0 B11R0.3 CCCCCCCCCCC#N CS-0450091 [0,0,0,0,0,0|1,0,3]=4 1 B11R0.3 CCCCCCCCCCCN CS-0168422 [0,0,0,0,0,0|1,0,2]=3 2 B11R0.3 CCCCCCCCCCNC CS-0539232 [0,0,0,0,0,0|2,0,2]=4 3 B11R0.3 CCCCCCCCOCCO CS-0364860 [0,0,0,0,0,0|1,0,1]=2 4 B11R0.3 CCCCCCCCSCCO CS-0309383 [0,0,0,0,0,0|1,0,1]=2 5 B11R0.3 CCCCCCCNCCCO CS-0249249 [0,0,0,0,0,0|1,0,2]=3 6 B11R0.3 CCOCCOCCOCCO CS-W017329 [0,0,0,0,0,0|3,0,1]=4 7 B10R0.71 CCC#CCCCCCCC CS-0454085 [1,0,0,0,0,0|0,0,3]=4 8 B10R0.71 CCCCC#CCCCCO CS-0360772 [1,0,0,0,0,0|0,0,3]=4 9 B10R0.71 CCCCCCCCN=[N+]=[N-] CS-0647254 [1,0,0,0,0,0|3,0,0]=4 10 B10R0.71 CCCCCNCCCCC CS-0449866 [1,0,0,0,0,0|1,0,2]=4 11 B10R0.71 CCCCC\C=C/CCCO CS-0185745 [1,0,0,0,0,0|0,0,3]=4 12 B10R0.71 CCCCC\C=C\C=C\CO CS-0504165 [1,0,0,0,0,0|0,0,2]=3 13 B10R0.71 CCCCOCCOCCO CS-W013256 [1,0,0,0,0,0|2,0,1]=4 14 B10R0.71 CCCC\C=C/CCCCO CS-0162006 [1,0,0,0,0,0|0,0,3]=4 15 B12R0.1 CCCCCCCCC(C)CCC CS-0205047 [0,1,0,0,0,0|1,0,2]=4 16 B12R0.5 C#CCCCCCCCCCCC CS-0756666 [0,1,0,0,0,0|1,0,2]=4 17 B12R0.5 CCC#CCCCCCCCCO CS-0466244 [0,1,0,0,0,0|0,0,3]=4 18 B12R0.5 CCCCCCCCCCCCN CS-0196435 [0,1,0,0,0,0|1,0,2]=4 19 B12R0.5 CCCCCCCCCCCC[S-] CS-0757942 [0,1,0,0,0,0|0,1,2]=4 20 B12R0.5 CCCCCCNCCCCCC CS-0465330 [0,1,0,0,0,0|1,0,2]=4 21 B12R0.5 CCCC\C=C/CCCCCCO CS-0160250 [0,1,0,0,0,0|0,0,3]=4 22 B12R0.5 CC\C=C/CCCCCCCCO CS-0162465 [0,1,0,0,0,0|1,0,0]=2 23 B12R0.5 NCCCCCCCCCCCO CS-0468523 [0,1,0,0,0,0|0,0,2]=3 24 B12R0.206 CCCCCCCC(=O)NCCO CS-0261772 [0,1,0,0,0,0|1,0,2]=4 25 B12R0.206 CCCCCCCC(=O)SCCO CS-0457306 [0,1,0,0,0,0|1,0,2]=4 26 B12R0.234 CCCCCCCCCCC(C)N CS-0224543 [0,1,0,0,0,0|1,0,2]=4 27 B12R0.234 CCCCCCCC\C=C\C(=O)O CS-0783271 [0,1,0,0,0,0|0,0,1]=2 28 B12R0.248 C=CC(=O)NCCCCCCCC CS-1007810 [0,1,0,0,0,0|2,0,1]=4 29 B12R0.248 C=CC(=O)OCCCCCCCC CS-0167393 [0,1,0,0,0,0|2,0,1]=4 30 B12R0.248 OCCCCCCCCC(O)CO CS-0330326 [0,1,0,0,0,0|1,0,2]=4 31 B12R1.8 OCCCCCN1CCCCC1 CS-0316254 [0,0,0,1,0,0|1,0,2]=4 32 B12R1.8 OC\C=C/COC1CCCCO1 CS-0312363 [0,0,0,1,0,0|2,0,0]=3 33 B12R1.37 CCCCCCCC1=CNC=C1 CS-0456769 [0,0,0,1,0,0|2,0,1]=4 34 B12R1.37 CCCCCCCC1=CSC=C1 CS-0168056 [0,0,0,1,0,0|2,0,1]=4 35 B12R1.121 CCC1CCCCC1OCCO CS-0487737 [0,0,0,1,0,0|1,0,1]=3 36 B12R1.550 C1CCCCCCCCCCC1 CS-0155296 [0,0,0,1,0,0|1,0,2]=4 37 B9R0.45 C=CCCCCCCCCl CS-0187294 [2,0,0,0,0,0|1,0,0]=3 38 B9R0.45 CC#CCCCCCCC CS-0213303 [2,0,0,0,0,0|0,0,2]=4 39 B9R0.45 CCCCCCCCC#N CS-0204913 [2,0,0,0,0,0|1,0,1]=4 40 B9R0.45 CCCCCCCCCCl CS-0198808 [2,0,0,0,0,0|1,0,0]=3 