0  B9R1.12  CNCCc1c[nH]cn1 T23038 [0,0,0,0,0,0|4,0,0]=4
1  B8R1.8  NCCC1=CSC=N1 T29422 [1,0,0,0,0,0|3,0,0]=4
2  B8R1.8  NCCc1c[nH]cn1 T0965 [1,0,0,0,0,0|3,0,0]=4
3  B8R1.8  NCCc1c[nH]cn1 T6535 [1,0,0,0,0,0|3,0,0]=4
4  B8R1.8  NCCc1cc[nH]n1 T8599 [1,0,0,0,0,0|3,0,0]=4
5  B8R1.8  NCCc1cnc[nH]1 T6534 [1,0,0,0,0,0|3,0,0]=4
6  B10R1.11  CCCC(=O)c1cccs1 T20377 [0,1,0,0,0,0|1,1,1]=4
7  B10R1.21  CCCCCc1ccco1 TCS0324 [0,1,0,0,0,0|1,0,0]=2
8  B10R1.66  CC(=O)OCc1ccco1 T8088 [0,1,0,0,0,0|0,0,1]=2
9  B10R1.17  CCOCc1ccccc1 T36790 [0,0,0,0,0,1|1,0,0]=2
10  B10R1.17  CNCCc1ccccn1 T0246 [0,0,0,0,0,1|3,0,0]=4
11  B10R1.17  CNCCc1ccccn1 T0246L [0,0,0,0,0,1|3,0,0]=4
12  B10R1.17  CNCCc1ccccn1 T4195 [0,0,0,0,0,1|3,0,0]=4
13  B10R1.17  OCCCc1ccccc1 T3754 [0,0,0,0,0,1|3,0,0]=4
14  B7R1.1  COc1ccoc1 TN2959 [2,0,0,0,0,0|2,0,0]=4
15  B9R0.2  CCCCC/C=C/C(O)=O T5261 [0,1,1,0,0,0|1,0,1]=4
16  B9R1.11  COC(=O)c1ccco1 T8022 [1,1,0,0,0,0|0,0,1]=3
17  B9R1.13  C[C@@H](N)Cc1c[nH]cn1 T24698 [1,1,0,0,0,0|2,0,0]=4
18  B9R1.13  C[C@@H](N)Cc1cnc[nH]1 T12630 [1,1,0,0,0,0|2,0,0]=4
19  B11R1.1  CCOCc1ccc(O)cc1 TN3029 [0,1,0,0,0,1|1,0,0]=3
20  B11R1.16  CCOC(=O)c1ccccc1 TN4020 [0,1,0,0,0,1|1,0,1]=4
21  B11R1.28  OCCCCc1ccccc1 T20370 [0,1,0,0,0,1|2,0,0]=4
22  B11R1.28  OCCOCc1ccccc1 T14013 [0,1,0,0,0,1|1,0,0]=3
23  B11R1.28  OCCSCc1ccncc1 T34331 [0,1,0,0,0,1|1,1,0]=4
24  B11R1.91  CC(=O)OCc1ccccc1 T5615 [0,1,0,0,0,1|1,0,1]=4
25  B11R1.4  CCOCCCc1cnc[nH]1 T31884 [0,2,0,0,0,0|2,0,0]=4
26  B9R1.2  CCc1cccc(O)c1 T21170 [0,0,1,1,0,0|1,0,1]=4