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1  B10R1.66  O=C(O)CCC1=CC=CS1 69875 [0,0,0,0,1,0|1,1,0]=3
2  B10R1.66  O=C(O)CCC1=CN=CN1 28308 [0,0,0,0,1,0|3,0,0]=4
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4  B10R1.66  O=C(O)CCC1=CNC=C1 65418 [0,0,0,0,1,0|3,0,0]=4
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6  B10R1.66  O=C(O)CCC1=NC=CN1 69196 [0,0,0,0,1,0|3,0,0]=4
7  B10R1.66  O=C(O)CCC1=NC=CS1 69864 [0,0,0,0,1,0|2,1,0]=4
8  B10R1.66  O=C(O)CCN1C=CC=N1 30854 [0,0,0,0,1,0|3,0,0]=4
9  B12R1.252  O=C(Cl)CCCC1=CC=CC=C1 F52615 [0,0,0,0,0,1|3,0,0]=4
10  B12R1.252  O=C(O)CCCC1=CC=NC=C1 F15138 [0,0,0,0,0,1|3,0,0]=4
11  B12R1.252  O=C(O)CCCC1=NC=CC=C1 O11098 [0,0,0,0,0,1|3,0,0]=4
12  B9R1.12  CCNCC1=CC=CO1 C77903 [2,0,0,0,0,0|1,0,0]=3
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14  B11R1.35  N[C@@H](CC1=CC=CS1)C(=O)O F52519 [0,1,0,0,1,0|1,1,0]=4
15  B11R1.75  CC1=CC=C(CCC(=O)O)O1 W18846 [0,1,0,0,1,0|1,0,0]=3
16  B11R1.75  CC1=CC=C(CCC(=O)O)S1 71574 [0,1,0,0,1,0|1,1,0]=4
17  B11R1.75  CC1=CSC(CCC(=O)O)=C1 72711 [0,1,0,0,1,0|1,1,0]=4
18  B11R1.77  N[C@@H](CC(=O)O)C1=CC=CO1 Y11316 [0,1,0,0,1,0|1,0,0]=3
19  B11R1.77  N[C@@H](CC(=O)O)C1=CC=CS1 D81679 [0,1,0,0,1,0|1,1,0]=4
20  B11R1.77  N[C@@H](CC(=O)O)C1=CC=CS1 N12535 [0,1,0,0,1,0|1,1,0]=4
21  B13R1.348  CC(=O)CC(=O)CC1=CC=CC=C1 27901 [0,1,0,0,0,1|2,0,0]=4
22  B13R1.718  CCC(=O)COCC1=CC=CC=C1 C74376 [0,1,0,0,0,1|1,1,0]=4
23  B13R1.718  COC(=O)COCC1=CC=CC=C1 W10280 [0,1,0,0,0,1|1,1,0]=4
24  B11R2.2  C1=COC([C@@H]2CCCN2)=C1 N12240 [1,0,0,1,0,0|1,0,1]=4
25  B11R2.106  O=C1CCCC2=C1C=NO2 A10532 [1,0,0,1,0,0|2,0,0]=4
26  B11R2.36  O=C1CCC2=C(C1)SC=N2 N13364 [0,0,0,1,1,0|2,0,0]=4
27  B13R2.10  O=C1CC[C@H](C2=CC=CC=C2)C1 53458 [0,0,0,1,0,1|2,0,0]=4
28  B13R2.10  O=C1CC[C@H](C2=CC=CC=C2)C1 94449 [0,0,0,1,0,1|2,0,0]=4
29  B13R2.31  O=C1CC(CC2=CC=CC=C2)C1 67222 [0,0,0,1,0,1|2,0,0]=4
30  B9R1.13  CC(=O)CC1=CC=CS1 W16827 [0,0,0,0,2,0|0,1,0]=3
31  B9R1.13  O=C(O)CC1=CC=CN1 29609 [0,0,0,0,2,0|2,0,0]=4
32  B9R1.13  O=C(O)CC1=CC=CO1 W10208 [0,0,0,0,2,0|1,0,0]=3
33  B9R1.13  O=C(O)CC1=CC=NO1 AC1452 [0,0,0,0,2,0|2,0,0]=4
34  B11R1.28  O=CCCCC1=CN=CC=C1 P16929 [1,0,0,0,0,1|2,0,0]=4
35  B13R1.337  CC(=O)CCCCC1=CC=CC=C1 D97314 [0,0,0,0,0,2|2,0,0]=4
36  B13R1.337  CC(=O)CCNCC1=CC=CC=C1 50047 [0,0,0,0,0,2|2,0,0]=4