0  B7R0.1  C(CSSCCO)N S0683 [1,0,0,0,0,0|3,0,0]=4
1  B7R0.1  COCCOCCN S0639 [1,0,0,0,0,0|3,0,0]=4
2  B9R0.2  CC(=O)NCCCCCN S6187 [0,1,0,0,0,0|2,0,1]=4
3  B9R0.2  CCCCCC=CC(=O)O S6162 [0,1,0,0,0,0|0,0,3]=4
4  B9R0.2  CCCCCCCC(=O)O S6296 [0,1,0,0,0,0|0,0,1]=2
5  B9R0.45  C#CCOCCOCCO S1581 [0,1,0,0,0,0|1,0,2]=4
6  B9R0.45  C(CCNCCCN)CN S3653 [0,1,0,0,0,0|2,0,0]=3
7  B9R0.45  C(CNCCNCCN)N S6585 [0,1,0,0,0,0|3,0,0]=4
8  B9R0.45  C(CNCCNCCN)N S6585 [0,1,0,0,0,0|3,0,0]=4
9  B9R0.45  C(COCCI)OCCI S1783 [0,1,0,0,0,0|3,0,0]=4
10  B9R0.45  C(COCCOCCBr)O S1684 [0,1,0,0,0,0|2,0,0]=3
11  B9R0.45  C(COCCOCCN)N S1347 [0,1,0,0,0,0|3,0,0]=4
12  B9R0.45  C(COCCOCCO)N S1650 [0,1,0,0,0,0|2,0,0]=3
13  B9R0.45  C(COCCOCCO)O S1954 [0,1,0,0,0,0|2,0,0]=3
14  B6R0.6  C(CCN)CCN S6357 [2,0,0,0,0,0|2,0,0]=4
15  B6R0.6  C(COCCBr)O S1686 [2,0,0,0,0,0|2,0,0]=4
16  B6R0.6  CCC=CCCO S6059 [2,0,0,0,0,0|0,0,2]=4
17  B8R0.7  C(CCC(=O)O)CCN S1671 [1,1,0,0,0,0|1,0,1]=4
18  B8R0.7  C(CCC(=O)O)CCN S1671 [1,1,0,0,0,0|1,0,1]=4
19  B8R0.7  C(CCC(=O)O)CCN S1671 [1,1,0,0,0,0|1,0,1]=4
20  B10R0.3  CC(CCC=C(C)C)CCO S5584 [0,2,0,0,0,0|0,0,2]=4
21  B10R0.4  C(CCCC(=O)O)CCCN S6082 [0,2,0,0,0,0|0,0,1]=3
22  B10R0.4  CCCCCCCCC(=O)O S4949 [0,2,0,0,0,0|0,0,0]=2
23  B10R0.75  CCCCCCC(C(=O)O)O S5436 [0,2,0,0,0,0|0,0,1]=3
24  B10R0.78  CCCCC(C)CCC(=O)O S6029 [0,2,0,0,0,0|0,0,1]=3
25  B10R0.71  CCCCCCCCCC=O S5376 [0,2,0,0,0,0|0,0,1]=3
26  B10R0.71  COCCOCCOCCN S0667 [0,2,0,0,0,0|2,0,0]=4
27  B10R0.71  COCCOCCOCCO S1953 [0,2,0,0,0,0|1,0,0]=3
28  B8R1.5  C1CCC(C(C1)[NH-])[NH-] S1224 [1,0,0,1,0,0|2,0,0]=4
29  B8R1.5  C1CCC(C(C1)[NH-])[NH-] S1224 [1,0,0,1,0,0|2,0,0]=4
30  B8R1.5  C1CCC(C(C1)[NH-])[NH-] S1224 [1,0,0,1,0,0|2,0,0]=4
31  B10R1.18  C1CCC(CC1)CC(=O)O S6022 [0,1,0,1,0,0|0,0,1]=3