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3  B9R0.53  CC(C)CC(C)CC(=O)O Z352782544 [1,0,0,0,0,0|3,0,0]=4
4  B9R0.53  CC(CC(=O)O)CN(C)C Z2824350104 [1,0,0,0,0,0|2,0,1]=4
5  B9R0.56  CC(=O)OCC[N+](C)(C)C Z600425176 [1,0,0,0,0,0|1,0,0]=2
6  B9R0.56  CC(C)(C)CCCC(=O)O Z819995404 [1,0,0,0,0,0|3,0,0]=4
7  B9R0.56  CC(C)(C)NCCC(=O)N Z382711920 [1,0,0,0,0,0|3,0,0]=4
8  B9R0.56  C[N+](C)(C)CCOC(=O)N Z1255415481 [1,0,0,0,0,0|0,0,0]=1
9  B9R0.56  C[N+](C)(C)NCCC(=O)[O-] Z1198155653 [1,0,0,0,0,0|3,0,0]=4
10  B11R0.208  CC(C)(C)CC(C)(C)NC(=O)N Z839077184 [0,1,0,0,0,0|2,0,0]=3
11  B11R1.76  CC(C)(C)CC1CNC(=O)C1 Z1270255672 [0,0,0,1,0,0|2,0,0]=3
12  B9R0.10  CC(CC(=O)O)C(C)(C)C Z352782682 [0,0,0,0,1,0|3,0,0]=4
13  B9R0.57  CC(C)(C)CC(N)C(=O)O Z1492781338 [0,0,0,0,1,0|3,0,0]=4
14  B9R0.57  CC(C)(C)CC(O)C(=O)O Z1041195612 [0,0,0,0,1,0|3,0,0]=4
15  B9R0.57  CC(CC(C)(C)C)C(=O)O Z1198149948 [0,0,0,0,1,0|2,0,0]=3
16  B9R0.57  CC(CC(C)(C)N)C(=O)O Z1742056030 [0,0,0,0,1,0|3,0,0]=4
17  B11R0.34  C[N+](C)(C)CC(O)CCC(=O)[O-] Z1896737076 [0,0,0,0,0,1|3,0,0]=4
18  B8R0.5  COCC(C)NC(=O)N Z56989549 [2,0,0,0,0,0|2,0,0]=4
19  B8R0.28  CC(C)CCNC(=O)N Z56904577 [2,0,0,0,0,0|2,0,0]=4
20  B10R0.92  CC(C)(C)CCC(N)C(=O)N Z1889917254 [1,1,0,0,0,0|2,0,0]=4
21  B10R0.95  CNC(CC(C)(C)C)C(=O)O Z1041195030 [0,1,0,0,1,0|2,0,0]=4
22  B10R0.163  CC(C)(C)CC(C)(C)C(=O)O Z1262511189 [0,1,0,0,1,0|2,0,0]=4
23  B10R1.95  CC1(CCC(C1)CC=O)C Z3271409982 [1,0,0,1,0,0|2,0,0]=4
24  B10R1.329  CC1CC(=O)CC(C1)(C)C Z104472308 [1,0,0,1,0,0|2,0,0]=4
25  B10R1.54  CC(C)CC1CNC(=O)C1 Z1198235319 [1,0,0,1,0,0|2,0,0]=4
26  B10R1.54  CN(C)CC1CNC(=O)C1 Z3378088376 [1,0,0,1,0,0|1,0,1]=4
27  B10R1.330  CC1CNC(=O)CC(C1)C Z1203735002 [1,0,0,1,0,0|2,0,0]=4
28  B10R1.302  CC1(CCOC(=O)CC1)C Z1278923571 [1,0,0,1,0,0|2,0,0]=4
29  B10R1.147  CC1CC(CCC1=O)(C)C Z1330860174 [0,0,0,1,1,0|2,0,0]=4
30  B10R1.147  CC1CC(CNC1=O)(C)C Z1649611706 [0,0,0,1,1,0|1,0,0]=3
31  B8R0.23  CC(C)CC(C)C(=O)O Z756390494 [1,0,0,0,1,0|2,0,0]=4
32  B8R0.23  CC(CN(C)C)C(=O)O Z2106602539 [1,0,0,0,1,0|1,0,1]=4
33  B8R0.29  CC(=O)CCC(C)(C)C Z992965824 [1,0,0,0,1,0|2,0,0]=4
34  B8R0.29  CC(C)(C)CCC(=N)N Z3481620976 [1,0,0,0,1,0|2,0,0]=4
35  B8R0.29  CC(C)(C)CCC(=O)O Z819990896 [1,0,0,0,1,0|2,0,0]=4
36  B8R0.29  CC(C)(C)CNC(=O)N Z763367008 [1,0,0,0,1,0|2,0,0]=4
37  B8R0.29  CC(C)(C)NCC(=O)N Z104690680 [1,0,0,0,1,0|2,0,0]=4
38  B8R0.27  CC(C(=O)O)C(C)(C)C Z792377250 [0,0,0,0,2,0|2,0,0]=4
39  B8R0.27  CC(C)(C)[C@H](N)C(=O)N Z1274177433 [0,0,0,0,2,0|2,0,0]=4
40  B10R0.96  CC(CN(C)C)OCC(=O)O Z2740196787 [1,0,0,0,0,1|1,0,1]=4
41  B10R0.15  C[N+](C)(C)CCCCC(=O)O Z1262519915 [1,0,0,0,0,1|2,0,0]=4