0  B9R0.5  C(CSC(=O)CC[S-])C=O OPS [0,0,0,0,0,0|2,1,1]=4
1  B8R0.4  CCCCCCCCC DD9 [1,0,0,0,0,0|1,0,1]=3
2  B8R0.4  CCCCCCCCO OC9 [1,0,0,0,0,0|2,0,1]=4
3  B8R0.4  COCCOCCOC M2M [1,0,0,0,0,0|2,0,1]=4
4  B10R0.3  COCC(=O)CCCC(O)O M1T [0,1,0,0,0,0|3,0,0]=4
5  B10R0.6  CCCCCC(=O)CC(=O)O OOA [0,1,0,0,0,0|2,0,1]=4
6  B10R0.91  CCCCC[C@@H](CCCO)O HND [0,1,0,0,0,0|1,0,2]=4
7  B7R0.1  CCCCCCCC OCT [2,0,0,0,0,0|0,0,1]=3
8  B7R0.1  CCCCCCCO HE4 [2,0,0,0,0,0|1,0,1]=4
9  B7R0.1  CCCSSCCC SSP [2,0,0,0,0,0|1,1,0]=4
10  B7R0.1  COCCOCCO PG0 [2,0,0,0,0,0|2,0,0]=4
11  B7R0.3  COC(=O)CCCN GVE [2,0,0,0,0,0|2,0,0]=4
12  B7R0.7  CCOP(=O)OCC DEP [2,0,0,0,0,0|2,0,0]=4
13  B7R0.4  CCCCCC(=O)C HTX [2,0,0,0,0,0|1,0,0]=3
14  B7R0.4  CCCCCC(=O)O 6NA [2,0,0,0,0,0|2,0,0]=4
15  B7R0.4  CCCCOC(=O)C 8JZ [2,0,0,0,0,0|0,0,0]=2
16  B9R0.4  CCCCC(=O)CC(=O)O BKA [1,1,0,0,0,0|1,0,1]=4
17  B9R0.45  CCCCCCCCCC D10 [1,1,0,0,0,0|1,0,1]=4
18  B9R0.45  CCCCCCCCCO F09 [1,1,0,0,0,0|1,0,1]=4
19  B9R0.45  CCOCCOCCOC ME2 [1,1,0,0,0,0|1,0,1]=4
20  B9R0.47  CCCCNC(=O)[C@H](C)N UM2 [1,1,0,0,0,0|1,0,0]=3
21  B11R0.141  CCCC(=O)OC[C@@H](C(=O)O)N 432 [0,2,0,0,0,0|1,0,1]=4
22  B11R0.180  CCCC(=O)SCC[N+](C)(C)C BCH [0,2,0,0,0,0|1,1,0]=4
23  B9R1.75  CCOC(=O)C[C@H]1CO1 IXW [1,0,0,1,0,0|2,0,0]=4