0 B11R1.166 CC1CCC(C(C)C)C(O)C1 CS11550 [0,0,0,0,0,0|0,0,0]=0 1 B11R1.166 CC1CCC(C(C)C)C(O)C1 MC41830 [0,0,0,0,0,0|0,0,0]=0 2 B11R1.166 CC1CCC(C(C)C)C(O)C1 MC41843 [0,0,0,0,0,0|0,0,0]=0 3 B10R1.13 CC1CCC(C(C)C)CC1 MC428284 [1,0,0,0,0,0|0,0,0]=1 4 B10R1.13 CN(C)C1CCC(=O)CC1 MC429047 [1,0,0,0,0,0|2,0,1]=4 5 B10R1.13 CN(C)C1CCC(N)CC1 MC103148 [1,0,0,0,0,0|2,0,0]=3 6 B10R1.13 CN(C)C1CCC(O)CC1 CS18395 [1,0,0,0,0,0|2,0,0]=3 7 B10R1.61 CC(C)N1CCNCC1C MC101889 [1,0,0,0,0,0|3,0,0]=4 8 B10R1.61 O=C(O)C1CCCCC1O CS21597 [1,0,0,0,0,0|2,0,1]=4 9 B9R0.5 CCCCCC(C)CCBr MC112329 [1,0,1,0,0,0|1,0,0]=3 10 B9R0.5 CCCCCC(C)CCO MC112328 [1,0,1,0,0,0|0,0,0]=2 11 B9R1.1 CN1CCC(CN)CC1 CS21766 [2,0,0,0,0,0|2,0,0]=4 12 B9R1.1 CN1CCC(CO)CC1 CS19632 [2,0,0,0,0,0|2,0,0]=4 13 B9R1.1 CNC1CCC(O)CC1 MC103812 [2,0,0,0,0,0|2,0,0]=4 14 B9R1.1 CNC1CCN(C)CC1 CS18451 [2,0,0,0,0,0|2,0,0]=4 15 B9R1.1 COC1CCC(N)CC1 CS13257 [2,0,0,0,0,0|2,0,0]=4 16 B9R1.1 COC1CCC(N)CC1 MC429972 [2,0,0,0,0,0|2,0,0]=4 17 B9R1.1 COC1CCC(O)CC1 CS15906 [2,0,0,0,0,0|2,0,0]=4 18 B9R1.1 NC1CCC(CO)CC1 MC425647 [2,0,0,0,0,0|2,0,0]=4 19 B9R1.1 NCC1CCC(O)CC1 MC102788 [2,0,0,0,0,0|2,0,0]=4 20 B9R1.1 NCC1CCC(O)CC1 MC103405 [2,0,0,0,0,0|2,0,0]=4 21 B9R1.1 NCC1CCC(O)CC1 MC104233 [2,0,0,0,0,0|2,0,0]=4 22 B9R1.6 CC(C)C1CNCCO1 CS16451 [2,0,0,0,0,0|2,0,0]=4 23 B9R1.6 CC(C)C1CNCCO1 MC444036 [2,0,0,0,0,0|2,0,0]=4 24 B9R1.6 CC(C)C1CNCCO1 MC444059 [2,0,0,0,0,0|2,0,0]=4 25 B9R1.6 CC(C)C1COCCN1 MC20926 [2,0,0,0,0,0|2,0,0]=4 26 B9R1.6 CC(C)C1COCCN1 MC444041 [2,0,0,0,0,0|2,0,0]=4 27 B9R1.6 CC(C)C1COCCN1 MC444063 [2,0,0,0,0,0|2,0,0]=4 28 B9R1.6 CC(C)C1COCCN1 MC444288 [2,0,0,0,0,0|2,0,0]=4 29 B9R1.6 CC(C)N1CCNCC1 CS19740 [2,0,0,0,0,0|2,0,0]=4 30 B9R1.6 CN(C)C1CCNCC1 CS14539 [2,0,0,0,0,0|2,0,0]=4 31 B9R1.15 NCC1CCNCC1O MC105550 [2,0,0,0,0,0|2,0,0]=4 32 B9R1.15 NCC1CCNCC1O MC105642 [2,0,0,0,0,0|2,0,0]=4 33 B11R2.34 O=C1CCC(C2CC2)CC1 MC105704 [1,0,0,1,0,0|1,0,1]=4 34 B13R2.5070 CC1CCC2(OC2(C)C)C(=O)C1 MC427311 [0,0,0,1,0,1|0,0,2]=4 35 B9R1.35 CC(C)N1CCC(N)C1 CS18842 [1,0,0,0,1,0|2,0,0]=4