0  B14R1.818  CC(=O)CC(=O)OCC1=CC=CC=C1 BBL027729 [0,0,0,0,0,0|0,0,0]=0
1  B13R1.42  CCOC(=O)CCC1=CC=CC=C1 BBL035649 [1,0,0,0,0,0|2,0,1]=4
2  B13R1.42  CNCC(=O)NCC1=CC=CC=C1 BBL029662 [1,0,0,0,0,0|2,0,0]=3
3  B13R1.42  CNCC(=O)NCC1=CC=CN=C1 BBL031825 [1,0,0,0,0,0|3,0,0]=4
4  B13R1.42  CNCC(=O)NCC1=NC=CC=C1 BBL031632 [1,0,0,0,0,0|3,0,0]=4
5  B13R1.42  NCCC(=O)NCC1=CC=CC=C1 BBL011279 [1,0,0,0,0,0|2,0,1]=4
6  B13R1.337  NC(=O)CCNCC1=CC=CC=C1 BBL023090 [1,0,0,0,0,0|2,0,1]=4
7  B13R1.337  O=C(O)CCSCC1=CC=CC=C1 BBL022628 [1,0,0,0,0,0|1,1,1]=4
8  B15R2.27  NC1=CC(=O)CC(C2=CC=CC=C2)C1 BBL011882 [0,0,0,1,0,0|2,0,1]=4
9  B15R2.27  O=C1C=C(Cl)CC(C2=CC=CC=C2)C1 BBL036946 [0,0,0,1,0,0|2,0,1]=4
10  B15R2.27  O=C1CC(=O)OC(C2=CC=CC=C2)O1 BBL028678 [0,0,0,1,0,0|1,0,0]=2
11  B15R2.325  O=C1CC(CC2=CC=CC=C2)C(=O)O1 BBL000780 [0,0,0,1,0,0|2,0,0]=3
12  B13R1.348  CN(CC(=O)O)CC1=CC=CC=C1 BBL008871 [0,0,0,0,1,0|3,0,0]=4
13  B15R1.5919  O=C(O)CCC(=O)NCC1=CC=CC=C1 BBL023580 [0,0,0,0,0,1|2,0,0]=3
14  B15R1.5919  O=C(O)CNC(=O)COC1=CC=CC=C1 BBL002332 [0,0,0,0,0,1|3,0,0]=4
15  B15R1.5919  O=C(O)\C=C/C(=O)NCC1=CC=CC=C1 BBL012859 [0,0,0,0,0,1|2,0,1]=4
16  B12R1.27  O=C(CCl)OCC1=CC=CC=C1 BBL034736 [2,0,0,0,0,0|1,0,0]=3
17  B14R1.598  CNCC(=O)NCC1=C(Cl)C=CC=C1 BBL011283 [1,1,0,0,0,0|2,0,0]=4
18  B14R1.549  C(=O)\C(=C/C1=CC=CC=C1)CC(=C)C BBL011004 [0,1,0,0,1,0|1,0,1]=4
19  B14R1.698  CC(=O)CC(=O)NC1=CC=C(Br)C=C1 BBL040552 [0,1,0,0,1,0|1,0,0]=3
20  B14R1.1485  O=C(O)CS(=O)(=O)CC1=CC=CC=C1 BBL000359 [0,1,0,0,1,0|2,0,0]=4
21  B14R1.5978  CC(=O)CC(=O)NC1=CC(C)=CC=C1 BBL040549 [0,1,0,0,1,0|1,0,0]=3
22  B16R1.1343  COC(=O)CNC(=O)\C=C\C1=CC=CC=C1 BBL034957 [0,1,0,0,0,1|1,0,1]=4
23  B16R1.6944  CN(CC(=O)O)C(=O)CCC1=CC=CC=C1 BBL019108 [0,1,0,0,0,1|2,0,0]=4
24  B14R2.249  O=C1CC(=O)CC(C2=CC=CO2)C1 BBL012460 [0,0,0,1,1,0|2,0,0]=4
25  B12R1.252  O=C(O)CSCC1=CC=CC=C1 BBL000319 [1,0,0,0,1,0|1,1,0]=4
26  B12R1.43  O=C(O)C(=O)NC1=CC=CC=C1 BBL005466 [0,0,0,0,2,0|2,0,0]=4
27  B14R1.520  CNCC(=O)NCCC1=CC=CC=C1 BBL011307 [1,0,0,0,0,1|2,0,0]=4
28  B16R1.608  O=C(O)CCCC(=O)NCC1=CC=CC=C1 BBL036015 [0,0,0,0,0,2|2,0,0]=4