0  B6R1.1  C1CC=CC=C1 C0259 [1,0,0,0,0,0|0,0,1]=2
1  B6R1.1  c1ccncc1 P0710 [1,0,0,0,0,0|1,0,2]=4
2  B8R1.5  BrC1CCCCC1=O B0249 [0,1,0,0,0,0|0,0,2]=3
3  B6R0.4  OC(CCCN)=O G0043 [0,0,1,0,0,0|2,0,0]=3
4  B6R0.6  CCCC/C=C/I I0047 [0,0,1,0,0,0|1,0,1]=3
5  B8R2.25  C1CC2OC2C=C1 E0058 [0,0,0,1,0,0|0,0,2]=3
6  B5R0.1  CC(OCBr)=O B0074 [1,0,1,0,0,0|2,0,0]=4
7  B5R0.1  CNCC(O)=O S0121 [1,0,1,0,0,0|2,0,0]=4
8  B5R0.2  BrCCCC=C B0624 [1,0,1,0,0,0|1,0,0]=3
9  B5R0.2  C=C\C=C\OC M0649 [1,0,1,0,0,0|1,0,1]=4
10  B7R0.2  COC(=O)C[C@@H](C)O H0102 [0,1,1,0,0,0|1,0,1]=4
11  B7R0.4  C\C=C\C=C\C(Cl)=O S0036 [0,1,1,0,0,0|1,0,1]=4
12  B7R1.1  C1CCN(C1)N=O N0378 [0,1,0,0,1,0|1,0,1]=4
13  B7R1.4  O=C1NOC[C@H]1N D0356 [0,1,0,0,1,0|2,0,0]=4
14  B7R1.4  O=C1[C@@H]([NH3+])CCO1 H0310 [0,1,0,0,1,0|1,0,0]=3
15  B9R1.5  BrC1CCCCCC1=O B0101 [0,1,0,0,0,1|0,0,2]=4
16  B9R1.66  C[C@@]1(O)CCOC(=O)C1 M0662 [0,2,0,0,0,0|1,0,1]=4
17  B7R1.18  OC([C@@H]1CCN1)=O A0051 [0,0,1,1,0,0|2,0,0]=4