0  B8R0.9  CCC(N)CCC(=O)O ALBB-018090 [0,0,0,0,0,0|0,0,2]=2
1  B8R0.9  CCS(=O)CCC(=O)O ALBB-004314 [0,0,0,0,0,0|2,0,2]=4
2  B8R0.9  CNC(=O)CCC(=O)O ALBB-033143 [0,0,0,0,0,0|2,0,2]=4
3  B8R0.9  NCC(=O)CCC(=O)O ALBB-023627 [0,0,0,0,0,0|2,0,2]=4
4  B8R0.9  NNC(=O)CCC(=O)O ALBB-035096 [0,0,0,0,0,0|3,0,1]=4
5  B7R0.4  C=CCSCC(=O)O ALBB-000400 [1,0,0,0,0,0|1,0,0]=2
6  B7R0.4  CC(=O)CCCCCl ALBB-025821 [1,0,0,0,0,0|2,0,1]=4
7  B7R0.4  CCCOCC(=O)O ALBB-014631 [1,0,0,0,0,0|1,0,2]=4
8  B7R0.4  CCCSCC(=O)O ALBB-004309 [1,0,0,0,0,0|1,0,2]=4
9  B7R0.4  CCOCCC(=O)O ALBB-022360 [1,0,0,0,0,0|1,0,2]=4
10  B7R0.4  CNCCCC(=O)O ALBB-026447 [1,0,0,0,0,0|1,0,1]=3
11  B7R0.4  CNCCCC(=O)O ALBB-026447 [1,0,0,0,0,0|1,0,1]=3
12  B7R0.6  CN(C)CCC(=O)O ALBB-004693 [1,0,0,0,0,0|2,0,1]=4
13  B7R0.6  CN(C)CCC(=O)O ALBB-004693 [1,0,0,0,0,0|2,0,1]=4
14  B7R0.6  N=C(N)SCC(=O)O ALBB-009286 [1,0,0,0,0,0|2,0,1]=4
15  B9R0.48  C\C=C\C(=O)NCC(=O)O ALBB-034135 [0,1,0,0,0,0|2,0,1]=4
16  B9R1.35  O=C(O)C1CC(O)CN1 ALBB-006175 [0,0,0,1,0,0|2,0,1]=4
17  B7R0.2  NCC(O)CC(=O)O ALBB-023689 [0,0,0,0,1,0|2,0,1]=4
18  B6R0.4  CCNCC(=O)O ALBB-034584 [2,0,0,0,0,0|1,0,1]=4
19  B6R0.4  CCSCC(=O)O ALBB-004310 [2,0,0,0,0,0|1,0,1]=4
20  B8R0.7  CCCCNCC(=O)O ALBB-034572 [1,1,0,0,0,0|0,0,2]=4
21  B8R0.7  COCCOCC(=O)O ALBB-025890 [1,1,0,0,0,0|1,0,1]=4
22  B8R0.7  NCCCCCC(=O)O ALBB-022460 [1,1,0,0,0,0|0,0,2]=4
23  B8R0.28  CC(=O)NCCC(=O)O ALBB-033160 [1,1,0,0,0,0|1,0,1]=4
24  B8R0.28  CN(C)CCCC(=O)O ALBB-006206 [1,1,0,0,0,0|1,0,1]=4
25  B8R0.23  CC(C)C(N)CC(=O)O ALBB-007459 [1,1,0,0,0,0|1,0,1]=4
26  B8R0.29  CC(C)(N)CCC(=O)O ALBB-016157 [1,1,0,0,0,0|0,0,1]=3
27  B8R0.29  CC(C)(N)CCC(=O)O ALBB-016157 [1,1,0,0,0,0|0,0,1]=3
28  B8R0.29  O=C(O)CCC(F)(F)F ALBB-012055 [1,1,0,0,0,0|2,0,0]=4
29  B10R0.98  NC(CCCC(=O)O)C(=O)O ALBB-025696 [0,1,0,0,0,1|1,0,0]=3
30  B8R1.4  O=C1COCC(=O)O1 ALBB-035717 [1,0,0,1,0,0|2,0,0]=4
31  B8R1.7  O=C(O)C1CCOC1 ALBB-028032 [1,0,0,1,0,0|1,0,1]=4
32  B10R1.66  O=C(O)CCN1C=CC=C1 ALBB-012483 [0,1,0,1,0,0|2,0,0]=4
33  B10R1.66  O=C(O)CCN1C=CC=N1 ALBB-004381 [0,1,0,1,0,0|1,0,1]=4
34  B10R1.66  O=C(O)CCN1C=CN=C1 ALBB-007358 [0,1,0,1,0,0|1,0,1]=4
35  B10R1.66  O=C(O)CCN1C=CN=C1 ALBB-007358 [0,1,0,1,0,0|1,0,1]=4
36  B10R1.66  O=C(O)CCN1C=NC=N1 ALBB-016473 [0,1,0,1,0,0|1,0,1]=4
37  B6R0.2  CC(N)CC(=O)O ALBB-014344 [1,0,0,0,1,0|0,0,1]=3
38  B6R0.3  CCC(N)C(=O)O ALBB-016221 [0,0,0,0,2,0|0,0,2]=4