0  B9R1.41  Cc1ccsc1C(=O)O 60P [1,0,0,0,0,0|3,0,0]=4
1  B9R0.2  C\C=C\C=C\C=C\C(=O)O OTT [0,0,1,0,0,0|2,0,1]=4
2  B11R1.53  COc1ccccc1C(=O)O 71F [0,0,0,0,0,1|3,0,0]=4
3  B11R1.266  COc1cccc(c1)C(=O)N 3MB [0,0,0,0,0,1|3,0,0]=4
4  B11R1.266  c1cc(cc(c1)C(=O)O)CN 3AZ [0,0,0,0,0,1|3,0,0]=4
5  B8R1.11  Cn1cccc1CN 278 [2,0,0,0,0,0|1,0,1]=4
6  B8R1.11  Cn1cncc1C=O 280 [2,0,0,0,0,0|1,0,0]=3
7  B8R1.7  c1cc([nH]c1)C(=O)[O-] PYC [2,0,0,0,0,0|1,0,0]=3
8  B8R1.7  c1cc(oc1)C(=O)O FOA [2,0,0,0,0,0|2,0,0]=4
9  B8R1.7  c1cc(sc1)C(=O)O C21 [2,0,0,0,0,0|2,0,0]=4
10  B10R0.97  CC(C)C/C=C/C=C\C(=O)O FA7 [0,1,1,0,0,0|2,0,0]=4
11  B10R1.59  Cn1cc(cc1C(=O)O)N PYB [1,1,0,0,0,0|1,0,0]=3
12  B10R1.59  Cn1cc(nc1C(=O)O)N IMT [1,1,0,0,0,0|2,0,0]=4
13  B12R1.56  CC(=O)c1ccc(c(c1)OC)O I75 [0,1,0,0,0,1|2,0,0]=4
14  B12R1.386  CCCCn1c(ccn1)C(=O)O XXB [0,2,0,0,0,0|2,0,0]=4
15  B12R2.1081  c1ccc2c(c1)CCNC2=O JOZ [0,0,0,1,0,1|2,0,0]=4
16  B12R1.438  CC(=O)Nc1cccc(c1)CN 463 [0,0,0,0,0,2|2,0,0]=4