0  B10R1.20  CCC1=C(CC)C=CC=C1 1495AL [0,0,0,0,0,0|3,0,0]=3
1  B10R1.20  COC1=NC=CN=C1CBr Z2522 [0,0,0,0,0,0|1,1,0]=2
2  B10R1.20  CSC1=CC=CC=C1C=O I066 [0,0,0,0,0,0|3,0,1]=4
3  B10R1.20  CSC1=CC=CC=C1CN Y9469 [0,0,0,0,0,0|3,0,0]=3
4  B10R1.20  N#CC1=C(CN)C=CC=N1 Y1964 [0,0,0,0,0,0|4,0,0]=4
5  B9R1.15  CC1=C(NN)C=CC=N1 8099AA [1,0,0,0,0,0|3,0,0]=4
6  B9R1.15  CCC1=C(C)C=CN=C1 R348 [1,0,0,0,0,0|3,0,0]=4
7  B9R1.15  CCC1=CC=CN=C1C X8230 [1,0,0,0,0,0|1,0,0]=2
8  B9R1.15  CNC1=NC=CC=C1I Y3706 [1,0,0,0,0,0|3,0,0]=4
9  B9R1.15  CSC1=CC=CN=C1Cl Z0760 [1,0,0,0,0,0|2,0,0]=3
10  B9R1.15  FC1=C(CBr)N=CC=C1 4239AA [1,0,0,0,0,0|3,0,0]=4
11  B11R1.41  COC1=C(CCN)C=CC=C1 Y1181 [0,1,0,0,0,0|2,1,0]=4
12  B11R1.53  COC1=C(C(C)Br)C=CC=C1 1291AB [0,1,0,0,0,0|2,1,0]=4
13  B11R1.53  COC1=CC=CC=C1[C@@H](C)N W7850 [0,1,0,0,0,0|2,1,0]=4
14  B11R1.53  COC1=CC=CC=C1[C@H](C)N W7851 [0,1,0,0,0,0|2,1,0]=4
15  B11R1.53  CSC1=NC=CC=C1C(=O)O Y9981 [0,1,0,0,0,0|2,0,1]=4
16  B11R1.265  COC1=C(Cl)C=CN=C1CCl 9849AL [0,1,0,0,0,0|2,1,0]=4
17  B11R2.20  C1=CC=C2SCCSC2=C1 6902AE [0,0,0,1,0,0|3,0,0]=4
18  B9R1.14  CCC1=NNC=C1C=O Y5289 [0,0,0,0,1,0|3,0,0]=4
19  B9R1.14  CSC1=C(C=O)C=CS1 Z0839 [0,0,0,0,1,0|2,0,1]=4
20  B8R1.2  BrCC1=CN=CC=C1 0834AC [2,0,0,0,0,0|2,0,0]=4
21  B8R1.2  BrCC1=NC=CC=C1 8088AB [2,0,0,0,0,0|2,0,0]=4
22  B8R1.2  BrCC1=NC=CN=C1 Y9584 [2,0,0,0,0,0|1,0,0]=3
23  B10R1.4  CCOC1=CC=CC=C1S I213 [1,1,0,0,0,0|2,0,0]=4
24  B10R1.25  COC1=NC=C(I)C=C1C Z0408 [1,1,0,0,0,0|1,1,0]=4
25  B10R1.25  CSC1=CC=C(Cl)N=C1Cl Z1280 [1,1,0,0,0,0|2,0,0]=4
26  B10R1.25  CSC1=CC=C(F)N=C1C Y3810 [1,1,0,0,0,0|1,0,0]=3
27  B10R1.61  CC(O)C1=C(N)C=CC=N1 9430AH [1,1,0,0,0,0|2,0,0]=4
28  B12R1.46  CSC1=NC=C(F)C=C1C(C)=O Y5004 [0,2,0,0,0,0|1,0,1]=4
29  B10R1.15  CSC(=N)C1=NC=CC=C1 4542AF [0,0,1,1,0,0|0,0,2]=4
30  B10R1.176  CSC1=NC=C(Br)C(C)=C1 Z0427 [0,0,1,1,0,0|1,0,1]=4
31  B10R2.7  C1=CN=C2CNCC2=N1 V8402 [1,0,0,1,0,0|1,0,0]=3
32  B12R2.24  NC1CCC2=C(C1)N=CC=C2 6045AA [0,1,0,1,0,0|2,0,0]=4
33  B12R2.2048  COC1=NC=CC=C1C2CC2 Z1430 [0,1,0,1,0,0|1,1,0]=4
34  B8R1.11  CC1=C(CN)SC=C1 0965AA [1,0,0,0,1,0|2,0,0]=4
35  B8R1.11  CCC1=NNC=C1Br Y5291 [1,0,0,0,1,0|2,0,0]=4