0  B9R1.35  CC(=O)C1=CSC(N)=N1 ALBB-023268 [0,0,0,0,0,0|3,0,0]=3
1  B9R1.35  NC(=O)C1=CC(Br)=CS1 ALBB-012020 [0,0,0,0,0,0|3,1,0]=4
2  B9R1.35  NC(=O)C1=NC(Cl)=NN1 ALBB-014174 [0,0,0,0,0,0|4,0,0]=4
3  B9R1.35  NC1=NC=C(C(=O)O)S1 ALBB-022659 [0,0,0,0,0,0|3,0,0]=3
4  B9R1.35  NC1=NN=C(C(=O)O)O1 ALBB-018080 [0,0,0,0,0,0|4,0,0]=4
5  B9R1.35  O=C(Cl)C1=CC=C(Br)S1 ALBB-011189 [0,0,0,0,0,0|3,1,0]=4
6  B8R1.7  NC(=O)C1=CC=CS1 ALBB-019885 [1,0,0,0,0,0|3,0,0]=4
7  B10R1.14  COC(=O)C1=CC(N)=CS1 ALBB-028479 [0,1,0,0,0,0|3,0,0]=4
8  B10R1.59  CC1=C(C(=O)O)SC(=O)N1 ALBB-027618 [0,1,0,0,0,0|3,0,0]=4
9  B10R1.194  NC1=C(Cl)C(C(=O)O)=NN1 ALBB-013988 [0,1,0,0,0,0|3,0,0]=4
10  B10R1.54  NC1=NC(CC(=O)O)=CS1 ALBB-021297 [0,0,0,0,0,1|2,0,0]=3
11  B7R1.1  O=CC1=CSC=N1 ALBB-004689 [2,0,0,0,0,0|1,0,0]=3
12  B9R1.11  NNC(=O)C1=CSC=C1 ALBB-020982 [1,1,0,0,0,0|1,0,0]=3
13  B11R1.3  NC(=O)C1=CC=C(CCl)C=C1 ALBB-012285 [0,1,0,0,0,1|2,0,0]=4
14  B11R1.166  CC1=NC(O)=CC=C1C(=O)O ALBB-032771 [0,1,0,0,0,1|2,0,0]=4
15  B11R1.166  NC1=C(C(=O)O)C=NC(S)=N1 ALBB-017399 [0,1,0,0,0,1|2,0,0]=4
16  B11R1.166  OC(=O)C1=C(O)N=C(C)C=C1 ALBB-021331 [0,1,0,0,0,1|2,0,0]=4
17  B11R1.74  N=C1NC(=O)C=C(C(=O)O)S1 ALBB-020298 [0,1,0,0,0,1|2,0,0]=4
18  B11R1.74  NC1=CC(N)=CC(C(=O)O)=C1 ALBB-020012 [0,1,0,0,0,1|2,0,0]=4
19  B11R1.159  NC1=NC=CC(C(=O)O)=C1N ALBB-033769 [0,1,0,0,0,1|2,0,0]=4
20  B9R1.13  O=C(O)CC1=CC=CN1 ALBB-026954 [1,0,0,0,0,1|2,0,0]=4