0  B12R0.337  CCCCC(=C(Br)Br)C(=O)OCC CNP0282639.0 [0,0,0,0,0,0|2,0,1]=3
1  B11R0.36  CCCCN(CCCC)C(=O)C CNP0611687.0 [1,0,0,0,0,0|2,0,1]=4
2  B11R0.191  C=COC(=O)C(CC)CCCC CNP0559773.0 [1,0,0,0,0,0|0,0,3]=4
3  B11R0.191  CCCCC(CC)C(=O)OCC CNP0003276.0 [1,0,0,0,0,0|0,0,1]=2
4  B13R1.1601  CCCCC1C(=O)CC(CC1=O)C CNP0563635.0 [0,0,0,1,0,0|1,0,0]=2
5  B13R1.3230  CC[C@H]1C(=O)[C@@H](CC[C@@H]1C)C(C)C CNP0153017.1 [0,0,0,1,0,0|2,0,1]=4
6  B13R1.3230  CC[C@H]1C(=O)[C@H](CC[C@@H]1C)C(C)C CNP0153017.2 [0,0,0,1,0,0|2,0,1]=4
7  B10R0.16  CCCCC(C=O)CCCC CNP0136450.0 [2,0,0,0,0,0|1,0,1]=4
8  B10R0.17  CCCCC(C(=O)O)C(=O)O CNP0456271.0 [2,0,0,0,0,0|1,0,0]=3
9  B10R0.17  CCN=CC(C(=O)C)C(=O)C CNP0029724.0 [2,0,0,0,0,0|1,0,1]=4
10  B10R0.85  CCCC[C@@H](CC)C(=O)OC CNP0295957.1 [2,0,0,0,0,0|0,0,1]=3
11  B10R0.85  CCOC[C@@H](NC)C(=O)OC CNP0524975.1 [2,0,0,0,0,0|2,0,0]=4
12  B10R0.85  CCOC[C@H](NC)C(=O)OC CNP0524975.2 [2,0,0,0,0,0|2,0,0]=4
13  B10R0.85  CN[C@@H](CCSC)C(=O)OC CNP0087048.1 [2,0,0,0,0,0|2,0,0]=4
14  B10R0.19  CCCCC(O)C(=O)OCC CNP0612227.0 [2,0,0,0,0,0|0,0,1]=3
15  B10R0.19  CCCC[C@H](Br)C(=O)OCC CNP0154903.1 [2,0,0,0,0,0|1,0,0]=3
16  B10R0.19  CCOC(=O)[C@@H](N)CCSC CNP0177391.1 [2,0,0,0,0,0|2,0,0]=4
17  B14R0.123  CCOC(=O)[C@H](CSC(=O)C)NC(=O)C CNP0099559.1 [0,1,0,0,0,1|1,0,1]=4
18  B14R0.2450  CCOC(=O)[C@@H](CCSC)NC(=O)CN CNP0365953.2 [0,1,0,0,0,1|1,0,0]=3
19  B14R0.2450  CCOC(=O)[C@H](CCSC)NC(=O)CN CNP0365953.1 [0,1,0,0,0,1|1,0,0]=3
20  B14R0.1084  C=CCCC(C(=O)OCC)C(=O)OCC CNP0199658.0 [0,2,0,0,0,0|0,0,2]=4
21  B12R1.317  CCOC(=O)[C@@H]1CCC[N+]1(C)C CNP0263585.1 [1,0,0,1,0,0|2,0,0]=4
22  B12R1.893  CC(C)[C@@H]1CC[C@@H]([C@H](C1=O)C)C CNP0323339.1 [1,0,0,1,0,0|1,0,1]=4
23  B12R1.542  C/C=C\1/C(=O)OCC[C@@H]1CCO CNP0204624.1 [1,0,0,1,0,0|1,0,1]=4
24  B14R1.7271  CCOC(=O)[C@@H]1C(=C(C)C)CC[C@@H]1C CNP0045426.4 [0,0,0,1,0,1|1,0,1]=4
25  B14R1.7271  CCOC(=O)[C@@H]1C(=C(C)C)CC[C@H]1C CNP0045426.3 [0,0,0,1,0,1|1,0,1]=4
26  B14R1.7271  CCOC(=O)[C@H]1C(=C(C)C)CC[C@@H]1C CNP0045426.1 [0,0,0,1,0,1|1,0,1]=4
27  B14R1.7271  CCOC(=O)[C@H]1C(=C(C)C)CC[C@H]1C CNP0045426.2 [0,0,0,1,0,1|1,0,1]=4
28  B14R0.2537  CCCCN(CCC(=O)OCC)C(=O)C CNP0609105.0 [0,0,0,0,0,2|1,0,0]=3