0  B8R0.23  CC(CN(C)C)C(=O)O BB12-1434 [0,0,0,0,0,0|2,0,0]=2
1  B7R0.2  CC(CO)CN(C)C BB12-3644 [1,0,0,0,0,0|2,0,1]=4
2  B7R0.5  CCSC(C)C(=O)O BB12-3261 [1,0,0,0,0,0|2,0,0]=3
3  B7R0.5  CNCC(C)C(=O)O BB12-1637 [1,0,0,0,0,0|2,0,0]=3
4  B7R0.6  CC(C)SCC(=O)O BB12-3365 [1,0,0,0,0,0|1,0,0]=2
5  B9R0.23  COC(=O)C(C)CN(C)C BB12-3648 [0,1,0,0,0,0|2,0,0]=3
6  B9R0.42  CCN(C)CC(C)C(=O)O BB12-1433 [0,1,0,0,0,0|2,0,0]=3
7  B9R1.35  CC1=NOC(C(=O)O)C1 BB55-3992 [0,0,0,1,0,0|2,0,1]=4
8  B7R0.16  CC(C(=O)O)N(C)C BB12-1429 [0,0,0,0,1,0|2,0,0]=3
9  B9R0.7  C[S+](C)CC[C@H](N)C(=O)O BB12-2279 [0,0,0,0,0,1|1,0,0]=2
10  B6R0.1  CCC\C(N)=N\O BB10-0037 [2,0,0,0,0,0|1,0,1]=4
11  B6R0.4  C=CCNC(C)C BB12-1319 [2,0,0,0,0,0|2,0,0]=4
12  B6R0.4  CC(C)CN=C=O BB01-8145 [2,0,0,0,0,0|1,0,1]=4
13  B6R0.4  CC(C)SCCO BB53-1392 [2,0,0,0,0,0|1,0,1]=4
14  B6R0.4  CCSCC(=O)O BB12-3264 [2,0,0,0,0,0|1,0,0]=3
15  B6R0.4  CNCCC(=O)O BB12-1452 [2,0,0,0,0,0|1,0,0]=3
16  B6R0.4  COCCC(=O)Cl BB20-1617 [2,0,0,0,0,0|2,0,0]=4
17  B6R0.3  CSC(C)C(=O)O BB12-2671 [2,0,0,0,0,0|2,0,0]=4
18  B8R0.8  CCCC[C@H](N)C(=O)O BB12-2277 [1,1,0,0,0,0|0,0,0]=2
19  B8R0.9  CCN(C)CCC(=O)O BB12-3650 [1,1,0,0,0,0|1,0,0]=3
20  B8R0.9  CCS(=O)CCC(=O)O BB12-3269 [1,1,0,0,0,0|2,0,0]=4
21  B8R0.29  CC(C)(N)CCC(=O)O BB12-1634 [1,1,0,0,0,0|0,0,0]=2
22  B8R0.18  CCC(C(=O)O)N(C)C BB12-3549 [0,1,0,0,1,0|2,0,0]=4
23  B8R0.37  CN(C)C(C)(C)C(=O)O BB12-3603 [0,1,0,0,1,0|2,0,0]=4
24  B10R0.56  C=C(C(=O)OC)C(O)C(C)C BB17-2996 [0,2,0,0,0,0|1,0,1]=4
25  B8R1.5  O=C1OCCCC1Br BB17-3008 [1,0,0,1,0,0|1,0,0]=3
26  B8R1.7  NC(=O)[C@@H]1CCCN1 BB12-3488 [1,0,0,1,0,0|1,0,0]=3
27  B10R1.13  CN1CCC(C(=O)O)CC1 BB12-2769 [0,0,0,1,0,1|2,0,0]=4
28  B10R1.13  CN1CCC(C(=O)O)CC1 BB56-1999 [0,0,0,1,0,1|2,0,0]=4
29  B10R1.329  CC1(C)CC(=O)C=C(N)C1 BB17-0154 [0,0,0,1,0,1|1,0,1]=4
30  B10R1.113  CN1CCCC(C(=O)O)C1 BB12-2768 [0,1,0,1,0,0|2,0,0]=4
31  B8R0.28  CN(C)CCCC(=O)O BB01-6266 [1,0,0,0,0,1|1,0,0]=3