0  B10R1.11  CCC[C@H](N)C1=CC=CS1 Y13697 [0,0,0,0,0,0|1,1,1]=3
1  B9R1.11  N[C@@H](CO)C1=CC=CO1 Y13914 [1,0,0,0,0,0|2,0,1]=4
2  B9R1.11  N[C@@H](CO)C1=CC=CO1 Y13915 [1,0,0,0,0,0|2,0,1]=4
3  B11R1.15  CCOC(=O)C1=CC(N)=NO1 AC5337 [0,1,0,0,0,0|2,0,0]=3
4  B11R1.15  CCOC(=O)C1=NNC(F)=C1 P15484 [0,1,0,0,0,0|3,0,0]=4
5  B11R1.199  CCOC(=O)C1=C(F)NC=N1 F30601 [0,1,0,0,0,0|3,0,0]=4
6  B9R0.35  C=CC[C@H](O)C(=O)OCC AC9119 [0,0,1,0,0,0|1,0,2]=4
7  B11R2.106  O=C1NCCC2=C1C=CO2 P17386 [0,0,0,1,0,0|3,0,0]=4
8  B8R1.7  C[C@H](N)C1=CC=CO1 Y14798 [2,0,0,0,0,0|1,0,1]=4
9  B8R1.8  CNCC1=NC=CO1 66406 [2,0,0,0,0,0|2,0,0]=4
10  B12R1.55  CCOC(=O)[C@H](F)C1=CC=CS1 AC9181 [0,1,0,0,0,1|1,1,0]=4
11  B12R1.312  C=CC1=NC=C(C(=O)OCC)O1 C72035 [0,2,0,0,0,0|2,0,0]=4
12  B10R2.32  O=C1CCN2C=NC=C12 65837 [1,0,0,1,0,0|2,0,0]=4
13  B12R2.1081  O=C1CCNC2=C1C=CC=N2 W12418 [0,0,0,1,0,1|2,0,0]=4
14  B12R2.1081  O=C1CCOC2=C1C=NC=C2 F53452 [0,0,0,1,0,1|2,0,0]=4
15  B12R2.1081  O=C1COCC2=C1C=CC=N2 A10613 [0,0,0,1,0,1|2,0,0]=4
16  B12R2.2028  C[C@@H]1NC(=O)C2=C1C=CC=C2 D72990 [0,0,0,1,0,1|2,0,0]=4
17  B12R2.202  O=C1NCCC2=C1SC(Br)=C2 C77320 [0,1,0,1,0,0|1,1,0]=4
18  B12R2.202  O=C1OCCC2=C1SC(Br)=C2 W18182 [0,1,0,1,0,0|1,1,0]=4
19  B12R2.82  C[C@H]1CCC2=C(NN=C2)C1=O D79429 [0,1,0,1,0,0|2,0,0]=4
20  B12R1.32  CCOC(=O)CC1=NN=CC=C1 P11834 [0,0,0,0,0,2|2,0,0]=4
21  B12R1.32  CCOC(=O)NC1=NC=CC=C1 D96330 [0,0,0,0,0,2|2,0,0]=4