0 B10R0.3 C/C(=C\CO)/CCCC(C)C MCULE-2452185402 [0,0,0,0,0,0|0,0,2]=2 1 B10R0.3 C=C(C)CCCC(=CC=O)C MCULE-3325268372 [0,0,0,0,0,0|0,0,4]=4 2 B10R0.3 C=C(C)CCC[C@H](C)CCO MCULE-1006941082 [0,0,0,0,0,0|0,0,4]=4 3 B10R0.3 C=CC=C(C)CCC=C(C)C MCULE-6184569010 [0,0,0,0,0,0|1,0,1]=2 4 B10R0.3 CC(=CCC/C(=C/C#N)/C)C MCULE-6692599891 [0,0,0,0,0,0|1,0,1]=2 5 B10R0.3 CC(=CCC/C(=C/C=O)/C)C MCULE-9879493059 [0,0,0,0,0,0|0,0,2]=2 6 B10R0.3 CC(=CCC/C(=C/CBr)/C)C MCULE-9024059261 [0,0,0,0,0,0|1,0,0]=1 7 B10R0.3 CC(=CCC/C(=C/CCl)/C)C MCULE-6843014043 [0,0,0,0,0,0|1,0,0]=1 8 B10R0.3 CC(=CCC/C(=C/CN)/C)C MCULE-7548252563 [0,0,0,0,0,0|1,0,0]=1 9 B10R0.3 CC(=CCC/C(=C/CN)/C)C MCULE-9951707217 [0,0,0,0,0,0|1,0,0]=1 10 B10R0.3 CC(=CCC/C(=C/CO)/C)C MCULE-9442424770 [0,0,0,0,0,0|0,0,0]=0 11 B10R0.3 CC(=CCC/C(=C\CO)/C)C MCULE-9192624300 [0,0,0,0,0,0|0,0,0]=0 12 B10R0.3 CC(=CCCC(=CC#N)C)C MCULE-7916897836 [0,0,0,0,0,0|1,0,1]=2 13 B10R0.3 CC(=CCCC(=CC=O)C)C MCULE-3630781826 [0,0,0,0,0,0|0,0,2]=2 14 B10R0.3 CC(=CCCC(=CCBr)C)C MCULE-5311545534 [0,0,0,0,0,0|1,0,0]=1 15 B10R0.3 CC(=CCCC(=CCCl)C)C MCULE-7655016155 [0,0,0,0,0,0|1,0,0]=1 16 B10R0.3 CC(=CCCC(=CCN)C)C MCULE-4232398028 [0,0,0,0,0,0|1,0,0]=1 17 B10R0.3 CC(=CCCC(=CCN)C)C MCULE-4493382694 [0,0,0,0,0,0|1,0,0]=1 18 B10R0.3 CC(=CCCC(=CCO)C)C MCULE-8438901369 [0,0,0,0,0,0|0,0,0]=0 19 B10R0.3 CC(=CCCC(C)CC#N)C MCULE-4074366257 [0,0,0,0,0,0|1,0,3]=4 20 B10R0.3 CC(=CCCC(C)CC=O)C MCULE-7345203515 [0,0,0,0,0,0|0,0,4]=4 21 B10R0.3 CC(=CCCC(C)CCBr)C MCULE-2284266813 [0,0,0,0,0,0|1,0,2]=3 22 B10R0.3 CC(=CCCC(C)CCO)C MCULE-4204888723 [0,0,0,0,0,0|0,0,2]=2 23 B10R0.3 CC(=CCCC(C)CCO)C MCULE-5978920721 [0,0,0,0,0,0|0,0,2]=2 24 B10R0.3 CC(=CCCC(C)NC=O)C MCULE-9904135046 [0,0,0,0,0,0|1,0,3]=4 25 B10R0.3 CC(=CCC[C@@H](C)CC=O)C MCULE-9069221095 [0,0,0,0,0,0|0,0,4]=4 26 B10R0.3 CC(=CCC[C@@H](C)CC=O)C MCULE-9469254915 [0,0,0,0,0,0|0,0,4]=4 27 B10R0.3 CC(=CCC[C@@H](C)CCBr)C MCULE-3266058118 [0,0,0,0,0,0|1,0,2]=3 28 B10R0.3 CC(=CCC[C@@H](C)CCO)C MCULE-3946157075 [0,0,0,0,0,0|0,0,2]=2 29 B10R0.3 