0 B9R0.44 C#CCC(=O)CC(C)(C)C 1458a_100000211214_100000184674 [0,0,0,0,0,0|2,0,2]=4 1 B9R0.44 C#CCC(C)OC(C)(C)C 34a_100000685586_100000210625 [0,0,0,0,0,0|2,0,1]=3 2 B9R0.44 C#CCN(C)CC(C)(C)C 2230a_100000742839_100000038162 [0,0,0,0,0,0|2,0,1]=3 3 B9R0.44 C#CCN(C)CC(C)(C)C 270004a_100000225692_100011204126 [0,0,0,0,0,0|2,0,1]=3 4 B9R0.44 C#CCN(C)CC(C)(C)C 34a_100000225692_100011219605 [0,0,0,0,0,0|2,0,1]=3 5 B9R0.44 C#CCN(C)CC(C)(C)F 34a_100000225692_100011997219 [0,0,0,0,0,0|3,0,1]=4 6 B9R0.44 C#CCN(C)CC(C)(C)O 2230a_100000755907_100000038162 [0,0,0,0,0,0|3,0,1]=4 7 B9R0.44 C#CCN(C)CC(C)(C)O 34a_100000225692_100000764493 [0,0,0,0,0,0|3,0,1]=4 8 B9R0.44 C#CCN(C)C[Si](C)(C)C 2230a_100000225692_100000037933 [0,0,0,0,0,0|2,1,1]=4 9 B9R0.44 C/C=C/C(C)OC(C)(C)C 34a_200102604097_100000210625 [0,0,0,0,0,0|2,0,1]=3 10 B9R0.44 C=CCC(=O)CC(C)(C)C 1458a_100000211214_100000210623 [0,0,0,0,0,0|2,0,1]=3 11 B9R0.44 C=CCC(=O)CC(C)(C)O 1458a_100000693243_100000210623 [0,0,0,0,0,0|3,0,1]=4 12 B9R0.44 C=CCC(=O)C[N+](C)(C)C 1458a_100000033712_100000210623 [0,0,0,0,0,0|3,0,1]=4 13 B9R0.44 C=CCC(=O)C[Si](C)(C)C 1458a_100000210193_100000233785 [0,0,0,0,0,0|2,1,1]=4 14 B9R0.44 C=CCC(=O)C[Si](C)(C)C 1458a_100011218504_100000210623 [0,0,0,0,0,0|2,1,1]=4 15 B9R0.44 C=CCC(=O)NC(C)(C)C 11a_100000715429_100000210193 [0,0,0,0,0,0|3,0,1]=4 16 B9R0.44 C=CCC(=O)NC(C)(C)C 1626a_100000715429_100000210193 [0,0,0,0,0,0|3,0,1]=4 17 B9R0.44 C=CCC(=O)NC(C)(C)C 240690a_100000715429_100000210193 [0,0,0,0,0,0|3,0,1]=4 18 B9R0.44 C=CCC(=O)NC(C)(C)C 527a_100000715429_100000210193 [0,0,0,0,0,0|3,0,1]=4 19 B9R0.44 C=CCN(C)CC(C)(C)C 2230a_100000742839_100000210623 [0,0,0,0,0,0|2,0,0]=2 20 B9R0.44 C=CCN(C)CC(C)(C)C 269982a_100000742839_100000210623 [0,0,0,0,0,0|2,0,0]=2 21 B9R0.44 C=CCN(C)CC(C)(C)C 270004a_100000225617_100011204126 [0,0,0,0,0,0|2,0,0]=2 22 B9R0.44 C=CCN(C)CC(C)(C)O 2230a_100000755907_100000210623 [0,0,0,0,0,0|3,0,0]=3 23 B9R0.44 C=CCN(C)CC(C)(C)O 269982a_100000755907_100000210623 [0,0,0,0,0,0|3,0,0]=3 24 B9R0.44 C=CCN(C)C[N+](C)(C)C 269982a_100000225617_200000036245 [0,0,0,0,0,0|3,0,0]=3 25 B9R0.44 C=CCN(C)C[Si](C)(C)C 2230a_100000225617_100000037933 [0,0,0,0,0,0|2,1,0]=3 26 B9R0.44 C=CCN(C)C[Si](C)(C)C 269982a_200020589227_100000210623 [0,0,0,0,0,0|2,1,0]=3 27 B9R0.44 C=CC[C@@H](C)OC(C)(C)C 34a_100000731007_100000210625 [0,0,0,0,0,0|2,0,0]=2 28 B9R0.44 CC#CC(C)OC(C)(C)C 34a_100011216543_100000210625 [0,0,0,0,0,0|2,0,2]=4 29 B9R0.44 CC(C)(C)CC(=O)CC#N 1458a_100000211214_100011214920 [0,0,0,0,0,0|2,0,2]=4 30 B9R0.44 CC(C)(C)CC(=O)CCF 1458a_100000211214_100011217306 [0,0,0,0,0,0|2,0,2]=4 31 B9R0.44 CC(C)(C)CC(=O)CCO 1458a_100000211214_100000211926 [0,0,0,0,0,0|1,0,3]=4 32 B9R0.44 CC(C)(C)CN([13CH3])CCO 2230a_100000752879_200025704644 [0,0,0,0,0,0|1,0,2]=3 33 B9R0.44 CC(C)(C)CN([13CH3])CCO 269982a_100000752879_200025704644 [0,0,0,0,0,0|1,0,2]=3 34 B9R0.44 CC(CC#N)NC(C)(C)C 2230a_100000715429_100009813641 [0,0,0,0,0,0|2,0,1]=3 35 B9R0.44 CC(CC#N)OC(C)(C)C 7a_100015890283_100009813641 [0,0,0,0,0,0|2,0,1]=3 36 B9R0.44 CC(CC#N)SC(C)(C)C 62a_100000211941_100009813641 [0,0,0,0,0,0|2,0,1]=3 37 B9R0.44 CC(CC#N)SC(C)(C)C 62a_100009813641_100000211941 [0,0,0,0,0,0|2,0,1]=3 38 B9R0.44 CC(CC(C)(C)C)OCF 7a_200011218616_100015361967 [0,0,0,0,0,0|2,0,1]=3 39 B9R0.44 CC(CCBr)OC(C)(C)C 34a_100012276601_100000210625 [0,0,0,0,0,0|2,0,1]=3 40 B9R0.44 CC(CCO)NC(C)(C)C 2230a_100000715429_100009893172 [0,0,0,0,0,0|1,0,2]=3 41 B9R0.44 CC(CCO)OC(C)(C)C 34a_100015890283_100009893172 [0,0,0,0,0,0|1,0,2]=3 42 B9R0.44 CC(CCO)OC(C)(C)C 7a_100015890283_100009893172 [0,0,0,0,0,0|1,0,2]=3 43 B9R0.44 CC(CCO)SC(C)(C)C 62a_100000211941_100009893172 [0,0,0,0,0,0|1,0,2]=3 44 B9R0.44 CC(CCO)SC(C)(C)C 62a_100009893172_100000211941 [0,0,0,0,0,0|1,0,2]=3 45 B9R0.44 CC(CO[13CH3])CC(C)(C)C 7a_200011215325_200025704644 [0,0,0,0,0,0|2,0,0]=2 46 B9R0.44 CCCC(=O)CC(C)(C)C 1458a_100000211214_100000210303 [0,0,0,0,0,0|2,0,2]=4 47 B9R0.44 CCCC(C)NC(C)(C)C 2230a_100000715429_100000766640 [0,0,0,0,0,0|2,0,1]=3 48 B9R0.44 CCCC(C)OC(C)(C)C 34a_100000764384_100000210625 [0,0,0,0,0,0|2,0,1]=3 49 B9R0.44 CCCC(C)OC(C)(C)C 34a_100015890283_100000766640 [0,0,0,0,0,0|2,0,1]=3 50 B9R0.44 CCCC(C)OC(C)(C)C 7a_100015890283_100000766640 [0,0,0,0,0,0|2,0,1]=3 51 B9R0.44 CCCC(C)SC(C)(C)C 62a_100000211941_100000766640 [0,0,0,0,0,0|2,0,1]=3 52 B9R0.44 CCCC(C)SC(C)(C)C 62a_100000766640_100000211941 [0,0,0,0,0,0|2,0,1]=3 53 B9R0.44 CCCN(C)CC(C)(C)C 2230a_100000742839_100000210303 [0,0,0,0,0,0|2,0,1]=3 54 B9R0.44 CCCN(C)CC(C)(C)C 2230a_107254831479_200000210301 [0,0,0,0,0,0|2,0,1]=3 55 B9R0.44 CCCN(C)CC(C)(C)C 269982a_100000742839_100000210303 [0,0,0,0,0,0|2,0,1]=3 56 B9R0.44 CCCN(C)CC(C)(C)C 269982a_107254831479_200000210301 [0,0,0,0,0,0|2,0,1]=3 57 B9R0.44 CCCN(C)CC(C)(C)C 270004a_100000747261_100011204126 [0,0,0,0,0,0|2,0,1]=3 58 B9R0.44 CCCN(C)CC(C)(C)O 2230a_100000755907_100000210303 [0,0,0,0,0,0|3,0,1]=4 59 B9R0.44 CCCN(C)CC(C)(C)O 269982a_100000755907_100000210303 [0,0,0,0,0,0|3,0,1]=4 60 B9R0.44 CCCN(C)C[N+](C)(C)C 269982a_100000747261_200000036245 [0,0,0,0,0,0|3,0,1]=4 61 B9R0.44 CCCN(C)C[Si](C)(C)C 2230a_100000747261_100000037933 [0,0,0,0,0,0|2,1,1]=4 62 B9R0.44 CCCN(C)C[Si](C)(C)C 269982a_200020589227_100000210303 [0,0,0,0,0,0|2,1,1]=4 63 B9R0.44 CCCN([13CH3])CC(C)(C)C 2230a_107254831479_200025704644 [0,0,0,0,0,0|2,0,1]=3 64 B9R0.44 CCCN([13CH3])CC(C)(C)C 269982a_107254831479_200025704644 [0,0,0,0,0,0|2,0,1]=3 65 B9R0.44 CCN[C@@H](C)CC(C)(C)C 2230a_106358413534_100000210202 [0,0,0,0,0,0|2,0,1]=3 66 B9R0.44 CCOC(C)CC(C)(C)C 7a_200011218616_100000210202 [0,0,0,0,0,0|2,0,1]=3 67 B9R0.44 CN(CC#N)CC(C)(C)C 2230a_100000742839_100011215382 [0,0,0,0,0,0|2,0,1]=3 68 B9R0.44 CN(CC#N)CC(C)(C)C 269982a_100000742839_100011214920 [0,0,0,0,0,0|2,0,1]=3 69 B9R0.44 CN(CC#N)CC(C)(C)O 2230a_100000755907_100011215382 [0,0,0,0,0,0|3,0,1]=4 70 B9R0.44 CN(CC#N)CC(C)(C)O 269982a_100000755907_100011214920 [0,0,0,0,0,0|3,0,1]=4 71 B9R0.44 CN(CC#N)C[Si](C)(C)C 2230a_100000748184_100000037933 [0,0,0,0,0,0|2,1,1]=4 72 B9R0.44 CN(CC#N)C[Si](C)(C)C 269982a_200020589227_100011214920 [0,0,0,0,0,0|2,1,1]=4 73 B9R0.44 CN(CC=O)CC(C)(C)C 2230a_100000742839_200015260668 [0,0,0,0,0,0|1,0,0]=1 74 B9R0.44 CN(CC=O)CC(C)(C)C 269982a_100000742839_200015260668 [0,0,0,0,0,0|1,0,0]=1 75 B9R0.44 CN(CC=O)CC(C)(C)O 2230a_100000755907_200015260668 [0,0,0,0,0,0|2,0,0]=2 76 B9R0.44 CN(CC=O)CC(C)(C)O 269982a_100000755907_200015260668 [0,0,0,0,0,0|2,0,0]=2 77 B9R0.44 CN(CC=O)CC(F)(F)F 2230a_100000738877_200015260668 [0,0,0,0,0,0|4,0,0]=4 78 B9R0.44 CN(CC=O)C[Si](C)(C)C 269982a_200020589227_200015260668 [0,0,0,0,0,0|1,1,0]=2 79 B9R0.44 CN(CCF)CC(C)(C)C 2230a_100000742839_100011217306 [0,0,0,0,0,0|2,0,1]=3 80 B9R0.44 CN(CCF)CC(C)(C)C 269982a_100000742839_100011217306 [0,0,0,0,0,0|2,0,1]=3 81 B9R0.44 CN(CCF)CC(C)(C)O 2230a_100000755907_100011217306 [0,0,0,0,0,0|3,0,1]=4 82 B9R0.44 CN(CCF)CC(C)(C)O 269982a_100000755907_100011217306 [0,0,0,0,0,0|3,0,1]=4 83 B9R0.44 CN(CCF)C[Si](C)(C)C 269982a_200020589227_100011217306 [0,0,0,0,0,0|2,1,1]=4 84 B9R0.44 CN(CCO)CC(C)(C)C 2230a_100000742839_100000211926 [0,0,0,0,0,0|1,0,2]=3 85 B9R0.44 CN(CCO)CC(C)(C)C 2230a_100000752879_200000210301 [0,0,0,0,0,0|1,0,2]=3 86 B9R0.44 CN(CCO)CC(C)(C)C 269982a_100000742839_100000211926 [0,0,0,0,0,0|1,0,2]=3 87 B9R0.44 CN(CCO)CC(C)(C)C 269982a_100000752879_200000210301 [0,0,0,0,0,0|1,0,2]=3 88 B9R0.44 CN(CCO)CC(C)(C)C 270004a_100000210263_100011204126 [0,0,0,0,0,0|1,0,2]=3 89 B9R0.44 CN(CCO)CC(C)(C)O 2230a_100000755907_100000211926 [0,0,0,0,0,0|2,0,2]=4 90 B9R0.44 CN(CCO)CC(C)(C)O 269982a_100000755907_100000211926 [0,0,0,0,0,0|2,0,2]=4 91 B9R0.44 CN(CCO)C[N+](C)(C)C 269982a_100000210263_200000036245 [0,0,0,0,0,0|2,0,2]=4 92 B9R0.44 CN(CCO)C[Si](C)(C)C 2230a_100000210263_100000037933 [0,0,0,0,0,0|1,1,2]=4 93 B9R0.44 CN(CCO)C[Si](C)(C)C 269982a_200020589227_100000211926 [0,0,0,0,0,0|1,1,2]=4 94 B9R0.44 CNCC(O)C[N+](C)(C)C 2230a_106832991635_100000032816 [0,0,0,0,0,0|4,0,0]=4 95 B9R0.44 CNCC(O)C[N+](C)(C)C 34a_100102657272_100000032816 [0,0,0,0,0,0|4,0,0]=4 96 B9R0.44 CNCC(O)C[N+](C)(C)C 7a_106832991635_100000032816 [0,0,0,0,0,0|4,0,0]=4 97 B9R0.44 COCC(C)CC(C)(C)C 7a_200011215325_200000210301 [0,0,0,0,0,0|2,0,0]=2 98 B9R0.44 COCC(C)NC(C)(C)C 2230a_100000715429_100000765312 [0,0,0,0,0,0|3,0,0]=3 99 B9R0.44 COCC(C)OC(C)(C)C 34a_100015890283_100000765312 [0,0,0,0,0,0|3,0,0]=3 100 B9R0.44 COCC(C)OC(C)(C)C 7a_100015890283_100000765312 [0,0,0,0,0,0|3,0,0]=3 101 B9R0.44 COCC(C)SC(C)(C)C 62a_100000211941_100000765312 [0,0,0,0,0,0|3,0,0]=3 102 B9R0.44 COCC(C)SC(C)(C)C 62a_100000765312_100000211941 [0,0,0,0,0,0|3,0,0]=3 103 B9R0.44 COCC(O)C[N+](C)(C)C 34a_100138415774_100000032816 [0,0,0,0,0,0|4,0,0]=4 104 B9R0.44 COCN(C)CC(C)(C)C 2230a_100000742839_100000766300 [0,0,0,0,0,0|3,0,0]=3 105 B9R0.44 COCN(C)CC(C)(C)C 269982a_100000742839_100000766300 [0,0,0,0,0,0|3,0,0]=3 106 B9R0.44 COCN(C)CC(C)(C)O 2230a_100000755907_100000766300 [0,0,0,0,0,0|4,0,0]=4 107 B9R0.44 COCN(C)CC(C)(C)O 269982a_100000755907_100000766300 [0,0,0,0,0,0|4,0,0]=4 108 B9R0.44 COCN(C)C[Si](C)(C)C 269982a_200020589227_100000766300 [0,0,0,0,0,0|3,1,0]=4 109 B9R0.44 COC[C@@H](C)OC(C)(C)C 34a_100011934205_100000210625 [0,0,0,0,0,0|3,0,0]=3 110 B9R0.44 CSCC(O)C[N+](C)(C)C 62a_100000032816_200000210301 [0,0,0,0,0,0|4,0,0]=4 111 B9R0.44 CSCC(O)C[N+](C)(C)C 62a_200000210301_100000032816 [0,0,0,0,0,0|4,0,0]=4 112 B9R0.44 CSCN(C)CC(C)(C)C 2230a_100000742839_100011218213 [0,0,0,0,0,0|3,0,0]=3 113 B9R0.44 CSCN(C)CC(C)(C)C 269982a_100000742839_100011218213 [0,0,0,0,0,0|3,0,0]=3 114 B9R0.44 CSCN(C)CC(C)(C)O 2230a_100000755907_100011218213 [0,0,0,0,0,0|4,0,0]=4 115 B9R0.44 CSCN(C)CC(C)(C)O 269982a_100000755907_100011218213 [0,0,0,0,0,0|4,0,0]=4 116 B9R0.44 CSCN(C)C[Si](C)(C)C 269982a_200020589227_100011218213 [0,0,0,0,0,0|3,1,0]=4 117 B9R0.44 C[C@H](CCO)NC(C)(C)C 34a_100000706166_100000210625 [0,0,0,0,0,0|1,0,2]=3 118 B9R0.44 C[N+](C)(C)CC(O)CS[13CH3] 62a_100000032816_200025704644 [0,0,0,0,0,0|4,0,0]=4 119 B9R0.44 C[N+](C)(C)CC(O)CS[13CH3] 62a_200025704644_100000032816 [0,0,0,0,0,0|4,0,0]=4 120 B8R0.5 C#CCC(C)OC(C)C 34a_100000685586_100000210206 [1,0,0,0,0,0|2,0,1]=4 121 B8R0.5 C#CCC(C)OC(C)C 7a_100000685586_100000210206 [1,0,0,0,0,0|2,0,1]=4 122 B8R0.5 C#CCN(C)CC(C)C 2230a_100000225692_100000210760 [1,0,0,0,0,0|2,0,1]=4 123 B8R0.5 C#CCN(C)CC(C)C 2230a_100000747067_100000038162 [1,0,0,0,0,0|2,0,1]=4 124 B8R0.5 C#CCN(C)CC(C)C 270004a_100000225692_100000210432 [1,0,0,0,0,0|2,0,1]=4 125 B8R0.5 C#CCN(C)CC(C)C 34a_100000225692_100000210624 [1,0,0,0,0,0|2,0,1]=4 126 B8R0.5 C/C=C/C(C)OC(C)C 34a_200102604097_100000210206 [1,0,0,0,0,0|2,0,1]=4 127 B8R0.5 C=C(C)CN(C)CC=O 2230a_100000225649_200015260668 [1,0,0,0,0,0|1,0,2]=4 128 B8R0.5 C=C(C)CN(C)CC=O 269982a_100000225649_200015260668 [1,0,0,0,0,0|1,0,2]=4 129 B8R0.5 C=CCC(=O)CC(C)C 1458a_100000210193_100000210624 [1,0,0,0,0,0|2,0,1]=4 130 B8R0.5 C=CCC(=O)CC(C)C 1458a_100000210554_100000210623 [1,0,0,0,0,0|2,0,1]=4 131 B8R0.5 C=CCN(C)CC(C)C 2230a_100000225617_100000210760 [1,0,0,0,0,0|2,0,0]=3 132 B8R0.5 C=CCN(C)CC(C)C 2230a_100000747067_100000210623 [1,0,0,0,0,0|2,0,0]=3 133 B8R0.5 C=CCN(C)CC(C)C 269982a_100000225617_100000210624 [1,0,0,0,0,0|2,0,0]=3 134 B8R0.5 C=CCN(C)CC(C)C 269982a_100000747067_100000210623 [1,0,0,0,0,0|2,0,0]=3 135 B8R0.5 C=CCN(C)CC(C)C 270004a_100000225617_100000210432 [1,0,0,0,0,0|2,0,0]=3 136 B8R0.5 C=CCN(C)CC(C)O 2230a_100000225617_100011218427 [1,0,0,0,0,0|3,0,0]=4 137 B8R0.5 C=CCN(C)CC(C)O 2230a_100000227577_100000210623 [1,0,0,0,0,0|3,0,0]=4 138 B8R0.5 C=CCN(C)CC(C)O 269982a_100000225617_100011218427 [1,0,0,0,0,0|3,0,0]=4 139 B8R0.5 C=CCN(C)CC(C)O 269982a_100000227577_100000210623 [1,0,0,0,0,0|3,0,0]=4 140 B8R0.5 C=CCN(C)C[C@@H](C)O 2230a_100000225617_100009817552 [1,0,0,0,0,0|3,0,0]=4 141 B8R0.5 C=CCN(C)C[C@@H](C)O 269982a_100000225617_100009817552 [1,0,0,0,0,0|3,0,0]=4 142 B8R0.5 C=CC[C@@H](C)OC(C)C 34a_100000731007_100000210206 [1,0,0,0,0,0|2,0,0]=3 143 B8R0.5 C=CC[C@@H](C)OC(C)C 7a_100000731007_100000210206 [1,0,0,0,0,0|2,0,0]=3 144 B8R0.5 CC(C)CC(C)OCF 34a_100000211805_100015361967 [1,0,0,0,0,0|2,0,1]=4 145 B8R0.5 CC(C)CC(C)OCF 7a_100000211805_100015361967 [1,0,0,0,0,0|2,0,1]=4 146 B8R0.5 CC(C)CC(C)SCF 62a_100000731052_100015361967 [1,0,0,0,0,0|2,0,1]=4 147 B8R0.5 CC(C)CC(C)SCF 62a_100015361967_100000731052 [1,0,0,0,0,0|2,0,1]=4 148 B8R0.5 CC(C)CN(C)CC#N 2230a_100000747067_100011215382 [1,0,0,0,0,0|2,0,1]=4 149 B8R0.5 CC(C)CN(C)CC#N 2230a_100000748184_100000210760 [1,0,0,0,0,0|2,0,1]=4 150 B8R0.5 CC(C)CN(C)CC#N 269982a_100000747067_100011214920 [1,0,0,0,0,0|2,0,1]=4 151 B8R0.5 CC(C)CN(C)CC=O 2230a_100000747067_200015260668 [1,0,0,0,0,0|1,0,0]=2 152 B8R0.5 CC(C)CN(C)CC=O 269982a_100000747067_200015260668 [1,0,0,0,0,0|1,0,0]=2 153 B8R0.5 CC(C)CN(C)CCF 2230a_100000747067_100011217306 [1,0,0,0,0,0|2,0,1]=4 154 B8R0.5 CC(C)CN(C)CCF 269982a_100000747067_100011217306 [1,0,0,0,0,0|2,0,1]=4 155 B8R0.5 CC(C)CN(C)CCO 2230a_100000210263_100000210760 [1,0,0,0,0,0|1,0,2]=4 156 B8R0.5 CC(C)CN(C)CCO 2230a_100000747067_100000211926 [1,0,0,0,0,0|1,0,2]=4 157 B8R0.5 CC(C)CN(C)CCO 2230a_100015185251_200000210301 [1,0,0,0,0,0|1,0,2]=4 158 B8R0.5 CC(C)CN(C)CCO 269982a_100000210263_100000210624 [1,0,0,0,0,0|1,0,2]=4 159 B8R0.5 CC(C)CN(C)CCO 