0  B10R0.4  NCCOCCOCC(=O)O CS-0097751 [0,0,0,0,0,0|3,0,0]=3
1  B9R0.45  BrCCCCCCCCBr CS-0007585 [1,0,0,0,0,0|2,0,1]=4
2  B9R0.45  OCCCCCCCCBr CS-0015428 [1,0,0,0,0,0|1,0,1]=3
3  B9R0.45  OCCCCCCCCO CS-W018224 [1,0,0,0,0,0|1,0,1]=3
4  B11R0.42  C=CCCCCC[C@@H](N)C(=O)O CS-M1676 [0,1,0,0,0,0|0,0,2]=3
5  B11R0.148  O=C(O)CCCCCCCCBr CS-W007587 [0,1,0,0,0,0|0,0,0]=1
6  B11R0.159  CCCCCCCCS(=O)(=O)[O-] CS-W009316 [0,1,0,0,0,0|1,0,1]=3
7  B11R0.176  CCOC(=O)CCCCC(=O)O CS-W020587 [0,1,0,0,0,0|1,0,1]=3
8  B11R1.91  O=C(O)CCC1CCCCC1 CS-W018002 [0,0,0,1,0,0|0,0,0]=1
9  B11R1.91  O=C(O)\C=C\C1CCCCC1 CS-0031387 [0,0,0,1,0,0|0,0,2]=3
10  B8R0.4  BrCCCCCCCBr CS-W010166 [2,0,0,0,0,0|2,0,0]=4
11  B8R0.4  CCOCCOCCO CS-0015134 [2,0,0,0,0,0|2,0,0]=4
12  B8R0.4  OCCCCCCCBr CS-W008425 [2,0,0,0,0,0|1,0,0]=3
13  B8R0.7  C=CCCCCC(=O)O CS-0097711 [2,0,0,0,0,0|0,0,2]=4
14  B8R0.7  COCCOCC(=O)O CS-0084611 [2,0,0,0,0,0|2,0,0]=4
15  B8R0.7  O=C(O)CCCCCCl CS-W018132 [2,0,0,0,0,0|1,0,0]=3
16  B10R0.55  COC(=O)CCCCC(=O)O CS-W017938 [1,1,0,0,0,0|1,0,1]=4
17  B10R0.75  [C@H](N)(CCCCCC)C(=O)O CS-W006364 [1,1,0,0,0,0|0,0,0]=2
18  B10R0.97  CC(=O)CCCCCC(=O)O CS-0046839 [1,1,0,0,0,0|0,0,1]=3
19  B10R0.71  C=CCCCCCCCCBr CS-W013154 [1,1,0,0,0,0|1,0,0]=3
20  B10R0.71  OCCCCCCCCCBr CS-B0284 [1,1,0,0,0,0|0,0,1]=3
21  B10R0.71  OCCCCCCOCCO CS-0040286 [1,1,0,0,0,0|1,0,1]=4
22  B12R0.1  CCOC(=O)CCCCCCCBr CS-D1735 [0,2,0,0,0,0|1,0,0]=3
23  B10R1.18  O=C(O)CC1CCCCC1 CS-W019439 [1,0,0,1,0,0|0,0,0]=2
24  B10R1.18  O=C(O)CN1CCOCC1 CS-M2890 [1,0,0,1,0,0|2,0,0]=4
25  B10R1.66  O=C(O)CCC1CCCC1 CS-W018280 [1,0,0,1,0,0|0,0,0]=2
26  B10R1.66  O=C(O)CCN1CCCC1 CS-0035766 [1,0,0,1,0,0|1,0,0]=3
27  B10R1.78  O=C1CCCCCCCN1 CS-0090258 [1,0,0,1,0,0|1,0,0]=3
28  B10R1.29  CCCCN1CCCC1=O CS-W016436 [1,0,0,1,0,0|1,0,0]=3
29  B10R1.85  OCCN1CCCCCC1 CS-B0251 [1,0,0,1,0,0|1,0,1]=4
30  B12R1.43  N[C@@H](CC1CCCCC1)C(=O)O CS-0042555 [0,1,0,1,0,0|0,0,0]=2
31  B12R1.43  N[C@H](CC1CCCCC1)C(=O)O CS-B1050 [0,1,0,1,0,0|0,0,0]=2
32  B12R1.368  COC(=O)[C@H]1CCC[C@H]1C(=O)O CS-M0977 [0,1,0,1,0,0|1,0,1]=4
33  B12R1.255  O=C(O)CCCC[C@H]1CCSS1 CS-W015306 [0,1,0,1,0,0|1,0,0]=3
34  B12R2.2918  O=C1CC2(CCCCC2)CN1 CS-0096868 [0,0,0,2,0,0|2,0,0]=4
35  B12R2.3066  O=C(O)C12CCCN1CCC2 CS-B0605 [0,0,0,2,0,0|1,0,0]=3