0  B13R1.718  NNC(=S)NCCC1=CC=CC=C1 7767-1-30 [0,0,0,0,0,0|0,0,2]=2
1  B12R1.252  NC(=S)NCCC1=CC=CC=C1 7767-1-31 [1,0,0,0,0,0|0,0,1]=2
2  B12R1.252  O=C(O)CCCC1=CC=CC=C1 2621-1-X9 [1,0,0,0,0,0|2,1,0]=4
3  B14R1.13  CC1=CC=C(CCNC(=S)NN)C=C1 7767-1-23 [0,1,0,0,0,0|0,0,2]=3
4  B14R2.19  O=C1N[C@@H](CC2=CC=CC=C2)CO1 4H17-1-Y7 [0,0,0,1,0,0|2,1,0]=4
5  B14R2.19  O=C1N[C@H](CC2=CC=CC=C2)CO1 4H17-1-Y8 [0,0,0,1,0,0|2,1,0]=4
6  B14R2.19  S=C1N[C@@H](CC2=CC=CC=C2)CS1 7H67-1-S3 [0,0,0,1,0,0|2,0,1]=4
7  B12R1.27  CNC(=S)NCC1=CC=CC=C1 7767-1-03 [0,0,0,0,1,0|1,0,2]=4
8  B12R1.27  COC(=O)CCC1=CC=CC=C1 2723-1-38 [0,0,0,0,1,0|2,1,0]=4
9  B12R1.27  NCC(=O)OCC1=CC=CC=C1 4657-5-0Q [0,0,0,0,1,0|2,1,0]=4
10  B12R1.27  NNC(=O)OCC1=CC=CC=C1 4648-1-Y5 [0,0,0,0,1,0|1,1,1]=4
11  B12R1.27  NNC(=S)NCC1=CC=CC=C1 7767-1-01 [0,0,0,0,1,0|0,0,2]=3
12  B12R1.27  NNC(=S)NCC1=CC=CN=C1 7H67-1-05 [0,0,0,0,1,0|1,0,2]=4
13  B12R1.27  O=C(CCl)NCC1=CC=CC=C1 4748-5-X3 [0,0,0,0,1,0|2,1,0]=4
14  B13R1.14  NNC(=S)NCC1=CC=C(Cl)C=C1 7767-5-01 [0,1,0,0,1,0|0,0,2]=4
15  B13R2.3  C1=CC=C(C2CNCCN2)C=C1 3H31-1-T6 [1,0,0,1,0,0|1,0,1]=4
16  B13R2.10  O=C1CC(C2=CC=CC=C2)CN1 4H48-1-FA [1,0,0,1,0,0|1,1,0]=4
17  B13R2.10  O=C1N[C@@H](C2=CC=CC=C2)CO1 4H56-1-S6 [1,0,0,1,0,0|1,1,0]=4
18  B13R2.10  O=C1N[C@H](C2=CC=CC=C2)CO1 G311-A-06 [1,0,0,1,0,0|1,1,0]=4
19  B13R2.72  CC(=O)N1CCC2=CC=CC=C21 4H17-1-0U [1,0,0,1,0,0|1,1,0]=4
20  B11R1.91  CC(N)CCC1=CC=CC=C1 3630-1-X9 [1,0,0,0,1,0|1,0,1]=4
21  B11R1.91  N=C(N)COC1=CC=CC=C1 4641-5-X3 [1,0,0,0,1,0|2,0,0]=4
22  B11R1.91  N=C(N)CSC1=CC=CC=C1 7666-5-X5 [1,0,0,0,1,0|2,0,0]=4
23  B11R1.91  NC(=O)COC1=CC=CC=C1 4648-1-17 [1,0,0,0,1,0|1,1,0]=4
24  B11R1.91  NC(=O)OCC1=CC=CC=C1 4756-1-47 [1,0,0,0,1,0|1,1,0]=4
25  B11R1.91  NC(=S)NCC1=CC=CC=C1 7767-1-06 [1,0,0,0,1,0|0,0,1]=3
26  B11R1.91  O=C(Cl)CCC1=CC=CC=C1 2616-5-13 [1,0,0,0,1,0|1,1,0]=4
27  B11R1.91  O=C(O)CCC1=CC=CC=C1 2721-1-01 [1,0,0,0,1,0|1,1,0]=4
28  B11R1.40  NNC(=O)CC1=CC=CC=C1 4648-1-76 [0,0,0,0,2,0|0,1,1]=4