269982a_100000747067_100000211926 [1,0,0,0,0,0|1,0,2]=4 160 B8R0.5 CC(C)CN(C)CCO 269982a_100015185251_200000210301 [1,0,0,0,0,0|1,0,2]=4 161 B8R0.5 CC(C)CN(C)CCO 270004a_100000210263_100000210432 [1,0,0,0,0,0|1,0,2]=4 162 B8R0.5 CC(C)CN([13CH3])CCO 2230a_100015185251_200025704644 [1,0,0,0,0,0|1,0,2]=4 163 B8R0.5 CC(C)CN([13CH3])CCO 269982a_100015185251_200025704644 [1,0,0,0,0,0|1,0,2]=4 164 B8R0.5 CC(C)C[C@H](N)CO[13CH3] 34a_100011830311_200025704644 [1,0,0,0,0,0|3,0,0]=4 165 B8R0.5 CC(C)NC(C)CC#N 2230a_100138425928_100009813641 [1,0,0,0,0,0|2,0,1]=4 166 B8R0.5 CC(C)NC(C)CCO 2230a_100138425928_100009893172 [1,0,0,0,0,0|1,0,2]=4 167 B8R0.5 CC(C)NC(C)CCO 34a_100138425928_100009893172 [1,0,0,0,0,0|1,0,2]=4 168 B8R0.5 CC(C)N[C@@H](C)CC#N 2230a_100016994482_100000210206 [1,0,0,0,0,0|2,0,1]=4 169 B8R0.5 CC(C)N[C@H](C)CCO 2230a_100000706166_100000210206 [1,0,0,0,0,0|1,0,2]=4 170 B8R0.5 CC(C)N[C@H](C)CCO 34a_100000706166_100000210206 [1,0,0,0,0,0|1,0,2]=4 171 B8R0.5 CC(C)OC(C)CCBr 34a_100012276601_100000210206 [1,0,0,0,0,0|2,0,1]=4 172 B8R0.5 CC(C)OC(C)CCO 34a_100000212225_100009893172 [1,0,0,0,0,0|1,0,2]=4 173 B8R0.5 CC(C)SC(C)CC#N 62a_100000210206_100009813641 [1,0,0,0,0,0|2,0,1]=4 174 B8R0.5 CC(C)SC(C)CC#N 62a_100009813641_100000210206 [1,0,0,0,0,0|2,0,1]=4 175 B8R0.5 CC(C)SC(C)CCO 62a_100000210206_100009893172 [1,0,0,0,0,0|1,0,2]=4 176 B8R0.5 CC(C)SC(C)CCO 62a_100009893172_100000210206 [1,0,0,0,0,0|1,0,2]=4 177 B8R0.5 CC(CS[13CH3])CN(C)C 62a_100015348159_200025704644 [1,0,0,0,0,0|3,0,0]=4 178 B8R0.5 CC(CS[13CH3])CN(C)C 62a_200025704644_100015348159 [1,0,0,0,0,0|3,0,0]=4 179 B8R0.5 CC(O)CN(C)CC=O 2230a_100000227577_200015260668 [1,0,0,0,0,0|2,0,0]=3 180 B8R0.5 CC(O)CN(C)CC=O 269982a_100000227577_200015260668 [1,0,0,0,0,0|2,0,0]=3 181 B8R0.5 CCCC(C)CN(C)C 2230a_100102631434_100011216630 [1,0,0,0,0,0|2,0,1]=4 182 B8R0.5 CCCC(C)CN(C)C 269982a_100102631434_100011216630 [1,0,0,0,0,0|2,0,1]=4 183 B8R0.5 CCCC(C)CN(C)C 270004a_100102631434_100000243154 [1,0,0,0,0,0|2,0,1]=4 184 B8R0.5 CCCC(C)NC(C)C 2230a_100000741246_100000210206 [1,0,0,0,0,0|2,0,1]=4 185 B8R0.5 CCCC(C)NC(C)C 2230a_100138425928_100000766640 [1,0,0,0,0,0|2,0,1]=4 186 B8R0.5 CCCC(C)NC(C)C 34a_100138425928_100000766640 [1,0,0,0,0,0|2,0,1]=4 187 B8R0.5 CCCC(C)OC(C)C 34a_100000212225_100000766640 [1,0,0,0,0,0|2,0,1]=4 188 B8R0.5 CCCC(C)OC(C)C 34a_100000764384_100000210206 [1,0,0,0,0,0|2,0,1]=4 189 B8R0.5 CCCC(C)OC(C)C 7a_100000764384_100000210206 [1,0,0,0,0,0|2,0,1]=4 190 B8R0.5 CCCC(C)SC(C)C 62a_100000210206_100000766640 [1,0,0,0,0,0|2,0,1]=4 191 B8R0.5 CCCC(C)SC(C)C 62a_100000766640_100000210206 [1,0,0,0,0,0|2,0,1]=4 192 B8R0.5 CCCN(C)CC(C)C 2230a_100000747067_100000210303 [1,0,0,0,0,0|2,0,1]=4 193 B8R0.5 CCCN(C)CC(C)C 2230a_100000747261_100000210760 [1,0,0,0,0,0|2,0,1]=4 194 B8R0.5 CCCN(C)CC(C)C 269982a_100000747067_100000210303 [1,0,0,0,0,0|2,0,1]=4 195 B8R0.5 CCCN(C)CC(C)C 269982a_100000747261_100000210624 [1,0,0,0,0,0|2,0,1]=4 196 B8R0.5 CCCN(C)CC(C)C 270004a_100000747261_100000210432 [1,0,0,0,0,0|2,0,1]=4 197 B8R0.5 CCNC(C)CC(C)C 2230a_100000692259_100000210202 [1,0,0,0,0,0|2,0,1]=4 198 B8R0.5 CCNC(C)CC(C)C 2230a_100015525214_100000731052 [1,0,0,0,0,0|2,0,1]=4 199 B8R0.5 CCOC(C)CC(C)C 34a_100000211805_100000210202 [1,0,0,0,0,0|2,0,1]=4 200 B8R0.5 CCOC(C)CC(C)C 34a_100121572206_100000731052 [1,0,0,0,0,0|2,0,1]=4 201 B8R0.5 CCOC(C)CC(C)C 7a_100000211805_100000210202 [1,0,0,0,0,0|2,0,1]=4 202 B8R0.5 CCSC(C)CC(C)C 62a_100000210202_100000731052 [1,0,0,0,0,0|2,0,1]=4 203 B8R0.5 CCSC(C)CC(C)C 62a_100000731052_100000210202 [1,0,0,0,0,0|2,0,1]=4 204 B8R0.5 CNCC(C)CN(C)C 2230a_106832991635_100015348159 [1,0,0,0,0,0|3,0,0]=4 205 B8R0.5 CNCC(C)CN(C)C 7a_106832991635_100015348159 [1,0,0,0,0,0|3,0,0]=4 206 B8R0.5 COCC(C)NC(C)C 2230a_100138425928_100000765312 [1,0,0,0,0,0|3,0,0]=4 207 B8R0.5 COCC(C)NC(C)C 34a_100138425928_100000765312 [1,0,0,0,0,0|3,0,0]=4 208 B8R0.5 COCC(C)OC(C)C 34a_100000212225_100000765312 [1,0,0,0,0,0|3,0,0]=4 209 B8R0.5 COCC(C)SC(C)C 62a_100000210206_100000765312 [1,0,0,0,0,0|3,0,0]=4 210 B8R0.5 COCC(C)SC(C)C 62a_100000765312_100000210206 [1,0,0,0,0,0|3,0,0]=4 211 B8R0.5 COCN(C)CC(C)C 2230a_100000747067_100000766300 [1,0,0,0,0,0|3,0,0]=4 212 B8R0.5 COCN(C)CC(C)C 269982a_100000747067_100000766300 [1,0,0,0,0,0|3,0,0]=4 213 B8R0.5 COC[C@@H](C)NC(C)C 2230a_100000764878_100000210206 [1,0,0,0,0,0|3,0,0]=4 214 B8R0.5 COC[C@@H](C)OC(C)C 34a_100011934205_100000210206 [1,0,0,0,0,0|3,0,0]=4 215 B8R0.5 COC[C@@H](N)CC(C)C 34a_100011830311_200000210301 [1,0,0,0,0,0|3,0,0]=4 216 B8R0.5 CSCC(C)CN(C)C 62a_100015348159_200000210301 [1,0,0,0,0,0|3,0,0]=4 217 B8R0.5 CSCC(C)CN(C)C 62a_200000210301_100015348159 [1,0,0,0,0,0|3,0,0]=4 218 B8R0.5 CSCN(C)CC(C)C 2230a_100000747067_100011218213 [1,0,0,0,0,0|3,0,0]=4 219 B8R0.5 CSCN(C)CC(C)C 269982a_100000747067_100011218213 [1,0,0,0,0,0|3,0,0]=4 220 B8R0.21 C#CCCNC(C)(C)C 2230a_100000715429_100000688953 [1,0,0,0,0,0|2,0,1]=4 221 B8R0.21 C#CCCNC(C)(C)C 34a_100000755551_100000210625 [1,0,0,0,0,0|2,0,1]=4 222 B8R0.21 C#CCCOC(C)(C)C 34a_100011215631_100000210625 [1,0,0,0,0,0|2,0,1]=4 223 B8R0.21 C#CCCOC(C)(C)C 34a_100015890283_100000688953 [1,0,0,0,0,0|2,0,1]=4 224 B8R0.21 C#CCCOC(C)(C)C 7a_100015890283_100000688953 [1,0,0,0,0,0|2,0,1]=4 225 B8R0.21 C#CCCSC(C)(C)C 62a_100000211941_100000688953 [1,0,0,0,0,0|2,0,1]=4 226 B8R0.21 C#CCCSC(C)(C)C 62a_100000688953_100000211941 [1,0,0,0,0,0|2,0,1]=4 227 B8R0.21 C#CCNCC(C)(C)C 2230a_100000743828_100000038162 [1,0,0,0,0,0|2,0,1]=4 228 B8R0.21 C#CCNCC(C)(C)C 34a_100000212058_100011219605 [1,0,0,0,0,0|2,0,1]=4 229 B8R0.21 C#CCOCC(C)(C)C 34a_100000210247_100011219605 [1,0,0,0,0,0|2,0,1]=4 230 B8R0.21 C#CCSCC(C)(C)C 62a_100000038162_100011219605 [1,0,0,0,0,0|2,0,1]=4 231 B8R0.21 C/C=C/COC(C)(C)C 34a_100015890283_100102629194 [1,0,0,0,0,0|2,0,1]=4 232 B8R0.21 C/C=C/COC(C)(C)C 34a_100016270725_100000210625 [1,0,0,0,0,0|2,0,1]=4 233 B8R0.21 C/C=C/COC(C)(C)C 7a_100015890283_100102629194 [1,0,0,0,0,0|2,0,1]=4 234 B8R0.21 C/C=C/CSC(C)(C)C 62a_100000211941_100102629194 [1,0,0,0,0,0|2,0,1]=4 235 B8R0.21 C/C=C/CSC(C)(C)C 62a_100102629194_100000211941 [1,0,0,0,0,0|2,0,1]=4 236 B8R0.21 C=CCCNC(C)(C)C 2230a_100000715429_100000754431 [1,0,0,0,0,0|2,0,0]=3 237 B8R0.21 C=CCCOC(C)(C)C 34a_100011205117_100000210625 [1,0,0,0,0,0|2,0,0]=3 238 B8R0.21 C=CCCOC(C)(C)C 34a_100015890283_100000754431 [1,0,0,0,0,0|2,0,0]=3 239 B8R0.21 C=CCCOC(C)(C)C 7a_100015890283_100000754431 [1,0,0,0,0,0|2,0,0]=3 240 B8R0.21 C=CCCSC(C)(C)C 62a_100000211941_100000754431 [1,0,0,0,0,0|2,0,0]=3 241 B8R0.21 C=CCCSC(C)(C)C 62a_100000754431_100000211941 [1,0,0,0,0,0|2,0,0]=3 242 B8R0.21 C=CCNCC(C)(C)C 2230a_100000743828_100000210623 [1,0,0,0,0,0|2,0,0]=3 243 B8R0.21 C=CCNCC(C)(C)C 270004a_100020586998_100011204126 [1,0,0,0,0,0|2,0,0]=3 244 B8R0.21 C=CCNCC(C)(C)F 2230a_100020643315_100000210623 [1,0,0,0,0,0|3,0,0]=4 245 B8R0.21 C=CCNCC(C)(C)O 2230a_100000751335_100000210623 [1,0,0,0,0,0|3,0,0]=4 246 B8R0.21 C=CCNC[Si](C)(C)C 2230a_100020586998_100000037933 [1,0,0,0,0,0|2,1,0]=4 247 B8R0.21 C=CCOCC(C)(C)C 34a_200000210373_100011219605 [1,0,0,0,0,0|2,0,0]=3 248 B8R0.21 C=CCOCC(C)(C)F 34a_100000716592_100015514636 [1,0,0,0,0,0|3,0,0]=4 249 B8R0.21 C=CCOCC(C)(C)F 34a_200000210373_100011997219 [1,0,0,0,0,0|3,0,0]=4 250 B8R0.21 C=CCOCC(C)(C)O 34a_200000210373_100000764493 [1,0,0,0,0,0|3,0,0]=4 251 B8R0.21 C=CCSCC(C)(C)C 62a_100000210623_100011219605 [1,0,0,0,0,0|2,0,0]=3 252 B8R0.21 C=CCSCC(C)(C)C 62a_100011219605_100000210623 [1,0,0,0,0,0|2,0,0]=3 253 B8R0.21 C=CCSCC(C)(C)F 62a_100000210623_100011997219 [1,0,0,0,0,0|3,0,0]=4 254 B8R0.21 C=CCSCC(C)(C)F 62a_100011997219_100000210623 [1,0,0,0,0,0|3,0,0]=4 255 B8R0.21 C=CCSCC(C)(C)O 62a_100000210623_100000764493 [1,0,0,0,0,0|3,0,0]=4 256 B8R0.21 C=CCSCC(C)(C)O 62a_100000764493_100000210623 [1,0,0,0,0,0|3,0,0]=4 257 B8R0.21 C=CCSC[N+](C)(C)C 62a_100000210623_200000036245 [1,0,0,0,0,0|3,0,0]=4 258 B8R0.21 C=CCSC[N+](C)(C)C 62a_200000036245_100000210623 [1,0,0,0,0,0|3,0,0]=4 259 B8R0.21 C=CCSC[Si](C)(C)C 62a_100000037933_100000210623 [1,0,0,0,0,0|2,1,0]=4 260 B8R0.21 C=CCSC[Si](C)(C)C 62a_100000210623_100000037933 [1,0,0,0,0,0|2,1,0]=4 261 B8R0.21 CC(C)(C)CCOCF 7a_100000765024_100015361967 [1,0,0,0,0,0|2,0,1]=4 262 B8R0.21 CC(C)(C)CCSCF 62a_100000755188_100015361967 [1,0,0,0,0,0|2,0,1]=4 263 B8R0.21 CC(C)(C)CCSCF 62a_100015361967_100000755188 [1,0,0,0,0,0|2,0,1]=4 264 B8R0.21 CC(C)(C)CNCC#N 2230a_100000743828_100011215382 [1,0,0,0,0,0|2,0,1]=4 265 B8R0.21 CC(C)(C)CNCC=O 2230a_100000743828_200015260668 [1,0,0,0,0,0|1,0,0]=2 266 B8R0.21 CC(C)(C)CNCCF 2230a_100000743828_100011217306 [1,0,0,0,0,0|2,0,1]=4 267 B8R0.21 CC(C)(C)CNCCF 34a_100000724931_100011219605 [1,0,0,0,0,0|2,0,1]=4 268 B8R0.21 CC(C)(C)CNCCO 2230a_100000743828_100000211926 [1,0,0,0,0,0|1,0,2]=4 269 B8R0.21 CC(C)(C)CNCCO 270004a_100000210304_100011204126 [1,0,0,0,0,0|1,0,2]=4 270 B8R0.21 CC(C)(C)CNCCO 34a_100016990907_100011219605 [1,0,0,0,0,0|1,0,2]=4 271 B8R0.21 CC(C)(C)COCCBr 34a_100000211926_100011219605 [1,0,0,0,0,0|2,0,1]=4 272 B8R0.21 CC(C)(C)COCCN 34a_100000210304_100011219605 [1,0,0,0,0,0|2,0,1]=4 273 B8R0.21 CC(C)(C)CSCC#N 62a_100011215382_100011219605 [1,0,0,0,0,0|2,0,1]=4 274 B8R0.21 CC(C)(C)CSCC#N 62a_100011219605_100011215382 [1,0,0,0,0,0|2,0,1]=4 275 B8R0.21 CC(C)(C)CSCC=O 62a_100011219605_200015260668 [1,0,0,0,0,0|1,0,0]=2 276 B8R0.21 CC(C)(C)CSCC=O 62a_200015260668_100011219605 [1,0,0,0,0,0|1,0,0]=2 277 B8R0.21 CC(C)(C)CSCCF 62a_100011217306_100011219605 [1,0,0,0,0,0|2,0,1]=4 278 B8R0.21 CC(C)(C)CSCCF 62a_100011219605_100011217306 [1,0,0,0,0,0|2,0,1]=4 279 B8R0.21 CC(C)(C)CSCCO 62a_100000211926_100011219605 [1,0,0,0,0,0|1,0,2]=4 280 B8R0.21 CC(C)(C)CSCCO 62a_100011219605_100000211926 [1,0,0,0,0,0|1,0,2]=4 281 B8R0.21 CC(C)(C)NCCC#N 2230a_100000715429_100011215226 [1,0,0,0,0,0|2,0,1]=4 282 B8R0.21 CC(C)(C)NCCCF 2230a_100000715429_100011934791 [1,0,0,0,0,0|2,0,1]=4 283 B8R0.21 CC(C)(C)NCCCF 34a_100015189416_100000210625 [1,0,0,0,0,0|2,0,1]=4 284 B8R0.21 CC(C)(C)NCCCO 2230a_100000715429_100000230001 [1,0,0,0,0,0|1,0,2]=4 285 B8R0.21 CC(C)(C)OCCC#N 7a_100015890283_100000184422 [1,0,0,0,0,0|2,0,1]=4 286 B8R0.21 CC(C)(C)OCCCBr 34a_100011217188_100000210625 [1,0,0,0,0,0|2,0,1]=4 287 B8R0.21 CC(C)(C)OCCCCl 34a_100000230001_100000210625 [1,0,0,0,0,0|2,0,1]=4 288 B8R0.21 CC(C)(C)OCCCF 34a_100000759539_100000210625 [1,0,0,0,0,0|2,0,1]=4 289 B8R0.21 CC(C)(C)OCCCF 34a_100015890283_100011934791 [1,0,0,0,0,0|2,0,1]=4 290 B8R0.21 CC(C)(C)OCCCF 7a_100015890283_100011934791 [1,0,0,0,0,0|2,0,1]=4 291 B8R0.21 CC(C)(C)OCCCN 34a_100000182051_100000210625 [1,0,0,0,0,0|2,0,1]=4 292 B8R0.21 CC(C)(C)OCCCO 34a_100015890283_100000230001 [1,0,0,0,0,0|1,0,2]=4 293 B8R0.21 CC(C)(C)OCCCO 7a_100015890283_100011215043 [1,0,0,0,0,0|1,0,2]=4 294 B8R0.21 CC(C)(C)OCCN[13CH3] 2230a_100000747557_200025704644 [1,0,0,0,0,0|3,0,0]=4 295 B8R0.21 CC(C)(C)OCCON 34a_100000700252_100000210625 [1,0,0,0,0,0|3,0,0]=4 296 B8R0.21 CC(C)(C)OCCO[13CH3] 34a_100000693234_200025704644 [1,0,0,0,0,0|3,0,0]=4 297 B8R0.21 CC(C)(C)OCCO[13CH3] 7a_100000693234_200025704644 [1,0,0,0,0,0|3,0,0]=4 298 B8R0.21 CC(C)(C)SCCC#N 62a_100000211941_100011215226 [1,0,0,0,0,0|2,0,1]=4 299 B8R0.21 CC(C)(C)SCCC#N 62a_100011215226_100000211941 [1,0,0,0,0,0|2,0,1]=4 300 B8R0.21 CC(C)(C)SCCCF 62a_100000211941_100011934791 [1,0,0,0,0,0|2,0,1]=4 301 B8R0.21 CC(C)(C)SCCCF 62a_100011934791_100000211941 [1,0,0,0,0,0|2,0,1]=4 302 B8R0.21 CC(C)(C)SCCCO 62a_100000211941_100011215043 [1,0,0,0,0,0|1,0,2]=4 303 B8R0.21 CC(C)(C)SCCCO 62a_100011215043_100000211941 [1,0,0,0,0,0|1,0,2]=4 304 B8R0.21 CC(C)(C)SCCN[13CH3] 2230a_100000689375_200025704644 [1,0,0,0,0,0|3,0,0]=4 305 B8R0.21 CC(C)(F)CNCC=O 2230a_100020643315_200015260668 [1,0,0,0,0,0|2,0,0]=3 306 B8R0.21 CC(C)(F)COCC=O 34a_100000716592_200009817547 [1,0,0,0,0,0|2,0,0]=3 307 B8R0.21 CC(C)(F)CSCC=O 62a_100011997219_200015260668 [1,0,0,0,0,0|2,0,0]=3 308 B8R0.21 CC(C)(F)CSCC=O 62a_200015260668_100011997219 [1,0,0,0,0,0|2,0,0]=3 309 B8R0.21 CC(C)(O)CCCS[13CH3] 62a_100009888830_200025704644 [1,0,0,0,0,0|3,0,0]=4 310 B8R0.21 CC(C)(O)CCCS[13CH3] 62a_200025704644_100009888830 [1,0,0,0,0,0|3,0,0]=4 311 B8R0.21 CC(C)(O)CNCC=O 2230a_100000751335_200015260668 [1,0,0,0,0,0|2,0,0]=3 312 B8R0.21 CC(C)(O)CSCC=O 62a_100000764493_200015260668 [1,0,0,0,0,0|2,0,0]=3 313 B8R0.21 CC(C)(O)CSCC=O 62a_200015260668_100000764493 [1,0,0,0,0,0|2,0,0]=3 314 B8R0.21 CC(F)(F)COCC=O 34a_100000068830_200009817547 [1,0,0,0,0,0|3,0,0]=4 315 B8R0.21 CC=CCNC(C)(C)C 2230a_100000715429_100000070051 [1,0,0,0,0,0|2,0,1]=4 316 B8R0.21 CC=CCOC(C)(C)C 34a_100015890283_100000070051 [1,0,0,0,0,0|2,0,1]=4 317 B8R0.21 CC=CCOC(C)(C)C 7a_100015890283_100000070051 [1,0,0,0,0,0|2,0,1]=4 318 B8R0.21 CC=CCSC(C)(C)C 62a_100000070051_100000211941 [1,0,0,0,0,0|2,0,1]=4 319 B8R0.21 CC=CCSC(C)(C)C 62a_100000211941_100000070051 [1,0,0,0,0,0|2,0,1]=4 320 B8R0.21 CCCCNC(C)(C)C 2230a_100000715429_100000210211 [1,0,0,0,0,0|2,0,1]=4 321 B8R0.21 CCCCOC(C)(C)C 34a_100000210227_100000210625 [1,0,0,0,0,0|2,0,1]=4 322 B8R0.21 CCCCOC(C)(C)C 34a_100015890283_100000210210 [1,0,0,0,0,0|2,0,1]=4 323 B8R0.21 CCCCOC(C)(C)C 7a_100015890283_100000210211 [1,0,0,0,0,0|2,0,1]=4 324 B8R0.21 CCCCSC(C)(C)C 62a_100000210211_100000211941 [1,0,0,0,0,0|2,0,1]=4 325 B8R0.21 CCCCSC(C)(C)C 62a_100000211941_100000210210 [1,0,0,0,0,0|2,0,1]=4 326 B8R0.21 CCCNCC(C)(C)C 2230a_100000743828_100000210303 [1,0,0,0,0,0|2,0,1]=4 327 B8R0.21 CCCNCC(C)(C)C 270004a_100020643023_100011204126 [1,0,0,0,0,0|2,0,1]=4 328 B8R0.21 CCCOCC(C)(C)C 34a_100000210258_100011219605 [1,0,0,0,0,0|2,0,1]=4 329 B8R0.21 CCCSCC(C)(C)C 62a_100000210303_100011219605 [1,0,0,0,0,0|2,0,1]=4 330 B8R0.21 CCCSCC(C)(C)C 62a_100011219605_100000210303 [1,0,0,0,0,0|2,0,1]=4 331 B8R0.21 CCNCCC(C)(C)C 2230a_100000738805_100000210202 [1,0,0,0,0,0|2,0,1]=4 332 B8R0.21 CCNCCC(C)(C)C 2230a_100015525214_100000755188 [1,0,0,0,0,0|2,0,1]=4 333 B8R0.21 CCOCCC(C)(C)C 34a_100121572206_100000755188 [1,0,0,0,0,0|2,0,1]=4 334 B8R0.21 CCOCCC(C)(C)C 7a_100000765024_100000210202 [1,0,0,0,0,0|2,0,1]=4 335 B8R0.21 CCSCCC(C)(C)C 62a_100000210202_100000755188 [1,0,0,0,0,0|2,0,1]=4 336 B8R0.21 CCSCCC(C)(C)C 62a_100000755188_100000210202 [1,0,0,0,0,0|2,0,1]=4 337 B8R0.21 CNCCCC(C)(C)O 2230a_106832991635_100009888830 [1,0,0,0,0,0|3,0,0]=4 338 B8R0.21 CNCCCC(C)(C)O 34a_100102657272_100009888830 [1,0,0,0,0,0|3,0,0]=4 339 B8R0.21 CNCCCC(C)(C)O 7a_106832991635_100009888830 [1,0,0,0,0,0|3,0,0]=4 340 B8R0.21 CNCCC[N+](C)(C)C 2230a_106832991635_100016990835 [1,0,0,0,0,0|3,0,0]=4 341 B8R0.21 CNCCC[N+](C)(C)C 34a_100102657272_100016990835 [1,0,0,0,0,0|3,0,0]=4 342 B8R0.21 CNCCC[N+](C)(C)C 7a_106832991635_100016990835 [1,0,0,0,0,0|3,0,0]=4 343 B8R0.21 CNCCC[Si](C)(C)C 2230a_106832991635_100011219597 [1,0,0,0,0,0|2,1,0]=4 344 B8R0.21 CNCCC[Si](C)(C)C 34a_100102657272_100011219597 [1,0,0,0,0,0|2,1,0]=4 345 B8R0.21 CNCCC[Si](C)(C)C 7a_106832991635_100011219597 [1,0,0,0,0,0|2,1,0]=4 346 B8R0.21 CNCCOC(C)(C)C 2230a_100000747557_200000210301 [1,0,0,0,0,0|3,0,0]=4 347 B8R0.21 CNCCSC(C)(C)C 2230a_100000689375_200000210301 [1,0,0,0,0,0|3,0,0]=4 348 B8R0.21 COCCCC(C)(C)O 34a_100138415774_100009888830 [1,0,0,0,0,0|3,0,0]=4 349 B8R0.21 COCCC[N+](C)(C)C 34a_100138415774_100016990835 [1,0,0,0,0,0|3,0,0]=4 350 B8R0.21 COCCC[Si](C)(C)C 34a_100138415774_100011219597 [1,0,0,0,0,0|2,1,0]=4 351 B8R0.21 COCCC[Si](C)(C)C 7a_200011215415_200000210301 [1,0,0,0,0,0|2,1,0]=4 352 B8R0.21 COCCNC(C)(C)C 2230a_100000715429_100011201679 [1,0,0,0,0,0|3,0,0]=4 353 B8R0.21 COCCOC(C)(C)C 34a_100000210237_100000210625 [1,0,0,0,0,0|3,0,0]=4 354 B8R0.21 COCCOC(C)(C)C 34a_100000693234_200000210301 [1,0,0,0,0,0|3,0,0]=4 355 B8R0.21 COCCOC(C)(C)C 34a_100015890283_100011201679 [1,0,0,0,0,0|3,0,0]=4 356 B8R0.21 COCCOC(C)(C)C 7a_100000693234_200000210301 [1,0,0,0,0,0|3,0,0]=4 357 B8R0.21 COCCOC(C)(C)C 7a_100015890283_100000233755 [1,0,0,0,0,0|3,0,0]=4 358 B8R0.21 COCCSC(C)(C)C 62a_100000211941_100000233755 [1,0,0,0,0,0|3,0,0]=4 359 B8R0.21 COCCSC(C)(C)C 62a_100000233755_100000211941 [1,0,0,0,0,0|3,0,0]=4 360 B8R0.21 COCNCC(C)(C)C 2230a_100000743828_100000766300 [1,0,0,0,0,0|3,0,0]=4 361 B8R0.21 COCSCC(C)(C)C 62a_100000766300_100011219605 [1,0,0,0,0,0|3,0,0]=4 362 B8R0.21 COCSCC(C)(C)C 62a_100011219605_100000766300 [1,0,0,0,0,0|3,0,0]=4 363 B8R0.21 CSCCCC(C)(C)O 62a_100009888830_200000210301 [1,0,0,0,0,0|3,0,0]=4 364 B8R0.21 CSCCCC(C)(C)O 62a_200000210301_100009888830 [1,0,0,0,0,0|3,0,0]=4 365 B8R0.21 CSCCC[N+](C)(C)C 62a_100016990835_200000210301 [1,0,0,0,0,0|3,0,0]=4 366 B8R0.21 CSCCC[N+](C)(C)C 62a_200000210301_100016990835 [1,0,0,0,0,0|3,0,0]=4 367 B8R0.21 CSCCC[Si](C)(C)C 62a_100011219597_200000210301 [1,0,0,0,0,0|2,1,0]=4 368 B8R0.21 CSCCC[Si](C)(C)C 62a_200000210301_100011219597 [1,0,0,0,0,0|2,1,0]=4 369 B8R0.21 CSCCNC(C)(C)C 2230a_100000715429_100000751147 [1,0,0,0,0,0|3,0,0]=4 370 B8R0.21 CSCCOC(C)(C)C 34a_100000230434_100000210625 [1,0,0,0,0,0|3,0,0]=4 371 B8R0.21 CSCCOC(C)(C)C 34a_100015890283_100000212216 [1,0,0,0,0,0|3,0,0]=4 372 B8R0.21 CSCCOC(C)(C)C 7a_100015890283_100000212216 [1,0,0,0,0,0|3,0,0]=4 373 B8R0.21 CSCCSC(C)(C)C 62a_100000211941_100000751147 [1,0,0,0,0,0|3,0,0]=4 374 B8R0.21 CSCCSC(C)(C)C 62a_100000212216_100000211941 [1,0,0,0,0,0|3,0,0]=4 375 B8R0.21 CSCNCC(C)(C)C 2230a_100000743828_100011218213 [1,0,0,0,0,0|3,0,0]=4 376 B8R0.21 CSCSCC(C)(C)C 62a_100011218213_100011219605 [1,0,0,0,0,0|3,0,0]=4 377 B8R0.21 CSCSCC(C)(C)C 62a_100011219605_100011218213 [1,0,0,0,0,0|3,0,0]=4 378 B8R0.21 C[N+](C)(C)CCCS[13CH3] 62a_100016990835_200025704644 [1,0,0,0,0,0|3,0,0]=4 379 B8R0.21 C[N+](C)(C)CCCS[13CH3] 62a_200025704644_100016990835 [1,0,0,0,0,0|3,0,0]=4 380 B8R0.21 C[N+](C)(C)CSCC=O 62a_200000036245_200015260668 [1,0,0,0,0,0|2,0,0]=3 381 B8R0.21 C[N+](C)(C)CSCC=O 62a_200015260668_200000036245 [1,0,0,0,0,0|2,0,0]=3 382 B8R0.21 C[Si](C)(C)CCCO[13CH3] 7a_200011215415_200025704644 [1,0,0,0,0,0|2,1,0]=4 383 B8R0.21 C[Si](C)(C)CCCS[13CH3] 62a_100011219597_200025704644 [1,0,0,0,0,0|2,1,0]=4 384 B8R0.21 C[Si](C)(C)CCCS[13CH3] 62a_200025704644_100011219597 [1,0,0,0,0,0|2,1,0]=4 385 B8R0.21 C[Si](C)(C)CSCC=O 62a_100000037933_200015260668 [1,0,0,0,0,0|1,1,0]=3 386 B8R0.21 C[Si](C)(C)CSCC=O 62a_200015260668_100000037933 [1,0,0,0,0,0|1,1,0]=3 387 B8R0.24 C#CC(C)NC(C)(C)C 34a_100000707721_100000210625 [1,0,0,0,0,0|1,0,2]=4 388 B8R0.24 C#CC(C)OC(C)(C)C 34a_100015890283_200000035995 [1,0,0,0,0,0|1,0,2]=4 389 B8R0.24 C#CC(C)SC(C)(C)C 62a_200000035995_100000211941 [1,0,0,0,0,0|1,0,2]=4 390 B8R0.24 C#C[C@@H](C)OC(C)(C)C 34a_100009815206_100000210625 [1,0,0,0,0,0|1,0,2]=4 391 B8R0.24 C=CC(C)OC(C)(C)C 34a_100000695699_100000210625 [1,0,0,0,0,0|1,0,1]=3 392 B8R0.24 C=CC(C)SC(C)(C)C 62a_100011215867_100000211941 [1,0,0,0,0,0|1,0,1]=3 393 B8R0.24 CC(C#N)NC(C)(C)C 2230a_100000715429_100000184139 [1,0,0,0,0,0|2,0,1]=4 394 B8R0.24 CC(C#N)OC(C)(C)C 34a_100011218135_100000210625 [1,0,0,0,0,0|2,0,1]=4 395 B8R0.24 CC(C#N)OC(C)(C)C 7a_100015890283_100000703298 [1,0,0,0,0,0|2,0,1]=4 396 B8R0.24 CC(C#N)SC(C)(C)C 62a_100000211941_100000703298 [1,0,0,0,0,0|2,0,1]=4 397 B8R0.24 CC(C#N)SC(C)(C)C 62a_100000703298_100000211941 [1,0,0,0,0,0|2,0,1]=4 398 B8R0.24 CC(C)(C)CC(=O)CF 1458a_100000211214_100015361967 [1,0,0,0,0,0|2,0,1]=4 399 B8R0.24 CC(CC(C)(C)C)O[13CH3] 7a_200011218616_200025704644 [1,0,0,0,0,0|1,0,1]=3 400 B8R0.24 CC(CF)OC(C)(C)C 34a_100016041109_100000210625 [1,0,0,0,0,0|2,0,0]=3 401 B8R0.24 CC(CN)OC(C)(C)C 34a_100000210904_100000210625 [1,0,0,0,0,0|2,0,0]=3 402 B8R0.24 CC(CO)NC(C)(C)C 2230a_100000715429_100012180447 [1,0,0,0,0,0|1,0,1]=3 403 B8R0.24 CC(CO)OC(C)(C)C 34a_100015890283_100012180447 [1,0,0,0,0,0|1,0,1]=3 404 B8R0.24 CC(CO)OC(C)(C)C 7a_100015890283_100012180447 [1,0,0,0,0,0|1,0,1]=3 405 B8R0.24 CC(CO)SC(C)(C)C 62a_100012180447_100000211941 [1,0,0,0,0,0|1,0,1]=3 406 B8R0.24 CCC(=O)CC(C)(C)C 1458a_100000211214_100000210202 [1,0,0,0,0,0|1,0,2]=4 407 B8R0.24 CCC(C)NC(C)(C)C 2230a_100000715429_100000758301 [1,0,0,0,0,0|1,0,1]=3 408 B8R0.24 CCC(C)OC(C)(C)C 34a_100015890283_100011215416 [1,0,0,0,0,0|1,0,1]=3 409 B8R0.24 CCC(C)OC(C)(C)C 7a_100015890283_100000758301 [1,0,0,0,0,0|1,0,1]=3 410 B8R0.24 CCC(C)SC(C)(C)C 62a_100000211941_100000758301 [1,0,0,0,0,0|1,0,1]=3 411 B8R0.24 CCC(C)SC(C)(C)C 62a_100000758301_100000211941 [1,0,0,0,0,0|1,0,1]=3 412 B8R0.24 CCN(C)CC(C)(C)C 2230a_100000732750_200000210301 [1,0,0,0,0,0|1,0,1]=3 413 B8R0.24 CCN(C)CC(C)(C)C 2230a_100000742839_100000210202 [1,0,0,0,0,0|1,0,1]=3 414 B8R0.24 CCN(C)CC(C)(C)C 269982a_100000732750_200000210301 [1,0,0,0,0,0|1,0,1]=3 415 B8R0.24 CCN(C)CC(C)(C)C 269982a_100000742839_100000204670 [1,0,0,0,0,0|1,0,1]=3 416 B8R0.24 CCN(C)CC(C)(C)O 2230a_100000755687_200000210301 [1,0,0,0,0,0|2,0,1]=4 417 B8R0.24 CCN(C)CC(C)(C)O 2230a_100000755907_100000210202 [1,0,0,0,0,0|2,0,1]=4 418 B8R0.24 CCN(C)CC(C)(C)O 269982a_100000755687_200000210301 [1,0,0,0,0,0|2,0,1]=4 419 B8R0.24 CCN(C)CC(C)(C)O 269982a_100000755907_100000204670 [1,0,0,0,0,0|2,0,1]=4 420 B8R0.24 CCN(C)C[N+](C)(C)C 269982a_100000225621_200000036245 [1,0,0,0,0,0|2,0,1]=4 421 B8R0.24 CCN(C)C[Si](C)(C)C 2230a_100000225621_100000037933 [1,0,0,0,0,0|1,1,1]=4 422 B8R0.24 CCN(C)C[Si](C)(C)C 269982a_200020589227_100000204670 [1,0,0,0,0,0|1,1,1]=4 423 B8R0.24 CCN([13CH3])CC(C)(C)C 2230a_100000732750_200025704644 [1,0,0,0,0,0|1,0,1]=3 424 B8R0.24 CCN([13CH3])CC(C)(C)C 269982a_100000732750_200025704644 [1,0,0,0,0,0|1,0,1]=3 425 B8R0.24 CCN([13CH3])CC(C)(C)O 2230a_100000755687_200025704644 [1,0,0,0,0,0|2,0,1]=4 426 B8R0.24 CCN([13CH3])CC(C)(C)O 269982a_100000755687_200025704644 [1,0,0,0,0,0|2,0,1]=4 427 B8R0.24 CN(CF)CC(C)(C)C 269982a_100000742839_100015361967 [1,0,0,0,0,0|2,0,0]=3 428 B8R0.24 CN(CF)CC(C)(C)O 269982a_100000755907_100015361967 [1,0,0,0,0,0|3,0,0]=4 429 B8R0.24 CN(CF)C[Si](C)(C)C 269982a_200020589227_100015361967 [1,0,0,0,0,0|2,1,0]=4 430 B8R0.24 CN[C@@H](C)CC(C)(C)C 2230a_106358413534_200000210301 [1,0,0,0,0,0|1,0,1]=3 431 B8R0.24 COC(C)CC(C)(C)C 7a_200011218616_200000210301 [1,0,0,0,0,0|1,0,1]=3 432 B8R0.24 COC(C)SC(C)(C)C 62a_100000211941_100009879195 [1,0,0,0,0,0|2,0,1]=4 433 B8R0.24 COC(C)SC(C)(C)C 62a_100009879195_100000211941 [1,0,0,0,0,0|2,0,1]=4 434 B8R0.24 C[C@@H](CC(C)(C)C)N[13CH3] 2230a_106358413534_200025704644 [1,0,0,0,0,0|1,0,1]=3 435 B8R0.24 C[C@H](CO)SC(C)(C)C 62a_100000211941_100016084084 [1,0,0,0,0,0|1,0,1]=3 436 B8R0.24 C[C@H](CO)SC(C)(C)C 62a_100016084084_100000211941 [1,0,0,0,0,0|1,0,1]=3 437 B10R0.7 C#CC(C)(C)O[C@H](C)CC=C 34a_100000731007_100000038118 [0,1,0,0,0,0|2,0,1]=4 438 B10R0.7 C#CCC(C)OC(C)(C)CC 7a_100000685586_100000210677 [0,1,0,0,0,0|2,0,1]=4 439 B10R0.7 C#CCN(C)CC(C)(C)CO 2230a_100000732702_100000038162 [0,1,0,0,0,0|2,0,1]=4 440 B10R0.7 C#CCN(C)CC(C)(C)CO 34a_100000225692_100009813988 [0,1,0,0,0,0|2,0,1]=4 441 B10R0.7 C#CCN(C)CC(C)(C)OC 34a_100000225692_100000701081 [0,1,0,0,0,0|2,0,1]=4 442 B10R0.7 C#CCN(C)CC(C)(C)SC 270004a_100000225692_100009845794 [0,1,0,0,0,0|2,0,1]=4 443 B10R0.7 C=CCC(=O)CC(C)(C)CC 1458a_200000763500_100000210623 [0,1,0,0,0,0|2,0,1]=4 444 B10R0.7 C=CCN(C)CC(C)(C)CO 2230a_100000732702_100000210623 [0,1,0,0,0,0|2,0,0]=3 445 B10R0.7 C=CCN(C)CC(C)(C)CO 269982a_100000732702_100000210623 [0,1,0,0,0,0|2,0,0]=3 446 B10R0.7 C=CCN(C)CC(C)(C)OC 269982a_100000225617_100000701081 [0,1,0,0,0,0|2,0,0]=3 447 B10R0.7 C=CCN(C)CC(C)(C)SC 270004a_100000225617_100009845794 [0,1,0,0,0,0|2,0,0]=3 448 B10R0.7 C=CC[C@@H](C)OC(C)(C)C#N 34a_100000731007_100011162410 [0,1,0,0,0,0|2,0,1]=4 449 B10R0.7 C=CC[C@@H](C)OC(C)(C)C#N 7a_100000731007_100011162410 [0,1,0,0,0,0|2,0,1]=4 450 B10R0.7 C=CC[C@@H](C)OC(C)(C)CC 7a_100000731007_100000210677 [0,1,0,0,0,0|2,0,0]=3 451 B10R0.7 CC(CC#N)NC(C)(C)CO 2230a_100000210608_100009813641 [0,1,0,0,0,0|2,0,1]=4 452 B10R0.7 CC(CC#N)OC(C)(C)CCl 7a_100000764493_100009813641 [0,1,0,0,0,0|2,0,1]=4 453 B10R0.7 CC(CCO)NC(C)(C)CO 2230a_100000210608_100009893172 [0,1,0,0,0,0|1,0,2]=4 454 B10R0.7 CC(CCO)OC(C)(C)CCl 7a_100000764493_100009893172 [0,1,0,0,0,0|1,0,2]=4 455 B10R0.7 CCC(C)(C)NC(C)CC#N 2230a_100000211385_100009813641 [0,1,0,0,0,0|2,0,1]=4 456 B10R0.7 CCC(C)(C)NC(C)CCO 2230a_100000211385_100009893172 [0,1,0,0,0,0|1,0,2]=4 457 B10R0.7 CCC(C)(C)NC(C)COC 2230a_100000211385_100000765312 [0,1,0,0,0,0|3,0,0]=4 458 B10R0.7 CCC(C)(C)NC(C)COC 270004a_100000211385_100000749346 [0,1,0,0,0,0|3,0,0]=4 459 B10R0.7 CCC(C)(C)NC(C)CSC 270004a_100000211385_100011216314 [0,1,0,0,0,0|3,0,0]=4 460 B10R0.7 CCC(C)(C)OC(C)CC#N 7a_100000210230_100009813641 [0,1,0,0,0,0|2,0,1]=4 461 B10R0.7 CCC(C)(C)OC(C)CCO 7a_100000210230_100009893172 [0,1,0,0,0,0|1,0,2]=4 462 B10R0.7 CCC(C)(C)OC(C)COC 7a_100000210230_100000765312 [0,1,0,0,0,0|3,0,0]=4 463 B10R0.7 CCC(C)(C)SC(C)CC#N 62a_100000032637_100009813641 [0,1,0,0,0,0|2,0,1]=4 464 B10R0.7 CCC(C)(C)SC(C)CC#N 62a_100009813641_100000032637 [0,1,0,0,0,0|2,0,1]=4 465 B10R0.7 CCC(C)(C)SC(C)CCO 62a_100000032637_100009893172 [0,1,0,0,0,0|1,0,2]=4 466 B10R0.7 CCC(C)(C)SC(C)CCO 62a_100009893172_100000032637 [0,1,0,0,0,0|1,0,2]=4 467 B10R0.7 CCC(C)(C)SC(C)COC 62a_100000032637_100000765312 [0,1,0,0,0,0|3,0,0]=4 468 B10R0.7 CCC(C)(C)SC(C)COC 62a_100000765312_100000032637 [0,1,0,0,0,0|3,0,0]=4 469 B10R0.7 CCCC(C)NC(C)(C)CC 2230a_100000211385_100000766640 [0,1,0,0,0,0|2,0,1]=4 470 B10R0.7 CCCC(C)NC(C)(C)CC 270004a_100000211385_100000211909 [0,1,0,0,0,0|2,0,1]=4 471 B10R0.7 CCCC(C)NC(C)(C)CO 2230a_100000210608_100000766640 [0,1,0,0,0,0|2,0,1]=4 472 B10R0.7 CCCC(C)NC(C)(C)CO 270004a_100000210608_100000211909 [0,1,0,0,0,0|2,0,1]=4 473 B10R0.7 CCCC(C)OC(C)(C)CC 7a_100000210230_100000766640 [0,1,0,0,0,0|2,0,1]=4 474 B10R0.7 CCCC(C)OC(C)(C)CC 7a_100000764384_100000210677 [0,1,0,0,0,0|2,0,1]=4 475 B10R0.7 CCCC(C)OC(C)(C)CCl 7a_100000764493_100000766640 [0,1,0,0,0,0|2,0,1]=4 476 B10R0.7 CCCC(C)SC(C)(C)CC 62a_100000032637_100000766640 [0,1,0,0,0,0|2,0,1]=4 477 B10R0.7 CCCC(C)SC(C)(C)CC 62a_100000766640_100000032637 [0,1,0,0,0,0|2,0,1]=4 478 B10R0.7 CCCN(C)CC(C)(C)CO 2230a_100000732702_100000210303 [0,1,0,0,0,0|2,0,1]=4 479 B10R0.7 CCCN(C)CC(C)(C)CO 269982a_100000732702_100000210303 [0,1,0,0,0,0|2,0,1]=4 480 B10R0.7 CCCN(C)CC(C)(C)OC 269982a_100000747261_100000701081 [0,1,0,0,0,0|2,0,1]=4 481 B10R0.7 CCCN(C)CC(C)(C)SC 270004a_100000747261_100009845794 [0,1,0,0,0,0|2,0,1]=4 482 B10R0.7 CCOC(C)CC(C)(C)OC 7a_200011252547_100000210202 [0,1,0,0,0,0|2,0,1]=4 483 B10R0.7 CN(CC#N)CC(C)(C)CO 2230a_100000732702_100011215382 [0,1,0,0,0,0|2,0,1]=4 484 B10R0.7 CN(CC#N)CC(C)(C)CO 269982a_100000732702_100011214920 [0,1,0,0,0,0|2,0,1]=4 485 B10R0.7 CN(CC=O)CC(C)(C)CO 2230a_100000732702_200015260668 [0,1,0,0,0,0|1,0,0]=2 486 B10R0.7 CN(CC=O)CC(C)(C)CO 