0  B10R1.17  [C-]#[N+]CCc1ccncc1 ISN-0736 [1,0,0,0,0,0|3,0,0]=4
1  B12R1.21  Cc1ccc(cc1)\C=C\C(=O)O MIX-0409 [0,1,0,0,0,0|0,0,2]=3
2  B12R1.21  c1cc(ccc1\C=C\C(=O)O)F MIX-0405 [0,1,0,0,0,0|0,0,2]=3
3  B12R1.125  Cc1ccccc1\C=C\C(=O)O MIX-0402 [0,1,0,0,0,0|0,0,2]=3
4  B12R1.125  c1ccc(c(c1)\C=C\C(=O)O)F MIX-0419 [0,1,0,0,0,0|0,0,2]=3
5  B12R1.226  Cc1cccc(c1)\C=C\C(=O)O MIX-0421 [0,1,0,0,0,0|0,0,2]=3
6  B12R1.226  c1cc(cc(c1)I)\C=C\C(=O)O MIX-0829 [0,1,0,0,0,0|0,0,2]=3
7  B10R1.66  c1cc(sc1)\C=C\C(=O)O MIX-0404 [0,0,0,0,1,0|1,0,2]=4
8  B10R1.66  c1cnn(c1)CCC(=O)O MIX-0245 [0,0,0,0,1,0|2,0,0]=3
9  B9R1.8  [C-]#[N+]Cc1ccccc1 ISN-0155 [2,0,0,0,0,0|1,0,1]=4
10  B11R1.75  Cc1ccn(n1)CCC(=O)O MIX-0912 [0,1,0,0,1,0|2,0,0]=4
11  B11R1.75  Cn1cc(cn1)CCC(=O)O MIX-0910 [0,1,0,0,1,0|2,0,0]=4
12  B11R1.75  c1c(cn(n1)CCC(=O)O)Br MIX-1004 [0,1,0,0,1,0|2,0,0]=4
13  B11R1.75  c1c(cn(n1)CCC(=O)O)Cl MIX-1096 [0,1,0,0,1,0|2,0,0]=4
14  B11R1.77  c1cc(oc1)C(CC(=O)O)N BAA-0099 [0,1,0,0,1,0|1,0,0]=3
15  B11R1.77  c1cc(sc1)C(CC(=O)O)N BAA-0088 [0,1,0,0,1,0|1,0,0]=3
16  B11R1.90  Cc1ccnn1CCC(=O)O MIX-0911 [0,1,0,0,1,0|2,0,0]=4
17  B13R1.3  CCc1ccc(cc1)\C=C\C(=O)O MIX-0410 [0,2,0,0,0,0|0,0,2]=4
18  B13R1.3  c1cc(ccc1C=O)OCC(=O)O MIX-0396 [0,2,0,0,0,0|1,0,0]=3
19  B13R1.132  c1cc(ccc1C(CC(=O)O)N)F BAA-0005 [0,2,0,0,0,0|0,0,0]=2
20  B13R1.164  Cc1ccc(c(c1)Br)\C=C\C(=O)O MIX-0418 [0,2,0,0,0,0|0,0,2]=4
21  B13R1.164  c1cc(c(cc1F)F)\C=C\C(=O)O MIX-0406 [0,2,0,0,0,0|0,0,2]=4
22  B13R1.147  c1cc(cc(c1)Br)C(CC(=O)O)N BAA-0006 [0,2,0,0,0,0|0,0,0]=2
23  B13R1.147  c1cc(cc(c1)F)C(CC(=O)O)N BAA-0054 [0,2,0,0,0,0|0,0,0]=2
24  B13R1.147  c1cc(cc(c1)I)C(CC(=O)O)N BAA-0039 [0,2,0,0,0,0|0,0,0]=2
25  B13R1.201  c1ccc(c(c1)C(CC(=O)O)N)Br BAA-0004 [0,2,0,0,0,0|0,0,0]=2
26  B13R1.90  CCc1ccccc1\C=C\C(=O)O MIX-0417 [0,2,0,0,0,0|0,0,2]=4
27  B13R1.150  Cc1cccc(c1C)\C=C\C(=O)O MIX-0420 [0,2,0,0,0,0|0,0,2]=4
28  B13R1.893  c1cc(c(cc1Br)\C=C\C(=O)O)F MIX-0401 [0,2,0,0,0,0|0,0,2]=4
29  B11R1.57  c1cc(n(c1)CC(=O)O)C=O PYA-1006 [0,0,1,1,0,0|2,0,0]=4
30  B13R2.72  c1ccc2c(c1)c(n[nH]2)C(=O)O IZA-0002 [0,0,0,1,0,1|1,0,1]=4
31  B9R1.6  B(c1ccccc1)(O)O MIX-0059 [0,0,0,0,2,0|1,0,1]=4
32  B9R1.13  c1ccn(c1)CC(=O)O PYR-1006 [0,0,0,0,2,0|1,0,0]=3
33  B9R1.13  c1cn(cn1)CC(=O)O MIX-0732 [0,0,0,0,2,0|2,0,0]=4
34  B9R1.13  c1cnn(c1)CC(=O)O MIX-0956 [0,0,0,0,2,0|2,0,0]=4