0 B11R0.81 C=CCOC(=O)CCCCCC HR125992 [0,0,0,0,0,0|0,0,0]=0 1 B11R0.81 CCCCCOC(=O)CCCC HR111176 [0,0,0,0,0,0|2,0,2]=4 2 B10R0.1 CCCCCCC(=O)OCC HR126759 [1,0,0,0,0,0|0,0,1]=2 3 B10R0.1 CCOC(=O)CCCCCBr HR132204 [1,0,0,0,0,0|1,0,1]=3 4 B10R0.71 C=CCCCCCCCCBr HR109564 [1,0,0,0,0,0|2,0,1]=4 5 B10R0.71 C=CCCCCCCCCC HR105109 [1,0,0,0,0,0|1,0,1]=3 6 B10R0.71 C=C\C=C\C=C\CCCCC HR145099 [1,0,0,0,0,0|1,0,2]=4 7 B10R0.71 CCCCCCCCCC=O HR134642 [1,0,0,0,0,0|2,0,1]=4 8 B10R0.91 C#CCOC(=O)NCCCC HR135969 [1,0,0,0,0,0|1,0,2]=4 9 B10R0.91 C=CCOC(=O)CCCCC HR122509 [1,0,0,0,0,0|0,0,0]=1 10 B12R0.47 CCCCCCC(=O)OCCCC HR140237 [0,1,0,0,0,0|0,0,2]=3 11 B12R0.95 C=CCOC(=O)COCCC(C)C HR135373 [0,1,0,0,0,0|1,0,0]=2 12 B12R0.102 C=CCOC(=O)COCC(C)CC HR109440 [0,1,0,0,0,0|1,0,0]=2 13 B12R0.206 C=CCOC(=O)CCCCCCC HR110224 [0,1,0,0,0,0|0,0,0]=1 14 B12R1.8 CCCCCCC1=CC=CC=C1 HR143920 [0,0,0,1,0,0|2,0,1]=4 15 B12R1.8 CCCCCCC1=NC=CC=C1 HR126066 [0,0,0,1,0,0|2,0,1]=4 16 B12R1.460 C=CCOC(=O)C1CCCC1=O HR109945 [0,0,0,1,0,0|1,0,1]=3 17 B12R1.567 CCCCCC1=C(C)CCC1=O HR137008 [0,0,0,1,0,0|1,0,2]=4 18 B9R0.5 CCOC(=O)CCCCBr HR125890 [2,0,0,0,0,0|1,0,1]=4 19 B9R0.5 CCOC(=O)CCCCN HR148504 [2,0,0,0,0,0|1,0,1]=4 20 B9R0.5 CCOCCC(=O)OCC HR122912 [2,0,0,0,0,0|1,0,1]=4 21 B9R0.45 C=CCCCCCCCBr HR120623 [2,0,0,0,0,0|1,0,1]=4 22 B9R0.45 C=CCOCCOCCO HR134248 [2,0,0,0,0,0|2,0,0]=4 23 B9R0.45 CCCCCCCCC=O HR129436 [2,0,0,0,0,0|1,0,1]=4 24 B9R0.45 CCCCCCCOC=O HR112750 [2,0,0,0,0,0|1,0,1]=4 25 B9R0.45 CCCCCC\C=C\C=O HR102101 [2,0,0,0,0,0|1,0,1]=4 26 B9R0.45 CCCCCC\C=C\C=O HR125439 [2,0,0,0,0,0|1,0,1]=4 27 B9R0.45 CCCCCC\C=C\CO HR110285 [2,0,0,0,0,0|2,0,0]=4 28 B9R0.45 CCCCC\C=C\CC=O HR101775 [2,0,0,0,0,0|1,0,1]=4 29 B9R0.46 C=CC(=O)OCCCCO HR100523 [2,0,0,0,0,0|2,0,0]=4 30 B9R0.46 C=CC(=O)OCCOCC HR128339 [2,0,0,0,0,0|2,0,0]=4 31 B9R0.46 CCCCCCC(=O)CC HR118308 [2,0,0,0,0,0|0,0,1]=3 32 B9R0.46 CCCCCCC(=O)OC HR101427 [2,0,0,0,0,0|0,0,0]=2 33 B9R0.46 COC(=O)CCCCCBr HR126143 [2,0,0,0,0,0|1,0,0]=3 34 B9R0.46 COC(=O)CCCCCN HR147662 [2,0,0,0,0,0|1,0,0]=3 35 B11R0.4 