0  B11R1.20  CC(=O)NC1CCC(=O)CC1 CS-M1862 [0,0,0,0,0,0|0,0,0]=0
1  B11R1.20  O=C(O)CC1CCC(O)CC1 CS-W021411 [0,0,0,0,0,0|2,0,2]=4
2  B10R1.18  O=C(O)CC1CCCCC1 CS-W019439 [1,0,0,0,0,0|2,0,1]=4
3  B10R0.55  COC(=O)CCCCC(=O)O CS-W017938 [0,0,1,0,0,0|3,0,0]=4
4  B10R1.13  CC(=O)C1CCN(C)CC1 CS-0042169 [0,0,0,0,1,0|2,0,0]=3
5  B10R1.13  CC(=O)N1CCC(=O)CC1 CS-W018303 [0,0,0,0,1,0|1,0,0]=2
6  B10R1.13  CC(=O)N1CCC(N)CC1 CS-W008618 [0,0,0,0,1,0|2,0,1]=4
7  B10R1.13  CC(C)C1CCC(=O)CC1 CS-W011030 [0,0,0,0,1,0|1,0,1]=3
8  B10R1.13  CC1CCC(C(=O)O)CC1 CS-0096911 [0,0,0,0,1,0|2,0,1]=4
9  B10R1.13  NC(=O)C1CCC(=O)CC1 CS-W022230 [0,0,0,0,1,0|1,0,0]=2
10  B9R1.1  CCC1CCC(=O)CC1 CS-W011153 [2,0,0,0,0,0|0,0,1]=3
11  B9R1.1  CN[C@H]1CC[C@H](O)CC1 CS-W019271 [2,0,0,0,0,0|0,0,2]=4
12  B9R1.1  N#CC1CCC(=O)CC1 CS-D0281 [2,0,0,0,0,0|1,0,1]=4
13  B9R1.8  CCNC1CCOCC1 CS-0040480 [2,0,0,0,0,0|1,0,1]=4
14  B11R0.176  CCOC(=O)CCCCC(=O)O CS-W020587 [0,1,1,0,0,0|2,0,0]=4
15  B11R1.22  COC(=O)C1CCC(=O)CC1 CS-W005848 [1,1,0,0,0,0|2,0,0]=4
16  B11R1.21  CN1CC(C(=O)O)CCC1=O CS-0052432 [0,1,0,0,1,0|2,0,0]=4
17  B11R1.727  O=C(O)C1CCS(=O)(=O)CC1 CS-W005642 [0,1,0,0,1,0|2,0,0]=4
18  B13R1.19  CCOC(=O)CC1CCC(=O)CC1 CS-M3542 [0,2,0,0,0,0|1,0,0]=3
19  B11R2.703  O=C1CC2(CCNCC2)N1 CS-0012646 [1,0,0,1,0,0|1,0,0]=3
20  B11R2.66  O=C1CN2C(=O)CCC2N1 CS-0026742 [0,0,0,1,1,0|1,0,0]=3
21  B13R2.5120  O=C1CCC2(CC1)CCC(=O)N2 CS-W019326 [0,0,0,1,0,1|2,0,0]=4
22  B9R0.1  COC(=O)CCCC(C)=O CS-0090564 [0,0,1,0,1,0|1,0,0]=3
23  B9R0.7  C[C@H](CCC(=O)O)C(=O)O CS-0063209 [0,0,1,0,1,0|2,0,0]=4
24  B9R1.6  CC(=O)C1CCCCC1 CS-W007597 [1,0,0,0,1,0|0,0,1]=3
25  B9R1.6  CC(=O)C1CCOCC1 CS-D1226 [1,0,0,0,1,0|1,0,0]=3
26  B9R1.6  CC(=O)N1CCNCC1 CS-W007382 [1,0,0,0,1,0|2,0,0]=4
27  B9R1.6  O=C(O)C1CC=CCC1 CS-W011160 [1,0,0,0,1,0|1,0,1]=4
28  B9R1.6  O=C(O)C1CCNCC1 CS-D1472 [1,0,0,0,1,0|2,0,0]=4
29  B9R1.35  O=C1CC[C@@H](C(=O)O)O1 CS-D0218 [0,0,0,0,2,0|2,0,0]=4