0 B12R0.234 C=CCCCCCCCCC(=O)O M10437 [0,0,0,0,0,0|0,0,2]=2 1 B12R0.234 C=CCCCCCCCCC(=O)O M15023 [0,0,0,0,0,0|0,0,2]=2 2 B12R0.234 CC(=O)NCCCCNCCCN M27096 [0,0,0,0,0,0|4,0,0]=4 3 B12R0.234 CCCCCCCCCCC(=O)O M20011 [0,0,0,0,0,0|0,0,0]=0 4 B12R0.234 CCCCCCCC\C=C\C(=O)O M27109 [0,0,0,0,0,0|0,0,2]=2 5 B12R0.234 O=C(O)CCCCCCCCCO M18111 [0,0,0,0,0,0|1,0,0]=1 6 B12R0.234 O=C(O)\C=C\CCCCCCCO M18005 [0,0,0,0,0,0|1,0,2]=3 7 B11R0.3 C=CCCCCCCCCCO M27520 [1,0,0,0,0,0|2,0,0]=3 8 B11R0.3 CCCCCCCCCCCO M20876 [1,0,0,0,0,0|0,0,1]=2 9 B11R0.148 CCCCCCCCCC(=O)O M18432 [1,0,0,0,0,0|0,0,0]=1 10 B11R0.148 CCCCCCCCCC(=O)[O-] M27380 [1,0,0,0,0,0|0,0,1]=2 11 B11R0.148 CCCCCCCCCC(C)=O M21330 [1,0,0,0,0,0|1,0,0]=2 12 B11R0.148 CCCCCCCCCC(C)O M27522 [1,0,0,0,0,0|1,0,1]=3 13 B11R0.148 CCCCCCCCOC(C)=O M20318 [1,0,0,0,0,0|2,0,0]=3 14 B11R0.148 CCCCCCC\C=C/C(=O)O M29617 [1,0,0,0,0,0|0,0,2]=3 15 B11R0.148 CCCCCCC\C=C\C(=O)O M20740 [1,0,0,0,0,0|0,0,2]=3 16 B13R0.54 CCCCCCCCCCCC(=O)O M18014 [0,1,0,0,0,0|0,0,0]=1 17 B13R0.54 CCCCCCCCCCCC(C)=O M28719 [0,1,0,0,0,0|1,0,0]=2 18 B13R0.54 CCCCCC\C=C/CCCC(=O)O M21240 [0,1,0,0,0,0|0,0,1]=2 19 B13R0.54 NCCCCCCCCCCC(=O)O M26872 [0,1,0,0,0,0|0,0,0]=1 20 B13R0.54 O=C(O)COCCOCCOCCO M27009 [0,1,0,0,0,0|3,0,0]=4 21 B13R0.147 C=CCCCCCCCCC(=O)OC M23314 [0,1,0,0,0,0|0,0,2]=3 22 B13R0.147 CCCCCCCCCCC(=O)OC M28722 [0,1,0,0,0,0|0,0,0]=1 23 B13R0.179 O=C(O)CCCCCCCCC(=O)O M17820 [0,1,0,0,0,0|1,0,1]=3 24 B13R1.27 CCCCCCCC1CCC(=O)O1 M23259 [0,0,0,1,0,0|0,0,0]=1 25 B10R0.71 CCCCCCCCCC=O M21351 [2,0,0,0,0,0|0,0,0]=2 26 B10R0.4 CCCCCCCCC(=O)O M19549 [2,0,0,0,0,0|0,0,0]=2 27 B10R0.4 NCCCCCCCC(=O)O M21406 [2,0,0,0,0,0|1,0,0]=3 28 B12R0.5 CCCCCCCCCCCCC M29326 [1,1,0,0,0,0|1,0,1]=4 29 B12R0.5 CCCCCCCCCCCCO M28730 [1,1,0,0,0,0|0,0,1]=3 30 B12R0.4 CCCCCCCC(O)CC(=O)O M20794 [1,1,0,0,0,0|0,0,0]=2 31 B12R0.251 CCCCCCCC[C@H](O)C(=O)O M27943 [1,1,0,0,0,0|0,0,0]=2 32 B12R0.268 O=C(O)CCCCCCCC(=O)O M10969 [1,1,0,0,0,0|1,0,1]=4 33 B12R0.277 CCOC(=O)CCCCCC(=O)O M26986 [1,1,0,0,0,0|1,0,1]=4 34 B14R0.68 O=C(O)CCCCCCCCCC(=O)O M20255 [0,2,0,0,0,0|0,0,1]=3 35 B14R0.337 CCCCCCCCCCCC(=O)OC M29393 [0,2,0,0,0,0|0,0,0]=2 36 B14R0.337 COC(=O)CCCCCCCCCCBr M26930 [0,2,0,0,0,0|0,0,0]=2 37 B14R0.394 CCCCCCCCCCCCC(=O)O M20012 [0,2,0,0,0,0|0,0,0]=2 38 B14R0.394 O=C(O)CCCCCCCCCCCO M19613 [0,2,0,0,0,0|0,0,0]=2 39 B14R0.394 O=C(O)CCOCCOCCOCCBr M24782 [0,2,0,0,0,0|2,0,0]=4 40 B12R1.7 CCCCCCC1CCC(=O)O1 M21350 [1,0,0,1,0,0|0,0,0]=2 41 B12R1.28 CCCCCC1CCCC(=O)O1 M28334 [1,0,0,1,0,0|0,0,0]=2 42 B12R1.255 O=C(O)CCCCC1CCSS1 M10312 [1,0,0,1,0,0|2,0,0]=4 43 B12R1.255 O=C(O)CCCCC1CCSS1 M18917 [1,0,0,1,0,0|2,0,0]=4 44 B12R1.255 O=C(O)CCCC[C@@H]1CCSS1 M10720 [1,0,0,1,0,0|2,0,0]=4