0  B9R0.19  CCOC(=O)C(C)(C)C#N ALBB-010178 [0,0,0,0,0,0|2,0,1]=3
1  B8R0.3  CCOC(=O)C(N)CC ALBB-025857 [1,0,0,0,0,0|1,0,0]=2
2  B8R0.14  CCNC(=O)C(C)(C)N ALBB-022400 [1,0,0,0,0,0|2,0,0]=3
3  B10R1.300  O=C1NCCCCC1(Br)Br ALBB-034181 [0,0,0,1,0,0|3,0,0]=4
4  B10R1.405  CCOC(=O)C1(C#N)CC1 ALBB-015985 [0,0,0,1,0,0|2,0,1]=4
5  B7R0.3  CCCNC(C)CC ALBB-022353 [2,0,0,0,0,0|2,0,0]=4
6  B7R0.3  CCNCC(O)CC ALBB-026226 [2,0,0,0,0,0|1,0,1]=4
7  B7R0.5  CCNC(=O)C(C)Br ALBB-032028 [2,0,0,0,0,0|2,0,0]=4
8  B7R0.5  CCNC(=O)C(C)Cl ALBB-009554 [2,0,0,0,0,0|2,0,0]=4
9  B7R0.7  CCNC(=O)CCCl ALBB-011970 [2,0,0,0,0,0|2,0,0]=4
10  B7R0.7  CCOC(=N)CCCl ALBB-003779 [2,0,0,0,0,0|2,0,0]=4
11  B7R0.7  CCOC(=N)CCO ALBB-033257 [2,0,0,0,0,0|2,0,0]=4
12  B7R0.7  CCOC(=O)CCO ALBB-013457 [2,0,0,0,0,0|1,0,0]=3
13  B7R0.7  CCOC(=O)CNN ALBB-008928 [2,0,0,0,0,0|2,0,0]=4
14  B7R0.7  CCOC(=O)CNN ALBB-008928 [2,0,0,0,0,0|2,0,0]=4
15  B7R0.7  CCOC(=O)NNC ALBB-035548 [2,0,0,0,0,0|2,0,0]=4
16  B7R0.10  CCC(C)C(=O)NN ALBB-016228 [2,0,0,0,0,0|2,0,0]=4
17  B7R0.10  CCN(C)C(=O)CCl ALBB-003893 [2,0,0,0,0,0|2,0,0]=4
18  B7R0.10  COC(=O)C(O)CCl ALBB-023713 [2,0,0,0,0,0|1,0,0]=3
19  B7R0.13  COC(C)(C)C(=O)O ALBB-010768 [2,0,0,0,0,0|2,0,0]=4
20  B7R0.14  COC(=O)C(C)(C)N ALBB-016215 [2,0,0,0,0,0|1,0,0]=3
21  B9R0.6  CCOC(=O)C(=O)C(C)Br ALBB-022331 [1,1,0,0,0,0|0,0,2]=4
22  B9R0.8  CCCNC(=O)C(Br)CC ALBB-007290 [1,1,0,0,0,0|2,0,0]=4
23  B9R0.23  CCC(Br)C(=O)NC(C)C ALBB-007264 [1,1,0,0,0,0|2,0,0]=4
24  B9R0.35  CCOC(=O)C(C)CNC ALBB-016161 [1,1,0,0,0,0|0,0,0]=2
25  B9R0.35  CCOC(=O)C(C)N=C=S ALBB-011898 [1,1,0,0,0,0|1,0,1]=4
26  B9R0.3  CCCNC(=O)C(C)(C)N ALBB-022401 [1,1,0,0,0,0|2,0,0]=4
27  B9R0.10  CC(C)NC(=O)C(C)(C)N ALBB-022402 [1,1,0,0,0,0|2,0,0]=4
28  B11R0.252  CCOC(=O)C(C#N)(CC)CC ALBB-010179 [0,2,0,0,0,0|1,0,0]=3
29  B9R1.5  NC1CCCCNC1=O ALBB-022356 [1,0,0,1,0,0|2,0,0]=4
30  B9R1.5  O=C1NCCCCC1Br ALBB-030091 [1,0,0,1,0,0|2,0,0]=4
31  B9R1.38  CC1CC(=O)C(C)(C)O1 ALBB-035570 [1,0,0,1,0,0|1,0,0]=3
32  B9R0.34  CCOC(=O)CC(C)NC ALBB-004101 [1,0,0,0,0,1|1,0,0]=3
33  B9R0.34  CCOC(=O)\C=C(/C)CC ALBB-032756 [1,0,0,0,0,1|0,0,1]=3