0  B11R1.16  CCCC(=O)c1cccnc1 PBO [1,0,0,0,0,0|2,0,0]=3
1  B11R1.16  c1ccc(cc1)C(=O)CCO P18 [1,0,0,0,0,0|2,0,0]=3
2  B11R1.16  c1ccc(cc1)C(=O)NCO 1Q8 [1,0,0,0,0,0|2,0,0]=3
3  B11R1.91  CC(=O)OCc1ccccc1 J0Z [1,0,0,0,0,0|1,0,2]=4
4  B11R1.91  C[C@H](CCc1ccccc1)N 4DD [1,0,0,0,0,0|2,0,1]=4
5  B13R1.201  CC(C)NC(=O)c1ccccc1I EBM [0,1,0,0,0,0|1,0,0]=2
6  B13R2.328  CC1=Nc2ccccc2C(=O)N1 MEW [0,0,0,1,0,0|2,0,1]=4
7  B11R1.36  C[C@H]([C@@H](c1ccccc1)O)N NPU [0,0,0,0,1,0|1,0,2]=4
8  B11R1.36  c1ccc(cc1)C(=O)C(=O)O 173 [0,0,0,0,1,0|2,0,1]=4
9  B10R1.15  CCC(=O)c1ccccc1 I1E [2,0,0,0,0,0|0,0,0]=2
10  B10R1.15  CC[C@@H](C)c1ccccc1 3GY [2,0,0,0,0,0|1,0,1]=4
11  B10R1.15  c1ccc(cc1)C(=O)CO HXT [2,0,0,0,0,0|1,0,0]=3
12  B10R1.15  c1ccc(cc1)C(=O)NN WM4 [2,0,0,0,0,0|2,0,0]=4
13  B10R1.15  c1ccc(cc1)C(=O)NO BHO [2,0,0,0,0,0|2,0,0]=4
14  B10R1.17  CCCCc1ccccc1 N4B [2,0,0,0,0,0|1,0,1]=4
15  B12R1.16  CCOC(=O)c1ccc(cc1)O E4B [1,1,0,0,0,0|0,0,0]=2
16  B12R1.17  CCOC(=O)c1cccc(c1)N FG7 [1,1,0,0,0,0|0,0,0]=2
17  B12R1.30  c1ccc(cc1)C(=O)NCCS BFE [1,1,0,0,0,0|1,0,0]=3
18  B14R1.160  CC(=O)ONC(=O)c1ccccc1O SCL [0,1,0,0,0,1|1,0,1]=4
19  B14R1.160  CN(C)\C=C\C(=O)c1ccccc1O 5KL [0,1,0,0,0,1|2,0,0]=4
20  B12R2.1081  c1ccc2c(c1)CCNC2=O JOZ [1,0,0,1,0,0|1,0,0]=3
21  B12R2.18  CN1Cc2ccccc2C1=O 5WV [0,0,0,1,1,0|1,0,0]=3
22  B14R2.738  C[C@@H]1CC(=O)Nc2ccccc2N1 98 [0,0,0,1,0,1|2,0,0]=4
23  B10R1.18  CC(=O)Oc1ccccc1 QY9 [1,0,0,0,1,0|1,0,1]=4
24  B10R1.18  CC(C)Cc1ccccc1 I4B [1,0,0,0,1,0|0,0,1]=3
25  B10R1.18  C[C@@H](Cc1ccccc1)N 1WE [1,0,0,0,1,0|1,0,1]=4
26  B10R1.18  C[C@H](Cc1ccccc1)N FRD [1,0,0,0,1,0|1,0,1]=4
27  B12R1.32  CCSC(=Nc1ccccc1)N PTU [1,0,0,0,0,1|1,1,0]=4
28  B12R1.32  c1ccc(cc1)NC(=O)CCS 4K3 [1,0,0,0,0,1|2,0,0]=4