0  B11R1.91  CC(=O)CCC1=CC=CC=C1 TCS1709 [1,0,0,0,0,0|0,0,0]=1
1  B11R1.91  CC(=O)\C=C\c1ccccc1 TCS1554 [1,0,0,0,0,0|0,0,2]=3
2  B11R1.91  NC(=O)\C=C\C1=CC=CC=C1 BBP01257 [1,0,0,0,0,0|1,0,2]=4
3  B11R1.91  O=C(O)CCC1=CC=CC=C1 BBP02940 [1,0,0,0,0,0|0,0,0]=1
4  B11R1.91  O=C(O)\C=C\C1=CC=CC=C1 BBP00136 [1,0,0,0,0,0|0,0,2]=3
5  B11R1.91  O=C(O)\C=C\c1ccccc1 T2740 [1,0,0,0,0,0|0,0,2]=3
6  B13R1.14  COC(=O)\C=C\C1=CC=C(O)C=C1 BBP02877 [0,1,0,0,0,0|0,0,2]=3
7  B13R1.14  COC(=O)\C=C\c1ccc(O)cc1 T3733 [0,1,0,0,0,0|0,0,2]=3
8  B13R1.42  CCOC(=O)\C=C\C1=CC=CC=C1 BBP04531 [0,1,0,0,0,0|0,0,2]=3
9  B10R1.17  O=C\C=C\C1=CC=CC=C1 BBP01535 [2,0,0,0,0,0|0,0,2]=4
10  B10R1.17  O=C\C=C\c1ccccc1 T3S1553 [2,0,0,0,0,0|0,0,2]=4
11  B10R1.17  O=C\C=C\c1ccccc1 T4S1551 [2,0,0,0,0,0|0,0,2]=4
12  B12R1.21  CC(=O)CCC1=CC=C(O)C=C1 BBP04146 [1,1,0,0,0,0|0,0,0]=2
13  B12R1.21  CC(=O)CCc1ccc(O)cc1 T2S0633 [1,1,0,0,0,0|0,0,0]=2
14  B12R1.21  CN(C)CCc1ccc(O)cc1 T2890 [1,1,0,0,0,0|2,0,0]=4
15  B12R1.21  C[C@@H](O)CCC1=CC=C(O)C=C1 BBP03225 [1,1,0,0,0,0|0,0,2]=4
16  B12R1.21  C[C@H](O)CCC1=CC=C(O)C=C1 BBP01811 [1,1,0,0,0,0|0,0,2]=4
17  B12R1.21  O=C(O)CCc1ccc(O)cc1 T2862 [1,1,0,0,0,0|0,0,0]=2
18  B12R1.21  O=C(O)\C=C\C1=CC=C(O)C=C1 BBP00382 [1,1,0,0,0,0|0,0,2]=4
19  B12R1.21  O=C(O)\C=C\c1ccc(O)cc1 T2863 [1,1,0,0,0,0|0,0,2]=4
20  B12R1.21  O=C(O)\C=C\c1ccc(O)cc1 T7053 [1,1,0,0,0,0|0,0,2]=4
21  B12R1.43  N[C@@H](Cc1ccccc1)C(=O)O T3377 [1,1,0,0,0,0|0,0,0]=2
22  B12R1.43  N[C@H](Cc1ccccc1)C(=O)O T0689 [1,1,0,0,0,0|0,0,0]=2
23  B12R1.125  O=C(O)CCc1ccccc1O T4892 [1,1,0,0,0,0|0,0,0]=2
24  B12R1.49  COC(=O)CC1=CC=C(O)C=C1 BBP04425 [0,1,0,0,1,0|0,0,0]=2
25  B14R1.5  COC(=O)CCC1=CC=C(OC)C=C1 BBP02933 [0,2,0,0,0,0|0,0,0]=2
26  B14R1.134  COC(=O)C(O)CC1=CC=C(O)C=C1 BBP03339 [0,2,0,0,0,0|0,0,0]=2
27  B14R1.502  CCOC(=O)CCC1=CC=C(O)C=C1 BBP05110 [0,2,0,0,0,0|0,0,0]=2
28  B14R1.502  CCOC(=O)\C=C\C1=CC=C(O)C=C1 BBP01659 [0,2,0,0,0,0|0,0,2]=4
29  B14R1.727  COC(=O)CCC1=C(O)C=C(O)C=C1 BBP02112 [0,2,0,0,0,0|0,0,0]=2
30  B12R2.24  O=C1C=CC2=C(C=CC=C2)O1 BBP03981 [1,0,0,1,0,0|0,0,2]=4
31  B12R2.24  O=C1CCc2ccccc2O1 T2S0300 [1,0,0,1,0,0|0,0,0]=2
32  B12R2.24  O=c1ccc2ccccc2o1 T0775 [1,0,0,1,0,0|0,0,2]=4
33  B14R2.95  COC(=O)C1=CNC2=CC=CC=C21 BBP00701 [0,0,0,1,0,1|0,0,2]=4
34  B14R2.4514  CN1C(=O)CC[C@H]1c2cccnc2 T1202 [0,0,0,1,0,1|2,0,0]=4
35  B10R1.18  CC(=O)Oc1ccccc1 T0650 [1,0,0,0,1,0|1,0,0]=3
36  B10R1.18  O=C(O)Cc1ccccc1 T4935 [1,0,0,0,1,0|0,0,0]=2