0  B11R1.35  N[C@H](CC1=CC=CS1)C(=O)O CS-M2655 [0,1,0,0,0,0|2,1,0]=4
1  B11R1.35  [C@@H](N)(CC1=CC=CO1)C(=O)O CS-0043946 [0,1,0,0,0,0|2,0,0]=3
2  B9R1.13  CC(=O)NC1=NC=CS1 CS-0095600 [0,0,0,0,1,0|2,1,0]=4
3  B11R1.91  CC(=O)\C=C\C1=CC=CC=C1 CS-W013311 [0,0,0,0,0,1|2,0,1]=4
4  B11R1.91  N=C(O)OCC1=CC=CC=C1 CS-W004984 [0,0,0,0,0,1|2,0,1]=4
5  B8R1.8  CNCC1=CC=CS1 CS-W018825 [2,0,0,0,0,0|1,1,0]=4
6  B8R1.8  NCCC1=CC=CO1 CS-B1143 [2,0,0,0,0,0|1,0,1]=4
7  B12R1.27  NNC(=O)OCC1=CC=CC=C1 CS-W016057 [0,1,0,0,0,1|2,0,0]=4
8  B12R1.27  O=C(CBr)OCC1=CC=CC=C1 CS-W010391 [0,1,0,0,0,1|1,0,0]=3
9  B12R1.27  O=C(CO)OCC1=CC=CC=C1 CS-W007485 [0,1,0,0,0,1|1,0,0]=3
10  B12R1.15  COC(=O)CC(=O)C1=CC=CO1 CS-0044463 [0,2,0,0,0,0|1,0,1]=4
11  B12R2.24  O=C1CC2=CC=CC=C2CO1 CS-W016337 [0,0,0,1,0,1|1,0,0]=3
12  B12R2.2383  C1=COC(COCC2CO2)=C1 CS-W018044 [0,0,0,1,0,1|0,0,2]=4
13  B8R1.7  CC(=O)C1=CC=NN1 CS-0036771 [0,0,0,0,2,0|2,0,0]=4
14  B8R1.7  CC(=O)C1=CNC=C1 CS-W005542 [0,0,0,0,2,0|2,0,0]=4
15  B8R1.7  O=C(O)C1=CC=CS1 CS-W020070 [0,0,0,0,2,0|1,1,0]=4
16  B8R1.7  O=C([O-])C1=CC=CS1 CS-W000340 [0,0,0,0,2,0|1,1,0]=4
17  B10R1.17  CCOCC1=CC=CC=C1 CS-W018329 [1,0,0,0,0,1|1,0,1]=4