0  B14R2.8235  CC1CC(=O)C2=CC(F)=CC=C2O1 008563 [0,0,0,0,0,0|2,0,2]=4
1  B13R2.3683  O=C1CCC2=C(C=CC(Br)=C2)N1 040729 [1,0,0,0,0,0|2,0,1]=4
2  B13R2.3683  O=C1CCC2=CC(O)=CC=C2N1 011766 [1,0,0,0,0,0|2,0,1]=4
3  B13R1.446  CCOC(=O)C1=CC(C)=CC=C1N 209804 [0,0,1,0,0,0|1,0,2]=4
4  B12R1.32  CN(CCO)CC1=CC=CC=C1 214692 [1,0,1,0,0,0|2,0,0]=4
5  B12R1.75  CC(C)OC1=C(CN)C=CC=C1 023444 [1,0,1,0,0,0|2,0,0]=4
6  B12R1.233  CC(=O)NC1=CC=C(C)C=C1C 099517 [1,0,1,0,0,0|1,0,1]=4
7  B12R1.233  CC1=CC(Br)=CC=C1OC(C)C 038827 [1,0,1,0,0,0|2,0,0]=4
8  B12R1.233  CC1=CC(N)=C(OC(C)C)C=C1 036189 [1,0,1,0,0,0|2,0,0]=4
9  B12R1.233  CC1=CC(N)=C(OC(C)C)C=C1 105078 [1,0,1,0,0,0|2,0,0]=4
10  B12R2.24  BrC1=CC=C2NCCOC2=C1 079243 [2,0,0,0,0,0|2,0,0]=4
11  B12R2.24  CC1=CC=C2NCCCC2=C1 431465 [2,0,0,0,0,0|0,0,0]=2
12  B12R2.24  O=C1CCC2=C(C=CC=C2)N1 047953 [2,0,0,0,0,0|1,0,1]=4
13  B12R2.24  OC1=CC=C2CCCCC2=C1 078989 [2,0,0,0,0,0|2,0,0]=4
14  B12R2.1081  NC1CCCC2=C1C=CC=C2 219818 [2,0,0,0,0,0|2,0,0]=4
15  B12R2.1081  NC1CCCC2=CC=CC=C21 048220 [2,0,0,0,0,0|2,0,0]=4
16  B12R2.1081  N[C@H]1CCCC2=C1C=CC=C2 048221 [2,0,0,0,0,0|2,0,0]=4
17  B12R2.1081  OC1CCCC2=C1N=CC=C2 040155 [2,0,0,0,0,0|2,0,0]=4
18  B12R2.1081  OC1CCCC2=CC=CC=C21 069137 [2,0,0,0,0,0|1,0,0]=3
19  B12R2.1081  OC1CCOC2=CC=CC=C21 104541 [2,0,0,0,0,0|1,0,0]=3
20  B12R2.1081  O[C@@H]1CCCC2=C1C=CC=C2 219879 [2,0,0,0,0,0|1,0,0]=3
21  B12R2.1081  O[C@H]1CCCC2=C1C=CC=C2 219880 [2,0,0,0,0,0|1,0,0]=3
22  B14R2.2332  COC1=CC=C2NC(=O)CCC2=C1 040329 [1,1,0,0,0,0|1,0,1]=4
23  B12R1.16  N[C@@H](CCO)C1=CC=C(Cl)C=C1 040399 [0,0,1,0,1,0|2,0,0]=4
24  B12R1.16  N[C@H](CCO)C1=CC=C(Cl)C=C1 034404 [0,0,1,0,1,0|2,0,0]=4
25  B12R1.57  COC1=C(C(C)C)C=CC(C)=C1 103225 [0,0,1,0,1,0|2,0,0]=4
26  B12R2.18  OC1C2=CC=CC=C2CC1Br 003061 [1,0,0,0,1,0|2,0,0]=4
27  B12R2.606  CC1=CC=C2NC(C)=CC2=C1 023432 [1,0,0,0,1,0|0,0,2]=4