CC(=CCC[C@@H](C)CCO)C MCULE-4399439382 [0,0,0,0,0,0|0,0,2]=2 30 B10R0.3 CC(=CCC[C@H](C)CC=O)C MCULE-8401226542 [0,0,0,0,0,0|0,0,4]=4 31 B10R0.3 CC(=CCC[C@H](C)CC=O)C MCULE-9019201073 [0,0,0,0,0,0|0,0,4]=4 32 B10R0.3 CC(=CCC[C@H](C)CCBr)C MCULE-1051199338 [0,0,0,0,0,0|1,0,2]=3 33 B10R0.3 CC(=CCC[C@H](C)CCBr)C MCULE-4086409612 [0,0,0,0,0,0|1,0,2]=3 34 B10R0.3 CC(=CCC[C@H](C)CCO)C MCULE-2407386794 [0,0,0,0,0,0|0,0,2]=2 35 B10R0.3 CC(=CCC[C@H](C)CCO)C MCULE-3900892809 [0,0,0,0,0,0|0,0,2]=2 36 B10R0.3 CC(=CCO)CCCC(C)C MCULE-2627205641 [0,0,0,0,0,0|0,0,2]=2 37 B10R0.3 CC(C)CCCC(C)CCO MCULE-5211094918 [0,0,0,0,0,0|0,0,4]=4 38 B10R0.3 CC(C)CCC[C@@H](C)CCO MCULE-8471234291 [0,0,0,0,0,0|0,0,4]=4 39 B10R0.3 CC(C)CCC[C@H](C)CCO MCULE-4390684031 [0,0,0,0,0,0|0,0,4]=4 40 B10R0.3 CC(C)CCC[C@H](C)CCO MCULE-8890978344 [0,0,0,0,0,0|0,0,4]=4 41 B10R0.3 CCOC(=O)CCC=C(C)C MCULE-5818108388 [0,0,0,0,0,0|3,0,0]=3 42 B9R0.1 C=C/C(=C/CC=C(C)C)/C MCULE-4471176275 [1,0,0,0,0,0|0,0,2]=3 43 B9R0.1 C=CC(=C)CCC=C(C)C MCULE-2247928070 [1,0,0,0,0,0|0,0,2]=3 44 B9R0.1 C=CC(=CCC=C(C)C)C MCULE-2222336240 [1,0,0,0,0,0|0,0,2]=3 45 B9R0.1 CC(=CCCC(C)C=O)C MCULE-6765236802 [1,0,0,0,0,0|0,0,2]=3 46 B9R0.1 CC(C)CCCC(C)CO MCULE-8737374566 [1,0,0,0,0,0|0,0,3]=4 47 B9R0.1 CC=C(C)C=CC=C(C)C MCULE-6256131722 [1,0,0,0,0,0|0,0,2]=3 48 B9R0.1 CN[C@H](C)CCC=C(C)C MCULE-1274555304 [1,0,0,0,0,0|1,0,1]=3 49 B9R0.2 CC/C=C/CCOC(=O)C MCULE-5255060122 [1,0,0,0,0,0|3,0,0]=4 50 B9R0.2 CC/C=C\CCOC(=O)C MCULE-6583289353 [1,0,0,0,0,0|3,0,0]=4 51 B9R0.2 CCC=CCCOC(=O)C MCULE-9625548755 [1,0,0,0,0,0|3,0,0]=4 52 B11R0.6 CC(=CCC/C(=C/C(=O)O)/C)C MCULE-1214369808 [0,1,0,0,0,0|0,0,1]=2 53 B11R0.6 CC(=CCC/C(=C\C(=O)O)/C)C MCULE-3232225553 [0,1,0,0,0,0|0,0,1]=2 54 B11R0.6 CC(=CCCC(=CC(=O)O)C)C MCULE-6185216642 [0,1,0,0,0,0|0,0,1]=2 55 B11R0.6 CC(=CCCC(C)CC(=O)O)C MCULE-3455137708 [0,1,0,0,0,0|0,0,3]=4 56 B11R0.6 CC(=CCC[C@@H](C)CC(=O)O)C MCULE-1765346802 [0,1,0,0,0,0|0,0,3]=4 57 B11R0.6 CC(=CCC[C@H](C)CC(=O)O)C MCULE-2400113823 [0,1,0,0,0,0|0,0,3]=4 58 B11R0.6 CC(=CCC[C@H](C)CC(=O)O)C