0 B8R0.4 C(CCNCCN)CN P24 [0,0,0,0,0,0|3,0,1]=4 1 B8R0.4 C(CN)CNCCCN NSD [0,0,0,0,0,0|3,0,1]=4 2 B8R0.4 CCCCCCCC=O OYA [0,0,0,0,0,0|0,0,4]=4 3 B8R0.4 CCCCCCCCC DD9 [0,0,0,0,0,0|1,0,2]=3 4 B8R0.4 CCCCCCCCO OC9 [0,0,0,0,0,0|0,0,2]=2 5 B8R0.4 CCOCCOCCO AE3 [0,0,0,0,0,0|2,0,1]=3 6 B7R0.1 C(CCCBr)CCO BHL [1,0,0,0,0,0|1,0,1]=3 7 B7R0.1 C(CCCN)CCN 16D [1,0,0,0,0,0|2,0,1]=4 8 B7R0.1 C(CCCO)CCN 6AH [1,0,0,0,0,0|1,0,1]=3 9 B7R0.1 C(CCCO)CCO HEZ [1,0,0,0,0,0|1,0,1]=3 10 B7R0.1 C(CSSCCO)O HED [1,0,0,0,0,0|3,0,0]=4 11 B7R0.1 CCCCCCC#N CNX [1,0,0,0,0,0|1,0,2]=4 12 B7R0.1 CCCCCCCC OCT [1,0,0,0,0,0|0,0,2]=3 13 B7R0.1 CCCCCCCO HE4 [1,0,0,0,0,0|0,0,1]=2 14 B7R0.1 CCCSSCCC SSP [1,0,0,0,0,0|2,0,1]=4 15 B7R0.1 COCCOCCO PG0 [1,0,0,0,0,0|2,0,0]=3 16 B9R0.2 CCCCCCCC(=O)O OCA [0,1,0,0,0,0|0,0,3]=4 17 B9R0.45 C(CCCCN)CCCN DIA [0,1,0,0,0,0|1,0,2]=4 18 B9R0.45 C(CCCCO)CCCO ODI [0,1,0,0,0,0|0,0,2]=3 19 B9R0.45 C(CCNCCCN)CN SPD [0,1,0,0,0,0|2,0,1]=4 20 B9R0.45 C(COCCOCCO)O PGE [0,1,0,0,0,0|2,0,1]=4 21 B9R0.45 C(COCCOCCO)O PIG [0,1,0,0,0,0|2,0,1]=4 22 B9R0.45 CCCCCCCCCC D10 [0,1,0,0,0,0|1,0,2]=4 23 B9R0.45 CCCCCCCCCO F09 [0,1,0,0,0,0|0,0,2]=3 24 B9R0.45 CCOCCOCCOC ME2 [0,1,0,0,0,0|2,0,1]=4 25 B9R0.46 C(CN)CSC[C@@H](CO)N BPE [0,1,0,0,0,0|2,0,1]=4 26 B6R0.6 C(CCN)CCN N2P [2,0,0,0,0,0|2,0,0]=4 27 B6R0.6 C(CCO)CC=O GAQ [2,0,0,0,0,0|1,0,1]=4 28 B6R0.6 C(COCCO)O PEG [2,0,0,0,0,0|2,0,0]=4 29 B6R0.6 CCCCCCC HP6 [2,0,0,0,0,0|0,0,1]=3 30 B6R0.6 CCCCCCO HE2 [2,0,0,0,0,0|0,0,0]=2 31 B6R0.6 CCCCNC=O YIV [2,0,0,0,0,0|1,0,1]=4 32 B6R0.6 CCCSCCO 266 [2,0,0,0,0,0|1,0,0]=3 33 B8R0.6 C(CCN)C[C@@H](CO)N LYJ [1,1,0,0,0,0|1,0,1]=4 34 B8R0.6 CCCCNC(=N)NO BHH [1,1,0,0,0,0|2,0,0]=4 35 B8R0.7 CC(C)CCCCCO MHN [1,1,0,0,0,0|0,0,1]=3 36 B8R0.7 CCCCCCC(=O)O SHV [1,1,0,0,0,0|0,0,2]=4 37 B10R0.4 CCCCCCCCC(=O)O KNA [0,2,0,0,0,0|0,0,2]=4 38 B10R0.6 CCCCCC(=O)CC(=O)O OOA [0,2,0,0,0,0|0,0,2]=4 39 B10R0.91 CCCCC[C@@H](CCCO)O HND [0,2,0,0,0,0|0,0,2]=4 40 B10R0.71 CCCCCCCCCCO DE1 [0,2,0,0,0,0|0,0,2]=4 41 B10R0.71 COCCOCCOCCO TOE [0,2,0,0,0,0|1,0,1]=4 42 B8R1.2 C1CCC(CC1)C[NH3+] AMC [1,0,0,1,0,0|1,0,1]=4 43 B8R1.2 CCC1CCNCC1 EPI [1,0,0,1,0,0|1,0,1]=4 44 B8R1.2 CC[C@H]1CCCCN1 2EP [1,0,0,1,0,0|1,0,1]=4 45 B8R1.5 C1CC[C@@H]([C@H](C1)O)O 3ZQ [1,0,0,1,0,0|1,0,1]=4 46 B8R1.5 C1CC[C@H]([C@@H](C1)O)O 40O [1,0,0,1,0,0|1,0,1]=4 47 B8R1.5 C1CNC[C@H]([C@@H]1O)O XIF [1,0,0,1,0,0|2,0,0]=4 48 B8R1.5 C[C@H]1CCCC[C@@H]1O 4DX [1,0,0,1,0,0|0,0,1]=3 49 B8R1.11 C1=CO[C@H]([C@@H]1O)CO R2G [1,0,0,1,0,0|2,0,0]=4 50 B8R1.11 C1CC(=O)C(=C1)CO 3RN [1,0,0,1,0,0|1,0,1]=4 51 B8R1.22 C1CCCC(CC1)N SZ1 [1,0,0,1,0,0|1,0,1]=4 52 B10R1.2 C1=CO[C@@H]([C@H]([C@@H]1O)O)CO DGO [0,1,0,1,0,0|2,0,0]=4 53 B10R1.2 C1C=C[C@H]([C@@H]([C@H]1CO)O)O 7LQ [0,1,0,1,0,0|1,0,0]=3