0  B7R0.6  CC(=O)CCC(=O)O Amb534169 [0,0,0,0,0,0|3,0,1]=4
1  B6R0.4  CC(C)CN=C=S Amb6565431 [1,0,0,0,0,0|1,1,1]=4
2  B6R0.4  CCCCC(=O)O Amb3939877 [1,0,0,0,0,0|2,0,0]=3
3  B6R0.4  CCCCC(C)O Amb4605977 [1,0,0,0,0,0|1,0,2]=4
4  B8R0.23  CC(C)CC(N)C(=O)O Amb2720579 [0,1,0,0,0,0|2,0,0]=3
5  B8R0.23  CC(C)CC(N)C(=O)O Amb4134814 [0,1,0,0,0,0|2,0,0]=3
6  B6R0.2  CC(C)CC(=O)O Amb3939848 [0,0,0,0,1,0|1,0,0]=2
7  B5R0.1  C=C(C)CCO Amb8513522 [2,0,0,0,0,0|2,0,0]=4
8  B5R0.1  CC(C)CC=O Amb3939851 [2,0,0,0,0,0|0,0,0]=2
9  B5R0.1  CC(C)CCO Amb4605831 [2,0,0,0,0,0|0,0,2]=4
10  B5R0.1  CCCC(=O)O Amb3939012 [2,0,0,0,0,0|1,0,0]=3
11  B5R0.2  CCCCCC Amb2447471 [2,0,0,0,0,0|1,0,1]=4
12  B7R0.4  CCCCCC(=O)O Amb3939846 [1,1,0,0,0,0|2,0,0]=4
13  B7R0.4  CCCCCC(C)C Amb8513253 [1,1,0,0,0,0|1,0,1]=4
14  B7R0.4  CCC\C=C\C(=O)O Amb2688715 [1,1,0,0,0,0|2,0,0]=4
15  B7R0.4  NCCCCC(=O)O Amb3941646 [1,1,0,0,0,0|2,0,0]=4
16  B7R0.5  CCCC(N)C(=O)O Amb8514700 [1,1,0,0,0,0|2,0,0]=4
17  B7R0.5  CCCC(N)C(=O)O Amb8514701 [1,1,0,0,0,0|2,0,0]=4
18  B7R0.9  C[N+](C)(C)CC(=O)O Amb6599998 [0,1,0,0,1,0|2,0,0]=4
19  B7R0.16  CC(C)C(N)C(=O)O Amb2720566 [0,1,0,0,1,0|1,0,0]=3
20  B7R0.16  CC(O)C(N)C(=O)O Amb6297293 [0,1,0,0,1,0|2,0,0]=4
21  B7R0.16  CC(O)C(N)C(=O)O Amb6599999 [0,1,0,0,1,0|2,0,0]=4
22  B7R0.16  CC(O)C(N)C(=O)O Amb8514159 [0,1,0,0,1,0|2,0,0]=4
23  B9R0.56  CC(=O)OCC[N+](C)(C)C Amb4605813 [0,1,0,0,0,1|1,0,0]=3
24  B9R0.11  CC(C)C(C)(O)CC(=O)O Amb18991699 [0,2,0,0,0,0|2,0,0]=4
25  B7R1.3  O=C1COCCN1 Amb15691115 [1,0,0,1,0,0|2,0,0]=4
26  B5R0.5  CC(=O)N(C)C Amb2793066 [0,0,0,0,2,0|1,0,0]=3
27  B5R0.5  CC(N)C(=O)O Amb3940457 [0,0,0,0,2,0|2,0,0]=4
28  B5R0.5  CC(N)C(=O)O Amb6298336 [0,0,0,0,2,0|2,0,0]=4
29  B5R0.5  CC(O)C(=O)O Amb6600026 [0,0,0,0,2,0|2,0,0]=4