0  B7R0.4  CCCCCC(=O)O T3944 [0,0,0,0,0,0|0,0,4]=4
1  B7R0.4  C\C=C\C=C\C(=O)[O-] T4807 [0,0,0,0,0,0|0,0,1]=1
2  B6R0.4  CCCCC(=O)O T4792 [1,0,0,0,0,0|0,0,3]=4
3  B8R0.5  CCOC(=O)CC(=O)O T4773 [0,1,0,0,0,0|1,0,2]=4
4  B8R1.1  CC1=CC=C(C=O)O1 TCP2934 [0,0,0,1,0,0|2,0,0]=3
5  B8R1.4  O=C1C=CNC(=O)N1 BBP01113 [0,0,0,1,0,0|3,0,0]=4
6  B8R1.4  OC1=CC=CC(O)=C1 BBP01971 [0,0,0,1,0,0|2,0,0]=3
7  B8R1.7  O=C(O)C1=CC=CO1 BBP02308 [0,0,0,1,0,0|1,0,0]=2
8  B8R1.7  O=C(O)C1=COC=C1 BBP04181 [0,0,0,1,0,0|1,0,1]=3
9  B5R0.1  CCCC(=O)O T3943 [2,0,0,0,0,0|0,0,2]=4
10  B7R0.6  CC(=O)NCC(=O)O T4822 [1,1,0,0,0,0|1,0,1]=4
11  B7R0.6  O=C(O)\C=C/C(=O)O T4913 [1,1,0,0,0,0|1,0,0]=3
12  B7R0.6  O=C(O)\C=C\C(=O)O BBP00430 [1,1,0,0,0,0|1,0,0]=3
13  B7R0.6  O=C(O)\C=C\C(=O)O T3763 [1,1,0,0,0,0|1,0,0]=3
14  B7R1.3  Nc1ccccc1 T4777 [1,0,0,1,0,0|2,0,0]=4
15  B7R1.3  O=C1C=CCCN1 BBP02874 [1,0,0,1,0,0|1,0,1]=4
16  B7R1.3  OC1=CC=CC=C1 TCS0927 [1,0,0,1,0,0|1,0,0]=3
17  B9R1.34  CC1=CC(O)=CC(O)=C1 BBP01205 [0,1,0,1,0,0|1,0,0]=3
18  B9R1.34  Cc1cc(O)cc(O)c1 T3748 [0,1,0,1,0,0|1,0,0]=3
19  B9R1.1  O=CC1=CC=C(O)C=C1 BBP00159 [0,1,0,1,0,0|2,0,0]=4
20  B9R1.1  O=Cc1ccc(O)cc1 T2S1814 [0,1,0,1,0,0|2,0,0]=4
21  B9R1.2  COC1=CC=CC(O)=C1 BBP00254 [0,1,0,1,0,0|1,0,0]=3
22  B9R1.2  OCc1cccc(O)c1 T4760 [0,1,0,1,0,0|1,0,0]=3
23  B9R1.3  CC1=C(O)C(=O)C=CO1 BBP02650 [0,1,0,1,0,0|1,0,0]=3
24  B9R1.3  OC1=CC=CC(O)=C1O BBP01103 [0,1,0,1,0,0|1,0,1]=4
25  B9R1.3  OC1=CC=CC(O)=C1O T3749 [0,1,0,1,0,0|1,0,1]=4
26  B9R1.21  O=CC1=CC=C(CO)O1 BBP01131 [0,1,0,1,0,0|1,0,1]=4
27  B9R1.21  O=Cc1ccc(CO)o1 T2943 [0,1,0,1,0,0|1,0,1]=4
28  B9R1.6  NC(=O)C1=CC=CC=C1 BBP01204 [0,1,0,1,0,0|1,0,1]=4
29  B9R1.6  NC(=O)C1=CC=CN=C1 BBP05373 [0,1,0,1,0,0|1,0,1]=4
30  B9R1.6  NC(=O)C1=CN=CC=C1 T0934 [0,1,0,1,0,0|1,0,1]=4
31  B9R1.6  O=C(O)C1=CC=CC=C1 BBP00049 [0,1,0,1,0,0|0,0,1]=3
32  B9R1.6  O=C(O)C1=CC=CN=C1 BBP05316 [0,1,0,1,0,0|0,0,1]=3
33  B9R1.6  O=C(O)c1ccccc1 T0833 [0,1,0,1,0,0|0,0,1]=3
34  B9R1.6  O=C(O)c1ccccn1 T4850 [0,1,0,1,0,0|0,0,1]=3
35  B9R1.6  O=C(O)c1cccnc1 T0879 [0,1,0,1,0,0|0,0,1]=3
36  B9R1.69  CC1=C(O)C=CC(O)=C1 BBP04832 [0,1,0,1,0,0|1,0,0]=3
37  B9R1.69  Cc1ccc(O)c(O)c1 T4779 [0,1,0,1,0,0|1,0,0]=3