0  B11R1.172  O=C(O)CCCC1=CC=CS1 MC443875 [0,0,0,0,0,0|2,1,0]=3
1  B12R2.114  O=C1CCCC2=C(C=CS2)N1 MC121300 [0,0,0,1,0,0|2,1,0]=4
2  B10R1.66  O=C(O)CCC1=CC=CN1 CS21786 [0,0,0,0,1,0|2,0,0]=3
3  B10R1.66  O=C(O)CCC1=CC=CO1 MC41688 [0,0,0,0,1,0|1,0,0]=2
4  B10R1.66  O=C(O)CCC1=CNC=C1 MC430255 [0,0,0,0,1,0|3,0,0]=4
5  B10R1.66  O=C(O)CCC1=CNC=N1 MC436928 [0,0,0,0,1,0|3,0,0]=4
6  B10R1.66  O=C(O)\C=C\C1=CC=CO1 MC41690 [0,0,0,0,1,0|1,0,2]=4
7  B12R1.252  CC(=O)OCCC1=CC=CC=C1 MC40009 [0,0,0,0,0,1|3,0,0]=4
8  B12R1.252  O=C(O)CCCC1=NC=CC=C1 CS12802 [0,0,0,0,0,1|3,0,0]=4
9  B12R1.252  O=C(O)CNCC1=CC=CC=C1 CS21182 [0,0,0,0,0,1|3,0,0]=4
10  B12R1.252  O=C(O)CNCC1=NC=CC=C1 MC105962 [0,0,0,0,0,1|3,0,0]=4
11  B12R1.252  O=C(O)COCC1=CC=CC=C1 CS14115 [0,0,0,0,0,1|2,1,0]=4
12  B9R1.12  CCOCC1=CC=CO1 CS17009 [2,0,0,0,0,0|0,1,0]=3
13  B9R1.12  O=C\C=C\C1=CC=CO1 CS21800 [2,0,0,0,0,0|0,0,2]=4
14  B9R1.12  O=C\C=C\C1=CC=CO1 CS21801 [2,0,0,0,0,0|0,0,2]=4
15  B11R1.35  NC(CC1=CC=CO1)C(=O)O CS13507 [0,1,0,0,1,0|1,0,0]=3
16  B11R1.35  NC(CC1=CC=CS1)C(=O)O CS20416 [0,1,0,0,1,0|1,1,0]=4
17  B11R1.35  NC(Cc1cccs1)C(=O)O MC438193 [0,1,0,0,1,0|1,1,0]=4
18  B11R1.35  NC(Cc1cccs1)C(=O)O MC438194 [0,1,0,0,1,0|1,1,0]=4
19  B11R2.106  O=C1COCC2=C1C=CN2 MC104839 [1,0,0,1,0,0|1,1,0]=4
20  B11R2.36  O=C1CCC2=C(C1)SC=N2 MC103261 [0,0,0,1,1,0|2,0,0]=4
21  B11R2.36  O=C1CCC2=C(C=NN2)C1 MC116171 [0,0,0,1,1,0|2,0,0]=4
22  B13R2.10  O=C1CCC(C2=CC=NC=C2)C1 MC106176 [0,0,0,1,0,1|2,0,0]=4
23  B13R2.10  O=C1CCC(C2=NC=CC=C2)C1 MC106175 [0,0,0,1,0,1|2,0,0]=4
24  B9R1.13  CC(N)CC1=CC=CO1 MC431346 [0,0,0,0,2,0|1,0,1]=4
25  B9R1.13  O=C(O)CC1=CC=CS1 CS23025 [0,0,0,0,2,0|1,1,0]=4
26  B11R1.28  O=CCOCC1=CC=CC=C1 MC429084 [1,0,0,0,0,1|1,1,0]=4
27  B13R1.337  O=C(O)CCSCC1=CC=CC=C1 MC439151 [0,0,0,0,0,2|2,0,0]=4