0  B5R0.5  CC(C(=O)[O-])O 1258 [0,0,0,0,0,0|0,0,1]=1
1  B5R0.5  CC(C(=O)[O-])O 293 [0,0,0,0,0,0|0,0,1]=1
2  B4R0.1  CC(=O)OC 753 [1,0,0,0,0,0|2,0,0]=3
3  B4R0.1  CN(C)C=S 110 [1,0,0,0,0,0|2,1,0]=4
4  B4R0.1  CNC(=S)N 117 [1,0,0,0,0,0|2,1,0]=4
5  B3R0.2  C(=O)(N)N 1178 [2,0,0,0,0,0|2,0,0]=4
6  B3R0.2  CC(C)O 275 [2,0,0,0,0,0|0,0,1]=3
7  B3R0.2  CS(=O)C 188 [2,0,0,0,0,0|2,0,0]=4
8  B5R0.1  CC(CCO)O 719 [1,1,0,0,0,0|0,0,1]=3
9  B5R0.1  CCNC(=S)N 112 [1,1,0,0,0,0|1,1,0]=4
10  B5R0.3  CCC(C=C)O 776 [1,1,0,0,0,0|1,0,0]=3
11  B7R0.2  CCC(=O)OC(C)C 731 [0,1,0,0,0,1|2,0,0]=4
12  B7R0.16  CC(C)[C@@H](C(=O)O)N 1154 [0,1,0,0,0,1|1,0,0]=3
13  B7R0.6  CC(C)COC(=O)C 721 [0,0,0,0,0,2|2,0,0]=4