0  B2R0.1  CCO Amb3938985 [1,0,0,0,0,0|1,0,1]=3
1  B4R0.1  CC(S)CS Amb4034635 [0,1,0,0,0,0|1,1,0]=3
2  B4R0.1  CCC(C)C Amb8513244 [0,1,0,0,0,0|2,0,0]=3
3  B4R0.1  O=CC(=O)O Amb3940872 [0,1,0,0,0,0|2,0,1]=4
4  B1R0.1  CO Amb2793005 [2,0,0,0,0,0|0,0,1]=3
5  B5R0.1  C#CCC(=O)O Amb6272489 [0,2,0,0,0,0|2,0,0]=4
6  B5R0.1  C=C(C)CCO Amb8513522 [0,2,0,0,0,0|2,0,0]=4
7  B5R0.1  CC(C)=CCO Amb4605830 [0,2,0,0,0,0|1,0,1]=4
8  B5R0.1  CC(C)CC=O Amb3939851 [0,2,0,0,0,0|1,0,0]=3
9  B5R0.1  CC(C)CCO Amb4605831 [0,2,0,0,0,0|1,0,1]=4
10  B5R0.1  CC(C)N=C=S Amb6565430 [0,2,0,0,0,0|1,1,0]=4
11  B5R0.1  CCCC(=O)O Amb3939012 [0,2,0,0,0,0|2,0,0]=4
12  B5R0.1  C\C=C\C(=O)O Amb8385856 [0,2,0,0,0,0|2,0,0]=4
13  B5R0.3  NC(CO)CO Amb3939868 [0,2,0,0,0,0|2,0,0]=4
14  B5R0.3  OCC(O)CO Amb6608790 [0,2,0,0,0,0|1,0,1]=4
15  B5R0.5  CC(=O)C(=O)O Amb932807 [0,2,0,0,0,0|1,0,1]=4
16  B5R0.5  CC(=O)N(C)C Amb2793066 [0,2,0,0,0,0|1,0,0]=3
17  B5R0.5  CC(N)C(=O)O Amb3940457 [0,2,0,0,0,0|2,0,0]=4
18  B5R0.5  CC(N)C(=O)O Amb6298336 [0,2,0,0,0,0|2,0,0]=4
19  B5R0.5  CC(O)C(=O)O Amb6600026 [0,2,0,0,0,0|2,0,0]=4
20  B5R0.5  CC(O)C(C)O Amb8514566 [0,2,0,0,0,0|1,0,1]=4
21  B5R1.3  OCC1CO1 Amb8389331 [0,1,0,1,0,0|1,0,1]=4