269982a_100000732702_200015260668 [0,1,0,0,0,0|1,0,0]=2 487 B10R0.7 CN(CCF)CC(C)(C)CO 2230a_100000732702_100011217306 [0,1,0,0,0,0|2,0,1]=4 488 B10R0.7 CN(CCF)CC(C)(C)CO 269982a_100000732702_100011217306 [0,1,0,0,0,0|2,0,1]=4 489 B10R0.7 CN(CCO)CC(C)(C)CO 2230a_100000732702_100000211926 [0,1,0,0,0,0|1,0,2]=4 490 B10R0.7 CN(CCO)CC(C)(C)CO 269982a_100000732702_100000211926 [0,1,0,0,0,0|1,0,2]=4 491 B10R0.7 COC(C)(C)CC(C)OCF 7a_200011252547_100015361967 [0,1,0,0,0,0|2,0,1]=4 492 B10R0.7 COC(C)(C)CN(C)CCO 269982a_100000210263_100000701081 [0,1,0,0,0,0|1,0,2]=4 493 B10R0.7 COCC(C)NC(C)(C)CO 2230a_100000210608_100000765312 [0,1,0,0,0,0|3,0,0]=4 494 B10R0.7 COCC(C)NC(C)(C)CO 270004a_100000210608_100000749346 [0,1,0,0,0,0|3,0,0]=4 495 B10R0.7 COCC(C)OC(C)(C)CCl 7a_100000764493_100000765312 [0,1,0,0,0,0|3,0,0]=4 496 B10R0.7 COCN(C)CC(C)(C)CO 2230a_100000732702_100000766300 [0,1,0,0,0,0|3,0,0]=4 497 B10R0.7 COCN(C)CC(C)(C)CO 269982a_100000732702_100000766300 [0,1,0,0,0,0|3,0,0]=4 498 B10R0.7 CSC(C)(C)CN(C)CCO 270004a_100000210263_100009845794 [0,1,0,0,0,0|1,0,2]=4 499 B10R0.7 CSCC(C)NC(C)(C)CO 270004a_100000210608_100011216314 [0,1,0,0,0,0|3,0,0]=4 500 B10R0.7 CSCN(C)CC(C)(C)CO 2230a_100000732702_100011218213 [0,1,0,0,0,0|3,0,0]=4 501 B10R0.7 CSCN(C)CC(C)(C)CO 269982a_100000732702_100011218213 [0,1,0,0,0,0|3,0,0]=4 502 B10R0.8 C#CCC(CC)OC(C)(C)C 34a_200011217983_100000210625 [0,1,0,0,0,0|2,0,1]=4 503 B10R0.8 C#CCN(CC)CC(C)(C)C 2230a_100000732750_100000038162 [0,1,0,0,0,0|2,0,1]=4 504 B10R0.8 C#CCN(CC)CC(C)(C)C 270004a_100000744766_100011204126 [0,1,0,0,0,0|2,0,1]=4 505 B10R0.8 C=CCC(C=C)OC(C)(C)C 34a_100000038011_100000210625 [0,1,0,0,0,0|2,0,1]=4 506 B10R0.8 C=CCN(CC)CC(C)(C)C 2230a_100000732750_100000210623 [0,1,0,0,0,0|2,0,0]=3 507 B10R0.8 C=CCN(CC)CC(C)(C)C 269982a_100000732750_100000210623 [0,1,0,0,0,0|2,0,0]=3 508 B10R0.8 C=CCN(CC)CC(C)(C)O 2230a_100000755687_100000210623 [0,1,0,0,0,0|3,0,0]=4 509 B10R0.8 C=CCN(CC)CC(C)(C)O 269982a_100000755687_100000210623 [0,1,0,0,0,0|3,0,0]=4 510 B10R0.8 CC(C)(C)CN(CF)CCO 269982a_100000752879_100015361967 [0,1,0,0,0,0|1,0,2]=4 511 B10R0.8 CCCC(CC)OC(C)(C)C 34a_100000687864_100000210625 [0,1,0,0,0,0|2,0,1]=4 512 B10R0.8 CCCC(CC)OC(C)(C)C 7a_100015890283_100011219200 [0,1,0,0,0,0|2,0,1]=4 513 B10R0.8 CCCC(CC)SC(C)(C)C 62a_100000211941_100011219200 [0,1,0,0,0,0|2,0,1]=4 514 B10R0.8 CCCC(CC)SC(C)(C)C 62a_100011219200_100000211941 [0,1,0,0,0,0|2,0,1]=4 515 B10R0.8 CCCN(CC)CC(C)(C)C 2230a_100000732750_100000210303 [0,1,0,0,0,0|2,0,1]=4 516 B10R0.8 CCCN(CC)CC(C)(C)C 2230a_107254831479_100000210202 [0,1,0,0,0,0|2,0,1]=4 517 B10R0.8 CCCN(CC)CC(C)(C)C 269982a_100000732750_100000210303 [0,1,0,0,0,0|2,0,1]=4 518 B10R0.8 CCCN(CC)CC(C)(C)C 269982a_107254831479_100000204670 [0,1,0,0,0,0|2,0,1]=4 519 B10R0.8 CCCN(CC)CC(C)(C)C 270004a_100000226822_100011204126 [0,1,0,0,0,0|2,0,1]=4 520 B10R0.8 CCCN(CF)CC(C)(C)C 269982a_107254831479_100015361967 [0,1,0,0,0,0|2,0,1]=4 521 B10R0.8 CCC[C@@H](CO)NC(C)(C)C 34a_100000732646_100000210625 [0,1,0,0,0,0|2,0,1]=4 522 B10R0.8 CCN(CC#N)CC(C)(C)C 2230a_100000732750_100011215382 [0,1,0,0,0,0|2,0,1]=4 523 B10R0.8 CCN(CC#N)CC(C)(C)C 269982a_100000732750_100011214920 [0,1,0,0,0,0|2,0,1]=4 524 B10R0.8 CCN(CC=O)CC(C)(C)C 2230a_100000732750_200015260668 [0,1,0,0,0,0|1,0,0]=2 525 B10R0.8 CCN(CC=O)CC(C)(C)C 269982a_100000732750_200015260668 [0,1,0,0,0,0|1,0,0]=2 526 B10R0.8 CCN(CC=O)CC(C)(C)O 2230a_100000755687_200015260668 [0,1,0,0,0,0|2,0,0]=3 527 B10R0.8 CCN(CC=O)CC(C)(C)O 269982a_100000755687_200015260668 [0,1,0,0,0,0|2,0,0]=3 528 B10R0.8 CCN(CCF)CC(C)(C)C 2230a_100000732750_100011217306 [0,1,0,0,0,0|2,0,1]=4 529 B10R0.8 CCN(CCF)CC(C)(C)C 269982a_100000732750_100011217306 [0,1,0,0,0,0|2,0,1]=4 530 B10R0.8 CCN(CCO)CC(C)(C)C 2230a_100000732750_100000211926 [0,1,0,0,0,0|1,0,2]=4 531 B10R0.8 CCN(CCO)CC(C)(C)C 2230a_100000752879_100000210202 [0,1,0,0,0,0|1,0,2]=4 532 B10R0.8 CCN(CCO)CC(C)(C)C 269982a_100000732750_100000211926 [0,1,0,0,0,0|1,0,2]=4 533 B10R0.8 CCN(CCO)CC(C)(C)C 269982a_100000752879_100000204670 [0,1,0,0,0,0|1,0,2]=4 534 B10R0.8 CCN(CCO)CC(C)(C)C 270004a_100000210973_100011204126 [0,1,0,0,0,0|1,0,2]=4 535 B10R0.8 CCN(COC)CC(C)(C)C 2230a_100000732750_100000766300 [0,1,0,0,0,0|3,0,0]=4 536 B10R0.8 CCN(COC)CC(C)(C)C 269982a_100000732750_100000766300 [0,1,0,0,0,0|3,0,0]=4 537 B10R0.8 CCN(CSC)CC(C)(C)C 2230a_100000732750_100011218213 [0,1,0,0,0,0|3,0,0]=4 538 B10R0.8 CCN(CSC)CC(C)(C)C 269982a_100000732750_100011218213 [0,1,0,0,0,0|3,0,0]=4 539 B10R0.8 COCC(CCl)OC(C)(C)C 34a_100011215053_100000210625 [0,1,0,0,0,0|3,0,0]=4 540 B10R0.8 COCC(CN)OC(C)(C)C 34a_100000756049_100000210625 [0,1,0,0,0,0|3,0,0]=4 541 B10R0.8 COCC(CO)NC(C)(C)C 34a_100000724102_100000210625 [0,1,0,0,0,0|3,0,0]=4 542 B10R0.28 C#CCCN(C)CC(C)(C)C 2230a_100000742839_100000688953 [0,1,0,0,0,0|2,0,1]=4 543 B10R0.28 C#CCCN(C)CC(C)(C)C 269982a_100000742839_100000730999 [0,1,0,0,0,0|2,0,1]=4 544 B10R0.28 C#CCN[C@@H](C)CC(C)(C)C 2230a_106358413534_100000038162 [0,1,0,0,0,0|1,0,1]=3 545 B10R0.28 C#CCOC(C)CC(C)(C)C 7a_200011218616_100000038162 [0,1,0,0,0,0|1,0,1]=3 546 B10R0.28 C/C=C/CC(=O)CC(C)(C)C 1458a_100000211214_100102629194 [0,1,0,0,0,0|2,0,1]=4 547 B10R0.28 C/C=C/CN(C)CC(C)(C)C 269982a_100000742839_100102629194 [0,1,0,0,0,0|2,0,0]=3 548 B10R0.28 C/C=C/CN(C)CC(C)(C)O 269982a_100000755907_100102629194 [0,1,0,0,0,0|3,0,0]=4 549 B10R0.28 C/C=C/CN(C)C[Si](C)(C)C 269982a_200020589227_100102629194 [0,1,0,0,0,0|2,1,0]=4 550 B10R0.28 C=CCCC(=O)CC(C)(C)C 1458a_100000211214_100000754431 [0,1,0,0,0,0|2,0,1]=4 551 B10R0.28 C=CCCC(C)OC(C)(C)C 34a_100000765329_100000210625 [0,1,0,0,0,0|2,0,0]=3 552 B10R0.28 C=CCCN(C)CC(C)(C)C 2230a_100000742839_100000754431 [0,1,0,0,0,0|2,0,0]=3 553 B10R0.28 C=CCCN(C)CC(C)(C)C 269982a_100000742839_100000754431 [0,1,0,0,0,0|2,0,0]=3 554 B10R0.28 C=CCCN(C)CC(C)(C)C 270004a_100020639649_100011204126 [0,1,0,0,0,0|2,0,0]=3 555 B10R0.28 C=CCCN(C)CC(C)(C)O 2230a_100000755907_100000754431 [0,1,0,0,0,0|3,0,0]=4 556 B10R0.28 C=CCCN(C)CC(C)(C)O 269982a_100000755907_100000754431 [0,1,0,0,0,0|3,0,0]=4 557 B10R0.28 C=CCCN(C)C[N+](C)(C)C 269982a_100020639649_200000036245 [0,1,0,0,0,0|3,0,0]=4 558 B10R0.28 C=CCCN(C)C[Si](C)(C)C 2230a_100020639649_100000037933 [0,1,0,0,0,0|2,1,0]=4 559 B10R0.28 C=CCCN(C)C[Si](C)(C)C 269982a_200020589227_100000754431 [0,1,0,0,0,0|2,1,0]=4 560 B10R0.28 C=CCNC(=O)CC(C)(C)C 1626a_100020586998_100000211214 [0,1,0,0,0,0|2,0,1]=4 561 B10R0.28 C=CCNC(=O)CC(C)(C)C 240690a_100020586998_100000211214 [0,1,0,0,0,0|2,0,1]=4 562 B10R0.28 C=CCNC(=O)CC(C)(C)C 527a_100020586998_100000211214 [0,1,0,0,0,0|2,0,1]=4 563 B10R0.28 C=CCN[C@@H](C)CC(C)(C)C 2230a_106358413534_100000210623 [0,1,0,0,0,0|1,0,0]=2 564 B10R0.28 C=CCOC(C)CC(C)(C)C 7a_200011218616_100015514636 [0,1,0,0,0,0|1,0,0]=2 565 B10R0.28 CC#CCN(C)CC(C)(C)C 2230a_100000742839_100000748600 [0,1,0,0,0,0|2,0,1]=4 566 B10R0.28 CC(C)(C)CN([13CH3])CCC#N 2230a_100000752284_200025704644 [0,1,0,0,0,0|2,0,1]=4 567 B10R0.28 CC(C)(C)CN([13CH3])CCCO 2230a_100000752882_200025704644 [0,1,0,0,0,0|1,0,2]=4 568 B10R0.28 CC(C)(C)CN([13CH3])CCCO 269982a_100000752882_200025704644 [0,1,0,0,0,0|1,0,2]=4 569 B10R0.28 CC(CC(C)(C)C)OCC#N 7a_200011218616_100011215382 [0,1,0,0,0,0|1,0,1]=3 570 B10R0.28 CC(CC(C)(C)C)OCC=O 7a_200011218616_200015260668 [0,1,0,0,0,0|0,0,0]=1 571 B10R0.28 CC(CC(C)(C)C)OCCF 7a_200011218616_100011217306 [0,1,0,0,0,0|1,0,1]=3 572 B10R0.28 CC(CC(C)(C)C)OCCO 7a_200011218616_100000211926 [0,1,0,0,0,0|0,0,2]=3 573 B10R0.28 CC(CC(F)(F)F)OCC=O 34a_200011470763_200009817547 [0,1,0,0,0,0|3,0,0]=4 574 B10R0.28 CC(CC(F)(F)F)OCC=O 7a_200011470763_200015260668 [0,1,0,0,0,0|3,0,0]=4 575 B10R0.28 CC(CC(F)(F)F)SCC=O 62a_200000065471_200015260668 [0,1,0,0,0,0|3,0,0]=4 576 B10R0.28 CC(CC(F)(F)F)SCC=O 62a_200015260668_200000065471 [0,1,0,0,0,0|3,0,0]=4 577 B10R0.28 CC(CCCCl)OC(C)(C)C 34a_200000718107_100000210625 [0,1,0,0,0,0|2,0,1]=4 578 B10R0.28 CC(CCO[13CH3])CC(C)(C)C 7a_200011215431_200025704644 [0,1,0,0,0,0|0,0,2]=3 579 B10R0.28 CC(COCF)CC(C)(C)C 7a_200011215325_100015361967 [0,1,0,0,0,0|1,0,1]=3 580 B10R0.28 CC=CCC(=O)CC(C)(C)C 1458a_100000211214_100000070051 [0,1,0,0,0,0|2,0,1]=4 581 B10R0.28 CC=CCN(C)CC(C)(C)C 2230a_100000742839_100000070051 [0,1,0,0,0,0|2,0,0]=3 582 B10R0.28 CC=CCN(C)CC(C)(C)O 2230a_100000755907_100000070051 [0,1,0,0,0,0|3,0,0]=4 583 B10R0.28 CCCCC(C)NC(C)(C)C 2230a_100000715429_200011215066 [0,1,0,0,0,0|2,0,1]=4 584 B10R0.28 CCCCC(C)OC(C)(C)C 34a_100000687866_100000210625 [0,1,0,0,0,0|2,0,1]=4 585 B10R0.28 CCCCC(C)OC(C)(C)C 34a_100015890283_200011215066 [0,1,0,0,0,0|2,0,1]=4 586 B10R0.28 CCCCC(C)OC(C)(C)C 7a_100015890283_200011215066 [0,1,0,0,0,0|2,0,1]=4 587 B10R0.28 CCCCC(C)SC(C)(C)C 62a_100000211941_200011215066 [0,1,0,0,0,0|2,0,1]=4 588 B10R0.28 CCCCC(C)SC(C)(C)C 62a_200011215066_100000211941 [0,1,0,0,0,0|2,0,1]=4 589 B10R0.28 CCCCN(C)CC(C)(C)C 2230a_100000742839_100000210211 [0,1,0,0,0,0|2,0,1]=4 590 B10R0.28 CCCCN(C)CC(C)(C)C 269982a_100000742839_100000210211 [0,1,0,0,0,0|2,0,1]=4 591 B10R0.28 CCCCN(C)CC(C)(C)C 270004a_100000207549_100011204126 [0,1,0,0,0,0|2,0,1]=4 592 B10R0.28 CCCN[C@@H](C)CC(C)(C)C 2230a_106358413534_100000210303 [0,1,0,0,0,0|1,0,1]=3 593 B10R0.28 CCCOC(C)CC(C)(C)C 7a_200011218616_100000210303 [0,1,0,0,0,0|1,0,1]=3 594 B10R0.28 CCOCC(C)CC(C)(C)C 7a_200011215325_100000210202 [0,1,0,0,0,0|1,0,1]=3 595 B10R0.28 CCOCC(C)OC(C)(C)C 34a_100000718985_100000210625 [0,1,0,0,0,0|2,0,1]=4 596 B10R0.28 CCOCN(C)CC(C)(C)C 269982a_100000742839_100000739092 [0,1,0,0,0,0|2,0,1]=4 597 B10R0.28 CN(CCC#N)CC(C)(C)C 2230a_100000742839_100011215226 [0,1,0,0,0,0|2,0,1]=4 598 B10R0.28 CN(CCC#N)CC(C)(C)C 2230a_100000752284_200000210301 [0,1,0,0,0,0|2,0,1]=4 599 B10R0.28 CN(CCC#N)CC(C)(C)C 269982a_100000742839_100011215226 [0,1,0,0,0,0|2,0,1]=4 600 B10R0.28 CN(CCC#N)CC(C)(C)C 270004a_100000184479_100011204126 [0,1,0,0,0,0|2,0,1]=4 601 B10R0.28 CN(CCCF)CC(C)(C)C 2230a_100000742839_100011934791 [0,1,0,0,0,0|2,0,1]=4 602 B10R0.28 CN(CCCF)CC(C)(C)C 269982a_100000742839_100011934791 [0,1,0,0,0,0|2,0,1]=4 603 B10R0.28 CN(CCCO)CC(C)(C)C 2230a_100000742839_100000230001 [0,1,0,0,0,0|1,0,2]=4 604 B10R0.28 CN(CCCO)CC(C)(C)C 2230a_100000752882_200000210301 [0,1,0,0,0,0|1,0,2]=4 605 B10R0.28 CN(CCCO)CC(C)(C)C 269982a_100000742839_100011215043 [0,1,0,0,0,0|1,0,2]=4 606 B10R0.28 CN(CCCO)CC(C)(C)C 269982a_100000752882_200000210301 [0,1,0,0,0,0|1,0,2]=4 607 B10R0.28 CN(CCCO)CC(C)(C)C 270004a_100000213112_100011204126 [0,1,0,0,0,0|1,0,2]=4 608 B10R0.28 CN(CSC#N)CC(C)(C)C 269982a_100000742839_100000211825 [0,1,0,0,0,0|2,0,1]=4 609 B10R0.28 COCCC(C)CC(C)(C)C 7a_200011215431_200000210301 [0,1,0,0,0,0|0,0,2]=3 610 B10R0.28 COCCN(C)CC(C)(C)C 2230a_100000742839_100011201679 [0,1,0,0,0,0|1,0,2]=4 611 B10R0.28 COCCN(C)CC(C)(C)C 269982a_100000742839_100000233755 [0,1,0,0,0,0|1,0,2]=4 612 B10R0.28 COCCN(C)CC(C)(C)C 270004a_100000743101_100011204126 [0,1,0,0,0,0|1,0,2]=4 613 B10R0.28 COCN[C@@H](C)CC(C)(C)C 2230a_106358413534_100000766300 [0,1,0,0,0,0|2,0,0]=3 614 B10R0.28 CSCCN(C)CC(C)(C)C 2230a_100000742839_100000751147 [0,1,0,0,0,0|1,1,1]=4 615 B10R0.28 CSCCN(C)CC(C)(C)C 269982a_100000742839_100000212216 [0,1,0,0,0,0|1,1,1]=4 616 B10R0.28 CSCCN(C)CC(C)(C)C 270004a_100000686725_100011204126 [0,1,0,0,0,0|1,1,1]=4 617 B10R0.28 CSCN[C@@H](C)CC(C)(C)C 2230a_106358413534_100011218213 [0,1,0,0,0,0|2,0,0]=3 618 B10R0.28 C[C@@H](CC(C)(C)C)NCC#N 2230a_106358413534_100011215382 [0,1,0,0,0,0|1,0,1]=3 619 B10R0.28 C[C@@H](CC(C)(C)C)NCC=O 2230a_106358413534_200015260668 [0,1,0,0,0,0|0,0,0]=1 620 B10R0.28 C[C@@H](CC(C)(C)C)NCCF 2230a_106358413534_100011217306 [0,1,0,0,0,0|1,0,1]=3 621 B10R0.28 C[C@@H](CC(C)(C)C)NCCO 2230a_106358413534_100000211926 [0,1,0,0,0,0|0,0,2]=3 622 B10R0.31 C=C(C)CC(=O)CC(C)(C)C 1458a_100000211214_100000748629 [0,1,0,0,0,0|2,0,1]=4 623 B10R0.31 C=C(C)CN(C)CC(C)(C)C 2230a_100000742839_100000748629 [0,1,0,0,0,0|2,0,0]=3 624 B10R0.31 C=C(C)CN(C)CC(C)(C)C 269982a_100000742839_100000748629 [0,1,0,0,0,0|2,0,0]=3 625 B10R0.31 C=C(C)CN(C)CC(C)(C)C 270004a_100000225649_100011204126 [0,1,0,0,0,0|2,0,0]=3 626 B10R0.31 C=C(C)CN(C)CC(C)(C)O 2230a_100000755907_100000748629 [0,1,0,0,0,0|3,0,0]=4 627 B10R0.31 C=C(C)CN(C)CC(C)(C)O 269982a_100000755907_100000748629 [0,1,0,0,0,0|3,0,0]=4 628 B10R0.31 C=C(C)CN(C)C[N+](C)(C)C 269982a_100000225649_200000036245 [0,1,0,0,0,0|3,0,0]=4 629 B10R0.31 C=C(C)CN(C)C[Si](C)(C)C 2230a_100000225649_100000037933 [0,1,0,0,0,0|2,1,0]=4 630 B10R0.31 C=C(C)CN(C)C[Si](C)(C)C 269982a_200020589227_100000748629 [0,1,0,0,0,0|2,1,0]=4 631 B10R0.31 C=C(F)CC(=O)CC(C)(C)C 1458a_100000211214_100009893438 [0,1,0,0,0,0|2,0,1]=4 632 B10R0.31 C=C(F)CN(C)CC(C)(C)C 2230a_100000742839_100009893438 [0,1,0,0,0,0|2,0,0]=3 633 B10R0.31 C=C(F)CN(C)CC(C)(C)C 269982a_100000742839_100009893438 [0,1,0,0,0,0|2,0,0]=3 634 B10R0.31 C=C(F)CN(C)CC(C)(C)O 2230a_100000755907_100009893438 [0,1,0,0,0,0|3,0,0]=4 635 B10R0.31 C=C(F)CN(C)CC(C)(C)O 269982a_100000755907_100009893438 [0,1,0,0,0,0|3,0,0]=4 636 B10R0.31 C=C(F)CN(C)C[Si](C)(C)C 269982a_200020589227_100009893438 [0,1,0,0,0,0|2,1,0]=4 637 B10R0.31 CC(=CC(C)OC(C)(C)C)C 34a_100000717055_100000210625 [0,1,0,0,0,0|2,0,1]=4 638 B10R0.31 CC(=O)CC(=O)NC(C)(C)C 1458a_100000070787_100000182746 [0,1,0,0,0,0|2,0,1]=4 639 B10R0.31 CC(=O)CC(=O)OC(C)(C)C 