0 B8R0.11 CC#CCN(CC)CC SBB008752 [1,0,0,0,0,0|2,0,1]=4 1 B8R0.11 CCCCC(CC)CBr SBB059938 [1,0,0,0,0,0|2,0,1]=4 2 B8R0.11 CCCCC(CC)CCl SBB005809 [1,0,0,0,0,0|2,0,1]=4 3 B8R0.11 CCCCC(CC)CI SBB061182 [1,0,0,0,0,0|2,0,1]=4 4 B8R0.11 CCCCC(CC)CO SBB059906 [1,0,0,0,0,0|2,0,1]=4 5 B8R0.11 NCC(CC)CCCC SBB006745 [1,0,0,0,0,0|2,0,1]=4 6 B10R0.144 CCN(CC)C(=O)CC(C)=O SBB042488 [0,1,0,0,0,0|2,0,1]=4 7 B10R1.66 CC(=O)CCC1CCCO1 SBB017110 [0,0,0,1,0,0|2,0,0]=3 8 B10R1.66 O=C(Cl)CCC1CCCC1 SBB058619 [0,0,0,1,0,0|2,0,0]=3 9 B10R1.66 O=C(O)CCC1CCCC1 SBB040565 [0,0,0,1,0,0|2,0,0]=3 10 B10R1.66 O=C(O)CCC1CCCO1 SBB014220 [0,0,0,1,0,0|3,0,0]=4 11 B10R1.66 O=C(O)CCN1CCCC1 SBB046363 [0,0,0,1,0,0|3,0,0]=4 12 B8R0.16 CCN(CC)CC(=O)O SBB010260 [0,0,0,0,1,0|2,0,0]=3 13 B8R0.16 CCN(CC)CC(C)N SBB020279 [0,0,0,0,1,0|2,0,1]=4 14 B8R0.16 CCN(CC)CC(C)O SBB060003 [0,0,0,0,1,0|1,0,2]=4 15 B10R0.77 C=C(C)C#CCN(CC)CC SBB001726 [0,0,0,0,0,1|3,0,0]=4 16 B7R0.4 CCCCCC(=O)Cl SBB060011 [2,0,0,0,0,0|2,0,0]=4 17 B7R0.4 CCCCCC(=O)O SBB053586 [2,0,0,0,0,0|2,0,0]=4 18 B7R0.4 CCCCCC(C)=O SBB061125 [2,0,0,0,0,0|1,0,0]=3 19 B7R0.4 CCCCCC(N)=O SBB061056 [2,0,0,0,0,0|2,0,0]=4 20 B7R0.4 CCCCOC(N)=O SBB060819 [2,0,0,0,0,0|1,0,0]=3 21 B7R0.4 COCCOC(C)=O SBB060999 [2,0,0,0,0,0|1,0,0]=3 22 B7R0.6 CC(C)CCC(=O)O SBB065829 [2,0,0,0,0,0|2,0,0]=4 23 B7R0.6 CC(C)CNC(N)=O SBB008242 [2,0,0,0,0,0|2,0,0]=4 24 B9R0.50 CCC(CC)COCCCl SBB060526 [1,1,0,0,0,0|0,0,1]=3 25 B9R0.50 CCC(CC)COCCO SBB061090 [1,1,0,0,0,0|0,0,1]=3 26 B9R0.14 CCCC(CC)OC(C)=O SBB060029 [0,1,0,0,1,0|0,0,0]=2 27 B11R0.164 CCCCC(CC)CCC(=O)O SBB067105 [0,2,0,0,0,0|2,0,0]=4 28 B11R0.164 CCCCC(CC)COC(C)=O SBB060584 [0,2,0,0,0,0|0,0,0]=2 29 B11R0.9 CCCC(=O)OCC(CC)CC SBB061314 [0,2,0,0,0,0|0,0,0]=2 30 B9R1.1 CCC1CCC(=O)CC1 SBB059272 [1,0,0,1,0,0|1,0,0]=3 31 B9R1.1 CCN1CCC(=O)CC1 SBB061714 [1,0,0,1,0,0|2,0,0]=4 32 B9R1.1 O=C1CCC(CO)CC1 SBB054860 [1,0,0,1,0,0|2,0,0]=4 33 B9R1.84 O=C(O)CCC1CCC1 SBB072391 [1,0,0,1,0,0|2,0,0]=4 34 B9R1.125 CC1=NC(C)(CO)CO1 SBB007772 [1,0,0,1,0,0|2,0,0]=4 35 B9R1.2 CCN1CCCC(=O)C1 SBB056089 [0,0,0,1,1,0|1,0,0]=3 36 B9R1.2 O=C1CCCC(CO)C1 SBB054862 [0,0,0,1,1,0|1,0,0]=3 37 B9R1.13 CC(=O)CC1CCCC1 SBB008343 [0,0,0,1,1,0|0,0,0]=2 38 B9R1.13 CC(=O)OC1CCCC1 SBB060737 [0,0,0,1,1,0|0,0,0]=2 39 B9R1.13 O=C(Cl)CC1CCCC1 SBB116687 [0,0,0,1,1,0|1,0,0]=3 40 B9R1.13 O=C(Cl)OC1CCCC1 SBB056243 [0,0,0,1,1,0|1,0,0]=3 41 B9R1.13 O=C(O)CC1CCCC1 SBB080711 [0,0,0,1,1,0|1,0,0]=3 42 B9R1.13 O=C(O)CC1CCCO1 SBB002788 [0,0,0,1,1,0|2,0,0]=4 43 B9R1.13 O=C(O)CN1CCCC1 SBB017909 [0,0,0,1,1,0|2,0,0]=4 44 B9R1.13 O=C(O)C[C@@H]1CCCN1 SBB066746 [0,0,0,1,1,0|2,0,0]=4 45 B9R1.128 O=C(O)CC1(CS)CC1 SBB053445 [0,0,0,1,1,0|2,0,0]=4 46 B11R1.3 CNC1CCN(C(C)=O)CC1 SBB052016 [0,0,0,1,0,1|2,0,0]=4 47 B11R1.3 [C@H]1(CC)CC[C@H](C(=O)O)CC1 SBB059323 [0,0,0,1,0,1|2,0,0]=4 48 B11R1.172 O=C(O)COCC1CCCO1 SBB010420 [0,0,0,1,0,1|2,0,0]=4 49 B11R1.91 CC(=O)NCC1CCNCC1 SBB047898 [0,1,0,1,0,0|1,0,0]=3 50 B11R1.91 O=C(Cl)CCC1CCCCC1 SBB005478 [0,1,0,1,0,0|2,0,0]=4 51 B11R1.91 O=C(O)CCC1CCCCN1 SBB018825 [0,1,0,1,0,0|2,0,0]=4 52 B11R1.91 O=C(O)CCC1CCCNC1 SBB014718 [0,1,0,1,0,0|2,0,0]=4 53 B11R1.25 C=CC(=O)OCC1CCCO1 SBB057151 [0,1,0,1,0,0|1,0,1]=4 54 B11R1.25 NNC(=O)CCC1CCCC1 SBB030323 [0,1,0,1,0,0|2,0,0]=4 55 B11R1.25 O=C(CBr)NCC1CCCO1 SBB080544 [0,1,0,1,0,0|2,0,0]=4 56 B11R1.25 O=C(CCl)NCC1CCCO1 SBB042460 [0,1,0,1,0,0|2,0,0]=4 57 B11R1.278 CCN1CCC(=O)C(C)C1C SBB002817 [0,1,0,1,0,0|2,0,0]=4 58 B11R2.845 O=C(O)C1CC2CCC1C2 SBB008208 [0,0,0,2,0,0|2,0,0]=4 59 B7R0.2 CCC(C)CC(=O)O SBB008180 [1,0,0,0,1,0|1,0,0]=3 60 B7R0.2 CCC(C)NC(N)=O SBB008605 [1,0,0,0,1,0|2,0,0]=4 61 B7R0.15 CCC(CC)C(=O)O SBB061341 [0,0,0,0,2,0|1,0,0]=3 62 B7R0.15 CCC(OC)C(N)=O SBB116762 [0,0,0,0,2,0|2,0,0]=4 63 B7R0.15 CCN(CC)C(=O)Cl SBB061734 [0,0,0,0,2,0|2,0,0]=4 64 B7R0.15 COC(OC)C(C)=O SBB060142 [0,0,0,0,2,0|2,0,0]=4 65 B9R0.1 CCC(C)NCCC(N)=O SBB116742 [1,0,0,0,0,1|2,0,0]=4