0 B11R0.46 CCCCC[C@H](C)CCC(=O)O M53337 [0,0,0,0,0,0|0,0,0]=0 1 B10R0.4 CCCCCCCCB(O)O O4860 [1,0,0,0,0,0|1,0,1]=3 2 B10R0.4 CCCCCCCCC(C)=O D53335 [1,0,0,0,0,0|1,0,0]=2 3 B10R0.4 NCCCCCCCC(=O)O A69217 [1,0,0,0,0,0|1,0,0]=2 4 B10R0.4 NCCOCCOCC(=O)O A41596 [1,0,0,0,0,0|3,0,0]=4 5 B10R0.4 NCCOCCOCC(=O)O A43505 [1,0,0,0,0,0|3,0,0]=4 6 B10R0.4 O=C(O)CCCCCCCBr B47140 [1,0,0,0,0,0|1,0,0]=2 7 B10R0.4 O=C(O)COCCOCCCl C61801 [1,0,0,0,0,0|3,0,0]=4 8 B10R0.4 [N-]=[N+]=NCCCCCC(=O)O A1945 [1,0,0,0,0,0|3,0,0]=4 9 B12R1.1 CCCCCC1CCC(=O)CC1 P55088 [0,0,0,1,0,0|1,0,0]=2 10 B12R1.1 CCCCCC1CCC(O)CC1 P55142 [0,0,0,1,0,0|1,0,1]=3 11 B9R0.2 CCCCCCCB(O)O H43957 [2,0,0,0,0,0|1,0,1]=4 12 B9R0.2 NCCCCCCC(=O)O A46516 [2,0,0,0,0,0|1,0,0]=3 13 B9R0.2 NCCCCCCC(=O)O A67452 [2,0,0,0,0,0|1,0,0]=3 14 B9R0.2 O=C(O)CCCCCCBr B43862 [2,0,0,0,0,0|1,0,0]=3 15 B9R0.2 O=C(O)CCCCCCO H36659 [2,0,0,0,0,0|1,0,0]=3 16 B9R0.45 C=CCCCCCCCCl C50527 [2,0,0,0,0,0|2,0,0]=4 17 B9R0.45 CCCCCCCCC[Mg+] N31713 [2,0,0,0,0,0|1,0,1]=4 18 B9R0.45 CCCCCCCCNC M50621 [2,0,0,0,0,0|2,0,0]=4 19 B9R0.45 OCCCCCCCCBr B47189 [2,0,0,0,0,0|1,0,1]=4 20 B9R0.45 OCCCCCCCCCl C47190 [2,0,0,0,0,0|1,0,1]=4 21 B9R0.45 OCCCCCCCCO X39448 [2,0,0,0,0,0|1,0,1]=4 22 B11R0.30 CC(=O)CCCCCCC(C)=O D53269 [1,1,0,0,0,0|1,0,1]=4 23 B11R0.40 CCCCCCC=CC(=O)OC M39622 [1,1,0,0,0,0|0,0,2]=4 24 B11R0.42 C=CCCCCC[C@@H](N)C(=O)O A66071 [1,1,0,0,0,0|0,0,2]=4 25 B11R0.42 C=CCCCCC[C@H](N)C(=O)O A50531 [1,1,0,0,0,0|0,0,2]=4 26 B11R0.111 COC(=O)CCCCCC(=O)O M6367 [1,1,0,0,0,0|1,0,1]=4 27 B11R0.148 NCCCCCCCCC(=O)O A50593 [1,1,0,0,0,0|0,0,0]=2 28 B11R0.148 O=C(O)CCCCCCCCBr B38107 [1,1,0,0,0,0|0,0,0]=2 29 B11R0.148 O=C(O)CCCCCCCCO H68316 [1,1,0,0,0,0|0,0,0]=2 30 B11R0.148 O=C(O)CCOCCOCCBr B43867 [1,1,0,0,0,0|2,0,0]=4 31 B11R0.159 CCCCCCCCS(=O)(=O)[O-] S68161 [1,1,0,0,0,0|1,0,1]=4 32 B11R1.91 O=C(O)CCC1CCCCC1 C39553 [1,0,0,1,0,0|0,0,0]=2 33 B11R1.91 O=C(O)CCC1CCNCC1 P60724 [1,0,0,1,0,0|1,0,0]=3 34 B11R1.91 O=C(O)CCN1CCOCC1 M43855 [1,0,0,1,0,0|2,0,0]=4 35 B11R1.91 O=C(O)\C=C\C1CCCCC1 C9422 [1,0,0,1,0,0|0,0,2]=4 36 B11R1.167 CN1CCN(C)[C@H](C(=O)O)C1 D63116 [1,0,0,1,0,0|2,0,0]=4 37 B11R1.77 N[C@@H](CC(=O)O)C1CCCC1 A49572 [0,0,0,1,1,0|1,0,0]=3 38 B11R1.928 NC1(CC(=O)O)CCCCC1 A47122 [0,0,0,1,1,0|1,0,0]=3 39 B13R1.165 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1C(=O)O M64539 [0,1,0,1,0,0|0,0,0]=2 40 B13R2.5037 O=C1CNC2(CCCCC2)CN1 D62270 [0,0,0,2,0,0|2,0,0]=4 41 B9R0.47 CCCCC[C@@H](N)C(=O)O A43920 [0,0,0,0,2,0|1,0,0]=3 42 B9R0.47 CCCCC[C@H](N)C(=O)O A43919 [0,0,0,0,2,0|1,0,0]=3 43 B9R0.47 CCCCC[C@H](N)C(=O)O A43921 [0,0,0,0,2,0|1,0,0]=3 44 B9R0.47 NCCCC[C@@H](N)C(=O)O L64962 [0,0,0,0,2,0|2,0,0]=4