0  B12R2.252  c1coc2c1[nH]c(c2)C(=O)O 4P5 [0,0,0,0,0,0|0,1,0]=1
1  B12R2.252  c1csc2c1[nH]c(c2)C(=O)O 4WL [0,0,0,0,0,0|0,0,0]=0
2  B12R2.252  c1csc2c1cc([nH]2)C(=O)O 4ZA [0,0,0,0,0,0|2,0,0]=2
3  B12R2.252  c1csc2c1sc(c2)C(=O)O NUK [0,0,0,0,0,0|1,0,0]=1
4  B13R2.400  c1c2cc(sc2[nH]c1C(=O)O)Cl 5LA [0,1,0,0,0,0|2,0,0]=3
5  B11R1.35  c1cc(sc1)C[C@@H](C(=O)O)N TIH [0,0,1,0,0,0|0,0,2]=3
6  B13R2.430  c1cc(cc2c1cc[nH]2)C(=O)O 1F1 [0,0,0,0,0,1|2,0,0]=3
7  B13R2.430  c1cc2c(cc[nH]2)cc1C(=O)O 4ZV [0,0,0,0,0,1|2,0,0]=3
8  B13R2.435  c1ccc2c(c1)[nH]c(n2)C(=O)O TRM [0,0,0,0,0,1|2,0,0]=3
9  B13R2.435  c1ccc2c(c1)cc([nH]2)C(=O)O ICB [0,0,0,0,0,1|1,0,0]=2
10  B13R2.435  c1ccc2c(c1)cc(o2)C(=O)O BZ2 [0,0,0,0,0,1|2,0,0]=3
11  B10R1.66  c1c(nc[nH]1)C=CC(=O)O URO [1,0,1,0,0,0|2,0,0]=4
12  B12R1.104  c1cc(sc1C[C@@H](C(=O)O)N)Br 33W [0,1,1,0,0,0|0,0,2]=4
13  B14R2.450  CC1=C(Cc2c1cccc2)C(=O)O 38U [0,1,0,0,0,1|2,0,0]=4
14  B14R2.4529  Cc1ccc2c(c1)cc([nH]2)C(=O)O 4BY [0,1,0,0,0,1|1,0,0]=3
15  B14R2.4529  Cc1ccc2cc([nH]c2c1)C(=O)O 4BL [0,1,0,0,0,1|1,0,0]=3
16  B14R2.4529  c1cc(cc2c1cc([nH]2)C(=O)O)Br 4ZU [0,1,0,0,0,1|1,0,0]=3
17  B14R2.4529  c1cc2c(cc1Br)cc(o2)C(=O)O UNJ [0,1,0,0,0,1|2,0,0]=4
18  B14R2.4529  c1cc2c(cc1Cl)cc([nH]2)C(=O)O 3ZB [0,1,0,0,0,1|1,0,0]=3
19  B14R2.4529  c1cc2c(cc1F)cc([nH]2)C(=O)O FIC [0,1,0,0,0,1|1,0,0]=3
20  B12R1.43  C\C(=C/c1ccccc1)\C(=O)O 4LV [0,0,1,0,0,1|2,0,0]=4
21  B12R1.43  c1ccc(cc1)/C=C(/C(=O)O)\N 23F [0,0,1,0,0,1|1,0,0]=3
22  B12R1.43  c1ccc(cc1)\C=C(\C(=O)O)/F 4LW [0,0,1,0,0,1|2,0,0]=4
23  B12R1.125  c1ccc(c(c1)/C=C/C(=O)O)O 2HC [0,0,1,0,0,1|2,0,0]=4
24  B12R2.44  c1c[nH]c2c1ncc(c2)C=O 1MJ [1,0,0,0,0,1|1,0,1]=4
25  B14R2.781  c1ccc2c(c1)cc(cn2)C(=O)O Q3C [0,0,0,0,0,2|1,0,1]=4
26  B14R2.781  c1ccc2c(c1)ccc(n2)C(=O)O QNC [0,0,0,0,0,2|1,0,1]=4
27  B14R2.781  c1ccc2c(c1)ccc(n2)C(=O)O QND [0,0,0,0,0,2|1,0,1]=4
28  B14R2.781  c1ccc2c(c1)ncc(n2)C(=O)O QUI [0,0,0,0,0,2|1,0,1]=4
29  B14R2.781  c1ccc2c(c1)ncc(n2)C(=O)O QX [0,0,0,0,0,2|1,0,1]=4
30  B14R2.781  c1ccc2cc(ccc2c1)C(=O)O FIV [0,0,0,0,0,2|2,0,0]=4
31  B14R2.781  c1ccc2cnc(cc2c1)C(=O)O 4K8 [0,0,0,0,0,2|1,0,1]=4
32  B14R2.768  c1ccc2c(c1)cc(s2)CC(=O)O 2FX [0,0,0,0,0,2|2,0,0]=4