0  B4R0.2  CCCCC Amb8513659 [0,0,0,0,0,0|2,0,0]=2
1  B4R0.2  CSSSC Amb8393151 [0,0,0,0,0,0|3,0,0]=3
2  B5R0.1  C#CCC(=O)O Amb6272489 [0,1,0,0,0,0|1,0,2]=4
3  B5R0.1  C=C(C)CCO Amb8513522 [0,1,0,0,0,0|1,0,0]=2
4  B5R0.1  CC(C)=CCO Amb4605830 [0,1,0,0,0,0|1,0,1]=3
5  B5R0.1  CC(C)CC=O Amb3939851 [0,1,0,0,0,0|1,0,2]=4
6  B5R0.1  CC(C)CCO Amb4605831 [0,1,0,0,0,0|1,0,0]=2
7  B5R0.1  CCCC(=O)O Amb3939012 [0,1,0,0,0,0|1,0,1]=3
8  B5R0.1  C\C=C\C(=O)O Amb8385856 [0,1,0,0,0,0|1,0,2]=4
9  B5R0.2  CC#CCCO Amb2721725 [0,1,0,0,0,0|1,0,0]=2
10  B5R0.2  CCCCCC Amb2447471 [0,1,0,0,0,0|2,0,0]=3
11  B5R0.3  NC(CO)CO Amb3939868 [0,1,0,0,0,0|2,0,0]=3
12  B5R0.3  OCC(O)CO Amb6608790 [0,1,0,0,0,0|2,0,0]=3
13  B5R1.3  OCC1CO1 Amb8389331 [0,0,0,1,0,0|0,1,0]=2
14  B2R0.1  CCO Amb3938985 [2,0,0,0,0,0|0,0,0]=2
15  B4R0.1  CC(S)CS Amb4034635 [1,1,0,0,0,0|0,1,0]=3
16  B4R0.1  CCC(C)C Amb8513244 [1,1,0,0,0,0|1,0,0]=3
17  B6R0.1  CCCC(=O)CC Amb8513390 [0,2,0,0,0,0|2,0,0]=4
18  B6R0.1  CCCC(=O)OC Amb8516697 [0,2,0,0,0,0|1,0,1]=4
19  B6R0.1  CCCC(O)CC Amb4037277 [0,2,0,0,0,0|1,0,0]=3
20  B6R0.2  CC(C)CC(=O)O Amb3939848 [0,2,0,0,0,0|1,0,1]=4
21  B6R0.3  CC(C)C(N)CO Amb3939342 [0,2,0,0,0,0|1,0,0]=3
22  B6R0.3  CCC(N)C(=O)O Amb2694208 [0,2,0,0,0,0|1,0,1]=4
23  B6R0.3  CNC(C)C(=O)O Amb9271766 [0,2,0,0,0,0|1,0,1]=4
24  B6R0.3  COC(=O)C(C)O Amb3939672 [0,2,0,0,0,0|0,1,1]=4
25  B6R0.3  NC(CO)C(=O)O Amb2690463 [0,2,0,0,0,0|2,0,0]=4
26  B6R0.3  NC(CO)C(=O)O Amb6410375 [0,2,0,0,0,0|2,0,0]=4
27  B6R0.3  NC(CO)C(=O)O Amb8387621 [0,2,0,0,0,0|2,0,0]=4
28  B6R0.3  O=C(O)C(O)CO Amb4166319 [0,2,0,0,0,0|2,0,0]=4
29  B6R0.4  CCCCC(=O)O Amb3939877 [0,2,0,0,0,0|1,0,0]=3
30  B6R0.4  CCCCC(C)O Amb4605977 [0,2,0,0,0,0|1,0,0]=3
31  B6R0.5  C[N+](C)(C)CCO Amb19748170 [0,2,0,0,0,0|1,0,0]=3
32  B6R0.6  C=CCCCCC Amb3940498 [0,2,0,0,0,0|2,0,0]=4
33  B6R0.6  CCCCCC=O Amb3939522 [0,2,0,0,0,0|1,0,1]=4
34  B6R0.6  CCCCCCC Amb8513177 [0,2,0,0,0,0|2,0,0]=4
35  B6R0.6  CCCCCCO Amb3941500 [0,2,0,0,0,0|1,0,0]=3
36  B6R0.6  C\C=C\CCCO Amb22347882 [0,2,0,0,0,0|1,0,0]=3