0  B14R1.520  CNCC(=O)NCCC1=CC=CC=C1 BBL011307 [0,0,0,0,0,0|3,0,0]=3
1  B14R1.520  N#CCC(=O)NCCC1=CC=CC=C1 BBL016277 [0,0,0,0,0,0|3,0,1]=4
2  B14R1.520  NCCC(=O)NCCC1=CC=CC=C1 BBL011171 [0,0,0,0,0,0|3,0,0]=3
3  B13R1.718  COC(=O)CCNC1=CC=CC=C1 BBL009803 [1,0,0,0,0,0|1,0,0]=2
4  B13R1.718  NCC(=O)NCCC1=CC=CC=C1 BBL012982 [1,0,0,0,0,0|2,0,0]=3
5  B13R1.718  NNC(=O)CSCC1=CC=CC=C1 BBL017070 [1,0,0,0,0,0|3,0,0]=4
6  B13R1.718  O=C(CCl)NCCC1=CC=CC=C1 BBL009402 [1,0,0,0,0,0|2,0,0]=3
7  B15R1.89  CCOC(=O)NCC(=O)C1=CC=CC=C1 BBL001977 [0,1,0,0,0,0|1,0,1]=3
8  B15R1.826  CCOC(=O)C(=O)NCC1=CC=NC=C1 BBL034203 [0,1,0,0,0,0|2,0,1]=4
9  B15R2.73  NCCC(=O)N1CCC2=CC=CC=C21 BBL011226 [0,0,0,1,0,0|3,0,0]=4
10  B15R2.325  O=C1CC(CC2=CC=CC=C2)C(=O)O1 BBL000780 [0,0,0,1,0,0|1,0,1]=3
11  B15R2.1342  CCOC(=O)C1CC1C2=CC=CC=C2 BBL028661 [0,0,0,1,0,0|0,0,0]=1
12  B13R1.42  CCOC(=O)CCC1=CC=CC=C1 BBL035649 [0,0,0,0,1,0|0,0,0]=1
13  B13R1.42  CNCC(=O)NCC1=CC=CC=C1 BBL029662 [0,0,0,0,1,0|3,0,0]=4
14  B13R1.42  NCCC(=O)NCC1=CC=CC=C1 BBL011279 [0,0,0,0,1,0|3,0,0]=4
15  B12R1.8  CCCCNCC1=CC=CC=C1 BBL010686 [2,0,0,0,0,0|1,0,1]=4
16  B12R1.252  O=C(O)CCSC1=CC=CC=C1 BBL000175 [2,0,0,0,0,0|1,0,0]=3
17  B12R1.252  O=C(O)CSCC1=CC=CC=C1 BBL000319 [2,0,0,0,0,0|1,0,0]=3
18  B14R1.13  COC(=O)CCNC1=CC=C(F)C=C1 BBL032008 [1,1,0,0,0,0|1,0,0]=3
19  B14R1.13  O=C(CCl)NCCC1=CC=C(F)C=C1 BBL025752 [1,1,0,0,0,0|2,0,0]=4
20  B14R1.1025  COC(=O)CCNC1=CC=CC(Cl)=C1 BBL032007 [1,1,0,0,0,0|1,0,0]=3
21  B14R1.29  CCOC(=O)CC(=O)C1=CC=CC=C1 BBL027743 [0,1,0,0,1,0|0,0,1]=3
22  B14R1.32  CCOC(=O)COC1=CC=CC(Br)=C1 BBL025626 [0,1,0,0,1,0|1,0,0]=3
23  B16R1.912  CCOC(=O)C(=O)CC(=O)C1=CC=CC=C1 BBL029524 [0,2,0,0,0,0|0,0,2]=4
24  B14R2.68  NC1CCC(C2=CC=CC=C2)CC1 BBL017880 [1,0,0,1,0,0|1,0,1]=4
25  B14R2.95  NCC(=O)N1CCC2=CC=CC=C21 BBL011299 [1,0,0,1,0,0|2,0,0]=4
26  B14R2.958  NNC(=O)C1CC1C2=CC=CC=C2 BBL012079 [1,0,0,1,0,0|2,0,0]=4
27  B14R2.4514  CN1C(=O)CC[C@H]1C2=CN=CC=C2 BBL102262 [1,0,0,1,0,0|2,0,0]=4
28  B16R2.160202  CNCC(=O)N1CCCC2=CC=CC=C21 BBL031631 [0,0,0,1,0,1|2,0,0]=4
29  B16R2.160202  NCCC(=O)N1CCCC2=C1C=CC=C2 BBL011154 [0,0,0,1,0,1|2,0,0]=4
30  B16R2.723  CCOC(=O)C1CC1C2=CC=C(C)C=C2 BBL038616 [0,1,0,1,0,0|0,0,0]=2
31  B16R2.723  CCOC(=O)C1CC1C2=CC=C(Cl)C=C2 BBL039238 [0,1,0,1,0,0|0,0,0]=2
32  B16R2.2948  CC1=NNC(=O)C1CCC2=CC=CC=C2 BBL032122 [0,1,0,1,0,0|1,0,1]=4
33  B12R1.27  COC(=O)CNC1=CC=CC=C1 BBL034685 [1,0,0,0,1,0|1,0,0]=3
34  B12R1.27  NNC(=O)CCC1=CC=CC=C1 BBL015565 [1,0,0,0,1,0|2,0,0]=4
35  B12R1.27  O=C(CCl)OCC1=CC=CC=C1 BBL034736 [1,0,0,0,1,0|2,0,0]=4
36  B12R1.477  COC(=O)CNCC1=CC=CO1 BBL031847 [1,0,0,0,1,0|2,0,0]=4