0  B7R1.2  CC1=CC=C(O1)C NPA006894 [0,0,0,0,0,0|2,0,2]=4
1  B8R1.1  C1=C(ONC1=O)CN NPA024780 [0,1,0,0,0,0|2,0,0]=3
2  B8R1.1  CCC1CC(=O)OC1 NPA004245 [0,1,0,0,0,0|1,0,2]=4
3  B8R1.18  CC1=CC(=C(O1)C)C NPA002957 [0,1,0,0,0,0|2,0,1]=4
4  B8R1.50  CN1C(=O)CNC1=O NPA006307 [0,1,0,0,0,0|3,0,0]=4
5  B6R0.1  CCCC(=O)CC NPA012016 [0,0,1,0,0,0|0,0,2]=3
6  B6R0.4  CC(=O)CCSC NPA010578 [0,0,1,0,0,0|1,0,1]=3
7  B6R0.4  CC(C)CNC=O NPA028553 [0,0,1,0,0,0|1,0,2]=4
8  B8R1.4  CC1=CC(=O)C=CN1 NPA011826 [0,0,0,0,0,1|0,0,2]=3
9  B8R1.4  CC1=CC(=O)C=CO1 NPA012777 [0,0,0,0,0,1|0,0,2]=3
10  B8R1.4  CC1=CC(=O)CCO1 NPA016314 [0,0,0,0,0,1|0,0,0]=1
11  B5R0.1  C(CO)C(=O)O NPA014979 [1,0,1,0,0,0|2,0,0]=4
12  B5R0.1  C=C(C)CCO NPA031414 [1,0,1,0,0,0|0,0,1]=3
13  B5R0.1  CC(=CCO)C NPA031413 [1,0,1,0,0,0|0,0,2]=4
14  B7R0.5  CCOC(=O)C(C)C NPA012370 [0,1,1,0,0,0|1,0,1]=4
15  B7R0.9  CC(=O)CC(C)(C)O NPA001228 [0,1,1,0,0,0|0,0,2]=4
16  B7R0.16  CC(C)C(=O)C(=O)O NPA002663 [0,1,1,0,0,0|1,0,1]=4
17  B7R0.4  CC(C)CCNC=O NPA028555 [0,1,1,0,0,0|0,0,2]=4
18  B7R1.1  CCC1=CC=CO1 NPA014078 [1,1,0,0,0,0|1,0,1]=4
19  B7R1.4  C1[C@H](C(=O)NO1)N NPA001237 [1,1,0,0,0,0|2,0,0]=4
20  B7R1.4  CC1=NCNC1=O NPA003654 [1,1,0,0,0,0|2,0,0]=4
21  B9R1.69  C[C@H]1C[C@H](C=CC1=O)O NPA016187 [0,1,0,0,0,1|1,0,1]=4
22  B9R1.2  COC1=CC(=O)OC=C1 NPA036051 [0,1,0,0,0,1|0,0,2]=4
23  B9R1.21  CCC1=CNC(=C1)C=O NPA002721 [0,2,0,0,0,0|1,0,1]=4
24  B9R1.35  C[C@@H]([C@H]1CCC(=O)O1)O NPA001683 [0,2,0,0,0,0|1,0,1]=4
25  B9R1.35  C[C@H](C1=CC(=O)CC1)O NPA023422 [0,2,0,0,0,0|0,0,0]=2
26  B9R1.37  CC1=C(C(=O)[C@H](C1)O)C NPA001091 [0,2,0,0,0,0|0,0,0]=2
27  B9R1.37  CC1C(=O)C(=C(O1)C)O NPA015223 [0,2,0,0,0,0|1,0,0]=3
28  B9R1.27  CC1=C(C(=O)CC1)CO NPA015964 [0,2,0,0,0,0|0,0,0]=2
29  B9R1.27  CC1=C(C(=O)OC1)CO NPA014974 [0,2,0,0,0,0|1,0,0]=3
30  B9R1.27  C[C@@H]1CCC(=O)[C@@H]1CO NPA015750 [0,2,0,0,0,0|0,0,2]=4
31  B9R1.198  CS1(=O)(CCC(=O)O1)O NPA017850 [0,2,0,0,0,0|2,0,0]=4
32  B5R0.5  CC(C(=O)C)O NPA007460 [0,0,1,0,1,0|1,0,1]=4