R2.1  CC1=CNC2=CC=CC=C12 S4959 [1,0,0,0,0,0|2,0,0]=3
3  B11R2.10  C1=CC=C2C(=C1)NC(=O)O2 S5575 [1,0,0,0,0,0|1,0,0]=2
4  B11R2.10  C1C2=CC=CC=C2NC1=O S4861 [1,0,0,0,0,0|1,0,0]=2
5  B11R1.36  C1=CC=C(C=C1)C(=O)C(=O)O S6053 [0,0,1,0,0,0|2,0,1]=4
6  B11R1.36  C1=CC=C(C=C1)C(C(=O)O)O S9003 [0,0,1,0,0,0|2,0,0]=3
7  B11R1.36  CC(=O)C(=O)C1=CC=CC=C1 S6009 [0,0,1,0,0,0|2,0,1]=4
8  B11R1.36  CC(C1=CC=CC=C1)C(=O)O S6321 [0,0,1,0,0,0|3,0,0]=4
9  B13R2.328  C1=CC=C2C(=C1)C(=O)NC(=O)N2 S5166 [0,0,0,0,0,1|1,0,1]=3
10  B13R2.328  C1=CC=C2C(=C1)C(=O)NC(=O)O2 S4555 [0,0,0,0,0,1|2,0,1]=4
11  B13R2.328  C1=CC=C2C(=C1)C(=O)NC(=O)O2 S4555 [0,0,0,0,0,1|2,0,1]=4
12  B10R1.17  C1=CC=C(C=C1)C=CCO S5824 [1,0,1,0,0,0|2,0,0]=4
13  B10R1.61  C1=CC=C(C(=C1)C(=O)O)O S4539 [1,0,1,0,0,0|2,0,0]=4
14  B10R1.61  C1=CC=C(C(=C1)C(=O)O)O S4539 [1,0,1,0,0,0|2,0,0]=4
15  B10R1.61  CC1=CC=CC=C1C(=O)O S6217 [1,0,1,0,0,0|2,0,0]=4
16  B10R2.7  C1=CC=C2C(=C1)C=CN2 S6358 [2,0,0,0,0,0|1,0,0]=3
17  B12R1.478  C1=CC=C(C=C1)C(CO)C(=O)O S5689 [0,1,1,0,0,0|2,0,0]=4
18  B12R1.43  C1=CC=C(C=C1)CC(=O)C(=O)O S6131 [0,1,1,0,0,0|2,0,0]=4
19  B12R1.75  CC(=O)NC1=CC=CC=C1SC S0210 [0,1,1,0,0,0|2,0,0]=4
20  B12R1.75  CC(=O)NC1=CC=CC=C1SC S0210 [0,1,1,0,0,0|2,0,0]=4
21  B12R2.1  C1=CC=C2C(=C1)C(=CN2)CO S2313 [1,1,0,0,0,0|1,0,0]=3
22  B12R2.1  C1=CC=C2C(=C1)C(=CN2)CO S2313 [1,1,0,0,0,0|1,0,0]=3
23  B12R2.606  C1=CC2=C(C=C1Cl)NC(=O)O2 S4155 [1,1,0,0,0,0|1,0,0]=3
24  B12R2.606  C1=CC2=C(C=C1O)OC(=O)S2 S2603 [1,1,0,0,0,0|2,0,0]=4
25  B12R2.606  C1=CC2=C(C=C1O)OC(=O)S2 S2603 [1,1,0,0,0,0|2,0,0]=4