0  B10R1.58  CC1=CC(C(=O)O)=NN1C 3002387 [0,0,0,0,0,0|3,0,0]=3
1  B10R1.58  CC1=NC(C(=O)O)=NN1C 4085547 [0,0,0,0,0,0|4,0,0]=4
2  B10R1.58  CN1N=C(C(=O)O)N=C1Cl 4087584 [0,0,0,0,0,0|3,0,0]=3
3  B9R1.23  CC1=C(C)SC(CO)=N1 4089722 [1,0,0,0,0,0|2,0,1]=4
4  B9R1.35  CC1=CC(C(=O)O)=CS1 3002756 [1,0,0,0,0,0|2,0,0]=3
5  B9R1.35  CC1=CC=C(C(=O)O)S1 3001579 [1,0,0,0,0,0|1,0,0]=2
6  B9R1.35  CC1=CNC(C(=O)O)=N1 4088804 [1,0,0,0,0,0|2,0,0]=3
7  B9R1.35  CC1=CSC(B(O)O)=C1 4089313 [1,0,0,0,0,0|1,0,1]=3
8  B9R1.35  CC1=NC(C(=O)O)=CN1 4088219 [1,0,0,0,0,0|3,0,0]=4
9  B9R1.35  CC1=NN=C(C(=O)O)O1 4088445 [1,0,0,0,0,0|3,0,0]=4
10  B9R1.35  CC1=NNC(C(=O)O)=N1 4003911 [1,0,0,0,0,0|3,0,0]=4
11  B9R1.35  NC(=O)C1=CSC(Cl)=N1 4036343 [1,0,0,0,0,0|3,0,0]=4
12  B9R1.35  O=C(O)C1=CC(Br)=CS1 3013954 [1,0,0,0,0,0|1,0,0]=2
13  B9R1.35  O=C(O)C1=NNC(Cl)=N1 4091079 [1,0,0,0,0,0|3,0,0]=4
14  B11R1.48  CC1=C(CN)C=C(C(=O)O)O1 4090563 [0,1,0,0,0,0|1,1,0]=3
15  B11R1.48  CCC1=C(Br)C=C(C(=O)O)S1 3013956 [0,1,0,0,0,0|2,0,0]=3
16  B11R1.226  COC(=O)C1=CC(Br)=C(C)N1 4085415 [0,1,0,0,0,0|2,1,0]=4
17  B11R1.21  CC1=C(C)N=CC(C(=O)O)=C1 4091150 [0,0,0,0,0,1|2,0,0]=3
18  B8R1.1  CC1=CNC(C=O)=C1 4036719 [2,0,0,0,0,0|1,0,0]=3
19  B8R1.1  CC1=NC=C(C=O)S1 4301186 [2,0,0,0,0,0|2,0,0]=4
20  B10R1.31  CCC1=CC(C(=O)O)=CS1 3007503 [1,1,0,0,0,0|2,0,0]=4
21  B10R1.31  CCC1=CC=C(C(=O)O)N1 4043364 [1,1,0,0,0,0|2,0,0]=4
22  B10R1.31  COC1=CC=C(C(=O)O)O1 4001967 [1,1,0,0,0,0|1,1,0]=4
23  B10R1.31  NCC1=CC=C(C(=O)O)O1 4089807 [1,1,0,0,0,0|1,1,0]=4
24  B10R1.194  CC1=C(C)C(C(=O)O)=CS1 3002457 [1,1,0,0,0,0|2,0,0]=4
25  B10R1.194  CC1=CC=C(C(=O)O)N1C 4028920 [1,1,0,0,0,0|2,0,0]=4
26  B10R1.194  CC1=NNC(C(=O)O)=C1C 4010193 [1,1,0,0,0,0|2,0,0]=4
27  B12R1.48  COC1=C(O)C=C(C(=O)O)N=C1 4088767 [0,1,0,0,0,1|2,0,0]=4
28  B12R1.1005  CC1=C(N)C(Br)=CC(C(=O)O)=C1 4029495 [0,1,0,0,0,1|2,0,0]=4
29  B12R1.274  CCCC1=C(Br)C=C(C(=O)O)S1 3013957 [0,2,0,0,0,0|2,0,0]=4
30  B10R1.54  CC1=CN(CC(=O)O)N=C1 4089617 [1,0,0,0,0,1|2,0,0]=4
31  B10R1.54  CN1C=CC(CC(=O)O)=C1 4400835 [1,0,0,0,0,1|2,0,0]=4
32  B12R1.101  CC1=CC(CC(=O)O)=CC(C)=N1 4054900 [0,0,0,0,0,2|2,0,0]=4