0  B12R1.21  O=C(O)\C=C\C1=CC=C(O)C=C1 YMDB00498 [0,0,0,0,0,0|2,0,2]=4
1  B11R1.91  O=C(O)\C=C\C1=CC=CC=C1 YMDB01324 [1,0,0,0,0,0|1,0,2]=4
2  B13R1.133  N[C@@H](CC1=CC=C(O)C=C1)C(=O)O YMDB00364 [0,1,0,0,0,0|2,0,0]=3
3  B13R1.133  N[C@H](CC1=CC=C(O)C=C1)C(=O)O YMDB00805 [0,1,0,0,0,0|2,0,0]=3
4  B13R1.133  O=C(O)C(=O)CC1=CC=C(O)C=C1 YMDB00958 [0,1,0,0,0,0|2,0,1]=4
5  B13R1.133  O=C(O)C(O)CC1=CC=C(O)C=C1 YMDB00457 [0,1,0,0,0,0|2,0,0]=3
6  B11R1.20  O=C(O)CC1=CC=C(O)C=C1 YMDB01486 [0,0,0,0,1,0|2,0,0]=3
7  B10R1.1  CCCC1=NC=C(C)N=C1 YMDB01504 [2,0,0,0,0,0|2,0,0]=4
8  B10R1.1  NCCC1=CC=C(O)C=C1 YMDB01797 [2,0,0,0,0,0|2,0,0]=4
9  B10R1.1  OCCC1=CC=C(O)C=C1 YMDB01798 [2,0,0,0,0,0|1,0,1]=4
10  B10R1.17  O=C\C=C\C1=CC=CC=C1 YMDB01654 [2,0,0,0,0,0|0,0,2]=4
11  B12R1.27  COC(=O)\C=C\C1=CC=CC=C1 YMDB01744 [1,1,0,0,0,0|0,0,2]=4
12  B12R1.43  N[C@@H](CC1=CC=CC=C1)C(=O)O YMDB00304 [1,1,0,0,0,0|1,0,0]=3
13  B12R1.43  N[C@H](CC1=CC=CC=C1)C(=O)O YMDB00995 [1,1,0,0,0,0|1,0,0]=3
14  B12R1.43  O=C(O)C(=O)CC1=CC=CC=C1 YMDB00786 [1,1,0,0,0,0|1,0,1]=4
15  B12R1.107  CC(=O)OC(C)C1=CC=CC=C1 YMDB01472 [1,1,0,0,0,0|1,0,0]=3
16  B12R1.107  CC(CC(=O)[O-])C1=CC=CC=C1 YMDB01773 [1,1,0,0,0,0|1,0,0]=3
17  B14R1.42  COC1=C(O)C=CC(CCC(C)=O)=C1 YMDB01809 [0,2,0,0,0,0|1,0,0]=3
18  B10R1.18  CC(=O)OC1=CC=CC=C1 YMDB00838 [1,0,0,0,1,0|1,0,0]=3
19  B10R1.18  O=C(O)CC1=CC=CC=C1 YMDB00891 [1,0,0,0,1,0|1,0,0]=3
20  B10R1.13  CC(=O)C1=CC=C(C)C=C1 YMDB01619 [0,0,0,0,2,0|0,0,0]=2
21  B10R1.13  NC1=CC=C(C(=O)O)C=C1 YMDB00493 [0,0,0,0,2,0|2,0,0]=4
22  B10R1.13  O=C(O)C1=CC=C(O)C=C1 YMDB00495 [0,0,0,0,2,0|2,0,0]=4
23  B12R1.252  CC(=O)OCCC1=CC=CC=C1 YMDB00574 [1,0,0,0,0,1|0,0,0]=2