0  B6R0.8  BrC(CC)(CC)C ACS024476 [1,0,0,0,0,0|3,0,0]=4
1  B6R0.8  OCC(C=O)(C)C ACS012227 [1,0,0,0,0,0|1,0,2]=4
2  B8R1.52  FC1(CCCC1)CO ACF020873 [0,0,0,1,0,0|3,0,0]=4
3  B8R1.52  FC1(CNCC1)CO ACF021408 [0,0,0,1,0,0|3,0,0]=4
4  B8R1.60  BrCC1(COC1)CBr ACS020890 [0,0,0,1,0,0|3,0,0]=4
5  B8R1.60  BrCC1(COC1)CF ACF023596 [0,0,0,1,0,0|3,0,0]=4
6  B8R1.60  ClCC1(COC1)CCl ACS015311 [0,0,0,1,0,0|3,0,0]=4
7  B8R1.60  FCC1(COC1)CF ACF023579 [0,0,0,1,0,0|3,0,0]=4
8  B8R1.60  FCC1(COC1)CN ACF023569 [0,0,0,1,0,0|3,0,0]=4
9  B8R1.60  FCC1(COC1)CO ACF023567 [0,0,0,1,0,0|2,0,0]=3
10  B5R0.3  C([C@@H](CCl)O)O ACS010830 [2,0,0,0,0,0|1,0,0]=3
11  B5R0.3  C([C@@H](CO)O)N ACS010825 [2,0,0,0,0,0|1,0,0]=3
12  B5R0.3  C([C@H](CCl)O)O ACS010831 [2,0,0,0,0,0|1,0,0]=3
13  B5R0.3  NC(CO)CC ACS011654 [2,0,0,0,0,0|1,0,0]=3
14  B5R0.3  NCC(CN)O ACS012389 [2,0,0,0,0,0|2,0,0]=4
15  B5R0.3  NC[C@@H](CCl)O ACS020120 [2,0,0,0,0,0|2,0,0]=4
16  B5R0.3  NC[C@@H](CO)F ACF022187 [2,0,0,0,0,0|2,0,0]=4
17  B5R0.3  NC[C@H](CO)F ACF022188 [2,0,0,0,0,0|2,0,0]=4
18  B5R0.3  O=C[C@@H](O)CO ACS010919 [2,0,0,0,0,0|0,0,2]=4
19  B5R0.3  O=C[C@@H](O)CO ACS010920 [2,0,0,0,0,0|0,0,2]=4
20  B5R0.4  CC(CN)(C)N ACS020018 [2,0,0,0,0,0|1,0,0]=3
21  B5R0.4  NCC(C)(S)C ACS017169 [2,0,0,0,0,0|2,0,0]=4
22  B7R0.13  CC(C(=O)O)(CO)C ACS012226 [1,1,0,0,0,0|1,0,1]=4
23  B7R1.25  BrCC1(COC1)F ACF022835 [1,0,0,1,0,0|2,0,0]=4
24  B7R1.25  FC1(CNC1)CO ACF023039 [1,0,0,1,0,0|2,0,0]=4
25  B7R1.25  FC1(CNC1)CO ACF023040 [1,0,0,1,0,0|2,0,0]=4
26  B7R1.25  FC1(COC1)CI ACF022836 [1,0,0,1,0,0|2,0,0]=4
27  B7R1.25  FC1(COC1)CN ACF022834 [1,0,0,1,0,0|2,0,0]=4
28  B7R1.25  FC1(COC1)CO ACF022833 [1,0,0,1,0,0|1,0,0]=3
29  B7R1.29  OCC1(CC1)CO ACS011692 [1,0,0,1,0,0|1,0,0]=3
30  B7R1.1  C1(CCCC1)CO ACS010445 [1,0,0,1,0,0|2,0,0]=4
31  B7R1.8  FC1C(CC1)CO ACF023531 [1,0,0,1,0,0|2,0,0]=4
32  B9R1.204  C1(CCCC1)(CO)CO ACS018952 [0,1,0,1,0,0|2,0,0]=4
33  B9R1.118  FC1(CCOCC1)CO ACF022893 [0,1,0,1,0,0|2,0,0]=4
34  B9R1.118  FC1(COCCC1)CO ACF021662 [0,1,0,1,0,0|2,0,0]=4
35  B9R1.119  FC(C1(COC1)CO)F ACF023568 [0,1,0,1,0,0|2,0,0]=4
36  B9R1.163  NC1(COCC1)C(=O)O ACS011672 [0,1,0,1,0,0|1,0,1]=4