0  B11R0.3  CCCCCSCCOCCO CSC011997630 [0,0,0,0,0,0|2,0,2]=4
1  B11R0.3  OCCSCCCCSCCO CSC009999245 [0,0,0,0,0,0|3,0,1]=4
2  B10R0.71  CCCCCCCSCCO CSC011304838 [1,0,0,0,0,0|1,0,1]=3
3  B10R0.71  CCCCSCCOCCO CSC011409991 [1,0,0,0,0,0|2,0,1]=4
4  B12R0.1  CCCCCCCCS(=O)CCO CSC009995003 [0,1,0,0,0,0|1,0,2]=4
5  B12R0.5  CCCCCCCCCSCCO CSC011304840 [0,1,0,0,0,0|0,0,2]=3
6  B12R0.5  CCCCCCCCSCCC#N CSC009848894 [0,1,0,0,0,0|2,0,1]=4
7  B12R0.5  CCCCCCSCCOCCO CSC019110770 [0,1,0,0,0,0|1,0,2]=4
8  B12R0.206  CCCCCCCC(C)NCCO CSC000713784 [0,1,0,0,0,0|1,0,2]=4
9  B12R0.234  CCCCCCCCCOC(=O)C CSC000210669 [0,1,0,0,0,0|2,0,1]=4
10  B12R0.234  CCCCCCCCSCC(=O)N CSC046179943 [0,1,0,0,0,0|3,0,0]=4
11  B12R1.8  OCCCCNC1CCCCC1 CSC000186385 [0,0,0,1,0,0|1,0,2]=4
12  B12R1.8  OCCCNCC1CCCCC1 CSC000200649 [0,0,0,1,0,0|1,0,2]=4
13  B12R1.169  COCC1CCCCN1CCO CSC010278134 [0,0,0,1,0,0|2,0,1]=4
14  B12R1.281  CCC1CCCCCN1CCO CSC012621646 [0,0,0,1,0,0|1,0,2]=4
15  B12R1.1414  OCCCCN1CCCCCC1 CSC011305542 [0,0,0,1,0,0|1,0,2]=4
16  B9R0.45  CCCCCCSCCO CSC011304839 [2,0,0,0,0,0|1,0,0]=3
17  B11R0.81  CCCCCCC(=O)OCC=C CSC000033353 [1,1,0,0,0,0|1,0,1]=4
18  B11R0.81  CCCCCCC(C)NCCO CSC011257444 [1,1,0,0,0,0|1,0,1]=4
19  B11R0.148  CCCCCCCCCC(=O)N CSC011216713 [1,1,0,0,0,0|1,0,0]=3
20  B13R0.66  CCCCCCCCS(=O)CCCO CSC010167664 [0,2,0,0,0,0|0,0,2]=4
21  B13R0.54  CCCCCCCCCCNC(=O)N CSC012710775 [0,2,0,0,0,0|2,0,0]=4
22  B13R0.54  CCCCCCCCCCOC(=O)C CSC000031374 [0,2,0,0,0,0|1,0,1]=4
23  B13R0.54  CCCCCCCCSCCC(=O)N CSC010587829 [0,2,0,0,0,0|2,0,0]=4
24  B13R0.147  CCCCCCCCCCC(=O)NN CSC000048412 [0,2,0,0,0,0|2,0,0]=4
25  B13R0.147  CCCCCCCCCCC(=O)OC CSC011215520 [0,2,0,0,0,0|1,0,1]=4
26  B11R1.5  CC1CCSCCN1CC=C CSC015540934 [1,0,0,1,0,0|2,0,0]=4
27  B11R1.17  CC1CCCCN1CCCO CSC000213889 [1,0,0,1,0,0|1,0,1]=4
28  B11R1.28  OCCCCN1CCCCC1 CSC011305566 [1,0,0,1,0,0|1,0,1]=4
29  B11R1.41  CCN1CCCCC1CCO CSC000228433 [1,0,0,1,0,0|1,0,1]=4
30  B11R1.203  OCCCN1CCCCCC1 CSC000212468 [1,0,0,1,0,0|1,0,1]=4
31  B13R1.28  OCCCCNCC1CCCCC1 CSC011521276 [0,1,0,1,0,0|0,0,2]=4
32  B13R1.343  NC(=O)CCSCCC1CCCO1 CSC020046681 [0,1,0,1,0,0|2,0,0]=4
33  B13R2.3  C1CCN(CC1)C2CCCC=C2 CSC011811444 [0,0,0,2,0,0|2,0,0]=4
34  B13R2.15  CC1CCCN1C2CCCC=C2 CSC015431548 [0,0,0,2,0,0|2,0,0]=4
35  B13R2.2520  OCCNCC1CC2CC1C=C2 CSC000207432 [0,0,0,2,0,0|1,0,0]=3