41 B9R0.45 CCCCCCNCCN CS-0341400 [2,0,0,0,0,0|2,0,0]=4 42 B9R0.45 CCCCC\C=C/CCO CS-0185562 [2,0,0,0,0,0|0,0,2]=4 43 B9R0.45 CCCCOCCCCO CS-0217821 [2,0,0,0,0,0|1,0,0]=3 44 B9R0.45 CC\C=C/CC\C=C\CO CS-0187695 [2,0,0,0,0,0|0,0,2]=4 45 B9R0.45 COCCCOCCCO CS-0878149 [2,0,0,0,0,0|2,0,0]=4 46 B9R0.45 C\C=C/CCCCCCC CS-0449480 [2,0,0,0,0,0|0,0,0]=2 47 B9R0.45 ClCCCCCCCCCl CS-0204527 [2,0,0,0,0,0|2,0,0]=4 48 B9R0.45 NCCCCCCCCN CS-0503782 [2,0,0,0,0,0|2,0,0]=4 49 B11R0.4 C\C=C\C(=O)OCCCCCC CS-0521307 [1,1,0,0,0,0|1,0,1]=4 50 B11R0.40 CCCCCCCCC(=O)NN CS-0320341 [1,1,0,0,0,0|2,0,0]=4 51 B11R0.81 CCCCCCC(O)CCCC CS-0206799 [1,1,0,0,0,0|0,0,2]=4 52 B11R0.148 CCCCCCCCCC(C)N CS-0698038 [1,1,0,0,0,0|0,0,2]=4 53 B11R0.148 CCCCCCCCNC(N)=O CS-0539311 [1,1,0,0,0,0|1,0,1]=4 54 B11R0.148 CCCCCCCCNC(N)=S CS-0700871 [1,1,0,0,0,0|1,1,0]=4 55 B11R0.148 CCCCCCCNCC(=O)O CS-0259161 [1,1,0,0,0,0|1,0,1]=4 56 B13R0.2 CCCCCCCCCC(O)CCO CS-0664495 [0,2,0,0,0,0|0,0,2]=4 57 B13R0.2 CCCCCCCCNC(=O)CC#N CS-0765719 [0,2,0,0,0,0|2,0,0]=4 58 B13R0.54 CCCCCCCCC\C=C/C(=O)O CS-0137857 [0,2,0,0,0,0|0,0,1]=3 59 B13R0.54 CCCCCCCCC\C=C\C(=O)O CS-0648877 [0,2,0,0,0,0|0,0,1]=3 60 B13R0.147 CCCCCCCCCCC(O)CO CS-0198136 [0,2,0,0,0,0|0,0,2]=4 61 B13R0.336 C=CCCCCCCCCCCCO CS-1022896 [0,2,0,0,0,0|0,0,2]=4 62 B11R1.4 BrCCCCCC1CCCO1 CS-0266156 [1,0,0,1,0,0|1,0,1]=4 63 B11R1.28 BrCCCCC1CCCCC1 CS-0071704 [1,0,0,1,0,0|1,0,1]=4 64 B11R1.28 C=COCCC1CCCCC1 CS-0858621 [1,0,0,1,0,0|1,0,1]=4 65 B11R1.28 CCCCCC1CCCCC1 CS-0207482 [1,0,0,1,0,0|0,0,2]=4 66 B11R1.28 CCCCCC1CCNCC1 CS-0517811 [1,0,0,1,0,0|1,0,1]=4 67 B11R1.28 OCCCCC1CCNCC1 CS-D0023 [1,0,0,1,0,0|1,0,1]=4 68 B11R1.28 OCCCCC1CCOCC1 CS-0509084 [1,0,0,1,0,0|1,0,1]=4 69 B11R1.28 OCCCCN1CCCCC1 CS-0173062 [1,0,0,1,0,0|1,0,1]=4 70 B11R1.101 O=C1CCCCCCCCN1 CS-0257778 [1,0,0,1,0,0|1,0,1]=4 71 B11R1.117 CNCC1CCCCCCC1 CS-0265135 [1,0,0,1,0,0|1,0,1]=4 72 B11R1.180 CCCCCC1CCCC1O CS-0354318 [1,0,0,1,0,0|0,0,1]=3 73 B11R1.203 NCCCC1CCCCCC1 CS-0237723 [1,0,0,1,0,0|1,0,1]=4 74 B13R1.119 CCCCCCCCC1=CC=CS1 CS-0152265 [0,1,0,1,0,0|0,1,1]=4 75 B13R1.119 CCCCCCCCC1=CNC=C1 CS-0452970 [0,1,0,1,0,0|1,0,1]=4 76 B13R1.119 CCCCCCNCC1=CC=CO1 CS-0236113 [0,1,0,1,0,0|0,0,2]=4 77 B13R1.9 CCCCCCC1CCC(=O)CC1 CS-0061493 [0,1,0,1,0,0|1,0,1]=4 78 B13R1.1870 O=C(CCl)NC1CCCCCCC1 CS-0647831 [0,1,0,1,0,0|2,0,0]=4 79 B13R2.3 C1CCC(C2CNCCO2)CC1 CS-0693329 [0,0,0,2,0,0|1,0,1]=4 80 B13R2.8001 C1CCCC2(CC1)CNCCO2 CS-0231685 [0,0,0,2,0,0|1,0,1]=4