0  B11R1.21  CC1=CCC(CC1=O)C(=C)C TS40910 [0,0,0,0,0,0|0,0,0]=0
1  B11R1.21  CC1=CCC(CC1=O)C(C)C TS10213 [0,0,0,0,0,0|0,0,2]=2
2  B11R1.21  CC1=CCC(CC1O)C(=C)C TS41185 [0,0,0,0,0,0|0,0,2]=2
3  B11R1.21  CC1=CC[C@H](CC1O)C(=C)C TS10204 [0,0,0,0,0,0|0,0,2]=2
4  B11R1.21  CC1CCC(CC1=O)C(C)C TS10483 [0,0,0,0,0,0|0,0,4]=4
5  B11R1.21  CC1CCC(CC1O)C(=C)C TS10489 [0,0,0,0,0,0|0,0,4]=4
6  B11R1.21  CC1CC[C@H](CC1=O)C(C)C TS10502 [0,0,0,0,0,0|0,0,4]=4
7  B11R1.21  CN1CCC(CC1=O)C(=O)O TS91629 [0,0,0,0,0,0|3,0,1]=4
8  B10R1.13  CC1=CCC(=C(C)C)CC1 TS37048 [1,0,0,0,0,0|0,0,3]=4
9  B10R1.13  CC1=CCC(C=C1)C(C)C TS37056 [1,0,0,0,0,0|0,0,3]=4
10  B10R1.13  CC1=CCC(CC1)C(=C)C TS37052 [1,0,0,0,0,0|0,0,1]=2
11  B10R1.13  CC1=CC[C@@H](C=C1)C(C)C TS37050 [1,0,0,0,0,0|0,0,3]=4
12  B10R1.13  CC1=CC[C@@H](CC1)C(=C)C TS37049 [1,0,0,0,0,0|0,0,1]=2
13  B10R1.13  CC1=CC[C@@H](CC1)C(C)C TS06322 [1,0,0,0,0,0|0,0,3]=4
14  B10R1.13  C[C@@H]1CC[C@H](C=C1)C(=C)C TS06123 [1,0,0,0,0,0|0,0,3]=4
15  B10R1.13  Cc1ccc(cc1)C(=C)C TS36715 [1,0,0,0,0,0|0,0,3]=4
16  B10R1.176  CC1=C(CC(CC1)C=O)C TS37225 [1,0,0,0,0,0|2,0,1]=4
17  B12R1.23  CC1=CC[C@@H](CC1=O)C(C)(C)O TS15649 [0,1,0,0,0,0|0,0,2]=3
18  B12R1.367  CN1CCC(CC1=O)C(=O)OC TS90939 [0,1,0,0,0,0|2,0,1]=4
19  B10R0.57  CC=C(C)C(=O)NCC(=O)O TS10845 [0,0,1,0,0,0|3,0,0]=4
20  B10R0.57  CC=C(C)C(=O)OCC(C)C TS41633 [0,0,1,0,0,0|1,0,2]=4
21  B10R0.57  CC=C(C)C(=O)OCC(C)C TS41653 [0,0,1,0,0,0|1,0,2]=4
22  B10R0.82  CC(=C)C(CC=C(C)C=C)O TS10206 [0,0,1,0,0,0|2,0,0]=3
23  B10R0.93  CC(=C)C(=O)OC(=O)C(=C)C TS56225 [0,0,1,0,0,0|2,0,1]=4
24  B10R1.58  CN1CC(CC1=O)C(=O)N TS06673 [0,0,0,0,1,0|3,0,0]=4
25  B10R1.58  CN1CC(CC1=O)C(=O)O TS06828 [0,0,0,0,1,0|3,0,0]=4
26  B9R0.42  CCC(C)OC(=O)C(=C)C TS06702 [1,0,1,0,0,0|1,0,1]=4
27  B9R0.7  CC(=C)COC(=O)C(=C)C TS06472 [1,0,1,0,0,0|1,0,0]=3
28  B9R0.8  CC=C(C)C(=O)OCC=C TS06474 [1,0,1,0,0,0|1,0,0]=3
29  B9R0.8  CCCOC(=O)C(=CC)C TS06700 [1,0,1,0,0,0|1,0,1]=4
30  B9R1.69  CC1CCC(C(=O)C1)C TS05183 [2,0,0,0,0,0|0,0,2]=4
31  B11R1.3  CC(=C)C1CCC(=CC1)C=O TS40892 [1,1,0,0,0,0|0,0,2]=4
32  B11R1.3  CC(=C)C1CCC(=CC1)CO TS10212 [1,1,0,0,0,0|0,0,1]=3
33  B11R1.3  CC(=C)[C@H]1CCC(=CC1)CO TS10222 [1,1,0,0,0,0|0,0,1]=3
34  B11R1.226  CNC(=O)C1CC(=O)N(C1)C TS10688 [0,1,0,0,1,0|2,0,0]=4