0  B7R0.6  C(C[N+](=O)[O-])C(=O)O CM10288 [0,0,0,0,0,0|3,0,0]=3
1  B7R0.6  CC(C)CO[N+](=O)[O-] CM13895 [0,0,0,0,0,0|2,0,1]=3
2  B8R1.23  C1C(CC1=O)C(=O)O CM10018 [0,0,0,1,0,0|1,0,1]=3
3  B8R1.23  C1C(CC1N)C(=O)O CM14276 [0,0,0,1,0,0|1,0,0]=2
4  B5R0.1  C(C#N)C(=O)O CM10060 [2,0,0,0,0,0|1,0,1]=4
5  B5R0.1  CC#CC(=O)O CM10024 [2,0,0,0,0,0|0,0,2]=4
6  B5R0.1  CC(CCO)N CM14429 [2,0,0,0,0,0|1,0,0]=3
7  B7R0.8  C(CN)CP(=O)(O)O CM10052 [1,1,0,0,0,0|2,0,0]=4
8  B7R1.2  C1C[C@H](C[C@@H]1N)O CM10407 [1,0,0,1,0,0|1,0,1]=4
9  B7R1.3  C1COC(=O)CN1 CM10412 [1,0,0,1,0,0|1,0,0]=3
10  B7R1.3  C1COCCC1=O CM14255 [1,0,0,1,0,0|2,0,0]=4
11  B7R1.18  C1C(CN1)C(=O)N CM14241 [1,0,0,1,0,0|2,0,0]=4
12  B7R1.18  C1C(CN1)C(=O)N CM14242 [1,0,0,1,0,0|2,0,0]=4
13  B7R1.18  C1C(CN1)C(=O)O CM14218 [1,0,0,1,0,0|1,0,0]=3
14  B7R1.18  C1CC(C1)C(=O)O CM11089 [1,0,0,1,0,0|0,0,0]=2
15  B7R1.20  C1CC1CC(=O)O CM13686 [1,0,0,1,0,0|0,0,0]=2
16  B9R1.66  CC1(CCCC(=O)C1)C CM14140 [0,0,0,1,0,1|1,0,0]=3
17  B9R1.10  C1CC(CCC1=O)(F)F CM14265 [0,1,0,1,0,0|2,0,0]=4
18  B9R1.69  CC1CN(CCC1=O)C CM11117 [0,1,0,1,0,0|2,0,0]=4
19  B9R1.82  COC(=O)C1CC(=O)C1 CM14244 [0,1,0,1,0,0|1,0,1]=4
20  B5R0.5  CC(C(=O)O)F CM13749 [0,0,0,0,2,0|1,0,0]=3