0  B11R1.35  NC(CC1=CC=CS1)C(=O)O 03432 [0,0,1,0,0,0|1,0,2]=4
1  B11R1.35  N[C@@H](CC1=CC=CS1)C(=O)O 01320 [0,0,1,0,0,0|1,0,2]=4
2  B11R1.35  N[C@@H](CC1=CSC=N1)C(=O)O 07376 [0,0,1,0,0,0|2,0,1]=4
3  B11R1.35  N[C@H](CC1=CC=CS1)C(=O)O 01321 [0,0,1,0,0,0|1,0,2]=4
4  B11R1.35  N[C@H](CC1=CSC=N1)C(=O)O 07377 [0,0,1,0,0,0|2,0,1]=4
5  B13R2.430  O=C(O)C1=CC2=C(C=C1)NC=C2 21884 [0,0,0,0,0,1|2,0,1]=4
6  B13R2.430  O=C(O)C1=CC2=C(C=C1)SC=N2 26205 [0,0,0,0,0,1|1,0,0]=2
7  B13R2.430  O=C(O)C1=CC2=C(C=CN2)C=C1 21866 [0,0,0,0,0,1|2,0,1]=4
8  B13R2.430  O=C(O)C1=CC2=NC=CN2C=C1 26304 [0,0,0,0,0,1|3,0,0]=4
9  B13R2.430  O=C(O)[C@@H]1CC2=C(CN1)N=CN2 09389 [0,0,0,0,0,1|1,0,2]=4
10  B13R2.435  O=C(O)C1=CC2=C(C=CC=C2)N1 21846 [0,0,0,0,0,1|2,0,0]=3
11  B10R1.66  CC(=O)\C=C\C1=CC=CS1 25725 [1,0,1,0,0,0|2,0,0]=4
12  B14R2.450  CN1C(C(=O)O)=CC2=C1C=CC=C2 21571 [0,1,0,0,0,1|2,0,0]=4
13  B14R2.972  COC(=O)C1=CC2=C(C=CC=C2)N1 21561 [0,1,0,0,0,1|2,0,0]=4
14  B14R2.4529  CC1=CC2=C(C=C1)NC(C(=O)O)=C2 21546 [0,1,0,0,0,1|2,0,0]=4
15  B14R2.4529  O=C(O)C1=CC2=C(C=CC(Br)=C2)N1 21839 [0,1,0,0,0,1|2,0,0]=4
16  B14R2.4529  O=C(O)C1=CC2=C(C=CC(Cl)=C2)N1 21995 [0,1,0,0,0,1|2,0,0]=4
17  B14R2.4529  O=C(O)C1=CC2=C(C=CC(F)=C2)N1 21996 [0,1,0,0,0,1|2,0,0]=4
18  B14R2.4529  O=C(O)C1=CC2=C(C=CC(O)=C2)N1 21566 [0,1,0,0,0,1|2,0,0]=4
19  B14R2.4529  O=C(O)C1=CC2=CC=C(Br)C=C2N1 24200 [0,1,0,0,0,1|2,0,0]=4
20  B14R2.7969  CC1=CC=CC2=C1NC(C(=O)O)=C2 21579 [0,1,0,0,0,1|2,0,0]=4
21  B14R2.7969  O=C(O)C1=CC2=C(F)C=CC=C2N1 21167 [0,1,0,0,0,1|2,0,0]=4
22  B14R2.7969  O=C(O)C1=CC2=CC=CC(Br)=C2N1 20896 [0,1,0,0,0,1|2,0,0]=4
23  B10R1.23  N[C@@H](C(=O)O)C1=CC=CS1 16638 [0,0,1,0,1,0|1,0,1]=4
24  B10R1.23  N[C@H](C(=O)O)C1=CC=CS1 16644 [0,0,1,0,1,0|1,0,1]=4
25  B12R2.32  O=CC1=CC2=C(C=CC=C2)N1 17607 [1,0,0,0,0,1|2,0,0]=4
26  B12R2.32  O=CC1=CC2=CN=CC=C2N1 18516 [1,0,0,0,0,1|2,0,0]=4
27  B14R2.781  O=C(O)C1=CC2=CC=CN=C2C=C1 27668 [0,0,0,0,0,2|2,0,0]=4