0  B5R0.1  CC(C)CCO DB02296 [1,0,0,0,0,0|0,0,3]=4
1  B5R0.2  CCCCC=O DB01919 [1,0,0,0,0,0|0,0,2]=3
2  B7R0.2  CC(C)NC(=N)NO DB02143 [0,1,0,0,0,0|2,0,1]=4
3  B7R0.6  CC(C)CCC(=O)O DB03993 [0,1,0,0,0,0|0,0,2]=3
4  B7R0.6  O=C(O)\C=C/C(=O)O DB04299 [0,1,0,0,0,0|2,0,1]=4
5  B7R0.6  O=C(O)\C=C\C(=O)O DB01677 [0,1,0,0,0,0|2,0,1]=4
6  B7R1.3  CC1=CC=CN=C1 DB01996 [0,0,0,1,0,0|1,0,2]=4
7  B4R0.1  CC(=O)C=O DB03587 [2,0,0,0,0,0|1,0,1]=4
8  B4R0.1  CN(C)C=O DB01844 [2,0,0,0,0,0|1,0,0]=3
9  B4R0.1  C[C@H](O)C=O DB03776 [2,0,0,0,0,0|1,0,0]=3
10  B4R0.2  C\C=C\C=O DB04381 [2,0,0,0,0,0|0,0,0]=2
11  B4R0.2  O=CCC=O DB03057 [2,0,0,0,0,0|1,0,1]=4
12  B6R0.2  CC(C)CC(=O)O DB03750 [1,1,0,0,0,0|0,0,1]=3
13  B6R0.2  CC(C)SC(=N)N DB04018 [1,1,0,0,0,0|2,0,0]=4
14  B6R0.2  CN(C)CC(=O)O DB02083 [1,1,0,0,0,0|1,0,1]=4
15  B6R0.5  CC(C)(C)OC=O DB02768 [1,1,0,0,0,0|1,0,0]=3
16  B6R0.5  C[N+](C)(C)CC=O DB04401 [1,1,0,0,0,0|1,0,1]=4
17  B8R0.23  CC(C)CC(=O)C(=O)O DB03229 [0,2,0,0,0,0|0,0,1]=3
18  B8R0.23  CC(C)C[C@@H](N)C(=O)O DB01746 [0,2,0,0,0,0|0,0,2]=4
19  B8R1.4  C[C@H]1CC=CC(=O)O1 DB14121 [0,1,0,1,0,0|1,0,0]=3
20  B8R1.40  [C@@H](C)(C=O)CC1CC1 DB03736 [0,1,0,1,0,0|0,0,2]=4