0  B8R0.16  COC(CC(C)=O)OC BBL011444 [0,0,0,0,0,0|0,0,0]=0
1  B7R0.2  CNC(C)CC(C)C BBL023276 [1,0,0,0,0,0|2,0,1]=4
2  B7R0.2  CNC(C)CC(N)=O BBL024637 [1,0,0,0,0,0|2,0,0]=3
3  B7R0.2  COC(=O)CC(C)=O BBL011420 [1,0,0,0,0,0|0,0,2]=3
4  B7R0.12  CNCC(OC)OC BBL027717 [1,0,0,0,0,0|1,0,0]=2
5  B7R0.12  [C-]#[N+]CC(OC)OC BBL020974 [1,0,0,0,0,0|1,0,1]=3
6  B7R0.15  CCC(CC)C(=O)O BBL018400 [0,0,0,0,1,0|3,0,0]=4
7  B7R0.15  CCC(NC)C(=O)O BBL022845 [0,0,0,0,1,0|3,0,0]=4
8  B7R0.15  COC(OC)C(C)=O BBL011442 [0,0,0,0,1,0|0,0,0]=1
9  B6R0.1  CNCC(C)OC BBL003985 [2,0,0,0,0,0|1,0,0]=3
10  B6R0.2  CC(C)CC(=O)Cl BBL027310 [2,0,0,0,0,0|1,0,0]=3
11  B6R0.2  CC(C)CC(=O)O BBL027399 [2,0,0,0,0,0|1,0,0]=3
12  B6R0.2  CC(O)CC(=O)O BBL027467 [2,0,0,0,0,0|1,0,0]=3
13  B6R0.4  CC(=O)CCCCl BBL010617 [2,0,0,0,0,0|2,0,0]=4
14  B6R0.4  CCCCC(=O)Cl BBL012216 [2,0,0,0,0,0|2,0,0]=4
15  B6R0.4  CCCCC(C)=O BBL011434 [2,0,0,0,0,0|1,0,0]=3
16  B6R0.4  CNCCC(N)=O BBL023425 [2,0,0,0,0,0|2,0,0]=4
17  B6R0.9  COC(CCl)OC BBL011494 [2,0,0,0,0,0|1,0,0]=3
18  B6R0.9  COC(CN)OC BBL011384 [2,0,0,0,0,0|1,0,0]=3
19  B8R0.2  CCC(C)C(N)C(=O)O BBL100034 [1,1,0,0,0,0|2,0,0]=4
20  B8R0.2  CC[C@H](C)[C@H](N)C(N)=O BBL033474 [1,1,0,0,0,0|2,0,0]=4
21  B8R0.5  CCOC(=O)CC(C)=O BBL012204 [1,1,0,0,0,0|0,0,2]=4
22  B8R0.19  CCC(=O)CC(C)CC BBL011426 [1,1,0,0,0,0|1,0,0]=3
23  B8R0.19  CCC(C)NC(=O)CCl BBL003704 [1,1,0,0,0,0|2,0,0]=4
24  B8R0.19  COC(=O)CC(=O)CCl BBL027316 [1,1,0,0,0,0|0,0,2]=4
25  B8R0.19  COC(=O)CC(=O)OC BBL011438 [1,1,0,0,0,0|0,0,2]=4
26  B10R0.134  COC(=O)CP(=O)(OC)OC BBL027713 [0,2,0,0,0,0|1,0,0]=3
27  B8R1.4  CC1CCCC(=O)C1 BBL013179 [1,0,0,1,0,0|1,0,0]=3
28  B8R1.7  O=C(O)C1CCCO1 BBL001404 [0,0,0,1,1,0|2,0,0]=4
29  B10R1.370  CC1(CC(=O)[O-])OCCO1 BBL036879 [0,1,0,1,0,0|1,0,0]=3
30  B6R0.3  CNC(C)C(=O)O BBL022510 [1,0,0,0,1,0|2,0,0]=4
31  B6R0.3  COC(=O)C(C)=O BBL027724 [1,0,0,0,1,0|0,0,2]=4
32  B8R0.9  COC(=O)CCC(C)=O BBL011529 [1,0,0,0,0,1|0,0,2]=4