0  B6R0.6  CCCC/C=C/I I0047 [0,0,0,0,0,0|1,0,3]=4
1  B5R0.2  BrCCCC=C B0624 [1,0,0,0,0,0|2,0,1]=4
2  B5R0.2  C=C\C=C\OC M0649 [1,0,0,0,0,0|1,0,1]=3
3  B5R0.2  ClC\C=C/CCl C0779 [1,0,0,0,0,0|2,0,0]=3
4  B7R0.4  C\C=C\C=C\C(Cl)=O S0036 [0,1,0,0,0,0|0,0,2]=3
5  B4R0.2  CC\C=N\O P0059 [2,0,0,0,0,0|1,0,1]=4
6  B6R0.4  OC(CCCN)=O G0043 [1,1,0,0,0,0|1,0,1]=4
7  B8R0.9  [NH3+]CC(CCC(O)=O)=O A0364 [0,2,0,0,0,0|1,0,1]=4
8  B6R1.1  C1CC=CC=C1 C0259 [1,0,0,1,0,0|0,0,1]=3
9  B8R1.5  BrC1CCCCC1=O B0249 [0,1,0,1,0,0|0,0,2]=4
10  B8R1.7  O=C(O)[C@H]1NCCC1 P0446 [0,1,0,1,0,0|1,0,1]=4
11  B8R1.19  CC1(C)CCCC1=O D0333 [0,1,0,1,0,0|0,0,2]=4
12  B8R2.25  C1CC2OC2C=C1 E0058 [0,0,0,2,0,0|0,0,2]=4