0  B6R0.2  CC(O)CC([O-])=O H0080 [0,0,1,0,0,0|3,0,0]=4
1  B6R0.4  OC(CCCN)=O G0043 [0,0,1,0,0,0|1,0,0]=2
2  B5R0.1  CC(OCBr)=O B0074 [1,0,1,0,0,0|1,0,0]=3
3  B5R0.1  CNCC(O)=O S0121 [1,0,1,0,0,0|1,0,0]=3
4  B5R0.2  BrCCCC=C B0624 [1,0,1,0,0,0|2,0,0]=4
5  B7R0.2  COC(=O)C[C@@H](C)O H0102 [0,1,1,0,0,0|2,0,0]=4
6  B7R1.1  C1CCN(C1)N=O N0378 [1,1,0,0,0,0|2,0,0]=4
7  B7R1.4  O=C1NOC[C@H]1N D0356 [1,1,0,0,0,0|2,0,0]=4
8  B7R1.4  O=C1[C@@H]([NH3+])CCO1 H0310 [1,1,0,0,0,0|0,0,0]=2
9  B9R1.66  C[C@@]1(O)CCOC(=O)C1 M0662 [0,1,0,0,0,1|1,0,0]=3
10  B9R1.35  O=C1CC[C@@H](C(O)=O)O1 O0227 [0,2,0,0,0,0|0,0,1]=3
11  B7R1.18  OC([C@@H]1CCN1)=O A0051 [0,0,1,1,0,0|1,0,0]=3