MCULE-9691367682 [0,1,0,0,0,0|0,0,3]=4 59 B11R0.6 [C@@H](C)(CCC=C(C)C)CC(=O)O MCULE-1438242882 [0,1,0,0,0,0|0,0,3]=4 60 B11R0.147 C(=N/O)\C=C(/C)\CCC=C(C)C MCULE-5600417698 [0,1,0,0,0,0|0,0,1]=2 61 B11R0.147 C(=NO)C=C(C)CCC=C(C)C MCULE-9674607930 [0,1,0,0,0,0|0,0,1]=2 62 B11R0.147 CC(=CCCC(C)CCC#N)C MCULE-9787670748 [0,1,0,0,0,0|1,0,2]=4 63 B11R0.147 CCCC[C@@H](C)CCC=C(C)C MCULE-6446802470 [0,1,0,0,0,0|1,0,2]=4 64 B11R0.147 COCC=C(C)CCC=C(C)C MCULE-3963813373 [0,1,0,0,0,0|0,0,0]=1 65 B11R0.174 CCOC(=O)CCC=C(C)CC MCULE-6307043891 [0,1,0,0,0,0|3,0,0]=4 66 B11R1.157 CC(=CC1CC(=CCO1)C)C MCULE-8051805329 [0,0,0,1,0,0|0,0,0]=1 67 B11R1.157 CC(=CC1CC(CCO1)C)C MCULE-9023631199 [0,0,0,1,0,0|0,0,2]=3 68 B11R1.157 CC(=CC1C[C@H](CCO1)C)C MCULE-1667683585 [0,0,0,1,0,0|0,0,2]=3 69 B11R1.166 CC1=CC(=O)C(=C(C)C)CC1 MCULE-2108234131 [0,0,0,1,0,0|0,0,2]=3 70 B11R1.172 CC(=CCCC1=COC=C1)C MCULE-1929621093 [0,0,0,1,0,0|0,0,2]=3 71 B11R1.424 CC1=C(C(CCC1)(C)C)CBr MCULE-9026935253 [0,0,0,1,0,0|1,0,2]=4 72 B11R1.424 CC1=C(C(CCC1)(C)C)CO MCULE-2011068282 [0,0,0,1,0,0|0,0,2]=3 73 B9R0.48 CC(=CCN(C)CCO)C MCULE-1775474207 [0,0,0,0,1,0|1,0,1]=3 74 B9R0.48 CN(C)CCN(C)CCO MCULE-9893960655 [0,0,0,0,1,0|2,0,1]=4 75 B8R0.7 CC=CCCCC(=O)C MCULE-7957571875 [2,0,0,0,0,0|1,0,1]=4 76 B8R0.28 C=C(C)CCCC(C)C MCULE-5830488183 [2,0,0,0,0,0|0,0,2]=4 77 B8R0.28 CC(=CCCC(=O)O)C MCULE-5848388333 [2,0,0,0,0,0|1,0,0]=3 78 B8R0.28 CC(=CCCC(C)C)Br MCULE-8539278626 [2,0,0,0,0,0|1,0,1]=4 79 B8R0.28 CC(=CCCC(C)N)C MCULE-4339510061 [2,0,0,0,0,0|1,0,1]=4 80 B8R0.28 CC(=CCCC(C)O)C MCULE-6046871097 [2,0,0,0,0,0|0,0,1]=3 81 B8R0.28 CC(=CCC[C@@H](C)O)C MCULE-5913564496 [2,0,0,0,0,0|0,0,1]=3 82 B8R0.28 CC(=CCC[C@@H](C)O)C MCULE-8239445037 [2,0,0,0,0,0|0,0,1]=3 83 B8R0.28 CC(=CCC[C@H](C)O)C MCULE-3685132186 [2,0,0,0,0,0|0,0,1]=3 84 B8R0.28 CC(=CCC[C@H](C)O)C MCULE-7339160655 [2,0,0,0,0,0|0,0,1]=3 85 B8R0.28 CC(=O)CCC=C(C)C MCULE-3832720881 [2,0,0,0,0,0|0,0,1]=3 86 B8R0.28 CC(=O)OCC=C(C)C MCULE-1590395935 [2,0,0,0,0,0|1,0,1]=4 87 B8R0.4 C=CCCC/C=C/CO