CCCCCCCC(=O)OCC HR135703 [1,1,0,0,0,0|0,0,1]=3 36 B11R0.4 CCCCCCOC(=O)CCC HR111803 [1,1,0,0,0,0|0,0,2]=4 37 B11R0.4 CCOC(=O)CCCCCCBr HR123277 [1,1,0,0,0,0|0,0,1]=3 38 B11R0.4 CCOC(=O)CCCCCCN HR125644 [1,1,0,0,0,0|0,0,1]=3 39 B11R0.155 CCCCCC(=O)C(=O)OCC HR115198 [1,1,0,0,0,0|0,0,2]=4 40 B11R0.155 CCCCCC(Br)C(=O)OCC HR101626 [1,1,0,0,0,0|0,0,1]=3 41 B11R0.155 CCOC(=O)C(N)CCCCN HR136498 [1,1,0,0,0,0|1,0,1]=4 42 B11R0.3 C=CCCCCCCCCCBr HR106670 [1,1,0,0,0,0|1,0,1]=4 43 B11R0.3 C=CCCCCCCCCCC HR132651 [1,1,0,0,0,0|1,0,1]=4 44 B11R0.3 C=CCCCCCCCCCCl HR141276 [1,1,0,0,0,0|1,0,1]=4 45 B11R0.3 CCCCCC\C=C\C=C\C=O HR107761 [1,1,0,0,0,0|1,0,1]=4 46 B11R0.40 C=CC(O)CCCCCCCC HR121436 [1,1,0,0,0,0|1,0,1]=4 47 B11R0.46 CCCCCC(=O)OCC(C)C HR142362 [1,1,0,0,0,0|0,0,2]=4 48 B13R0.1 CCCCCCC(=O)OCCC(C)C HR102585 [0,2,0,0,0,0|0,0,2]=4 49 B13R0.338 CCCCCCCC(=O)OCCCC HR119444 [0,2,0,0,0,0|0,0,2]=4 50 B13R0.154 CCCCCCCC(=O)NCC(=O)O HR107840 [0,2,0,0,0,0|2,0,0]=4 51 B11R1.4 CCCCCCC1=CC=CS1 HR112963 [1,0,0,1,0,0|0,1,1]=4 52 B11R1.16 CCOC(=O)C1CCCCC1 HR127700 [1,0,0,1,0,0|0,0,1]=3 53 B11R1.16 CCOC(=O)C1CCCCN1 HR141821 [1,0,0,1,0,0|1,0,1]=4 54 B11R1.16 CCOC(=O)C1CCCCN1 HR7720 [1,0,0,1,0,0|1,0,1]=4 55 B11R1.16 CCOC(=O)C1CCCNC1 HR122459 [1,0,0,1,0,0|1,0,1]=4 56 B11R1.16 CCOC(=O)C1CCCNC1 HR122723 [1,0,0,1,0,0|1,0,1]=4 57 B11R1.16 CCOC(=O)C1CCCNC1 HR125333 [1,0,0,1,0,0|1,0,1]=4 58 B11R1.16 CCOC(=O)C1CCCNC1 HR130346 [1,0,0,1,0,0|1,0,1]=4 59 B11R1.16 CCOC(=O)C1CCCNC1 HR138549 [1,0,0,1,0,0|1,0,1]=4 60 B11R1.16 CCOC(=O)C1CCNCC1 HR114915 [1,0,0,1,0,0|1,0,1]=4 61 B11R1.16 CCOC(=O)C1CCNCC1 HR150956 [1,0,0,1,0,0|1,0,1]=4 62 B11R1.16 CCOC(=O)C1CCNCC1 IBCQ00402 [1,0,0,1,0,0|1,0,1]=4 63 B11R1.16 N#CCC(=O)C1CCCCC1 HR121854 [1,0,0,1,0,0|1,0,1]=4 64 B11R1.30 CCOC(=O)CC1CCCN1 HR146017 [1,0,0,1,0,0|1,0,1]=4 65 B11R1.30 CCOC(=O)CC1CCCO1 HR15629 [1,0,0,1,0,0|1,0,1]=4 66 B11R1.101 O=C1CCCCCCCCC1 HR103181 [1,0,0,1,0,0|0,0,2]=4 67 B11R1.199 CCOC(=O)C1CCCC1O HR108336 [1,0,0,1,0,0|1,0,1]=4 68 B13R2.5151 CC1=COC(=O)C2C(C)CCC12 HR117998 [0,0,0,2,0,0|0,0,2]=4