0 B8R0.4 NCCCCCCCN T7998 [0,0,0,0,0,0|2,0,2]=4 1 B7R0.1 CCCCCCCO TN6893 [1,0,0,0,0,0|0,0,1]=2 2 B7R0.1 CNCCOCCO T32120 [1,0,0,0,0,0|2,0,1]=4 3 B9R0.2 CCCCC/C=C/C(O)=O T5261 [0,1,0,0,0,0|0,0,1]=2 4 B9R0.2 CCCCCCCC(C)O TN6692 [0,1,0,0,0,0|0,0,2]=3 5 B9R0.2 CCCCCCCC(O)=O T3946 [0,1,0,0,0,0|0,0,3]=4 6 B9R0.45 C=CCCC/C=C\CC=C T31277 [0,1,0,0,0,0|1,0,2]=4 7 B9R0.45 C=CCCCCCCCC T21040 [0,1,0,0,0,0|1,0,2]=4 8 B9R0.45 CCCC/C=C\CCCC T31276 [0,1,0,0,0,0|1,0,2]=4 9 B9R0.45 CCCCCCCCCO TN6912 [0,1,0,0,0,0|0,0,2]=3 10 B9R0.45 NCCOCCOCCO T16312 [0,1,0,0,0,0|2,0,1]=4 11 B9R0.45 OCCOCCOCCBr T14770 [0,1,0,0,0,0|2,0,1]=4 12 B9R0.45 OCCOCCOCCO T16665 [0,1,0,0,0,0|2,0,1]=4 13 B9R0.45 OCCOCCOCCS T20973 [0,1,0,0,0,0|2,0,1]=4 14 B9R1.8 CCCC1NCCCC1 TN3695 [0,0,0,1,0,0|1,0,2]=4 15 B9R1.8 OCCN1CCCCC1 T33732 [0,0,0,1,0,0|1,0,1]=3 16 B9R1.50 OC1CCC/C=C/CC1 T18751 [0,0,0,1,0,0|2,0,0]=3 17 B9R1.50 O[C@@H]1CCC/C=C/CC1 T18648 [0,0,0,1,0,0|2,0,0]=3 18 B6R0.6 CC/C=C\CCO T22295 [2,0,0,0,0,0|0,0,2]=4 19 B6R0.6 CCC/C=C/C=O T8099 [2,0,0,0,0,0|0,0,2]=4 20 B6R0.6 CCC/C=C/CO TN5162 [2,0,0,0,0,0|0,0,0]=2 21 B6R0.6 CCCCCCO TN6891 [2,0,0,0,0,0|0,0,0]=2 22 B6R0.6 NCCCCCN T4895 [2,0,0,0,0,0|2,0,0]=4 23 B6R0.6 OCCOCCBr T14787 [2,0,0,0,0,0|2,0,0]=4 24 B6R0.6 OCCOCCO T21019 [2,0,0,0,0,0|2,0,0]=4 25 B8R0.6 CCCCCC(O)CC TN1267 [1,1,0,0,0,0|0,0,2]=4 26 B8R0.7 CC(=O)NCCCCN T7508 [1,1,0,0,0,0|2,0,0]=4 27 B8R0.7 CCCCCCC(C)=O TN6693 [1,1,0,0,0,0|0,0,1]=3 28 B8R0.7 NCCCCCC(O)=O T0881 [1,1,0,0,0,0|1,0,1]=4 29 B10R0.3 CC(C)=CCC/C(C)=C/CO T5665 [0,2,0,0,0,0|0,0,2]=4 30 B10R0.3 CC(C)=CCC/C(C)=C\CO T5645 [0,2,0,0,0,0|0,0,2]=4 31 B10R0.4 CCCCCCCCC(O)=O T3947 [0,2,0,0,0,0|0,0,2]=4 32 B10R0.4 CCCCCCCC[C@@H](C)O T31300 [0,2,0,0,0,0|0,0,2]=4 33 B10R0.91 CCCCCC(=O)CCCC T29451 [0,2,0,0,0,0|1,0,1]=4 34 B10R0.91 CCCCCC(O)/C=C/C=O T10148 [0,2,0,0,0,0|0,0,2]=4 35 B10R0.71 C(CCCCC)CCCCO T21101 [0,2,0,0,0,0|0,0,2]=4 36 B10R0.71 C(CCCCC)CCCCO T30679 [0,2,0,0,0,0|0,0,2]=4 37 B10R0.71 CCCCC/C=C/C=C/C=O T9506 [0,2,0,0,0,0|0,0,2]=4 38 B10R0.71 CCCCCCCCCCO T31347 [0,2,0,0,0,0|0,0,2]=4 39 B10R0.71 CNCCOCCOCCO T16457 [0,2,0,0,0,0|1,0,1]=4 40 B10R0.71 COCCOCCOCCO T15860 [0,2,0,0,0,0|1,0,1]=4 41 B10R0.71 OCCCCCCCCC#C T17346 [0,2,0,0,0,0|0,0,2]=4 42 B8R1.5 CC1CCCCC1=O T36789 [1,0,0,1,0,0|0,0,2]=4 43 B8R1.5 O[C@@H]1CCCC[C@H]1O T4763 [1,0,0,1,0,0|1,0,1]=4 44 B8R1.5 O[C@H]1CCCC[C@H]1O TN6922 [1,0,0,1,0,0|1,0,1]=4 45 B8R1.22 O=C1CCCCCN1 T20386 [1,0,0,1,0,0|1,0,1]=4 46 B8R1.22 O=C1NCCCCC1 T20195 [1,0,0,1,0,0|1,0,1]=4 47 B8R1.22 O=C1NCCCCC1 T32363 [1,0,0,1,0,0|1,0,1]=4 48 B10R1.21 CCCCCc1ccco1 TCS0324 [0,1,0,1,0,0|0,0,1]=3