0  B7R1.2  O=C1C=CC(=O)N1 541-59-3 [0,0,0,0,0,0|1,0,2]=3
1  B6R1.2  O=C1CCCC1 120-92-3 [1,0,0,0,0,0|1,0,1]=3
2  B6R1.2  O=C1CCCN1 616-45-5 [1,0,0,0,0,0|1,0,1]=3
3  B8R1.18  CN1CC(=O)N=C1N 60-27-5 [0,1,0,0,0,0|3,0,0]=4
4  B8R1.18  CN1CC(=O)NC1=O 616-04-6 [0,1,0,0,0,0|2,0,0]=3
5  B6R0.2  CC(=O)CC(=O)[O-] 3483-11-2 [0,0,1,0,0,0|2,0,0]=3
6  B6R0.2  CC(C)=CC(=O)O 541-47-9 [0,0,1,0,0,0|3,0,0]=4
7  B6R0.2  O=C(O)CC(=O)O 141-82-2 [0,0,1,0,0,0|3,0,0]=4
8  B6R0.4  CCCCC(=O)O 109-52-4 [0,0,1,0,0,0|1,0,1]=3
9  B6R0.4  CSCCC(=O)O 646-01-5 [0,0,1,0,0,0|2,0,0]=3
10  B6R0.4  NCCCC(=O)O 56-12-2 [0,0,1,0,0,0|1,0,1]=3
11  B6R0.4  O=CNCC(=O)O 2491-15-8 [0,0,1,0,0,0|1,0,0]=2
12  B8R1.4  O=C1CCNC(=O)N1 504-07-4 [0,0,0,0,0,1|1,0,0]=2
13  B5R0.1  CCCC(=O)O 107-92-6 [1,0,1,0,0,0|0,0,1]=3
14  B5R0.1  CNCC(=O)O 107-97-1 [1,0,1,0,0,0|1,0,1]=4
15  B5R0.1  C\C=C\C(=O)O 107-93-7 [1,0,1,0,0,0|1,0,1]=4
16  B5R0.1  NCCC(=O)O 107-95-9 [1,0,1,0,0,0|1,0,0]=3
17  B5R0.1  NCCS(=O)O 300-84-5 [1,0,1,0,0,0|2,0,0]=4
18  B5R0.3  CCC(C)C=O 96-17-3 [1,0,1,0,0,0|1,0,1]=4
19  B7R0.9  CC(=O)OP(=O)([O-])[O-] 94249-01-1 [0,1,1,0,0,0|2,0,0]=4
20  B7R0.4  CCCCCC(=O)O 142-62-1 [0,1,1,0,0,0|1,0,1]=4
21  B7R0.4  NCCCCC(=O)O 660-88-8 [0,1,1,0,0,0|1,0,1]=4
22  B7R0.6  CC(=O)NCC(=O)O 543-24-8 [0,1,1,0,0,0|1,0,0]=3
23  B7R0.6  CC(C)CCC(=O)O 646-07-1 [0,1,1,0,0,0|1,0,1]=4
24  B7R0.6  N=C(N)NCC(=O)O 352-97-6 [0,1,1,0,0,0|2,0,0]=4
25  B7R0.6  NC(=O)\C=C/C(=O)O 557-24-4 [0,1,1,0,0,0|0,0,2]=4
26  B7R0.6  O=C(O)CCC(=O)O 110-15-6 [0,1,1,0,0,0|0,0,0]=2
27  B7R0.6  O=C(O)\C=C/C(=O)O 110-16-7 [0,1,1,0,0,0|0,0,2]=4
28  B7R0.6  O=C(O)\C=C\C(=O)O 110-17-8 [0,1,1,0,0,0|0,0,2]=4
29  B9R1.35  O=C1CCC(C(=O)O)N1 4042-36-8 [0,2,0,0,0,0|1,0,1]=4
30  B9R1.35  O=C1CC[C@@H](C(=O)O)N1 98-79-3 [0,2,0,0,0,0|1,0,1]=4
31  B7R1.3  O=C1CCCCO1 542-28-9 [0,0,1,1,0,0|1,0,1]=4
32  B5R0.5  CC(=O)C(=O)O 127-17-3 [0,0,1,0,1,0|1,0,0]=3
33  B5R0.5  CC(=O)C(C)=O 431-03-8 [0,0,1,0,1,0|0,0,0]=2
34  B5R0.5  O=C(O)C(=O)O 6153-56-6 [0,0,1,0,1,0|2,0,0]=4