0  B5R0.2  C=CCCCO HY-W010639 [1,0,0,0,0,0|1,1,0]=3
1  B7R0.1  C=CCCCCCO HY-W127475 [0,1,0,0,0,0|2,0,0]=3
2  B7R0.1  COCCOCCBr HY-133277 [0,1,0,0,0,0|1,1,1]=4
3  B7R0.1  COCCOCCO HY-140697 [0,1,0,0,0,0|0,1,2]=4
4  B7R0.1  COCCOCCS HY-140707 [0,1,0,0,0,0|0,2,1]=4
5  B7R0.1  COCCOCCS HY-140709 [0,1,0,0,0,0|0,2,1]=4
6  B7R0.4  NCCNCC(=O)O HY-W012883 [0,1,0,0,0,0|3,0,0]=4
7  B7R0.4  O=C(O)COCCO HY-W591338A [0,1,0,0,0,0|3,0,0]=4
8  B7R0.4  O=C(O)COCCO HY-W591338B [0,1,0,0,0,0|3,0,0]=4
9  B7R0.4  O=C(O)COCCS HY-140728 [0,1,0,0,0,0|3,0,0]=4
10  B7R1.1  O=CN1CCCC1 HY-W102648 [0,0,0,1,0,0|2,0,0]=3
11  B7R1.1  O=NN1CCCC1 HY-W141077 [0,0,0,1,0,0|3,0,0]=4
12  B7R1.3  CC1=CCCCC1 HY-W004338 [0,0,0,1,0,0|2,0,1]=4
13  B7R1.4  CC1OCCC1=O HY-W010608 [0,0,0,1,0,0|2,0,0]=3
14  B7R1.4  NN1CCOC1=O HY-W012982 [0,0,0,1,0,0|3,0,0]=4
15  B4R0.2  CCCNC HY-W250110E [2,0,0,0,0,0|1,0,0]=3
16  B4R0.2  CCCNC HY-W250110I [2,0,0,0,0,0|1,0,0]=3
17  B6R0.4  C#CCCC(=O)O HY-Y1230 [1,1,0,0,0,0|0,0,2]=4
18  B8R0.4  CCCCC\C=C\CO HY-W099724 [0,2,0,0,0,0|1,0,1]=4
19  B8R0.4  CSCCCCN=C=S HY-121323 [0,2,0,0,0,0|0,1,1]=4
20  B8R0.7  C#CCCCCC(=O)O HY-34643 [0,2,0,0,0,0|1,0,1]=4
21  B8R0.7  CC(=O)NCCCCN HY-W342604R [0,2,0,0,0,0|2,0,0]=4
22  B8R0.7  CCCC\C=C\C(=O)O HY-W107869 [0,2,0,0,0,0|1,0,1]=4
23  B8R0.7  NCCCCCC(=O)O HY-B0236 [0,2,0,0,0,0|1,0,0]=3
24  B8R0.7  NCCCNCC(=O)O HY-W077223 [0,2,0,0,0,0|2,0,0]=4
25  B8R0.7  O=C(O)CCCCCO HY-W105750 [0,2,0,0,0,0|1,0,0]=3
26  B8R0.7  O=C(O)CCOCCBr HY-130425 [0,2,0,0,0,0|2,0,0]=4
27  B8R0.8  C#CCCC(N)C(=O)O HY-W259668 [0,2,0,0,0,0|1,0,1]=4
28  B8R0.8  C#CCC[C@H](N)C(=O)O HY-140345A [0,2,0,0,0,0|1,0,1]=4
29  B8R0.8  CCCC[C@H](N)C(=O)O HY-Y0017R [0,2,0,0,0,0|1,0,0]=3
30  B8R0.8  NOCC[C@H](N)C(=O)O HY-129476 [0,2,0,0,0,0|1,1,0]=4
31  B8R0.8  N[13CH2][13CH2][13CH2][13C@H](N)[13C](=O)O HY-W017018S2 [0,2,0,0,0,0|2,0,0]=4
32  B8R0.8  [13CH3]SCC[C@H](N)C(=O)O HY-N0326S3 [0,2,0,0,0,0|0,0,0]=2
33  B8R0.8  [13CH3]S[13CH2][13CH2][13C@H](N)[13C](=O)O HY-N0326S5 [0,2,0,0,0,0|0,0,0]=2
34  B8R0.9  C=CC(N)CCC(=O)O HY-15399 [0,2,0,0,0,0|1,0,1]=4
35  B6R1.2  [C@H]1(F)CCNC1 HY-W004695 [1,0,0,1,0,0|2,0,0]=4
36  B8R1.11  CCN1CCCC1=O HY-B1620D [0,1,0,1,0,0|1,0,0]=3
37  B8R1.11  CCN1CCCC1=O HY-B1620K [0,1,0,1,0,0|1,0,0]=3
38  B8R1.50  CC1C(=O)CCC1=O HY-W012944 [0,1,0,1,0,0|1,0,1]=4
39  B8R1.7  O=C(O)[C@@H]1CCC[15NH]1 HY-Y0252S2 [0,1,0,1,0,0|2,0,0]=4
40  B8R1.7  O=[13C](O)[13C@@H]1[13CH2][13CH2][13CH2]N1 HY-Y0252S [0,1,0,1,0,0|2,0,0]=4
41  B8R2.34  C1=CC2CCC1C2 HY-W013021 [0,0,0,2,0,0|2,0,0]=4