1458a_100000033093_200000210301 [0,1,0,0,0,0|2,0,1]=4 640 B10R0.31 CC(=O)CC(=O)OC(C)(C)C 1458a_100000070787_100000183872 [0,1,0,0,0,0|2,0,1]=4 641 B10R0.31 CC(=O)CC(C)CC(C)(C)C 1458a_100000239893_200000210301 [0,1,0,0,0,0|0,0,0]=1 642 B10R0.31 CC(=O)CC(C)CC(F)(F)F 1458a_100000070787_100009814340 [0,1,0,0,0,0|3,0,0]=4 643 B10R0.31 CC(=O)CC(O)C[N+](C)(C)C 1458a_100000070787_100000032816 [0,1,0,0,0,0|2,0,0]=3 644 B10R0.31 CC(=O)C[C@@H](O)C[N+](C)(C)C 1458a_100000004043_200000210301 [0,1,0,0,0,0|2,0,0]=3 645 B10R0.31 CC(=O)N[C@@H](C)CC(C)(C)C 11a_106358413534_100015343762 [0,1,0,0,0,0|1,0,0]=2 646 B10R0.31 CC(=O)N[C@@H](C)CC(C)(C)C 1626a_106358413534_100015343762 [0,1,0,0,0,0|1,0,0]=2 647 B10R0.31 CC(=O)N[C@@H](C)CC(C)(C)C 240690a_106358413534_100015343762 [0,1,0,0,0,0|1,0,0]=2 648 B10R0.31 CC(=O)N[C@@H](C)CC(C)(C)C 527a_106358413534_100103153847 [0,1,0,0,0,0|1,0,0]=2 649 B10R0.31 CC(=O)OC(C)SC(C)(C)C 62a_100000211941_100009818208 [0,1,0,0,0,0|2,0,0]=3 650 B10R0.31 CC(=O)OC(C)SC(C)(C)C 62a_100009818208_100000211941 [0,1,0,0,0,0|2,0,0]=3 651 B10R0.31 CC(C)(C)CC(=O)CC(=O)N 1458a_100000211214_100000187820 [0,1,0,0,0,0|1,0,1]=3 652 B10R0.31 CC(C)(C)CC(=O)CC(=O)[O-] 1458a_100000211214_100020667443 [0,1,0,0,0,0|1,0,1]=3 653 B10R0.31 CC(C)(C)CC(=O)C[N+](=O)[O-] 1458a_100000211214_100000761209 [0,1,0,0,0,0|2,0,1]=4 654 B10R0.31 CC(C)(C)NC(=O)CC(=O)N 240690a_100000715429_100134613110 [0,1,0,0,0,0|2,0,1]=4 655 B10R0.31 CC(C)(C)NC(=O)CC(=O)N 527a_100000715429_100134613110 [0,1,0,0,0,0|2,0,1]=4 656 B10R0.31 CC(C)(C)OC(=O)CC(=O)[13CH3] 1458a_100000033093_200025704644 [0,1,0,0,0,0|2,0,1]=4 657 B10R0.31 CC(C)(O)CC(=O)CC(=O)N 1458a_100000693243_100000187820 [0,1,0,0,0,0|2,0,1]=4 658 B10R0.31 CC(C)(O)CC(=O)CC(=O)[O-] 1458a_100000693243_100020667443 [0,1,0,0,0,0|2,0,1]=4 659 B10R0.31 CC(C)CC(C)NC(C)(C)C 2230a_100000715429_100000731052 [0,1,0,0,0,0|2,0,1]=4 660 B10R0.31 CC(C)CC(C)OC(C)(C)C 34a_100000211805_100000210625 [0,1,0,0,0,0|2,0,1]=4 661 B10R0.31 CC(C)CC(C)OC(C)(C)C 34a_100015890283_100000731052 [0,1,0,0,0,0|2,0,1]=4 662 B10R0.31 CC(C)CC(C)OC(C)(C)C 7a_100015890283_100000731052 [0,1,0,0,0,0|2,0,1]=4 663 B10R0.31 CC(C)CC(C)SC(C)(C)C 62a_100000211941_100000731052 [0,1,0,0,0,0|2,0,1]=4 664 B10R0.31 CC(C)CC(C)SC(C)(C)C 62a_100000731052_100000211941 [0,1,0,0,0,0|2,0,1]=4 665 B10R0.31 CC(C)CN(C)CC(C)(C)C 2230a_100000742839_100000210760 [0,1,0,0,0,0|2,0,1]=4 666 B10R0.31 CC(C)CN(C)CC(C)(C)C 269982a_100000742839_100000210624 [0,1,0,0,0,0|2,0,1]=4 667 B10R0.31 CC(C)CN(C)CC(C)(C)C 270004a_100000742839_100000210432 [0,1,0,0,0,0|2,0,1]=4 668 B10R0.31 CC(C)CN(C)CC(C)(C)C 270004a_100000747067_100011204126 [0,1,0,0,0,0|2,0,1]=4 669 B10R0.31 CC(C)N[C@@H](C)CC(C)(C)C 2230a_106358413534_100000210206 [0,1,0,0,0,0|2,0,1]=4 670 B10R0.31 CC(C)OC(C)CC(C)(C)C 7a_200011218616_100000210206 [0,1,0,0,0,0|2,0,1]=4 671 B10R0.31 CC(CC(=O)[13CH3])CC(C)(C)C 1458a_100000239893_200025704644 [0,1,0,0,0,0|0,0,0]=1 672 B10R0.31 CC(CN(C)C)SC(C)(C)C 62a_100000211941_100020606517 [0,1,0,0,0,0|3,0,0]=4 673 B10R0.31 CC(CN(C)C)SC(C)(C)C 62a_100020606517_100000211941 [0,1,0,0,0,0|3,0,0]=4 674 B10R0.31 CC(O)CN(C)CC(C)(C)C 2230a_100000742839_100011218427 [0,1,0,0,0,0|1,0,2]=4 675 B10R0.31 CC(O)CN(C)CC(C)(C)C 269982a_100000742839_100011218427 [0,1,0,0,0,0|1,0,2]=4 676 B10R0.31 CC(O)CN(C)CC(C)(C)C 270004a_100000227577_100011204126 [0,1,0,0,0,0|1,0,2]=4 677 B10R0.31 CN(CC(=O)N)CC(C)(C)C 2230a_100000742839_100000747473 [0,1,0,0,0,0|1,0,0]=2 678 B10R0.31 CN(CC(=O)N)CC(C)(C)C 269982a_100000742839_100000187820 [0,1,0,0,0,0|1,0,0]=2 679 B10R0.31 CN(CC(=O)N)CC(C)(C)C 270004a_100000739694_100011204126 [0,1,0,0,0,0|1,0,0]=2 680 B10R0.31 CN(CC(=O)N)CC(C)(C)O 2230a_100000755907_100000747473 [0,1,0,0,0,0|2,0,0]=3 681 B10R0.31 CN(CC(=O)N)CC(C)(C)O 269982a_100000755907_100000187820 [0,1,0,0,0,0|2,0,0]=3 682 B10R0.31 CN(CC(=O)N)C[Si](C)(C)C 2230a_100000739694_100000037933 [0,1,0,0,0,0|1,1,0]=3 683 B10R0.31 CN(CC(=O)N)C[Si](C)(C)C 269982a_200020589227_100000187820 [0,1,0,0,0,0|1,1,0]=3 684 B10R0.31 CN(CC(=O)O)CC(C)(C)C 269956a_100000746989_100011219605 [0,1,0,0,0,0|1,0,0]=2 685 B10R0.31 CN(CC(=O)O)CC(C)(C)F 269956a_100000746989_100011997219 [0,1,0,0,0,0|2,0,0]=3 686 B10R0.31 CN(CC(=O)O)CC(C)(C)O 269956a_100000746989_100000764493 [0,1,0,0,0,0|2,0,0]=3 687 B10R0.31 CN(CC(=O)O)C[N+](C)(C)C 269956a_100000746989_200000036245 [0,1,0,0,0,0|2,0,0]=3 688 B10R0.31 CN(CC(=O)O)C[Si](C)(C)C 269956a_100000746989_100000037933 [0,1,0,0,0,0|1,1,0]=3 689 B10R0.31 CN(CC(=O)[O-])CC(C)(C)C 269982a_100000742839_100020667443 [0,1,0,0,0,0|1,0,0]=2 690 B10R0.31 CN(CC(=O)[O-])CC(C)(C)O 269982a_100000755907_100020667443 [0,1,0,0,0,0|2,0,0]=3 691 B10R0.31 CN(CC(=O)[O-])C[Si](C)(C)C 269982a_200020589227_100020667443 [0,1,0,0,0,0|1,1,0]=3 692 B10R0.31 CN(CC(F)F)CC(C)(C)C 2230a_100000742839_100011934356 [0,1,0,0,0,0|2,0,1]=4 693 B10R0.31 CN(CC(F)F)CC(C)(C)C 269982a_100000742839_100011934356 [0,1,0,0,0,0|2,0,1]=4 694 B10R0.31 CN(C[N+](=O)[O-])CC(C)(C)C 269982a_100000742839_100000761209 [0,1,0,0,0,0|2,0,0]=3 695 B10R0.31 CN(C[N+](=O)[O-])CC(C)(C)O 269982a_100000755907_100000761209 [0,1,0,0,0,0|3,0,0]=4 696 B10R0.31 CN(C[N+](=O)[O-])C[Si](C)(C)C 269982a_200020589227_100000761209 [0,1,0,0,0,0|2,1,0]=4 697 B10R0.31 C[C@@H](O)CN(C)CC(C)(C)C 2230a_100000742839_100009817552 [0,1,0,0,0,0|1,0,2]=4 698 B10R0.31 C[C@@H](O)CN(C)CC(C)(C)C 269982a_100000742839_100009817552 [0,1,0,0,0,0|1,0,2]=4 699 B10R0.31 C[N+](C)(C)CC(=O)CC(=O)N 1458a_100000033712_100000187820 [0,1,0,0,0,0|2,0,1]=4 700 B10R0.31 C[N+](C)(C)CC(=O)CC(=O)[O-] 1458a_100000033712_100020667443 [0,1,0,0,0,0|2,0,1]=4 701 B10R0.31 C[N+](C)(C)C[C@H](O)CC(=O)[13CH3] 1458a_100000004043_200025704644 [0,1,0,0,0,0|2,0,0]=3 702 B10R0.31 C[Si](C)(C)CC(=O)CC(=O)N 1458a_100011218504_100000187820 [0,1,0,0,0,0|1,1,1]=4 703 B10R0.31 C[Si](C)(C)CC(=O)CC(=O)N 1458a_100134613110_100000233785 [0,1,0,0,0,0|1,1,1]=4 704 B10R0.31 C[Si](C)(C)CC(=O)CC(=O)[O-] 1458a_100011218504_100020667443 [0,1,0,0,0,0|1,1,1]=4 705 B10R0.37 C=CC(=O)N(C)CC(C)(C)C 1626a_100000742839_100000185746 [0,1,0,0,0,0|2,0,1]=4 706 B10R0.37 C=CC(=O)N(C)CC(C)(C)C 240690a_100000742839_200121576911 [0,1,0,0,0,0|2,0,1]=4 707 B10R0.37 C=CC(C)N(C)CC(C)(C)C 269982a_100000742839_100011215867 [0,1,0,0,0,0|2,0,0]=3 708 B10R0.37 C=CC(C)N(C)CC(C)(C)O 269982a_100000755907_100011215867 [0,1,0,0,0,0|3,0,0]=4 709 B10R0.37 C=CC(C)N(C)C[Si](C)(C)C 269982a_200020589227_100011215867 [0,1,0,0,0,0|2,1,0]=4 710 B10R0.37 C=C[C@@H](C)[C@@H](C)OC(C)(C)C 34a_100015455354_100000210625 [0,1,0,0,0,0|2,0,0]=3 711 B10R0.37 CC(C#N)N(C)CC(C)(C)C 2230a_100000742839_100000184139 [0,1,0,0,0,0|2,0,1]=4 712 B10R0.37 CC(C#N)N(C)CC(C)(C)C 269982a_100000742839_100000703298 [0,1,0,0,0,0|2,0,1]=4 713 B10R0.37 CC(C#N)N(C)CC(C)(C)C 270004a_100000745055_100011204126 [0,1,0,0,0,0|2,0,1]=4 714 B10R0.37 CC(CO)N(C)CC(C)(C)C 2230a_100000742839_100012180447 [0,1,0,0,0,0|1,0,2]=4 715 B10R0.37 CC(CO)N(C)CC(C)(C)C 270004a_100000693034_100011204126 [0,1,0,0,0,0|1,0,2]=4 716 B10R0.37 CCC(C)N(C)CC(C)(C)C 2230a_100000742839_100000758301 [0,1,0,0,0,0|2,0,1]=4 717 B10R0.37 CCC(C)N(C)CC(C)(C)C 269982a_100000742839_100000758301 [0,1,0,0,0,0|2,0,1]=4 718 B10R0.37 CCC(C)N(C)CC(C)(C)C 270004a_100000741768_100011204126 [0,1,0,0,0,0|2,0,1]=4 719 B10R0.37 COC(C)N(C)CC(C)(C)C 269982a_100000742839_100009879195 [0,1,0,0,0,0|3,0,0]=4 720 B10R0.37 C[C@H](CO)N(C)CC(C)(C)C 269982a_100000742839_100016084084 [0,1,0,0,0,0|1,0,2]=4 721 B10R0.48 CC(C)(C)CC(C)(C)OCF 7a_100000065652_100015361967 [0,1,0,0,0,0|2,0,1]=4 722 B10R0.48 CCNC(C)(C)CC(C)(C)C 2230a_100000211918_100000210202 [0,1,0,0,0,0|2,0,1]=4 723 B10R0.48 CCOC(C)(C)CC(C)(C)C 7a_100000065652_100000210202 [0,1,0,0,0,0|2,0,1]=4 724 B10R0.100 C#CCN(C)C(C)C(C)(C)C 2230a_100000745498_100000038162 [0,1,0,0,0,0|2,0,1]=4 725 B10R0.100 C=CCC(=O)[C@@H](O)C(C)(C)C 1458a_100009816492_100000210623 [0,1,0,0,0,0|2,0,1]=4 726 B10R0.100 C=CCN(C)C(=O)C(C)(C)C 11a_100000225617_106744555173 [0,1,0,0,0,0|2,0,1]=4 727 B10R0.100 C=CCN(C)C(=O)C(C)(C)C 1626a_100000225617_106744555173 [0,1,0,0,0,0|2,0,1]=4 728 B10R0.100 C=CCN(C)C(=O)C(C)(C)C 240690a_100000225617_106744555173 [0,1,0,0,0,0|2,0,1]=4 729 B10R0.100 C=CCN(C)C(=O)C(C)(C)C 527a_100000225617_106744555173 [0,1,0,0,0,0|2,0,1]=4 730 B10R0.100 C=CCN(C)C(C)C(C)(C)C 2230a_100000745498_100000210623 [0,1,0,0,0,0|2,0,0]=3 731 B10R0.100 C=CCN(C)C(C)C(C)(C)C 269982a_100000745498_100000210623 [0,1,0,0,0,0|2,0,0]=3 732 B10R0.100 CC(CC#N)C(=O)C(C)(C)C 1458a_106744555173_100009813641 [0,1,0,0,0,0|1,0,2]=4 733 B10R0.100 CC(CC#N)N(C)C(C)(C)C 269982a_100011215553_100009813641 [0,1,0,0,0,0|2,0,1]=4 734 B10R0.100 CC(CCO)C(=O)C(C)(C)C 1458a_106744555173_100009893172 [0,1,0,0,0,0|0,0,3]=4 735 B10R0.100 CC(CCO)N(C)C(C)(C)C 269982a_100000731037_100000210625 [0,1,0,0,0,0|1,0,2]=4 736 B10R0.100 CC(CCO)N(C)C(C)(C)C 269982a_100011215553_100009893172 [0,1,0,0,0,0|1,0,2]=4 737 B10R0.100 CC(N(C)CC#N)C(C)(C)C 2230a_100000745498_100011215382 [0,1,0,0,0,0|2,0,1]=4 738 B10R0.100 CC(N(C)CC#N)C(C)(C)C 269982a_100000745498_100011214920 [0,1,0,0,0,0|2,0,1]=4 739 B10R0.100 CC(N(C)CC=O)C(C)(C)C 2230a_100000745498_200015260668 [0,1,0,0,0,0|1,0,0]=2 740 B10R0.100 CC(N(C)CC=O)C(C)(C)C 269982a_100000745498_200015260668 [0,1,0,0,0,0|1,0,0]=2 741 B10R0.100 CC(N(C)CCF)C(C)(C)C 2230a_100000745498_100011217306 [0,1,0,0,0,0|2,0,1]=4 742 B10R0.100 CC(N(C)CCF)C(C)(C)C 269982a_100000745498_100011217306 [0,1,0,0,0,0|2,0,1]=4 743 B10R0.100 CC(N(C)CCO)C(C)(C)C 2230a_100000745498_100000211926 [0,1,0,0,0,0|1,0,2]=4 744 B10R0.100 CC(N(C)CCO)C(C)(C)C 269982a_100000745498_100000211926 [0,1,0,0,0,0|1,0,2]=4 745 B10R0.100 CCCC(C)C(=O)C(C)(C)C 1458a_106744555173_100000766640 [0,1,0,0,0,0|1,0,2]=4 746 B10R0.100 CCCC(C)N(C)C(C)(C)C 269982a_100011215553_100000766640 [0,1,0,0,0,0|2,0,1]=4 747 B10R0.100 CCCC(C)N(C)C(C)(C)C 270004a_100011215553_100000211909 [0,1,0,0,0,0|2,0,1]=4 748 B10R0.100 CCCN(C)C(C)C(C)(C)C 2230a_100000745498_100000210303 [0,1,0,0,0,0|2,0,1]=4 749 B10R0.100 CCCN(C)C(C)C(C)(C)C 269982a_100000745498_100000210303 [0,1,0,0,0,0|2,0,1]=4 750 B10R0.100 COCC(C)C(=O)C(C)(C)C 1458a_106744555173_100000765312 [0,1,0,0,0,0|2,0,1]=4 751 B10R0.100 COCC(C)N(C)C(C)(C)C 269982a_100011215553_100000765312 [0,1,0,0,0,0|3,0,0]=4 752 B10R0.100 COCC(C)N(C)C(C)(C)C 270004a_100011215553_100000749346 [0,1,0,0,0,0|3,0,0]=4 753 B10R0.100 COCN(C)C(C)C(C)(C)C 2230a_100000745498_100000766300 [0,1,0,0,0,0|3,0,0]=4 754 B10R0.100 COCN(C)C(C)C(C)(C)C 269982a_100000745498_100000766300 [0,1,0,0,0,0|3,0,0]=4 755 B10R0.100 CSCC(C)N(C)C(C)(C)C 270004a_100011215553_100011216314 [0,1,0,0,0,0|3,0,0]=4 756 B10R0.100 CSCN(C)C(C)C(C)(C)C 2230a_100000745498_100011218213 [0,1,0,0,0,0|3,0,0]=4 757 B10R0.100 CSCN(C)C(C)C(C)(C)C 269982a_100000745498_100011218213 [0,1,0,0,0,0|3,0,0]=4 758 B10R1.33 CC1(C[C@@H](N(C1)[13CH3])CO)C 2230a_100020977354_200025704644 [0,0,0,1,0,0|1,0,2]=4 759 B10R1.33 CC1(C[C@@H](N(C1)[13CH3])CO)C 269982a_100020977354_200025704644 [0,0,0,1,0,0|1,0,2]=4 760 B10R1.33 CN1CC(C[C@@H]1CO)(C)C 2230a_100020977354_200000210301 [0,0,0,1,0,0|1,0,2]=4 761 B10R1.33 CN1CC(C[C@@H]1CO)(C)C 269982a_100020977354_200000210301 [0,0,0,1,0,0|1,0,2]=4 762 B10R1.33 CNC1CC(CC1C)(C)C 270004a_106832991635_100000720090 [0,0,0,1,0,0|2,0,0]=3 763 B10R1.65 C[C@@H]1CCCN1C(C)(C)C 269982a_100015189458_100000210625 [0,0,0,1,0,0|2,0,1]=4 764 B10R1.65 C[C@@H]1CCCN1C(C)(C)C 34a_100015189458_100000210625 [0,0,0,1,0,0|2,0,1]=4 765 B10R1.65 C[C@H]1CCCN1C(C)(C)C 269982a_100020605311_100000210625 [0,0,0,1,0,0|2,0,1]=4 766 B10R1.95 C#CCN1CCC(C1)(C)C 2230a_100000764714_100000038162 [0,0,0,1,0,0|2,0,1]=4 767 B10R1.95 C=CCN1CCC(C1)(C)C 2230a_100000764714_100000210623 [0,0,0,1,0,0|2,0,0]=3 768 B10R1.95 C=CCN1CCC(C1)(C)C 269982a_100000764714_100000210623 [0,0,0,1,0,0|2,0,0]=3 769 B10R1.95 C=CCN1CCC(C1)(C)O 2230a_100000718628_100000210623 [0,0,0,1,0,0|3,0,0]=4 770 B10R1.95 C=CCN1CCC(C1)(C)O 269982a_100000718628_100000210623 [0,0,0,1,0,0|3,0,0]=4 771 B10R1.95 CC1(CCN(C1)CC#N)C 2230a_100000764714_100011215382 [0,0,0,1,0,0|2,0,1]=4 772 B10R1.95 CC1(CCN(C1)CC#N)C 269982a_100000764714_100011214920 [0,0,0,1,0,0|2,0,1]=4 773 B10R1.95 CC1(CCN(C1)CC=O)C 2230a_100000764714_200015260668 [0,0,0,1,0,0|1,0,0]=2 774 B10R1.95 CC1(CCN(C1)CC=O)C 269982a_100000764714_200015260668 [0,0,0,1,0,0|1,0,0]=2 775 B10R1.95 CC1(CCN(C1)CC=O)O 2230a_100000718628_200015260668 [0,0,0,1,0,0|2,0,0]=3 776 B10R1.95 CC1(CCN(C1)CC=O)O 269982a_100000718628_200015260668 [0,0,0,1,0,0|2,0,0]=3 777 B10R1.95 CC1(CCN(C1)CCF)C 2230a_100000764714_100011217306 [0,0,0,1,0,0|2,0,1]=4 778 B10R1.95 CC1(CCN(C1)CCF)C 269982a_100000764714_100011217306 [0,0,0,1,0,0|2,0,1]=4 779 B10R1.95 CC1(CCN(C1)CCO)C 2230a_100000764714_100000211926 [0,0,0,1,0,0|1,0,2]=4 780 B10R1.95 CC1(CCN(C1)CCO)C 269982a_100000764714_100000211926 [0,0,0,1,0,0|1,0,2]=4 781 B10R1.95 CC1(CN[C@H](C1)CO[13CH3])C 34a_100020977354_200025704644 [0,0,0,1,0,0|3,0,0]=4 782 B10R1.95 CCCN1CCC(C1)(C)C 2230a_100000764714_100000210303 [0,0,0,1,0,0|2,0,1]=4 783 B10R1.95 CCCN1CCC(C1)(C)C 269982a_100000764714_100000210303 [0,0,0,1,0,0|2,0,1]=4 784 B10R1.95 CCNC1CCC(C1)(C)C 270004a_100015525214_100000759959 [0,0,0,1,0,0|2,0,1]=4 785 B10R1.95 COCN1CCC(C1)(C)C 2230a_100000764714_100000766300 [0,0,0,1,0,0|3,0,0]=4 786 B10R1.95 COCN1CCC(C1)(C)C 269982a_100000764714_100000766300 [0,0,0,1,0,0|3,0,0]=4 787 