0  B6R0.4  CC(=C)CCCO WX640339 [1,0,0,0,0,0|2,0,1]=4
1  B8R0.29  CS(=O)(=O)CCC(=O)O WX610094 [0,1,0,0,0,0|1,0,1]=3
2  B8R1.23  C1C(CC1F)C(=O)O WX610015 [0,0,0,1,0,0|2,0,1]=4
3  B8R1.23  C1C(CC1O)C(=O)O WX610009 [0,0,0,1,0,0|1,0,1]=3
4  B8R1.23  C1[C@@H](C[C@@H]1C(=O)O)O WX610012 [0,0,0,1,0,0|1,0,1]=3
5  B8R1.23  C=C1CC(C1)C(=O)O WX610003 [0,0,0,1,0,0|2,0,0]=3
6  B8R1.23  CC1CC(C1)C(=O)O WX610004 [0,0,0,1,0,0|2,0,1]=4
7  B8R1.23  CN1CC(C1)C(=O)O WX610403 [0,0,0,1,0,0|3,0,0]=4
8  B8R1.23  C[C@H]1C[C@@H](C1)C(=O)O WX610006 [0,0,0,1,0,0|2,0,1]=4
9  B8R1.23  C[C@H]1C[C@H](C1)C(=O)O WX610005 [0,0,0,1,0,0|2,0,1]=4
10  B8R1.51  C1CS(=O)(=O)CC1=O WX625144 [0,0,0,1,0,0|2,0,1]=4
11  B8R1.77  C1C(C1(F)F)C(=O)O WX611688 [0,0,0,1,0,0|2,0,1]=4
12  B6R0.2  C[C@@H](CC(=O)O)N WX665057 [0,0,0,0,1,0|2,0,1]=4
13  B6R0.2  C\C(=C\C(=O)O)\I WXC02281 [0,0,0,0,1,0|2,0,1]=4
14  B8R0.28  CC(C)CNCC(=O)O WXC00158 [0,0,0,0,0,1|2,0,1]=4
15  B5R0.1  C(CF)C(=O)O WX610266 [2,0,0,0,0,0|1,0,0]=3
16  B7R0.3  COC(=O)CCCN WX600050 [1,1,0,0,0,0|1,0,1]=4
17  B7R0.4  CC(=O)NCCCO WXC04434 [1,1,0,0,0,0|1,0,1]=4
18  B7R0.5  C(CN)[C@@H](C(=O)O)N WX665073 [1,1,0,0,0,0|1,0,1]=4
19  B9R0.1  COC(=O)CCC[N+](=O)[O-] WXC04005 [0,1,0,0,0,1|1,0,1]=4
20  B9R0.39  CC(=O)N[C@H](CO)C(=O)O WX665002 [0,2,0,0,0,0|2,0,0]=4
21  B7R1.3  C1CC(=O)COC1 WX625057 [1,0,0,1,0,0|1,0,1]=4
22  B7R1.12  C1[C@H]([C@@H]1F)C(=O)O WX610333 [1,0,0,1,0,0|1,0,1]=4
23  B7R1.12  C1[C@H]([C@H]1F)C(=O)O WX610334 [1,0,0,1,0,0|1,0,1]=4
24  B7R1.12  CC1CC1C(=O)O WX610273 [1,0,0,1,0,0|1,0,1]=4
25  B7R1.12  C[C@H]1C[C@@H]1C(=O)O WX611005 [1,0,0,1,0,0|1,0,1]=4
26  B9R1.35  C1C(CNC1=O)C(=O)N WXC03215 [0,0,0,1,0,1|2,0,0]=4
27  B9R1.35  C[C@@H]1CC[C@@H](O1)C(=O)O WX611125 [0,0,0,1,0,1|1,0,1]=4
28  B9R1.82  COC(=O)C1CC(C1)O WX642118 [0,1,0,1,0,0|1,0,1]=4
29  B9R1.82  COC(=O)[C@H]1C[C@H](C1)O WX642178 [0,1,0,1,0,0|1,0,1]=4