MCULE-8670012458 [2,0,0,0,0,0|0,0,2]=4 88 B8R0.4 C=CCCCC=CCO MCULE-8508232522 [2,0,0,0,0,0|0,0,2]=4 89 B8R0.4 CCCCC/C=C/CO MCULE-2538979274 [2,0,0,0,0,0|0,0,2]=4 90 B8R0.4 CCCCCC=CCO MCULE-7026544339 [2,0,0,0,0,0|0,0,2]=4 91 B10R0.44 C=CC(=C)CC(O)C=C(C)C MCULE-5950278843 [1,1,0,0,0,0|0,0,2]=4 92 B10R0.57 CCC(=O)C(C)CC=C(C)C MCULE-1075610884 [1,1,0,0,0,0|1,0,1]=4 93 B10R0.65 C=CC(C)(O)CCC=C(C)C MCULE-2407576698 [1,1,0,0,0,0|0,0,2]=4 94 B10R0.65 C=C[C@@](C)(O)CCC=C(C)C MCULE-4104124685 [1,1,0,0,0,0|0,0,2]=4 95 B10R0.65 C=C[C@](C)(O)CCC=C(C)C MCULE-2892441793 [1,1,0,0,0,0|0,0,2]=4 96 B10R0.65 C=C[C@](C)(O)CCC=C(C)C MCULE-4783414409 [1,1,0,0,0,0|0,0,2]=4 97 B10R0.65 CCC(C)(O)CCC=C(C)C MCULE-1170963979 [1,1,0,0,0,0|0,0,2]=4 98 B10R0.98 CC(=CCCC(C)C(C)O)C MCULE-5850991547 [1,1,0,0,0,0|0,0,1]=3 99 B10R0.97 CC(=CCCC=CC(=O)O)C MCULE-4585905513 [1,1,0,0,0,0|0,0,1]=3 100 B12R0.279 C/C(=C\CO)/CC/C=C(\C)/C(=O)O MCULE-4292831881 [0,1,0,0,0,1|2,0,0]=4 101 B12R0.279 CC(=CCO)CCC=C(C)C(=O)O MCULE-7343393456 [0,1,0,0,0,1|2,0,0]=4 102 B12R0.240 COC(=O)/C=C(\C)/CCC=C(C)C MCULE-6913797824 [0,2,0,0,0,0|0,0,1]=3 103 B12R0.240 COC(=O)C=C(C)CCC=C(C)C MCULE-2600851087 [0,2,0,0,0,0|0,0,1]=3 104 B12R0.44 CC(=CCCC(=CCC(=O)O)C)C MCULE-9523336581 [0,2,0,0,0,0|0,0,0]=2 105 B12R0.233 CC(=CCC/C(=C/COC=O)/C)C MCULE-6334497175 [0,2,0,0,0,0|0,0,0]=2 106 B12R0.233 CC(=CCCC(=CCOC=O)C)C MCULE-3941955944 [0,2,0,0,0,0|0,0,0]=2 107 B12R0.233 CC(=CCCC(C)CCOC=O)C MCULE-2860533435 [0,2,0,0,0,0|0,0,2]=4 108 B10R1.13 C=C(C)C1=CC=C(CC1)C MCULE-8568677604 [1,0,0,1,0,0|0,0,2]=4 109 B10R1.13 C=C(C)C1CC=C(CC1)C MCULE-2462317444 [1,0,0,1,0,0|0,0,2]=4 110 B10R1.13 C=C(C)[C@@H]1CC=C(CC1)C MCULE-5992544838 [1,0,0,1,0,0|0,0,2]=4 111 B10R1.13 C=C(C)[C@@H]1CC=C(CC1)C MCULE-6736529827 [1,0,0,1,0,0|0,0,2]=4 112 B10R1.13 C=C(C)[C@H]1CC=C(CC1)C MCULE-1385130554 [1,0,0,1,0,0|0,0,2]=4 113 B10R1.13 C=C(C)[C@H]1CC=C(CC1)C MCULE-7380592285 [1,0,0,1,0,0|0,0,2]=4 114 B10R1.13 CC(=C1CC=C(CC1)Br)C MCULE-8162525678 [1,0,0,1,0,0|1,0,0]=3 115 B10R1.13 CC(=C1CCC(=O)CC1)C MCULE-1974192999 [1,0,0,1,0,0|1,0,1]=4 116 B10R1.13 CC(=O)C1=CC=C(CC1)C MCULE-6088214601 [1,0,0,1,0,0|1,0,1]=4 117 B10R1.13 CC(=O)C1CC=C(CC1)C MCULE-3149377803 [1,0,0,1,0,0|1,0,1]=4 118 B10R1.13 CC1=CC=C(CC1)C(C)C MCULE-4783923707 [1,0,0,1,0,0|0,0,2]=4 119 B10R1.13 CC1=CCC(=C(C)C)CC1 MCULE-7193214900 [1,0,0,1,0,0|0,0,0]=2 120 B10R1.13 CC1=CCC(=CC1)C(C)C MCULE-7972715698 [1,0,0,1,0,0|0,0,2]=4 121 B10R1.13 CC1=CC[C@@H](CC1)C(C)C MCULE-7463586312 [1,0,0,1,0,0|0,0,2]=4 122 B10R1.13 CC1=CC[C@@H](CC1)C(C)C MCULE-7712751868 [1,0,0,1,0,0|0,0,2]=4 123 B10R1.245 CC1=CC=CC(=C1CO)C MCULE-8577571504 [1,0,0,1,0,0|0,0,2]=4 124 B10R1.245 CC1=CCCC(=C1C=O)C MCULE-6417573297 [1,0,0,1,0,0|0,0,2]=4 125 B10R1.245 CC1=CN=CC(=C1CO)C MCULE-8492960625 [1,0,0,1,0,0|1,0,1]=4 126 B10R1.245 CC1=NC=CC(=C1CO)C MCULE-8713709145 [1,0,0,1,0,0|1,0,1]=4 127 B10R1.30 CC1=CC(=C(C=C1)C)CO MCULE-3679041564 [0,0,0,1,1,0|0,0,2]=4 128 B10R1.30 CC1=CC=C(C(=N1)CO)C MCULE-6025294700 [0,0,0,1,1,0|1,0,1]=4 129 B10R1.30 CC1=CN=C(C(=C1)CO)C MCULE-6947902640 [0,0,0,1,1,0|1,0,1]=4 130 B12R1.16 C=C(CCO)C1CC=C(CC1)C MCULE-1753855464 [0,1,0,1,0,0|0,0,2]=4 131 B12R1.232 CC1=CC(C(CC1O)C(C)C)O MCULE-3726179107 [0,1,0,1,0,0|0,0,2]=4 132 B12R1.232 CC1=C[C@@H]([C@H](C[C@@H]1O)C(C)C)O MCULE-6022003482 [0,1,0,1,0,0|0,0,2]=4 133 B12R1.232 CC1=C[C@@H]([C@H](C[C@@H]1O)C(C)C)O MCULE-8793486504 [0,1,0,1,0,0|0,0,2]=4 134 B12R1.1348 CC(=CCCC(C)(O)C1CO1)C MCULE-9710892309 [0,1,0,1,0,0|0,0,2]=4 135 B12R1.57 CC(=C1CCC(CC1=NO)C)C MCULE-2263548466 [0,1,0,1,0,0|1,0,1]=4 136 B12R2.766 C12CC(C1(C)C)C(C=C2C)O MCULE-2216758301 [0,0,0,2,0,0|0,0,2]=4 137 B12R2.766 CC1=C[C@@H](C2CC1C2(C)C)O MCULE-2432339510 [0,0,0,2,0,0|0,0,2]=4 138 B12R2.766 [C@@H]12C[C@@H](C1(C)C)[C@H](C=C2C)O MCULE-2551341762 [0,0,0,2,0,0|0,0,2]=4 139 B12R2.766 [C@@H]12C[C@@H](C1(C)C)[C@H](C=C2C)O MCULE-7918435177 [0,0,0,2,0,0|0,0,2]=4 140 B8R0.9 C/C(=N\O)/CCC(C)C MCULE-6160318624 [1,0,0,0,1,0|1,0,1]=4 141 B8R0.9 CC(=NO)CCC(C)C MCULE-1275882348 [1,0,0,0,1,0|1,0,1]=4 142 B8R0.9 CC(C)CCC(C)CO MCULE-8698383870 [1,0,0,0,1,0|0,0,2]=4