0  B9R0.17  CCCP(CCC)CCC MC444860 [0,0,0,0,0,0|0,1,0]=1
1  B9R0.17  CCOP(OCC)OCC MC41970 [0,0,0,0,0,0|3,1,0]=4
2  B9R0.17  OCCN(CCO)CCO MC21131 [0,0,0,0,0,0|3,0,0]=3
3  B10R0.90  CCOC(CCCN)OCC CS20568 [0,1,0,0,0,0|3,0,0]=4
4  B10R1.10  CCCC1CCCC(=O)C1 MC106166 [0,0,0,1,0,0|2,0,1]=4
5  B10R1.10  CCCC1CCCC(O)C1 MC106169 [0,0,0,1,0,0|2,0,0]=3
6  B10R1.10  CCNC1CCCN(C)C1 MC103677 [0,0,0,1,0,0|3,0,0]=4
7  B10R1.10  CN1CCCC(CCN)C1 MC105153 [0,0,0,1,0,0|3,0,0]=4
8  B10R1.10  CN1CCCC(CCN)C1 MC105639 [0,0,0,1,0,0|3,0,0]=4
9  B7R0.7  CN(CCCl)CCCl CS11572 [2,0,0,0,0,0|2,0,0]=4
10  B7R0.12  CCN(CC)CCCl CS16184 [2,0,0,0,0,0|1,0,0]=3
11  B7R0.12  CCN(CC)CCN MC21046 [2,0,0,0,0,0|1,0,0]=3
12  B9R1.8  BrCCN1CCCCC1 CS16757 [1,0,0,1,0,0|1,0,0]=3
13  B9R1.8  BrCCN1CCOCC1 CS16378 [1,0,0,1,0,0|2,0,0]=4
14  B9R1.8  BrCCN1CCOCC1 CS20883 [1,0,0,1,0,0|2,0,0]=4
15  B9R1.8  C#CCN1CCCCC1 CS15416 [1,0,0,1,0,0|0,0,2]=4
16  B9R1.8  CCNC1CCCCC1 CS11778 [1,0,0,1,0,0|2,0,0]=4
17  B9R1.8  ClCCN1CCCCC1 CS19629 [1,0,0,1,0,0|1,0,0]=3
18  B9R1.8  ClCCN1CCOCC1 CS19905 [1,0,0,1,0,0|2,0,0]=4
19  B9R1.8  FCCN1CCNCC1 CS17106 [1,0,0,1,0,0|2,0,0]=4
20  B9R1.8  FCCN1CCNCC1 MC111122 [1,0,0,1,0,0|2,0,0]=4
21  B9R1.8  NCCC1CCCCC1 CS18358 [1,0,0,1,0,0|2,0,0]=4
22  B9R1.8  NCCN1CCCCC1 CS16099 [1,0,0,1,0,0|1,0,0]=3
23  B9R1.8  NCCN1CCNCC1 CS11705 [1,0,0,1,0,0|2,0,0]=4
24  B9R1.8  OCCN1CCNCC1 CS13442 [1,0,0,1,0,0|2,0,0]=4
25  B9R1.8  OCCN1CCOCC1 CS11708 [1,0,0,1,0,0|2,0,0]=4
26  B9R1.8  OCCN1CCSCC1 CS18622 [1,0,0,1,0,0|2,0,0]=4
27  B9R1.14  CCN1CCCC1CN CS10140 [1,0,0,1,0,0|1,0,0]=3