0  B12R2.2786  CC1(C2CCC1(C(=O)C2)C)C S3851 [0,0,0,0,0,0|0,0,0]=0
1  B12R2.2786  CC1(C2CCC1(C(=O)C2)C)C S4516 [0,0,0,0,0,0|0,0,0]=0
2  B12R2.2786  CC1(C2CCC1(C(=O)C2)C)C S4516 [0,0,0,0,0,0|0,0,0]=0
3  B12R2.2786  CC1(C2CCC1(C(C2)O)C)C S3605 [0,0,0,0,0,0|0,0,2]=2
4  B12R2.2786  CC1(C2CCC1(C(C2)O)C)C S3959 [0,0,0,0,0,0|0,0,2]=2
5  B12R2.2786  CC1(C2CCC1(C(C2)O)C)C S3977 [0,0,0,0,0,0|0,0,2]=2
6  B10R1.128  C[N+]1(CCCC1C(=O)O)C S3760 [1,0,1,0,0,0|2,0,0]=4
7  B10R1.128  C[N+]1(CCCC1C(=O)O)C S3760 [1,0,1,0,0,0|2,0,0]=4
8  B10R1.128  C[N+]1(CCCC1C(=O)[O-])C S3771 [1,0,1,0,0,0|2,0,0]=4
9  B10R1.128  C[N+]1(CCCC1C(=O)[O-])C S3771 [1,0,1,0,0,0|2,0,0]=4
10  B12R2.5234  CC12CCC(CC1)C(C)(C)O2 S3761 [1,0,0,0,0,1|0,0,1]=3
11  B12R2.5234  CC12CCC(CC1)C(C)(C)O2 S3761 [1,0,0,0,0,1|0,0,1]=3