0  B13R1.42  CCOC(=O)\C=C\c1ccccc1 M29141 [0,0,0,0,0,0|2,0,1]=3
1  B13R1.42  O=C(CCCl)NCC1=CC=CC=C1 M14688 [0,0,0,0,0,0|2,0,0]=2
2  B12R1.27  COC(=O)CCc1ccccc1 M28729 [1,0,0,0,0,0|2,0,0]=3
3  B12R1.27  COC(=O)\C=C\c1ccccc1 M20228 [1,0,0,0,0,0|2,0,1]=4
4  B14R1.32  CCNC(=O)\C=C\C1=CC=CC(Br)=C1 M15146 [0,1,0,0,0,0|2,0,1]=4
5  B14R1.156  O=C(NCC1=CC=CC=C1)OCCO M22234 [0,1,0,0,0,0|2,0,0]=3
6  B14R1.502  CCOC(=O)\C=C\c1ccc(O)cc1 M24744 [0,1,0,0,0,0|2,0,1]=4
7  B12R1.32  CCOC(=O)Cc1ccccc1 M27076 [0,0,0,0,1,0|1,0,0]=2
8  B14R1.520  CCOC(C)OCCC1=CC=CC=C1 M17723 [0,0,0,0,0,1|2,0,1]=4
9  B14R1.520  O=C(CCCl)NCCc1ccccc1 M22247 [0,0,0,0,0,1|2,0,0]=3
10  B11R1.91  CC(=O)CCC1=CC=CC=C1 M18315 [2,0,0,0,0,0|1,0,0]=3
11  B11R1.91  CC(=O)COc1ccccc1 M27826 [2,0,0,0,0,0|2,0,0]=4
12  B11R1.91  CC(=O)NCc1ccccc1 M22662 [2,0,0,0,0,0|1,0,0]=3
13  B11R1.91  CC(=O)OCc1ccccc1 M20248 [2,0,0,0,0,0|0,0,0]=2
14  B11R1.91  CC(=O)O[Hg]C1=CC=CC=C1 M19512 [2,0,0,0,0,0|1,0,0]=3
15  B11R1.91  CC(=O)\C=C\C1=CC=CC=C1 M18165 [2,0,0,0,0,0|1,0,1]=4
16  B11R1.91  NC(=O)NCc1ccccc1 M27376 [2,0,0,0,0,0|2,0,0]=4
17  B11R1.91  O=C(O)CCc1ccccc1 M18665 [2,0,0,0,0,0|2,0,0]=4
18  B13R1.19  CCOC(=O)CC1=CC=C(O)C=C1 M23773 [0,1,0,0,1,0|1,0,0]=3
19  B13R1.47  CCOC(=O)C(=O)c1ccccc1 M27256 [0,1,0,0,1,0|1,0,1]=4
20  B13R1.47  CCOC(=O)C(O)c1ccccc1 M27247 [0,1,0,0,1,0|1,0,0]=3
21  B15R1.3960  C=C(CC1=C(Cl)C=CC=C1)C(=O)OCC M16293 [0,2,0,0,0,0|2,0,0]=4
22  B15R1.5919  O=C(O)CNC(=O)OCc1ccccc1 M28002 [0,2,0,0,0,0|1,0,1]=4
23  B15R3.4266  C1=CC=C2N=C3CCCN3CC2=C1 M24453 [0,0,0,2,0,0|2,0,0]=4
24  B11R1.16  CCCC(=O)C1=CC=CC=C1 M24452 [0,0,0,0,2,0|0,0,0]=2
25  B11R1.16  O=C(CCCl)C1=CC=CC=C1 M16706 [0,0,0,0,2,0|1,0,0]=3