0  B13R1.21  NC1=CC=C(C(O)C(N)CO)C=C1 ALBB-026439 [0,0,0,0,0,0|0,0,0]=0
1  B13R1.21  NC1=CC=C(C(O)C(O)CO)C=C1 ALBB-025656 [0,0,0,0,0,0|1,0,0]=1
2  B12R1.16  CNCC(O)C1=CC=C(O)C=C1 ALBB-025740 [1,0,0,0,0,0|3,0,0]=4
3  B11R1.1  CCCOC1=CC=C(N)C=C1 ALBB-025751 [2,0,0,0,0,0|2,0,0]=4
4  B11R1.1  CCCOC1=CC=C(N)C=C1 ALBB-025751 [2,0,0,0,0,0|2,0,0]=4
5  B11R1.16  CNCC(O)C1=CC=CC=C1 ALBB-031903 [2,0,0,0,0,0|2,0,0]=4
6  B11R1.16  OC(CCCl)C1=CC=CC=C1 ALBB-004119 [2,0,0,0,0,0|1,0,0]=3
7  B11R1.22  CCC(N)C1=CC=C(C)C=C1 ALBB-001475 [2,0,0,0,0,0|2,0,0]=4
8  B11R1.22  CCC(N)C1=CC=C(Cl)C=C1 ALBB-002128 [2,0,0,0,0,0|2,0,0]=4
9  B11R1.22  CCN(C)C1=CC=C(N)C=C1 ALBB-032294 [2,0,0,0,0,0|2,0,0]=4
10  B11R1.22  NCC(O)C1=CC=C(O)C=C1 ALBB-025791 [2,0,0,0,0,0|1,0,0]=3
11  B11R1.36  CC(C)C(N)C1=CC=CC=C1 ALBB-027100 [2,0,0,0,0,0|2,0,0]=4
12  B11R1.36  CC(C)C(N)C1=CC=CC=C1 ALBB-027100 [2,0,0,0,0,0|2,0,0]=4
13  B13R1.1  CCN(CCO)C1=CC=C(N)C=C1 ALBB-025878 [1,1,0,0,0,0|2,0,0]=4
14  B13R1.152  NC(C(=O)O)C(O)C1=CC=CC=C1 ALBB-006730 [1,1,0,0,0,0|0,0,1]=3
15  B15R1.1333  N[C@H](CO)[C@H](O)C1=CC=C([N+](=O)[O-])C=C1 ALBB-015887 [0,2,0,0,0,0|0,0,1]=3
16  B15R1.1333  N[C@H](CO)[C@H](O)C1=CC=C([N+](=O)[O-])C=C1 ALBB-015887 [0,2,0,0,0,0|0,0,1]=3
17  B15R1.1333  N[C@H](CO)[C@H](O)C1=CC=C([N+](=O)[O-])C=C1 ALBB-015887 [0,2,0,0,0,0|0,0,1]=3
18  B15R1.1333  O=[N+]([O-])C1=CC=C(C(O)C(O)CO)C=C1 ALBB-023707 [0,2,0,0,0,0|1,0,1]=4
19  B15R1.1358  CN(C)C(CO)C(O)C1=CC=C(N)C=C1 ALBB-026440 [0,2,0,0,0,0|0,0,0]=2
20  B13R1.14  OCC(O)COC1=CC=C(Cl)C=C1 ALBB-025796 [1,0,0,0,0,1|2,0,0]=4