0  B10R0.31  CC(CC(=O)O)CC(C)(C)C S415006 [0,0,0,0,0,0|3,0,0]=3
1  B10R0.31  C[N+](C)(C)C[C@@H](O)CC(=O)[O-] CDS013585 [0,0,0,0,0,0|3,0,0]=3
2  B9R0.44  C=COC(=O)C[N+](C)(C)C R240613 [1,0,0,0,0,0|1,0,2]=4
3  B9R0.44  C=COC(=O)C[N+](C)(C)C R240966 [1,0,0,0,0,0|1,0,2]=4
4  B9R0.56  CC(=O)O[Hg]CC(C)(C)C S881805 [1,0,0,0,0,0|2,0,0]=3
5  B11R0.208  CC(=CC(C)(C)CC(C)(C)C)C S430013 [0,1,0,0,0,0|3,0,0]=4
6  B11R0.208  CC(=O)NC(C)(C)CC(C)(C)C R701432 [0,1,0,0,0,0|2,0,0]=3
7  B11R1.76  CC1=CC=C(O1)C[N+](C)(C)C S302872 [0,0,0,1,0,0|1,0,2]=4
8  B11R1.710  CC(=O)OC1CCS(=O)(=O)C1 PH004385 [0,0,0,1,0,0|3,0,0]=4
9  B9R0.57  CC(CC(C)(C)N)C(=O)O T160466 [0,0,0,0,1,0|3,0,0]=4
10  B8R0.21  CC(C)(S)CCOC=O CDS012047 [2,0,0,0,0,0|2,0,0]=4
11  B8R0.24  C=CC(C)CC(C)(C)C S431591 [2,0,0,0,0,0|1,0,1]=4
12  B8R0.28  C=C(C)CCOC(=O)C S881171 [2,0,0,0,0,0|1,0,1]=4
13  B8R0.28  CC(=O)CCCC(C)C CDS000306 [2,0,0,0,0,0|2,0,0]=4
14  B8R0.28  CC(=O)CCCN(C)C PH014778 [2,0,0,0,0,0|1,0,1]=4
15  B8R0.28  CC(=O)CCOC(=O)C PH003361 [2,0,0,0,0,0|2,0,0]=4
16  B8R0.28  CC(=O)OCCN(C)C PH011981 [2,0,0,0,0,0|0,0,1]=3
17  B10R0.60  C=CC(=O)NCC[N+](C)(C)C T300799 [1,1,0,0,0,0|1,0,1]=4
18  B10R0.60  CCC(=O)OCC[N+](C)(C)C S442631 [1,1,0,0,0,0|0,0,0]=2
19  B10R0.60  COC(=O)CCN[N+](C)(C)C S196320 [1,1,0,0,0,0|2,0,0]=4
20  B10R0.138  [C@H](CO)(NC(=O)C)C(C)(C)C R538736 [0,1,0,0,1,0|2,0,0]=4
21  B12R0.499  CC(C)(C)CC(C)(C)NC(=O)CCl PH015372 [0,2,0,0,0,0|2,0,0]=4
22  B10R1.302  C[N+]1(CCNC(=O)CC1)C T281166 [1,0,0,1,0,0|1,0,0]=3
23  B12R1.1819  CC(=O)OC1COC(OC1)(C)C T264539 [0,0,0,1,0,1|2,0,0]=4
24  B8R0.23  CC(CN(C)C)C(=O)O CBR01551 [1,0,0,0,1,0|1,0,1]=4
25  B8R0.29  CC(=O)CC[N+](C)(C)C S915017 [1,0,0,0,1,0|0,0,0]=2
26  B8R0.29  CC(C)(C)CCC(=O)O CDS009242 [1,0,0,0,1,0|2,0,0]=4
27  B10R0.15  CC(=O)OCCNC(C)(C)C PH012635 [1,0,0,0,0,1|1,0,0]=3
28  B12R0.140  CC(=O)OCCC(C)CC(C)(C)C S528536 [0,0,0,0,0,2|1,0,0]=3