0  B5R0.1  CS(=O)CCN ALBB-011537 [0,0,0,0,0,0|3,0,1]=4
1  B5R0.1  NC(=O)CCO ALBB-027682 [0,0,0,0,0,0|3,0,1]=4
2  B6R0.1  CCOC(=N)CC ALBB-022391 [0,1,0,0,0,0|1,0,2]=4
3  B6R0.1  CCOC(=N)CCl ALBB-022622 [0,1,0,0,0,0|1,0,2]=4
4  B6R0.1  COC(=O)CCO ALBB-013447 [0,1,0,0,0,0|2,0,1]=4
5  B6R0.2  NC(=O)CC(=O)O ALBB-009535 [0,1,0,0,0,0|3,0,0]=4
6  B6R0.4  CC(=O)NCC#N ALBB-022348 [0,1,0,0,0,0|1,0,2]=4
7  B6R0.4  COCCC(C)=O ALBB-027646 [0,1,0,0,0,0|1,0,2]=4
8  B6R1.2  O=C1NC=CN1 ALBB-023528 [0,0,0,1,0,0|2,0,0]=3
9  B6R1.2  OC1=NN=CO1 ALBB-027993 [0,0,0,1,0,0|2,0,1]=4
10  B5R0.3  CNC(=O)CBr ALBB-012802 [1,1,0,0,0,0|1,0,1]=4
11  B7R0.2  CNC(=O)CC(=O)O ALBB-009534 [0,2,0,0,0,0|2,0,0]=4
12  B7R0.5  CCOC(=O)N(C)N ALBB-022260 [0,2,0,0,0,0|0,0,2]=4
13  B7R1.1  BrCC1=NC=CS1 ALBB-031006 [0,1,0,1,0,0|1,1,0]=4
14  B7R1.1  ClCC1=NC=CS1 ALBB-015136 [0,1,0,1,0,0|1,1,0]=4
15  B7R1.1  ClCC1=NC=CS1 ALBB-015136 [0,1,0,1,0,0|1,1,0]=4
16  B7R1.1  NCC1=NC=CN1 ALBB-008641 [0,1,0,1,0,0|2,0,0]=4
17  B7R1.1  NCC1=NC=CN1 ALBB-008641 [0,1,0,1,0,0|2,0,0]=4
18  B7R1.1  OCC1=NC=NO1 ALBB-031523 [0,1,0,1,0,0|2,0,0]=4
19  B7R1.2  CC1=CC=C(N)S1 ALBB-009273 [0,1,0,1,0,0|1,1,0]=4
20  B7R1.2  CC1=NC(Br)=NO1 ALBB-016423 [0,1,0,1,0,0|2,0,0]=4
21  B7R1.2  CC1=NC(Cl)=NO1 ALBB-018604 [0,1,0,1,0,0|2,0,0]=4
22  B7R1.2  CC1=NC(N)=NO1 ALBB-014791 [0,1,0,1,0,0|2,0,0]=4
23  B7R1.2  CC1=NN=C(O)O1 ALBB-013469 [0,1,0,1,0,0|2,0,0]=4
24  B7R1.2  CC1=NOC(=O)N1 ALBB-032735 [0,1,0,1,0,0|1,0,1]=4
25  B7R1.2  CC1=NOC(Br)=N1 ALBB-030720 [0,1,0,1,0,0|2,0,0]=4
26  B7R1.2  CC1=NOC(N)=N1 ALBB-013551 [0,1,0,1,0,0|2,0,0]=4
27  B7R1.2  CC1CNC(=O)O1 ALBB-022254 [0,1,0,1,0,0|0,0,2]=4
28  B7R1.2  O=C1CNC(=O)C1 ALBB-030115 [0,1,0,1,0,0|1,0,1]=4
29  B7R1.2  O=C1NC(=S)CS1 ALBB-028937 [0,1,0,1,0,0|2,0,0]=4
30  B7R1.4  CC1=CNNC1=O ALBB-030475 [0,1,0,1,0,0|2,0,0]=4