0  B9R1.6  C1CNCC(=C1)C(=O)O 0234 [0,0,0,0,0,0|1,0,3]=4
1  B9R1.6  C1CNCC=C1C(=O)O 0235 [0,0,0,0,0,0|1,0,3]=4
2  B9R1.6  c1cc(cnc1)C(=O)N 4106 [0,0,0,0,0,0|2,0,0]=2
3  B10R1.61  c1cc(c(nc1)C(=O)O)O 3591 [0,1,0,0,0,0|1,0,0]=2
4  B10R1.113  c1cc(cc(c1)N)C(=O)N 0788 [0,1,0,0,0,0|1,0,0]=2
5  B10R1.18  C[C@@H](Cc1ccccc1)N 2813 [0,0,0,0,0,1|2,0,1]=4
6  B7R1.3  c1cnccc1N 0940 [2,0,0,0,0,0|2,0,0]=4
7  B11R1.20  CC(=O)Nc1ccc(cc1)O 1706 [0,1,0,0,0,1|1,0,0]=3
8  B11R1.20  c1cc(ccc1NC(=N)N)Cl 0442 [0,1,0,0,0,1|2,0,0]=4
9  B11R1.509  c1ccc(cc1)CS(=O)(=O)F 4486 [0,1,0,0,0,1|1,0,1]=4
10  B11R1.21  Cc1cnc(c[n+]1[O-])C(=O)O 2784 [0,2,0,0,0,0|2,0,0]=4
11  B11R1.22  c1cc(ccc1C(CN)O)O 2242 [0,2,0,0,0,0|1,0,1]=4
12  B11R1.74  c1c(cc(cc1O)O)C(=O)O 4599 [0,2,0,0,0,0|0,0,0]=2