0  B8R0.1  C=CCC[C@@H](O)CCC D93149 [0,0,0,0,0,0|1,0,2]=3
1  B7R0.3  CNC(=O)CCCO F10217 [1,0,0,0,0,0|2,0,1]=4
2  B9R0.5  CCCCNC(=O)CCC D86376 [0,1,0,0,0,0|1,0,2]=4
3  B9R0.34  CCOC(=O)C[C@@H](N)CC Y13948 [0,1,0,0,0,0|0,0,2]=3
4  B9R0.34  CCOC(=O)C[C@@H](O)CC D96332 [0,1,0,0,0,0|0,0,2]=3
5  B9R0.35  C=CC[C@H](O)C(=O)OCC AC9119 [0,1,0,0,0,0|0,0,0]=1
6  B9R1.33  COC[C@H]1CCCC1=O 79670 [0,0,0,1,0,0|2,0,1]=4
7  B9R1.69  C[C@@H]1OC(=O)COC1=O D75679 [0,0,0,1,0,0|2,0,0]=3
8  B8R0.19  CC[C@H](N)CC(=O)OC Y11154 [1,1,0,0,0,0|0,0,2]=4
9  B10R0.28  CC(C)(C)OC(=O)CCC=O R10009 [0,2,0,0,0,0|1,0,0]=3
10  B10R0.7  CCOC(=O)CC(C)(C)CN 21300 [0,2,0,0,0,0|1,0,1]=4
11  B10R0.129  CCOC(=O)C(C)(C)CCCl 79409 [0,2,0,0,0,0|1,0,1]=4
12  B8R1.8  C=CC[C@H]1CCCN1 Y11188 [1,0,0,1,0,0|2,0,0]=4
13  B8R1.49  C1=CCCC=CCC1 F10040 [1,0,0,1,0,0|1,0,0]=3
14  B8R1.1  C=C[C@@H]1COC(=O)C1 C12022 [1,0,0,1,0,0|0,0,0]=2
15  B8R1.1  C=C[C@@H]1COC(=O)N1 54688 [1,0,0,1,0,0|1,0,0]=3
16  B8R1.1  C=C[C@@H]1COC(=O)N1 54690 [1,0,0,1,0,0|1,0,0]=3
17  B8R1.1  O=C1C[C@H](CO)CO1 72726 [1,0,0,1,0,0|1,0,1]=4
18  B8R1.3  O=C1CCC(=O)NC1 65254 [1,0,0,1,0,0|2,0,0]=4
19  B8R1.3  O=C1CCS(=O)CC1 D86028 [1,0,0,1,0,0|2,0,0]=4
20  B8R1.38  COC(=O)[C@@H]1CCO1 D96911 [1,0,0,1,0,0|1,0,1]=4
21  B8R1.4  CC1=CCCC(=O)C1 D79894 [1,0,0,1,0,0|1,0,1]=4
22  B8R1.4  C[C@H]1CC(=O)CCO1 P13205 [1,0,0,1,0,0|2,0,0]=4
23  B8R1.4  C[C@H]1CCCC(=O)N1 D85681 [1,0,0,1,0,0|1,0,1]=4
24  B10R1.11  CCOC(=O)[C@@H]1CCON1 AT25326 [0,1,0,1,0,0|1,0,1]=4
25  B10R1.181  CCOC(=O)CC1(N)CC1 AT20149 [0,1,0,1,0,0|0,0,2]=4