0  B7R0.6  CC(=O)CCN(C)C BB55-6125 [0,0,0,0,0,0|2,0,1]=3
1  B7R0.6  CC(=O)NCC(=O)O BB01-2573 [0,0,0,0,0,0|2,0,0]=2
2  B7R0.6  CC(C)OCC(=O)O BB55-5141 [0,0,0,0,0,0|1,0,1]=2
3  B6R0.4  CC(C)CCC=O BB58-4980 [1,0,0,0,0,0|0,0,2]=3
4  B6R0.4  CC(C)OCCO BB01-5911 [1,0,0,0,0,0|1,0,2]=4
5  B6R0.4  CCNCC(=O)O BB20-0183 [1,0,0,0,0,0|1,0,1]=3
6  B6R0.4  O=CNCC(=O)O BB01-7318 [1,0,0,0,0,0|2,0,0]=3
7  B8R0.9  CCC(=O)COC(C)=O BB58-4502 [0,1,0,0,0,0|3,0,0]=4
8  B8R0.9  COC(=O)CCC(=O)Cl BB57-0253 [0,1,0,0,0,0|2,0,1]=4
9  B8R0.23  CC(C)C(N)CC(=O)O BB01-4066 [0,1,0,0,0,0|0,0,2]=3
10  B8R0.23  CC(C)NC(=O)C(=O)O BB55-4701 [0,1,0,0,0,0|1,0,2]=4
11  B8R1.3  CC1=CC=C(O)N=N1 BB55-6305 [0,0,0,1,0,0|2,0,1]=4
12  B8R1.3  CC1=NNC(=O)CC1 BB55-6123 [0,0,0,1,0,0|2,0,1]=4
13  B6R0.2  CC(C)=CC(=O)Cl BB20-1413 [0,0,0,0,1,0|1,0,0]=2
14  B6R0.2  CC(C)CB(O)O BB01-8323 [0,0,0,0,1,0|1,0,2]=4
15  B6R0.2  CN(C)CC(N)=S BB58-0525 [0,0,0,0,1,0|2,1,0]=4
16  B8R0.28  O=C(O)CSCC(=O)O BB01-8012 [0,0,0,0,0,1|2,0,1]=4
17  B7R0.3  COC(=O)CCSC BB01-5905 [1,1,0,0,0,0|1,0,1]=4
18  B7R0.4  CCOCCC(=O)O BB57-3742 [1,1,0,0,0,0|0,0,2]=4
19  B7R0.4  CNCCCC(=O)O BB58-0143 [1,1,0,0,0,0|0,0,2]=4
20  B9R0.1  COC(=O)CCCC(C)=O BB58-1963 [0,1,0,0,0,1|1,0,1]=4
21  B9R0.7  CC(=O)N(C)CCC(=O)O BB32-3040 [0,1,0,0,0,1|1,0,1]=4
22  B9R0.7  CC(C)C(=O)NCC(=O)O BB58-4050 [0,1,0,0,0,1|0,0,1]=3
23  B9R0.7  CC(N)C(=O)NCC(=O)O BB58-5125 [0,1,0,0,0,1|1,0,1]=4
24  B9R0.7  C[S+](C)CC[C@H](N)C(=O)O BB55-8164 [0,1,0,0,0,1|1,0,1]=4
25  B9R0.53  CC(C)CC(N)CC(=O)O BB57-0289 [0,1,0,0,0,1|0,0,2]=4
26  B9R0.23  COC(=O)C(=O)CC(C)=O BB17-2983 [0,2,0,0,0,0|2,0,0]=4
27  B9R0.23  COC(=O)C(N)CC(C)C BB58-4604 [0,2,0,0,0,0|0,0,2]=4
28  B9R0.42  CC(NC(=O)CN)C(=O)O BB58-4661 [0,2,0,0,0,0|2,0,0]=4
29  B9R0.43  CCN(CC)CCC(=O)O BB58-0846 [0,2,0,0,0,0|1,0,1]=4
30  B9R0.48  CCOC(=O)\C=C\N(C)C BB20-1121 [0,2,0,0,0,0|1,0,1]=4
31  B9R0.39  CCC(NC(C)=O)C(=O)O BB57-4742 [0,2,0,0,0,0|2,0,0]=4
32  B7R1.20  O=C(O)CC1CC1 BB57-3745 [1,0,0,1,0,0|0,0,2]=4
33  B9R1.35  CC1=CC=C(C(=O)O)O1 BB58-0337 [0,0,0,1,0,1|1,0,1]=4
34  B9R1.35  CC1=CC=C(C(=O)O)S1 BB55-0510 [0,0,0,1,0,1|1,0,1]=4
35  B9R1.35  O=C1CCC(C(=O)O)C1 BB01-6440 [0,0,0,1,0,1|1,0,1]=4
36  B5R0.5  CC(C)C(N)=O BB01-6147 [0,0,0,0,2,0|1,0,1]=4