0  B6R0.2  CC(=O)NC(=N)N BB56-2578 [0,0,0,0,0,0|3,0,0]=3
1  B6R0.2  CC(N)CC(=O)O BB12-2890 [0,0,0,0,0,0|3,0,1]=4
2  B5R0.1  CCOC(C)=N BB12-3674 [1,0,0,0,0,0|1,0,1]=3
3  B5R0.1  CNCC(C)=O BB12-3010 [1,0,0,0,0,0|2,0,0]=3
4  B7R0.2  CCN(C)CC(C)=O BB12-2316 [0,1,0,0,0,0|3,0,0]=4
5  B7R0.2  CNC(=O)CC(C)N BB12-1658 [0,1,0,0,0,0|2,0,1]=4
6  B7R0.2  C\C(C=O)=C\N(C)C BB12-3546 [0,1,0,0,0,0|3,0,0]=4
7  B7R0.9  CC(=O)CS(C)(=O)=O BB12-0011 [0,1,0,0,0,0|2,0,0]=3
8  B7R0.9  CC(C)(C)OC(N)=O BB56-2323 [0,1,0,0,0,0|2,0,1]=4
9  B7R0.16  CC(C(=O)O)C(=O)O BB20-4558 [0,1,0,0,0,0|3,0,0]=4
10  B7R1.2  CC1=CC(C)=NO1 BB01-6357 [0,0,0,1,0,0|2,0,1]=4
11  B7R1.2  CC1=NN=C(O)O1 BB12-2756 [0,0,0,1,0,0|2,0,1]=4
12  B7R1.2  CC1=NN=C(S)O1 BB12-2764 [0,0,0,1,0,0|2,1,0]=4
13  B7R1.2  CC1=NNC(C)=N1 BB12-3420 [0,0,0,1,0,0|3,0,0]=4
14  B7R1.2  O=C1C=C(O)CC1 BB12-0743 [0,0,0,1,0,0|1,0,1]=3
15  B7R1.2  O=C1CNC(=S)N1 BB20-3124 [0,0,0,1,0,0|2,1,0]=4
16  B5R0.5  CC(Cl)C(N)=O BB12-1307 [0,0,0,0,1,0|2,0,1]=4
17  B7R0.6  C=C(C)COC(C)=O BB12-2984 [0,0,0,0,0,1|1,0,0]=2
18  B7R0.6  CC(=O)OCC(=O)Cl BB12-3445 [0,0,0,0,0,1|1,0,0]=2
19  B7R0.6  CC(C)=NNC(N)=O BB12-2973 [0,0,0,0,0,1|3,0,0]=4
20  B7R0.6  NC(=O)NNC(N)=O BB12-2767 [0,0,0,0,0,1|3,0,0]=4
21  B6R0.1  C#CC(=O)OCC BB53-1426 [1,1,0,0,0,0|0,0,2]=4
22  B8R0.18  CC(=O)C(=NO)C(C)=O BB12-1907 [0,2,0,0,0,0|1,0,0]=3
23  B8R1.3  O=C1CCS(=O)CC1 BB53-1536 [0,0,0,1,0,1|2,0,0]=4
24  B8R1.50  CN1C(=O)CNC1=O BB26-0158 [0,1,0,1,0,0|2,0,0]=4
25  B8R0.28  NC(=O)COCC(=O)O BB12-2362 [0,0,0,0,0,2|2,0,0]=4