B10R1.95 COC[C@H]1CC(CN1)(C)C 34a_100020977354_200000210301 [0,0,0,1,0,0|3,0,0]=4 788 B10R1.95 CSCN1CCC(C1)(C)C 2230a_100000764714_100011218213 [0,0,0,1,0,0|3,0,0]=4 789 B10R1.95 CSCN1CCC(C1)(C)C 269982a_100000764714_100011218213 [0,0,0,1,0,0|3,0,0]=4 790 B10R1.95 O=CCN1CCC(C1)(F)F 2230a_100000697292_200015260668 [0,0,0,1,0,0|3,0,0]=4 791 B10R1.95 O=CCN1CCC(C1)(F)F 269982a_100000697292_200015260668 [0,0,0,1,0,0|3,0,0]=4 792 B10R1.95 O=CCN1CCC(C1)(F)F 34a_100000697292_200009817547 [0,0,0,1,0,0|3,0,0]=4 793 B10R1.112 CC(C)(C)CN1CC(C1)F 270004a_100000690557_100011204126 [0,0,0,1,0,0|2,0,1]=4 794 B10R1.112 CC(C)(C)CN1CC(C1)F 34a_100000690557_100011219605 [0,0,0,1,0,0|2,0,1]=4 795 B10R1.112 CC(C)(C)SC1CC(=O)C1 62a_100009894365_100000211941 [0,0,0,1,0,0|1,0,0]=2 796 B10R1.112 CC1CN(C1)CC(C)(C)C 270004a_100000702820_100011204126 [0,0,0,1,0,0|2,0,1]=4 797 B10R1.112 CC1CN(C1)CC(C)(C)C 34a_100000702820_100011219605 [0,0,0,1,0,0|2,0,1]=4 798 B10R1.181 C=CCC(=O)CC1(CC1)C 1458a_100000112800_100000210623 [0,0,0,1,0,0|2,0,1]=4 799 B10R1.181 C=CCN(C)CC1(CO1)C 269982a_100000225617_100000760498 [0,0,0,1,0,0|3,0,0]=4 800 B10R1.181 CC(CC#N)NC1(CC1)C 2230a_100000757604_100009813641 [0,0,0,1,0,0|2,0,1]=4 801 B10R1.181 CC(CC#N)OC1(CC1)C 7a_100011725673_100009813641 [0,0,0,1,0,0|2,0,1]=4 802 B10R1.181 CC(CCO)NC1(CC1)C 2230a_100000757604_100009893172 [0,0,0,1,0,0|1,0,2]=4 803 B10R1.181 CC(CCO)OC1(CC1)C 7a_100011725673_100009893172 [0,0,0,1,0,0|1,0,2]=4 804 B10R1.181 CCCC(C)NC1(CC1)C 2230a_100000757604_100000766640 [0,0,0,1,0,0|2,0,1]=4 805 B10R1.181 CCCC(C)OC1(CC1)C 7a_100011725673_100000766640 [0,0,0,1,0,0|2,0,1]=4 806 B10R1.181 COCC(C)NC1(CC1)C 2230a_100000757604_100000765312 [0,0,0,1,0,0|3,0,0]=4 807 B10R1.181 COCC(C)OC1(CC1)C 7a_100011725673_100000765312 [0,0,0,1,0,0|3,0,0]=4 808 B10R1.281 CC(C)(C)CN1CCCC1 270004a_100000188435_100011204126 [0,0,0,1,0,0|2,0,1]=4 809 B10R1.281 CC(C)(C)CN1CCSC1 270004a_100011215254_100011204126 [0,0,0,1,0,0|1,1,1]=4 810 B10R1.281 CC(C)(C)NC1CCCC1 2230a_100000715429_100000179811 [0,0,0,1,0,0|2,0,1]=4 811 B10R1.281 CC(C)(C)NC1CCCC1 34a_100000211070_100000210625 [0,0,0,1,0,0|2,0,1]=4 812 B10R1.281 CC(C)(C)NC1CCOC1 2230a_100000715429_100000731011 [0,0,0,1,0,0|1,0,2]=4 813 B10R1.281 CC(C)(C)N[C@H]1CCOC1 34a_100015188467_100000210625 [0,0,0,1,0,0|1,0,2]=4 814 B10R1.281 CC(C)(C)OC1CCCC1 34a_100000210269_100000210625 [0,0,0,1,0,0|2,0,1]=4 815 B10R1.281 CC(C)(C)OC1CCCC1 34a_100015890283_100000179811 [0,0,0,1,0,0|2,0,1]=4 816 B10R1.281 CC(C)(C)OC1CCCC1 7a_100015890283_100000179811 [0,0,0,1,0,0|2,0,1]=4 817 B10R1.281 CC(C)(C)OC1CCOC1 34a_100015890283_100000690089 [0,0,0,1,0,0|1,0,2]=4 818 B10R1.281 CC(C)(C)OC1CCOC1 7a_100015890283_100000731011 [0,0,0,1,0,0|1,0,2]=4 819 B10R1.281 CC(C)(C)O[C@H]1CCOC1 34a_100000717292_100000210625 [0,0,0,1,0,0|1,0,2]=4 820 B10R1.281 CC(C)(C)SC1CCCC1 62a_100000211941_100000179811 [0,0,0,1,0,0|2,0,1]=4 821 B10R1.281 CC(C)(C)SC1CCCC1 62a_100011217020_100000211941 [0,0,0,1,0,0|2,0,1]=4 822 B10R1.281 CC(C)(C)SC1CCOC1 62a_100000211941_100000690089 [0,0,0,1,0,0|1,0,2]=4 823 B10R1.281 C[N+](C)(C)CN1CC=CC1 269982a_100015195280_200000036245 [0,0,0,1,0,0|3,0,0]=4 824 B10R1.306 CC(C)(C)NC1(CCC1)C 34a_100000692455_100000210625 [0,0,0,1,0,0|2,0,1]=4 825 B10R1.306 CC(C)(C)OC1(CCC1)C 34a_100000759064_100000210625 [0,0,0,1,0,0|2,0,1]=4 826 B10R1.373 CC(NC(C)(C)C)C1CC1 34a_100000700016_100000210625 [0,0,0,1,0,0|2,0,1]=4 827 B10R1.373 CC(OC(C)(C)C)C1CC1 34a_100000744524_100000210625 [0,0,0,1,0,0|2,0,1]=4 828 B10R1.373 CN(CC(C)(C)C)C1CC1 269982a_100000742839_100000211595 [0,0,0,1,0,0|2,0,1]=4 829 B10R1.373 CN(CC(C)(C)C)C1CC1 270004a_100000226674_100011204126 [0,0,0,1,0,0|2,0,1]=4 830 B10R1.400 C=CCC(=O)[C@H]1CC1(C)C 1458a_100000692687_100000210623 [0,0,0,1,0,0|2,0,1]=4 831 B8R0.14 C#CCN(C)C(C)(C)C 34a_100000225692_100000210625 [0,0,0,0,1,0|2,0,1]=4 832 B8R0.14 C=CCC(=O)C(C)(C)C 1458a_106744555173_100000210623 [0,0,0,0,1,0|2,0,1]=4 833 B8R0.14 C=CCN(C)C(C)(C)C 2230a_100025770937_200000210301 [0,0,0,0,1,0|2,0,0]=3 834 B8R0.14 C=CCN(C)C(C)(C)C 269982a_100000225617_100000210625 [0,0,0,0,1,0|2,0,0]=3 835 B8R0.14 C=CCN(C)C(C)(C)C 269982a_100011215553_100000210623 [0,0,0,0,1,0|2,0,0]=3 836 B8R0.14 C=CCN(C)C(C)(C)C 269982a_100025770937_200000210301 [0,0,0,0,1,0|2,0,0]=3 837 B8R0.14 C=CCN([13CH3])C(C)(C)C 2230a_100025770937_200025704644 [0,0,0,0,1,0|2,0,0]=3 838 B8R0.14 C=CCN([13CH3])C(C)(C)C 269982a_100025770937_200025704644 [0,0,0,0,1,0|2,0,0]=3 839 B8R0.14 CC(C)(C)N([13CH3])CCO 2230a_100011215626_200025704644 [0,0,0,0,1,0|1,0,2]=4 840 B8R0.14 CC(C)(C)N([13CH3])CCO 269982a_100011215626_200025704644 [0,0,0,0,1,0|1,0,2]=4 841 B8R0.14 CCCN(C)C(C)(C)C 2230a_100000743177_200000210301 [0,0,0,0,1,0|2,0,1]=4 842 B8R0.14 CCCN(C)C(C)(C)C 269982a_100000743177_200000210301 [0,0,0,0,1,0|2,0,1]=4 843 B8R0.14 CCCN(C)C(C)(C)C 269982a_100000747261_100000210625 [0,0,0,0,1,0|2,0,1]=4 844 B8R0.14 CCCN(C)C(C)(C)C 269982a_100011215553_100000210303 [0,0,0,0,1,0|2,0,1]=4 845 B8R0.14 CCCN([13CH3])C(C)(C)C 2230a_100000743177_200025704644 [0,0,0,0,1,0|2,0,1]=4 846 B8R0.14 CCCN([13CH3])C(C)(C)C 269982a_100000743177_200025704644 [0,0,0,0,1,0|2,0,1]=4 847 B8R0.14 CCN[C@H](C)C(C)(C)C 2230a_100025703359_100000210202 [0,0,0,0,1,0|2,0,1]=4 848 B8R0.14 CN(CC#N)C(C)(C)C 269982a_100011215553_100011214920 [0,0,0,0,1,0|2,0,1]=4 849 B8R0.14 CN(CC=O)C(C)(C)C 269982a_100011215553_200015260668 [0,0,0,0,1,0|1,0,0]=2 850 B8R0.14 CN(CCF)C(C)(C)C 269982a_100011215553_100011217306 [0,0,0,0,1,0|2,0,1]=4 851 B8R0.14 CN(CCO)C(C)(C)C 2230a_100011215626_200000210301 [0,0,0,0,1,0|1,0,2]=4 852 B8R0.14 CN(CCO)C(C)(C)C 269982a_100000210263_100000210625 [0,0,0,0,1,0|1,0,2]=4 853 B8R0.14 CN(CCO)C(C)(C)C 269982a_100011215553_100000211926 [0,0,0,0,1,0|1,0,2]=4 854 B8R0.14 CN(CCO)C(C)(C)C 269982a_100011215626_200000210301 [0,0,0,0,1,0|1,0,2]=4 855 B8R0.14 COCN(C)C(C)(C)C 269982a_100011215553_100000766300 [0,0,0,0,1,0|3,0,0]=4 856 B8R0.14 CSCN(C)C(C)(C)C 269982a_100011215553_100011218213 [0,0,0,0,1,0|3,0,0]=4 857 B10R0.109 C#CCC(C)OCC(C)(C)C 34a_100000685586_100011219605 [0,0,0,0,0,1|1,0,1]=3 858 B10R0.109 C#CCC(C)OCC(C)(C)F 34a_100000685586_100011997219 [0,0,0,0,0,1|2,0,1]=4 859 B10R0.109 C#CCC(C)OCC(C)(C)O 34a_100000685586_100000764493 [0,0,0,0,0,1|2,0,1]=4 860 B10R0.109 C#CCC(C)OCC(C)(C)O 7a_100000685586_100000764493 [0,0,0,0,0,1|2,0,1]=4 861 B10R0.109 C#CCC(C)OC[Si](C)(C)C 7a_100000685586_100000233785 [0,0,0,0,0,1|1,1,1]=4 862 B10R0.109 C#CCN(C)CCC(C)(C)C 2230a_100000225692_100000755188 [0,0,0,0,0,1|2,0,1]=4 863 B10R0.109 C#CCN(C)CCC(C)(C)C 34a_100000225692_100000755188 [0,0,0,0,0,1|2,0,1]=4 864 B10R0.109 C/C=C/C(C)OCC(C)(C)C 34a_200102604097_100011219605 [0,0,0,0,0,1|1,0,1]=3 865 B10R0.109 C/C=C/C(C)OCC(C)(C)F 34a_200102604097_100011997219 [0,0,0,0,0,1|2,0,1]=4 866 B10R0.109 C/C=C/C(C)OCC(C)(C)O 34a_200102604097_100000764493 [0,0,0,0,0,1|2,0,1]=4 867 B10R0.109 C=CCC(=O)CCC(C)(C)C 1458a_100000210193_100000755188 [0,0,0,0,0,1|2,0,1]=4 868 B10R0.109 C=CCC(=O)CCC(C)(C)C 1458a_100000757465_100000210623 [0,0,0,0,0,1|2,0,1]=4 869 B10R0.109 C=CCC(=O)COC(C)(C)C 1458a_100000686494_100000210623 [0,0,0,0,0,1|2,0,1]=4 870 B10R0.109 C=CCC(=O)NCC(C)(C)C 11a_100000743828_100000210193 [0,0,0,0,0,1|2,0,1]=4 871 B10R0.109 C=CCC(=O)NCC(C)(C)C 1626a_100000743828_100000210193 [0,0,0,0,0,1|2,0,1]=4 872 B10R0.109 C=CCC(=O)NCC(C)(C)C 240690a_100000743828_100000210193 [0,0,0,0,0,1|2,0,1]=4 873 B10R0.109 C=CCC(=O)NCC(C)(C)C 527a_100000743828_100000210193 [0,0,0,0,0,1|2,0,1]=4 874 B10R0.109 C=CCC(C)COC(C)(C)C 34a_100009832082_100000210625 [0,0,0,0,0,1|1,0,0]=2 875 B10R0.109 C=CCN(C)CCC(C)(C)C 2230a_100000225617_100000755188 [0,0,0,0,0,1|2,0,0]=3 876 B10R0.109 C=CCN(C)CCC(C)(C)C 269982a_100000225617_100000755188 [0,0,0,0,0,1|2,0,0]=3 877 B10R0.109 C=CCN(C)CCC(C)(C)O 2230a_100000225617_100000702414 [0,0,0,0,0,1|3,0,0]=4 878 B10R0.109 C=CCN(C)CC[N+](C)(C)C 269982a_100000225617_100000085578 [0,0,0,0,0,1|3,0,0]=4 879 B10R0.109 C=CCN(C)CC[Si](C)(C)C 2230a_100000225617_200000733723 [0,0,0,0,0,1|2,1,0]=4 880 B10R0.109 C=CCN(C)CC[Si](C)(C)C 269982a_100000225617_200000733723 [0,0,0,0,0,1|2,1,0]=4 881 B10R0.109 C=CC[C@@H](C)OCC(C)(C)C 34a_100000731007_100011219605 [0,0,0,0,0,1|1,0,0]=2 882 B10R0.109 C=CC[C@@H](C)OCC(C)(C)F 34a_100000731007_100011997219 [0,0,0,0,0,1|2,0,0]=3 883 B10R0.109 C=CC[C@@H](C)OCC(C)(C)O 34a_100000731007_100000764493 [0,0,0,0,0,1|2,0,0]=3 884 B10R0.109 C=CC[C@@H](C)OCC(C)(C)O 7a_100000731007_100000764493 [0,0,0,0,0,1|2,0,0]=3 885 B10R0.109 C=CC[C@@H](C)OC[Si](C)(C)C 7a_100000731007_100000233785 [0,0,0,0,0,1|1,1,0]=3 886 B10R0.109 C=CC[C@@H](N)COC(C)(C)C 34a_100020615467_100000210625 [0,0,0,0,0,1|2,0,0]=3 887 B10R0.109 CC#CC(C)OCC(C)(C)C 34a_100011216543_100011219605 [0,0,0,0,0,1|1,0,2]=4 888 B10R0.109 CC(C)(C)NC[C@@H](O)CC#N 2230a_100000715429_100000001066 [0,0,0,0,0,1|2,0,1]=4 889 B10R0.109 CC(C)(C)OC[C@@H](O)CC#N 7a_100015890283_100000001066 [0,0,0,0,0,1|2,0,1]=4 890 B10R0.109 CC(C)(C)SC[C@@H](O)CC#N 62a_100000001066_100000211941 [0,0,0,0,0,1|2,0,1]=4 891 B10R0.109 CC(C)(C)SC[C@@H](O)CC#N 62a_100000211941_100000001066 [0,0,0,0,0,1|2,0,1]=4 892 B10R0.109 CC(CC#N)NCC(C)(C)C 2230a_100000743828_100009813641 [0,0,0,0,0,1|1,0,1]=3 893 B10R0.109 CC(CC#N)NCC(C)(C)F 2230a_100020643315_100009813641 [0,0,0,0,0,1|2,0,1]=4 894 B10R0.109 CC(CC#N)NCC(C)(C)O 2230a_100000751335_100009813641 [0,0,0,0,0,1|2,0,1]=4 895 B10R0.109 CC(CC#N)SCC(C)(C)C 62a_100009813641_100011219605 [0,0,0,0,0,1|1,0,1]=3 896 B10R0.109 CC(CC#N)SCC(C)(C)C 62a_100011219605_100009813641 [0,0,0,0,0,1|1,0,1]=3 897 B10R0.109 CC(CC#N)SCC(C)(C)F 62a_100009813641_100011997219 [0,0,0,0,0,1|2,0,1]=4 898 B10R0.109 CC(CC#N)SCC(C)(C)F 62a_100011997219_100009813641 [0,0,0,0,0,1|2,0,1]=4 899 B10R0.109 CC(CC#N)SCC(C)(C)O 62a_100000764493_100009813641 [0,0,0,0,0,1|2,0,1]=4 900 B10R0.109 CC(CC#N)SCC(C)(C)O 62a_100009813641_100000764493 [0,0,0,0,0,1|2,0,1]=4 901 B10R0.109 CC(CC#N)SC[N+](C)(C)C 62a_100009813641_200000036245 [0,0,0,0,0,1|2,0,1]=4 902 B10R0.109 CC(CC#N)SC[N+](C)(C)C 62a_200000036245_100009813641 [0,0,0,0,0,1|2,0,1]=4 903 B10R0.109 CC(CC#N)SC[Si](C)(C)C 62a_100000037933_100009813641 [0,0,0,0,0,1|1,1,1]=4 904 B10R0.109 CC(CC#N)SC[Si](C)(C)C 62a_100009813641_100000037933 [0,0,0,0,0,1|1,1,1]=4 905 B10R0.109 CC(CCBr)OCC(C)(C)C 34a_100012276601_100011219605 [0,0,0,0,0,1|1,0,1]=3 906 B10R0.109 CC(CCBr)OCC(C)(C)F 34a_100012276601_100011997219 [0,0,0,0,0,1|2,0,1]=4 907 B10R0.109 CC(CCBr)OCC(C)(C)O 34a_100012276601_100000764493 [0,0,0,0,0,1|2,0,1]=4 908 B10R0.109 CC(CCN)COC(C)(C)C 34a_106354213184_100000210625 [0,0,0,0,0,1|1,0,1]=3 909 B10R0.109 CC(CCO)NCC(C)(C)C 2230a_100000743828_100009893172 [0,0,0,0,0,1|0,0,2]=3 910 B10R0.109 CC(CCO)NCC(C)(C)F 2230a_100020643315_100009893172 [0,0,0,0,0,1|1,0,2]=4 911 B10R0.109 CC(CCO)NCC(C)(C)O 2230a_100000751335_100009893172 [0,0,0,0,0,1|1,0,2]=4 912 B10R0.109 CC(CCO)OCC(C)(C)F 34a_100000716592_100009893172 [0,0,0,0,0,1|1,0,2]=4 913 B10R0.109 CC(CCO)SCC(C)(C)C 62a_100009893172_100011219605 [0,0,0,0,0,1|0,0,2]=3 914 B10R0.109 CC(CCO)SCC(C)(C)C 62a_100011219605_100009893172 [0,0,0,0,0,1|0,0,2]=3 915 B10R0.109 CC(CCO)SCC(C)(C)F 62a_100009893172_100011997219 [0,0,0,0,0,1|1,0,2]=4 916 B10R0.109 CC(CCO)SCC(C)(C)F 62a_100011997219_100009893172 [0,0,0,0,0,1|1,0,2]=4 917 B10R0.109 CC(CCO)SCC(C)(C)O 62a_100000764493_100009893172 [0,0,0,0,0,1|1,0,2]=4 918 B10R0.109 CC(CCO)SCC(C)(C)O 62a_100009893172_100000764493 [0,0,0,0,0,1|1,0,2]=4 919 B10R0.109 CC(CCO)SC[N+](C)(C)C 62a_100009893172_200000036245 [0,0,0,0,0,1|1,0,2]=4 920 B10R0.109 CC(CCO)SC[N+](C)(C)C 62a_200000036245_100009893172 [0,0,0,0,0,1|1,0,2]=4 921 B10R0.109 CC(CCO)SC[Si](C)(C)C 62a_100000037933_100009893172 [0,0,0,0,0,1|0,1,2]=4 922 B10R0.109 CC(CCO)SC[Si](C)(C)C 62a_100009893172_100000037933 [0,0,0,0,0,1|0,1,2]=4 923 B10R0.109 CC(COC(C)(C)C)OCF 7a_100011215624_100015361967 [0,0,0,0,0,1|2,0,1]=4 924 B10R0.109 CCCC(C)CNC(C)(C)C 2230a_100000715429_100011216630 [0,0,0,0,0,1|1,0,1]=3 925 B10R0.109 CCCC(C)COC(C)(C)C 34a_100000688023_100000210625 [0,0,0,0,0,1|1,0,1]=3 926 B10R0.109 CCCC(C)COC(C)(C)C 34a_100015890283_100011216630 [0,0,0,0,0,1|1,0,1]=3 927 B10R0.109 CCCC(C)COC(C)(C)C 7a_100015890283_100011216630 [0,0,0,0,0,1|1,0,1]=3 928 B10R0.109 CCCC(C)CSC(C)(C)C 62a_100000211941_100011216630 [0,0,0,0,0,1|1,0,1]=3 929 B10R0.109 CCCC(C)CSC(C)(C)C 62a_100011216630_100000211941 [0,0,0,0,0,1|1,0,1]=3 930 B10R0.109 CCCC(C)NCC(C)(C)C 2230a_100000743828_100000766640 [0,0,0,0,0,1|1,0,1]=3 931 B10R0.109 CCCC(C)NCC(C)(C)C 270004a_100000741246_100011204126 [0,0,0,0,0,1|1,0,1]=3 932 B10R0.109 CCCC(C)NCC(C)(C)C 270004a_100000743828_100000211909 [0,0,0,0,0,1|1,0,1]=3 933 B10R0.109 CCCC(C)NCC(C)(C)F 2230a_100020643315_100000766640 [0,0,0,0,0,1|2,0,1]=4 934 B10R0.109 CCCC(C)NCC(C)(C)F 270004a_100020643315_100000211909 [0,0,0,0,0,1|2,0,1]=4 935 B10R0.109 CCCC(C)NCC(C)(C)O 2230a_100000751335_100000766640 [0,0,0,0,0,1|2,0,1]=4 936 B10R0.109 CCCC(C)NCC(C)(C)O 270004a_100000751335_100000211909 [0,0,0,0,0,1|2,0,1]=4 937 B10R0.109 CCCC(C)NC[Si](C)(C)C 2230a_100000741246_100000037933 [0,0,0,0,0,1|1,1,1]=4 938 B10R0.109 CCCC(C)OCC(C)(C)C 34a_100000764384_100011219605 [0,0,0,0,0,1|1,0,1]=3 939 B10R0.109 CCCC(C)OCC(C)(C)F 34a_100000716592_100000766640 [0,0,0,0,0,1|2,0,1]=4 940 B10R0.109 CCCC(C)OCC(C)(C)F 34a_100000764384_100011997219 [0,0,0,0,0,1|2,0,1]=4 941 B10R0.109 CCCC(C)OCC(C)(C)O 34a_100000764384_100000764493 [0,0,0,0,0,1|2,0,1]=4 942 B10R0.109 CCCC(C)OCC(C)(C)O 7a_100000764384_100000764493 [0,0,0,0,0,1|2,0,1]=4 943 B10R0.109 CCCC(C)OC[Si](C)(C)C 7a_100000764384_100000233785 [0,0,0,0,0,1|1,1,1]=4 944 B10R0.109 CCCC(C)SCC(C)(C)C 62a_100000766640_100011219605 [0,0,0,0,0,1|1,0,1]=3 945 B10R0.109 CCCC(C)SCC(C)(C)C 62a_100011219605_100000766640 [0,0,0,0,0,1|1,0,1]=3 946 B10R0.109 CCCC(C)SCC(C)(C)F 62a_100000766640_100011997219 [0,0,0,0,0,1|2,0,1]=4 947 B10R0.109 CCCC(C)SCC(C)(C)F 62a_100011997219_100000766640 [0,0,0,0,0,1|2,0,1]=4 948 B10R0.109 CCCC(C)SCC(C)(C)O 62a_100000764493_100000766640 [0,0,0,0,0,1|2,0,1]=4 949 B10R0.109 CCCC(C)SCC(C)(C)O 62a_100000766640_100000764493 [0,0,0,0,0,1|2,0,1]=4 950 B10R0.109 CCCC(C)SC[N+](C)(C)C 62a_100000766640_200000036245 [0,0,0,0,0,1|2,0,1]=4 951 B10R0.109 CCCC(C)SC[N+](C)(C)C 62a_200000036245_100000766640 [0,0,0,0,0,1|2,0,1]=4 952 B10R0.109 CCCC(C)SC[Si](C)(C)C 62a_100000037933_100000766640 [0,0,0,0,0,1|1,1,1]=4 953 B10R0.109 CCCC(C)SC[Si](C)(C)C 62a_100000766640_100000037933 [0,0,0,0,0,1|1,1,1]=4 954 B10R0.109 CCCN(C)CCC(C)(C)C 2230a_100000747261_100000755188 [0,0,0,0,0,1|2,0,1]=4 955 B10R0.109 CCCN(C)CCC(C)(C)C 269982a_100000747261_100000755188 [0,0,0,0,0,1|2,0,1]=4 956 B10R0.109 CCC[C@H](N)COC(C)(C)C 34a_100000732646_100000210625 [0,0,0,0,0,1|2,0,1]=4 957 B10R0.109 CCNC(C)CSC(C)(C)C 270004a_100015525214_100000175412 [0,0,0,0,0,1|2,0,1]=4 958 B10R0.109 CCOC(C)COC(C)(C)C 7a_100011215624_100000210202 [0,0,0,0,0,1|2,0,1]=4 959 B10R0.109 CN(CC#N)CCC(C)(C)C 2230a_100000748184_100000755188 [0,0,0,0,0,1|2,0,1]=4 960 B10R0.109 CN(CCO)CCC(C)(C)C 2230a_100000210263_100000755188 [0,0,0,0,0,1|1,0,2]=4 961 B10R0.109 CN(CCO)CCC(C)(C)C 269982a_100000210263_100000755188 [0,0,0,0,0,1|1,0,2]=4 962 B10R0.109 COCC(C)NCC(C)(C)C 2230a_100000743828_100000765312 [0,0,0,0,0,1|2,0,0]=3 963 B10R0.109 COCC(C)NCC(C)(C)C 270004a_100000743828_100000749346 [0,0,0,0,0,1|2,0,0]=3 964 B10R0.109 COCC(C)NCC(C)(C)F 2230a_100020643315_100000765312 [0,0,0,0,0,1|3,0,0]=4 965 B10R0.109 COCC(C)NCC(C)(C)F 270004a_100020643315_100000749346 [0,0,0,0,0,1|3,0,0]=4 966 B10R0.109 COCC(C)NCC(C)(C)O 2230a_100000751335_100000765312 [0,0,0,0,0,1|3,0,0]=4 967 B10R0.109 COCC(C)NCC(C)(C)O 270004a_100000751335_100000749346 [0,0,0,0,0,1|3,0,0]=4 968 B10R0.109 COCC(C)OCC(C)(C)F 34a_100000716592_100000765312 [0,0,0,0,0,1|3,0,0]=4 969 B10R0.109 COCC(C)SCC(C)(C)C 62a_100000765312_100011219605 [0,0,0,0,0,1|2,0,0]=3 970 B10R0.109 COCC(C)SCC(C)(C)C 62a_100011219605_100000765312 [0,0,0,0,0,1|2,0,0]=3 971 B10R0.109 COCC(C)SCC(C)(C)F 62a_100000765312_100011997219 [0,0,0,0,0,1|3,0,0]=4 972 B10R0.109 COCC(C)SCC(C)(C)F 62a_100011997219_100000765312 [0,0,0,0,0,1|3,0,0]=4 973 B10R0.109 COCC(C)SCC(C)(C)O 62a_100000764493_100000765312 [0,0,0,0,0,1|3,0,0]=4 974 B10R0.109 COCC(C)SCC(C)(C)O 62a_100000765312_100000764493 [0,0,0,0,0,1|3,0,0]=4 975 B10R0.109 COCC(C)SC[N+](C)(C)C 62a_100000765312_200000036245 [0,0,0,0,0,1|3,0,0]=4 976 B10R0.109 COCC(C)SC[N+](C)(C)C 62a_200000036245_100000765312 [0,0,0,0,0,1|3,0,0]=4 977 B10R0.109 COCC(C)SC[Si](C)(C)C 62a_100000037933_100000765312 [0,0,0,0,0,1|2,1,0]=4 978 B10R0.109 COCC(C)SC[Si](C)(C)C 62a_100000765312_100000037933 [0,0,0,0,0,1|2,1,0]=4 979 B10R0.109 COCC(N)COC(C)(C)C 34a_100000724102_100000210625 [0,0,0,0,0,1|3,0,0]=4 980 B10R0.109 COCC(O)CNC(C)(C)C 34a_100000756049_100000210625 [0,0,0,0,0,1|3,0,0]=4 981 B10R0.109 COCC(O)COC(C)(C)C 34a_100015890283_100011215053 [0,0,0,0,0,1|3,0,0]=4 982 B10R0.109 COCC(O)COC(C)(C)C 7a_100015890283_100011215053 [0,0,0,0,0,1|3,0,0]=4 983 B10R0.109 COCC(O)CSC(C)(C)C 62a_100000211941_100011215053 [0,0,0,0,0,1|3,0,0]=4 984 B10R0.109 COCC(O)CSC(C)(C)C 62a_100011215053_100000211941 [0,0,0,0,0,1|3,0,0]=4 985 B10R0.109 COC[C@@H](C)NCC(C)(C)C 270004a_100000764878_100011204126 [0,0,0,0,0,1|2,0,0]=3 986 B10R0.109 COC[C@@H](C)NC[Si](C)(C)C 2230a_100000764878_100000037933 [0,0,0,0,0,1|2,1,0]=4 987 B10R0.109 COC[C@@H](C)OCC(C)(C)C 34a_100011934205_100011219605 [0,0,0,0,0,1|2,0,0]=3 988 B10R0.109 COC[C@@H](C)OCC(C)(C)F 34a_100011934205_100011997219 [0,0,0,0,0,1|3,0,0]=4 989 B10R0.109 COC[C@@H](C)OCC(C)(C)O 34a_100011934205_100000764493 [0,0,0,0,0,1|3,0,0]=4 990 B10R0.109 CSCC(C)NCC(C)(C)C 270004a_100000743828_100011216314 [0,0,0,0,0,1|2,0,0]=3 991 B10R0.109 CSCC(C)NCC(C)(C)F 270004a_100020643315_100011216314 [0,0,0,0,0,1|3,0,0]=4 992 B10R0.109 CSCC(C)NCC(C)(C)O 270004a_100000751335_100011216314 [0,0,0,0,0,1|3,0,0]=4 993 B10R0.109 C[C@@H](CC#N)NC[Si](C)(C)C 2230a_100016994482_100000037933 [0,0,0,0,0,1|1,1,1]=4 994 B10R0.109 C[C@H](CCO)NCC(C)(C)C 270004a_100000706166_100011204126 [0,0,0,0,0,1|0,0,2]=3 995 B10R0.109 C[C@H](CCO)NCC(C)(C)C 34a_100000706166_100011219605 [0,0,0,0,0,1|0,0,2]=3 996 B10R0.109 C[C@H](CCO)NCC(C)(C)F 34a_100000706166_100011997219 [0,0,0,0,0,1|1,0,2]=4 997 B10R0.109 C[C@H](CCO)NCC(C)(C)O 34a_100000706166_100000764493 [0,0,0,0,0,1|1,0,2]=4 998 B10R0.109 C[C@H](CCO)NC[Si](C)(C)C 2230a_100000706166_100000037933 [0,0,0,0,0,1|0,1,2]=4 999 B7R0.2 C=CC(C)OC(C)C 34a_100000695699_100000210206 [2,0,0,0,0,0|1,0,1]=4 1000 B7R0.2 C=CC(C)SC(C)C 62a_100011215867_100000210206 [2,0,0,0,0,0|1,0,1]=4 1001 B7R0.2 CC(C)CC(C)N[13CH3] 2230a_100000692259_200025704644 [2,0,0,0,0,0|1,0,1]=4 1002 B7R0.2 CC(C)CC(C)O[13CH3] 34a_100000211805_200025704644 [2,0,0,0,0,0|1,0,1]=4 1003 B7R0.2 CC(C)CC(C)O[13CH3] 7a_100000211805_200025704644 [2,0,0,0,0,0|1,0,1]=4 1004 B7R0.2 CC(C)CC(C)S[13CH3] 62a_100000731052_200025704644 [2,0,0,0,0,0|1,0,1]=4 1005 B7R0.2 CC(C)CC(C)S[13CH3] 62a_200025704644_100000731052 [2,0,0,0,0,0|1,0,1]=4 1006 B7R0.2 CC(C)CN(C)CF 269982a_100000747067_100015361967 [2,0,0,0,0,0|2,0,0]=4 1007 B7R0.2 CC(C)NC(C)CO 2230a_100138425928_100012180447 [2,0,0,0,0,0|1,0,1]=4 1008 B7R0.2 CC(C)NC(C)CO 34a_100138425928_100012180447 [2,0,0,0,0,0|1,0,1]=4 1009 B7R0.2 CC(C)N[C@H](C)CO 2230a_100000737577_100000210206 [2,0,0,0,0,0|1,0,1]=4 1010 B7R0.2 CC(C)OC(C)CF 34a_100016041109_100000210206 [2,0,0,0,0,0|2,0,0]=4 1011 B7R0.2 CC(C)OC(C)CF 7a_100016041109_100000210206 [2,0,0,0,0,0|2,0,0]=4 1012 B7R0.2 CC(C)OC(C)CN 34a_100000210904_100000210206 [2,0,0,0,0,0|2,0,0]=4 1013 B7R0.2 CC(C)OC(C)CO 34a_100000212225_100012180447 [2,0,0,0,0,0|1,0,1]=4 1014 B7R0.2 CC(C)SC(C)CO 62a_100012180447_100000210206 [2,0,0,0,0,0|1,0,1]=4 1015 B7R0.2 CC(C)S[C@H](C)CO 62a_100000210206_100016084084 [2,0,0,0,0,0|1,0,1]=4 1016 B7R0.2 CC(C)S[C@H](C)CO 62a_100016084084_100000210206 [2,0,0,0,0,0|1,0,1]=4 1017 B7R0.2 CCC(C)CN(C)C 2230a_100000753921_200000210301 [2,0,0,0,0,0|1,0,1]=4 1018 B7R0.2 CCC(C)CN(C)C 2230a_100102631434_100000748023 [2,0,0,0,0,0|1,0,1]=4 1019 B7R0.2 CCC(C)CN(C)C 269982a_100000753921_200000210301 [2,0,0,0,0,0|1,0,1]=4 1020 B7R0.2 CCC(C)CN(C)C 269982a_100102631434_100000748023 [2,0,0,0,0,0|1,0,1]=4 1021 B7R0.2 CCC(C)CN(C)C 270004a_100102631434_100000243153 [2,0,0,0,0,0|1,0,1]=4 1022 B7R0.2 CCC(C)CN(C)[13CH3] 2230a_100000753921_200025704644 [2,0,0,0,0,0|1,0,1]=4 1023 B7R0.2 CCC(C)CN(C)[13CH3] 269982a_100000753921_200025704644 [2,0,0,0,0,0|1,0,1]=4 1024 B7R0.2 CCC(C)NC(C)C 2230a_100000209981_100000210206 [2,0,0,0,0,0|1,0,1]=4 1025 B7R0.2 CCC(C)NC(C)C 2230a_100138425928_100000758301 [2,0,0,0,0,0|1,0,1]=4 1026 B7R0.2 CCC(C)NC(C)C 34a_100138425928_100011215416 [2,0,0,0,0,0|1,0,1]=4 1027 B7R0.2 CCC(C)OC(C)C 34a_100000212225_100011215416 [2,0,0,0,0,0|1,0,1]=4 1028 B7R0.2 CCC(C)OC(C)C 7a_100000210228_100000210206 [2,0,0,0,0,0|1,0,1]=4 1029 B7R0.2 CCC(C)SC(C)C 62a_100000210206_100000758301 [2,0,0,0,0,0|1,0,1]=4 1030 B7R0.2 CCC(C)SC(C)C 62a_100000758301_100000210206 [2,0,0,0,0,0|1,0,1]=4 1031 B7R0.2 CCN(C)CC(C)C 2230a_100000225621_100000210760 [2,0,0,0,0,0|1,0,1]=4 1032 B7R0.2 CCN(C)CC(C)C 2230a_100000738554_200000210301 [2,0,0,0,0,0|1,0,1]=4 1033 B7R0.2 CCN(C)CC(C)C 2230a_100000747067_100000210202 [2,0,0,0,0,0|1,0,1]=4 1034 B7R0.2 CCN(C)CC(C)C 269982a_100000225621_100000210624 [2,0,0,0,0,0|1,0,1]=4 1035 B7R0.2 CCN(C)CC(C)C 269982a_100000738554_200000210301 [2,0,0,0,0,0|1,0,1]=4 1036 B7R0.2 CCN(C)CC(C)C 269982a_100000747067_100000204670 [2,0,0,0,0,0|1,0,1]=4 1037 B7R0.2 CCN([13CH3])CC(C)C 2230a_100000738554_200025704644 [2,0,0,0,0,0|1,0,1]=4 1038 B7R0.2 CCN([13CH3])CC(C)C 269982a_100000738554_200025704644 [2,0,0,0,0,0|1,0,1]=4 1039 B7R0.2 CC[C@H](C)CN(C)C 2230a_100102631434_100009816398 [2,0,0,0,0,0|1,0,1]=4 1040 B7R0.2 CC[C@H](C)CN(C)C 269982a_100102631434_100009816398 [2,0,0,0,0,0|1,0,1]=4 1041 B7R0.2 CNC(C)CC(C)C 2230a_100000692259_200000210301 [2,0,0,0,0,0|1,0,1]=4 1042 B7R0.2 CNC(C)CC(C)C 2230a_106832991635_100000731052 [2,0,0,0,0,0|1,0,1]=4 1043 B7R0.2 CNC(C)CC(C)C 34a_100102657272_100000731052 [2,0,0,0,0,0|1,0,1]=4 1044 B7R0.2 CNC(C)CC(C)C 7a_106832991635_100000731052 [2,0,0,0,0,0|1,0,1]=4 1045 B7R0.2 COC(C)CC(C)C 34a_100000211805_200000210301 [2,0,0,0,0,0|1,0,1]=4 1046 B7R0.2 COC(C)CC(C)C 34a_100138415774_100000731052 [2,0,0,0,0,0|1,0,1]=4 1047 B7R0.2 COC(C)CC(C)C 7a_100000211805_200000210301 [2,0,0,0,0,0|1,0,1]=4 1048 B7R0.2 CSC(C)CC(C)C 62a_100000731052_200000210301 [2,0,0,0,0,0|1,0,1]=4 1049 B7R0.2 CSC(C)CC(C)C 62a_200000210301_100000731052 [2,0,0,0,0,0|1,0,1]=4 1050 B7R0.2 C[C@@H](CO)CN(C)C 2230a_100102631434_100000059175 [2,0,0,0,0,0|1,0,1]=4 1051 B7R0.2 C[C@@H](CO)CN(C)C 269982a_100102631434_100000059175 [2,0,0,0,0,0|1,0,1]=4 1052 B7R0.4 C=CCCCN(C)C 2230a_100102631434_100011713584 [2,0,0,0,0,0|2,0,0]=4 1053 B7R0.4 C=CCCCN(C)C 269982a_100102631434_100000757094 [2,0,0,0,0,0|2,0,0]=4 1054 B7R0.4 C=CCCNC(C)C 2230a_100015191253_100000210206 [2,0,0,0,0,0|2,0,0]=4 1055 B7R0.4 C=CCCNC(C)C 2230a_100138425928_100000754431 [2,0,0,0,0,0|2,0,0]=4 1056 B7R0.4 C=CCCNC(C)C 34a_100138425928_100000754431 [2,0,0,0,0,0|2,0,0]=4 1057 B7R0.4 C=CCCOC(C)C 34a_100000212225_100000754431 [2,0,0,0,0,0|2,0,0]=4 1058 B7R0.4 C=CCCOC(C)C 34a_100011205117_100000210206 [2,0,0,0,0,0|2,0,0]=4 1059 B7R0.4 C=CCCSC(C)C 62a_100000210206_100000754431 [2,0,0,0,0,0|2,0,0]=4 1060 B7R0.4 C=CCCSC(C)C 62a_100000754431_100000210206 [2,0,0,0,0,0|2,0,0]=4 1061 B7R0.4 C=CCNCC(C)C 2230a_100000210953_100000210623 [2,0,0,0,0,0|2,0,0]=4 1062 B7R0.4 C=CCNCC(C)C 2230a_100020586998_100000210760 [2,0,0,0,0,0|2,0,0]=4 1063 B7R0.4 C=CCNCC(C)C 270004a_100020586998_100000210432 [2,0,0,0,0,0|2,0,0]=4 1064 B7R0.4 C=CCNCC(C)C 34a_100000210953_100015514636 [2,0,0,0,0,0|2,0,0]=4 1065 B7R0.4 C=CCOCC(C)C 34a_100000210257_100015514636 [2,0,0,0,0,0|2,0,0]=4 1066 B7R0.4 C=CCOCC(C)C 34a_200000210373_100000210624 [2,0,0,0,0,0|2,0,0]=4 1067 B7R0.4 C=CCSCC(C)C 62a_100000210623_100000210760 [2,0,0,0,0,0|2,0,0]=4 1068 B7R0.4 C=CCSCC(C)C 62a_100000210624_100000210623 [2,0,0,0,0,0|2,0,0]=4 1069 B7R0.4 CC(Br)COCC=O 34a_100012180447_200009817547 [2,0,0,0,0,0|2,0,0]=4 1070 B7R0.4 CC(C)CCCN[13CH3] 2230a_200000737386_200025704644 [2,0,0,0,0,0|2,0,0]=4 1071 B7R0.4 CC(C)CCCN[13CH3] 34a_200000737386_200025704644 [2,0,0,0,0,0|2,0,0]=4 1072 B7R0.4 CC(C)CCCO[13CH3] 34a_100000210774_200025704644 [2,0,0,0,0,0|2,0,0]=4 1073 B7R0.4 CC(C)CCCO[13CH3] 7a_100000210774_200025704644 [2,0,0,0,0,0|2,0,0]=4 1074 B7R0.4 CC(C)CCCS[13CH3] 62a_100011214892_200025704644 [2,0,0,0,0,0|2,0,0]=4 1075 B7R0.4 CC(C)CCCS[13CH3] 62a_200025704644_100011214892 [2,0,0,0,0,0|2,0,0]=4 1076 B7R0.4 CC(C)CNCC=O 2230a_100000210953_200015260668 [2,0,0,0,0,0|1,0,0]=3 1077 B7R0.4 CC(C)CNCC=O 34a_100000210953_200009817547 [2,0,0,0,0,0|1,0,0]=3 1078 B7R0.4 CC(C)COCC=O 34a_100000210257_200009817547 [2,0,0,0,0,0|1,0,0]=3 1079 B7R0.4 CC(C)CSCC=O 62a_100000210624_200015260668 [2,0,0,0,0,0|1,0,0]=3 1080 B7R0.4 CC(C)CSCC=O 62a_200015260668_100000210760 [2,0,0,0,0,0|1,0,0]=3 1081 B7R0.4 CC(F)COCC=O 34a_100015925927_200009817547 [2,0,0,0,0,0|2,0,0]=4 1082 B7R0.4 CC(O)CNCC=O 2230a_100000210904_200015260668 [2,0,0,0,0,0|2,0,0]=4 1083 B7R0.4 CC(O)CNCC=O 34a_100000210904_200009817547 [2,0,0,0,0,0|2,0,0]=4 1084 B7R0.4 CC(O)CSCC=O 62a_100011218427_200015260668 [2,0,0,0,0,0|2,0,0]=4 1085 B7R0.4 CC(O)CSCC=O 62a_200015260668_100011218427 [2,0,0,0,0,0|2,0,0]=4 1086 B7R0.4 CN(C)CCCC=O 2230a_100102631434_200011292268 [2,0,0,0,0,0|1,0,0]=3 1087 B7R0.4 CN(C)CCCC=O 269982a_100102631434_200011292268 [2,0,0,0,0,0|1,0,0]=3 1088 B7R0.4 CNCCCC(C)C 2230a_106832991635_100011214892 [2,0,0,0,0,0|2,0,0]=4 1089 B7R0.4 CNCCCC(C)C 2230a_200000737386_200000210301 [2,0,0,0,0,0|2,0,0]=4 1090 B7R0.4 CNCCCC(C)C 34a_100102657272_100011214892 [2,0,0,0,0,0|2,0,0]=4 1091 B7R0.4 CNCCCC(C)C 34a_200000737386_200000210301 [2,0,0,0,0,0|2,0,0]=4 1092 B7R0.4 CNCCCC(C)C 7a_106832991635_100011214892 [2,0,0,0,0,0|2,0,0]=4 1093 B7R0.4 COCCCC(C)C 34a_100000210774_200000210301 [2,0,0,0,0,0|2,0,0]=4 1094 B7R0.4 COCCCC(C)C 34a_100138415774_100011214892 [2,0,0,0,0,0|2,0,0]=4 1095 B7R0.4 COCCCC(C)C 7a_100000210774_200000210301 [2,0,0,0,0,0|2,0,0]=4 1096 B7R0.4 CSCCCC(C)C 62a_100011214892_200000210301 [2,0,0,0,0,0|2,0,0]=4 1097 B7R0.4 CSCCCC(C)C 62a_200000210301_100011214892 [2,0,0,0,0,0|2,0,0]=4 1098 B7R0.4 C[C@@H](Cl)COCC=O 34a_100016084084_200009817547 [2,0,0,0,0,0|2,0,0]=4 1099 B7R0.4 C[C@@H](N)COCC=O 34a_100000737577_200009817547 [2,0,0,0,0,0|2,0,0]=4 1100 B7R0.4 C[C@@H](O)CSCC=O 62a_100009817552_200015260668 [2,0,0,0,0,0|2,0,0]=4 1101 B7R0.4 C[C@@H](O)CSCC=O 62a_200015260668_100009817552 [2,0,0,0,0,0|2,0,0]=4 1102 B7R0.7 C=CCC(C)COC 34a_100009832082_200000210301 [2,0,0,0,0,0|2,0,0]=4 1103 B7R0.7 C=CCC(C)COC 7a_100009832082_200000210301 [2,0,0,0,0,0|2,0,0]=4 1104 B7R0.7 C=CCC(C)CO[13CH3] 34a_100009832082_200025704644 [2,0,0,0,0,0|2,0,0]=4 1105 B7R0.7 C=CCC(C)CO[13CH3] 7a_100009832082_200025704644 [2,0,0,0,0,0|2,0,0]=4 1106 B7R0.7 C=CCN(C)CCC 2230a_100000225617_100000210303 [2,0,0,0,0,0|2,0,0]=4 1107 B7R0.7 C=CCN(C)CCC 2230a_100000747261_100000210623 [2,0,0,0,0,0|2,0,0]=4 1108 B7R0.7 C=CCN(C)CCC 269982a_100000225617_100000210303 [2,0,0,0,0,0|2,0,0]=4 1109 B7R0.7 C=CCN(C)CCC 269982a_100000747261_100000210623 [2,0,0,0,0,0|2,0,0]=4 1110 B7R0.7 C=CC[C@@H](C)OCC 34a_100000731007_100000210202 [2,0,0,0,0,0|2,0,0]=4 1111 B7R0.7 C=CC[C@@H](C)OCC 7a_100000731007_100000210202 [2,0,0,0,0,0|2,0,0]=4 1112 B7R0.7 CCCC(C)CNC 2230a_106832991635_100011216630 [2,0,0,0,0,0|2,0,0]=4 1113 B7R0.7 CCCC(C)CNC 270004a_106832991635_100000243154 [2,0,0,0,0,0|2,0,0]=4 1114 B7R0.7 CCCC(C)CNC 34a_100102657272_100011216630 [2,0,0,0,0,0|2,0,0]=4 1115 B7R0.7 CCCC(C)CNC 7a_106832991635_100011216630 [2,0,0,0,0,0|2,0,0]=4 1116 B7R0.7 CCCC(C)COC 34a_100000688023_200000210301 [2,0,0,0,0,0|2,0,0]=4 1117 B7R0.7 CCCC(C)COC 34a_100138415774_100011216630 [2,0,0,0,0,0|2,0,0]=4 1118 B7R0.7 CCCC(C)COC 7a_100000688023_200000210301 [2,0,0,0,0,0|2,0,0]=4 1119 B7R0.7 CCCC(C)CO[13CH3] 34a_100000688023_200025704644 [2,0,0,0,0,0|2,0,0]=4 1120 B7R0.7 CCCC(C)CO[13CH3] 7a_100000688023_200025704644 [2,0,0,0,0,0|2,0,0]=4 1121 B7R0.7 CCCC(C)CSC 62a_100011216630_200000210301 [2,0,0,0,0,0|2,0,0]=4 1122 B7R0.7 CCCC(C)CSC 62a_200000210301_100011216630 [2,0,0,0,0,0|2,0,0]=4 1123 B7R0.7 CCCC(C)CS[13CH3] 62a_100011216630_200025704644 [2,0,0,0,0,0|2,0,0]=4 1124 B7R0.7 CCCC(C)CS[13CH3] 62a_200025704644_100011216630 [2,0,0,0,0,0|2,0,0]=4 1125 B7R0.7 CCCN(C)CC=O 2230a_100000747261_200015260668 [2,0,0,0,0,0|1,0,0]=3 1126 B7R0.7 CCCN(C)CC=O 269982a_100000747261_200015260668 [2,0,0,0,0,0|1,0,0]=3 1127 B7R0.7 CN(CC=O)CCO 2230a_100000210263_200015260668 [2,0,0,0,0,0|2,0,0]=4 1128 B7R0.7 CN(CC=O)CCO 269982a_100000210263_200015260668 [2,0,0,0,0,0|2,0,0]=4 1129 B7R0.8 C=CCNC(C)(C)C 2230a_100000715429_100000210623 [2,0,0,0,0,0|1,0,1]=4 1130 B7R0.8 C=CCOC(C)(C)C 34a_100015890283_100015514636 [2,0,0,0,0,0|1,0,1]=4 1131 B7R0.8 C=CCOC(C)(C)C 34a_200000210373_100000210625 [2,0,0,0,0,0|1,0,1]=4 1132 B7R0.8 C=CCOC(C)(C)C 7a_100015890283_100015514636 [2,0,0,0,0,0|1,0,1]=4 1133 B7R0.8 C=CCSC(C)(C)C 62a_100000210623_100000211941 [2,0,0,0,0,0|1,0,1]=4 1134 B7R0.8 C=CCSC(C)(C)C 62a_100000211941_100000210623 [2,0,0,0,0,0|1,0,1]=4 1135 B7R0.8 CC(C)(C)CCN[13CH3] 2230a_100000738805_200025704644 [2,0,0,0,0,0|1,0,1]=4 1136 B7R0.8 CC(C)(C)CCO[13CH3] 7a_100000765024_200025704644 [2,0,0,0,0,0|1,0,1]=4 1137 B7R0.8 CC(C)(C)CCS[13CH3] 62a_100000755188_200025704644 [2,0,0,0,0,0|1,0,1]=4 1138 B7R0.8 CC(C)(C)CCS[13CH3] 62a_200025704644_100000755188 [2,0,0,0,0,0|1,0,1]=4 1139 B7R0.8 CC(C)(C)CSCF 62a_100011219605_100015361967 [2,0,0,0,0,0|2,0,0]=4 1140 B7R0.8 CC(C)(C)CSCF 62a_100015361967_100011219605 [2,0,0,0,0,0|2,0,0]=4 1141 B7R0.8 CC(C)(C)NCC=O 2230a_100000715429_200015260668 [2,0,0,0,0,0|1,0,0]=3 1142 B7R0.8 CC(C)(C)NCCF 2230a_100000715429_100011217306 [2,0,0,0,0,0|2,0,0]=4 1143 B7R0.8 CC(C)(C)NCCF 34a_100000724931_100000210625 [2,0,0,0,0,0|2,0,0]=4 1144 B7R0.8 CC(C)(C)NCCO 2230a_100000715429_100000211926 [2,0,0,0,0,0|1,0,1]=4 1145 B7R0.8 CC(C)(C)NCCO 34a_100016990907_100000210625 [2,0,0,0,0,0|1,0,1]=4 1146 B7R0.8 CC(C)(C)OCC=O 34a_100015890283_200009817547 [2,0,0,0,0,0|1,0,0]=3 1147 B7R0.8 CC(C)(C)OCC=O 7a_100015890283_200015260668 [2,0,0,0,0,0|1,0,0]=3 1148 B7R0.8 CC(C)(C)OCCBr 34a_100000211926_100000210625 [2,0,0,0,0,0|2,0,0]=4 1149 B7R0.8 CC(C)(C)OCCF 34a_100015890283_100011217306 [2,0,0,0,0,0|2,0,0]=4 1150 B7R0.8 CC(C)(C)OCCF 7a_100015890283_100011217306 [2,0,0,0,0,0|2,0,0]=4 1151 B7R0.8 CC(C)(C)OCCN 34a_100000210304_100000210625 [2,0,0,0,0,0|2,0,0]=4 1152 B7R0.8 CC(C)(C)OCCO 34a_100015890283_100000211926 [2,0,0,0,0,0|1,0,1]=4 1153 B7R0.8 CC(C)(C)OCCO 7a_100015890283_100000211926 [2,0,0,0,0,0|1,0,1]=4 1154 B7R0.8 CC(C)(C)SCC=O 62a_100000211941_200015260668 [2,0,0,0,0,0|1,0,0]=3 1155 B7R0.8 CC(C)(C)SCC=O 62a_200015260668_100000211941 [2,0,0,0,0,0|1,0,0]=3 1156 B7R0.8 CC(C)(C)SCCF 62a_100000211941_100011217306 [2,0,0,0,0,0|2,0,0]=4 1157 B7R0.8 CC(C)(C)SCCF 62a_100011217306_100000211941 [2,0,0,0,0,0|2,0,0]=4 1158 B7R0.8 CC(C)(C)SCCO 62a_100000211926_100000211941 [2,0,0,0,0,0|1,0,1]=4 1159 B7R0.8 CC(C)(C)SCCO 62a_100000211941_100000211926 [2,0,0,0,0,0|1,0,1]=4 1160 B7R0.8 CCCNC(C)(C)C 2230a_100000715429_100000210303 [2,0,0,0,0,0|1,0,1]=4 1161 B7R0.8 CCCOC(C)(C)C 34a_100000210258_100000210625 [2,0,0,0,0,0|1,0,1]=4 1162 B7R0.8 CCCOC(C)(C)C 34a_100015890283_100000210303 [2,0,0,0,0,0|1,0,1]=4 1163 B7R0.8 CCCOC(C)(C)C 7a_100015890283_100000210303 [2,0,0,0,0,0|1,0,1]=4 1164 B7R0.8 CCCSC(C)(C)C 62a_100000210303_100000211941 [2,0,0,0,0,0|1,0,1]=4 1165 B7R0.8 CCCSC(C)(C)C 62a_100000211941_100000210303 [2,0,0,0,0,0|1,0,1]=4 1166 B7R0.8 CCNCC(C)(C)C 2230a_100000743828_100000210202 [2,0,0,0,0,0|1,0,1]=4 1167 B7R0.8 CCNCC(C)(C)C 270004a_100015525214_100011204126 [2,0,0,0,0,0|1,0,1]=4 1168 B7R0.8 CCOCC(C)(C)C 34a_100121572206_100011219605 [2,0,0,0,0,0|1,0,1]=4 1169 B7R0.8 CCSCC(C)(C)C 62a_100000210202_100011219605 [2,0,0,0,0,0|1,0,1]=4 1170 B7R0.8 CCSCC(C)(C)C 62a_100011219605_100000210202 [2,0,0,0,0,0|1,0,1]=4 1171 B7R0.8 CNCCC(C)(C)C 2230a_100000738805_200000210301 [2,0,0,0,0,0|1,0,1]=4 1172 B7R0.8 CNCCC(C)(C)C 2230a_106832991635_100000755188 [2,0,0,0,0,0|1,0,1]=4 1173 B7R0.8 CNCCC(C)(C)C 34a_100102657272_100000755188 [2,0,0,0,0,0|1,0,1]=4 1174 B7R0.8 CNCCC(C)(C)C 7a_106832991635_100000755188 [2,0,0,0,0,0|1,0,1]=4 1175 B7R0.8 COCCC(C)(C)C 34a_100138415774_100000755188 [2,0,0,0,0,0|1,0,1]=4 1176 B7R0.8 COCCC(C)(C)C 7a_100000765024_200000210301 [2,0,0,0,0,0|1,0,1]=4 1177 B7R0.8 CSCCC(C)(C)C 62a_100000755188_200000210301 [2,0,0,0,0,0|1,0,1]=4 1178 B7R0.8 CSCCC(C)(C)C 62a_200000210301_100000755188 [2,0,0,0,0,0|1,0,1]=4 1179 B7R0.9 CC(=O)CC(C)(C)C 1458a_100000211214_200000210301 [2,0,0,0,0,0|0,0,1]=3 1180 B7R0.9 CC(=O)CC(C)(C)O 1458a_100000693243_200000210301 [2,0,0,0,0,0|1,0,1]=4 1181 B7R0.9 CC(=O)C[N+](C)(C)C 1458a_100000033712_200000210301 [2,0,0,0,0,0|1,0,1]=4 1182 B7R0.9 CC(=O)C[Si](C)(C)C 1458a_100000070787_100000233785 [2,0,0,0,0,0|0,1,1]=4 1183 B7R0.9 CC(=O)C[Si](C)(C)C 1458a_100011218504_200000210301 [2,0,0,0,0,0|0,1,1]=4 1184 B7R0.9 CC(=O)NC(C)(C)C 11a_100000715429_100015343762 [2,0,0,0,0,0|1,0,1]=4 1185 B7R0.9 CC(=O)NC(C)(C)C 1626a_100000715429_100015343762 [2,0,0,0,0,0|1,0,1]=4 1186 B7R0.9 CC(=O)NC(C)(C)C 240690a_100000715429_100015343762 [2,0,0,0,0,0|1,0,1]=4 1187 B7R0.9 CC(=O)NC(C)(C)C 527a_100000715429_100103153847 [2,0,0,0,0,0|1,0,1]=4 1188 B7R0.9 CC(C)(C)CC(=O)[13CH3] 1458a_100000211214_200025704644 [2,0,0,0,0,0|0,0,1]=3 1189 B7R0.9 CC(C)(O)CC(=O)[13CH3] 1458a_100000693243_200025704644 [2,0,0,0,0,0|1,0,1]=4 1190 B7R0.9 CC(C)NC(C)(C)C 2230a_100000715429_100000210206 [2,0,0,0,0,0|1,0,0]=3 1191 B7R0.9 CC(C)NC(C)(C)C 34a_100138425928_100000210625 [2,0,0,0,0,0|1,0,0]=3 1192 B7R0.9 CC(C)OC(C)(C)C 34a_100000212225_100000210625 [2,0,0,0,0,0|1,0,0]=3 1193 B7R0.9 CC(C)OC(C)(C)C 34a_100015890283_100000210206 [2,0,0,0,0,0|1,0,0]=3 1194 B7R0.9 CC(C)OC(C)(C)C 7a_100015890283_100000210206 [2,0,0,0,0,0|1,0,0]=3 1195 B7R0.9 CC(C)SC(C)(C)C 62a_100000210206_100000211941 [2,0,0,0,0,0|1,0,0]=3 1196 B7R0.9 CC(C)SC(C)(C)C 62a_100000211941_100000210206 [2,0,0,0,0,0|1,0,0]=3 1197 B7R0.9 CN(C)CC(C)(C)C 2230a_100000742839_200000210301 [2,0,0,0,0,0|1,0,0]=3 1198 B7R0.9 CN(C)CC(C)(C)C 269982a_100000742839_200000210301 [2,0,0,0,0,0|1,0,0]=3 1199 B7R0.9 CN(C)CC(C)(C)C 270004a_100102631434_100011204126 [2,0,0,0,0,0|1,0,0]=3 1200 B7R0.9 CN(C)CC(C)(C)O 2230a_100000755907_200000210301 [2,0,0,0,0,0|2,0,0]=4 1201 B7R0.9 CN(C)CC(C)(C)O 269982a_100000755907_200000210301 [2,0,0,0,0,0|2,0,0]=4 1202 B7R0.9 CN(C)C[N+](C)(C)C 269982a_100102631434_200000036245 [2,0,0,0,0,0|2,0,0]=4 1203 B7R0.9 CN(C)C[Si](C)(C)C 2230a_100102631434_100000037933 [2,0,0,0,0,0|1,1,0]=4 1204 B7R0.9 CN(C)C[Si](C)(C)C 269982a_200020589227_200000210301 [2,0,0,0,0,0|1,1,0]=4 1205 B7R0.9 CN([13CH3])CC(C)(C)C 2230a_100000742839_200025704644 [2,0,0,0,0,0|1,0,0]=3 1206 B7R0.9 CN([13CH3])CC(C)(C)C 269982a_100000742839_200025704644 [2,0,0,0,0,0|1,0,0]=3 1207 B7R0.9 CN([13CH3])CC(C)(C)O 2230a_100000755907_200025704644 [2,0,0,0,0,0|2,0,0]=4 1208 B7R0.9 CN([13CH3])CC(C)(C)O 269982a_100000755907_200025704644 [2,0,0,0,0,0|2,0,0]=4 1209 B7R0.9 CN([13CH3])C[Si](C)(C)C 269982a_200020589227_200025704644 [2,0,0,0,0,0|1,1,0]=4 1210 B7R0.9 C[N+](C)(C)CC(=O)[13CH3] 1458a_100000033712_200025704644 [2,0,0,0,0,0|1,0,1]=4 1211 B7R0.9 C[Si](C)(C)CC(=O)[13CH3] 1458a_100011218504_200025704644 [2,0,0,0,0,0|0,1,1]=4 1212 B9R0.4 C#CCNC(C)CC(C)C 2230a_100000692259_100000038162 [1,1,0,0,0,0|1,0,1]=4 1213 B9R0.4 C#CCNC(C)CC(C)C 34a_100000212058_100000731052 [1,1,0,0,0,0|1,0,1]=4 1214 B9R0.4 C#CCOC(C)CC(C)C 34a_100000210247_100000731052 [1,1,0,0,0,0|1,0,1]=4 1215 B9R0.4 C#CCOC(C)CC(C)C 34a_100000211805_100000184674 [1,1,0,0,0,0|1,0,1]=4 1216 B9R0.4 C#CCOC(C)CC(C)C 7a_100000211805_100000038162 [1,1,0,0,0,0|1,0,1]=4 1217 B9R0.4 C#CCSC(C)CC(C)C 62a_100000038162_100000731052 [1,1,0,0,0,0|1,0,1]=4 1218 B9R0.4 C/C=C/CN(C)CC(C)C 269982a_100000747067_100102629194 [1,1,0,0,0,0|2,0,0]=4 1219 B9R0.4 C=CCCC(C)OC(C)C 34a_100000765329_100000210206 [1,1,0,0,0,0|2,0,0]=4 1220 B9R0.4 C=CCCC(C)OC(C)C 7a_100000765329_100000210206 [1,1,0,0,0,0|2,0,0]=4 1221 B9R0.4 C=CCCN(C)CC(C)C 2230a_100000747067_100000754431 [1,1,0,0,0,0|2,0,0]=4 1222 B9R0.4 C=CCCN(C)CC(C)C 2230a_100020639649_100000210760 [1,1,0,0,0,0|2,0,0]=4 1223 B9R0.4 C=CCCN(C)CC(C)C 269982a_100000747067_100000754431 [1,1,0,0,0,0|2,0,0]=4 1224 B9R0.4 C=CCCN(C)CC(C)C 269982a_100020639649_100000210624 [1,1,0,0,0,0|2,0,0]=4 1225 B9R0.4 C=CCCN(C)CC(C)C 270004a_100020639649_100000210432 [1,1,0,0,0,0|2,0,0]=4 1226 B9R0.4 C=CCNC(C)CC(C)C 2230a_100000692259_100000210623 [1,1,0,0,0,0|1,0,0]=3 1227 B9R0.4 C=CCNC(C)CC(C)C 2230a_100020586998_100000731052 [1,1,0,0,0,0|1,0,0]=3 1228 B9R0.4 C=CCOC(C)CC(C)C 34a_100000211805_100015514636 [1,1,0,0,0,0|1,0,0]=3 1229 B9R0.4 C=CCOC(C)CC(C)C 34a_200000210373_100000731052 [1,1,0,0,0,0|1,0,0]=3 1230 B9R0.4 C=CCOC(C)CC(C)C 7a_100000211805_100015514636 [1,1,0,0,0,0|1,0,0]=3 1231 B9R0.4 C=CCSC(C)CC(C)C 62a_100000210623_100000731052 [1,1,0,0,0,0|1,0,0]=3 1232 B9R0.4 C=CCSC(C)CC(C)C 62a_100000731052_100000210623 [1,1,0,0,0,0|1,0,0]=3 1233 B9R0.4 C=CCSC(C)CN(C)C 62a_100000210623_100020606517 [1,1,0,0,0,0|2,0,0]=4 1234 B9R0.4 C=CCSC(C)CN(C)C 62a_100020606517_100000210623 [1,1,0,0,0,0|2,0,0]=4 1235 B9R0.4 CC(=CC(C)OCC=O)C 34a_100000717055_200009817547 [1,1,0,0,0,0|0,0,2]=4 1236 B9R0.4 CC(C)CC(C)NCC#N 2230a_100000692259_100011215382 [1,1,0,0,0,0|1,0,1]=4 1237 B9R0.4 CC(C)CC(C)NCC=O 2230a_100000692259_200015260668 [1,1,0,0,0,0|0,0,0]=2 1238 B9R0.4 CC(C)CC(C)NCCF 2230a_100000692259_100011217306 [1,1,0,0,0,0|1,0,1]=4 1239 B9R0.4 CC(C)CC(C)NCCF 34a_100000724931_100000731052 [1,1,0,0,0,0|1,0,1]=4 1240 B9R0.4 CC(C)CC(C)NCCO 2230a_100000692259_100000211926 [1,1,0,0,0,0|0,0,2]=4 1241 B9R0.4 CC(C)CC(C)NCCO 2230a_100016997473_100000731052 [1,1,0,0,0,0|0,0,2]=4 1242 B9R0.4 CC(C)CC(C)NCCO 34a_100016990907_100000731052 [1,1,0,0,0,0|0,0,2]=4 1243 B9R0.4 CC(C)CC(C)OCC#N 7a_100000211805_100011215382 [1,1,0,0,0,0|1,0,1]=4 1244 B9R0.4 CC(C)CC(C)OCC=O 34a_100000211805_200009817547 [1,1,0,0,0,0|0,0,0]=2 1245 B9R0.4 CC(C)CC(C)OCC=O 7a_100000211805_200015260668 [1,1,0,0,0,0|0,0,0]=2 1246 B9R0.4 CC(C)CC(C)OCCBr 34a_100000211926_100000731052 [1,1,0,0,0,0|1,0,1]=4 1247 B9R0.4 CC(C)CC(C)OCCF 34a_100000211805_100011217306 [1,1,0,0,0,0|1,0,1]=4 1248 B9R0.4 CC(C)CC(C)OCCF 7a_100000211805_100011217306 [1,1,0,0,0,0|1,0,1]=4 1249 B9R0.4 CC(C)CC(C)OCCN 34a_100000210304_100000731052 [1,1,0,0,0,0|1,0,1]=4 1250 B9R0.4 CC(C)CC(C)OCCO 34a_100000211805_100000211926 [1,1,0,0,0,0|0,0,2]=4 1251 B9R0.4 CC(C)CC(C)OCCO 7a_100000211805_100000211926 [1,1,0,0,0,0|0,0,2]=4 1252 B9R0.4 CC(C)CC(C)SCC#N 62a_100000731052_100011215382 [1,1,0,0,0,0|1,0,1]=4 1253 B9R0.4 CC(C)CC(C)SCC#N 62a_100011215382_100000731052 [1,1,0,0,0,0|1,0,1]=4 1254 B9R0.4 CC(C)CC(C)SCC=O 62a_100000731052_200015260668 [1,1,0,0,0,0|0,0,0]=2 1255 B9R0.4 CC(C)CC(C)SCC=O 62a_200015260668_100000731052 [1,1,0,0,0,0|0,0,0]=2 1256 B9R0.4 CC(C)CC(C)SCCF 62a_100000731052_100011217306 [1,1,0,0,0,0|1,0,1]=4 1257 B9R0.4 CC(C)CC(C)SCCF 62a_100011217306_100000731052 [1,1,0,0,0,0|1,0,1]=4 1258 B9R0.4 CC(C)CC(C)SCCO 62a_100000211926_100000731052 [1,1,0,0,0,0|0,0,2]=4 1259 B9R0.4 CC(C)CC(C)SCCO 62a_100000731052_100000211926 [1,1,0,0,0,0|0,0,2]=4 1260 B9R0.4 CC(CN(C)C)SCC=O 62a_100020606517_200015260668 [1,1,0,0,0,0|1,0,0]=3 1261 B9R0.4 CC(CN(C)C)SCC=O 62a_200015260668_100020606517 [1,1,0,0,0,0|1,0,0]=3 1262 B9R0.4 CC=CCN(C)CC(C)C 2230a_100000747067_100000070051 [1,1,0,0,0,0|2,0,0]=4 1263 B9R0.4 CCCNC(C)CC(C)C 2230a_100000692259_100000210303 [1,1,0,0,0,0|1,0,1]=4 1264 B9R0.4 CCCOC(C)CC(C)C 34a_100000210258_100000731052 [1,1,0,0,0,0|1,0,1]=4 1265 B9R0.4 CCCOC(C)CC(C)C 34a_100000211805_100000210303 [1,1,0,0,0,0|1,0,1]=4 1266 B9R0.4 CCCOC(C)CC(C)C 7a_100000211805_100000210303 [1,1,0,0,0,0|1,0,1]=4 1267 B9R0.4 CCCSC(C)CC(C)C 62a_100000210303_100000731052 [1,1,0,0,0,0|1,0,1]=4 1268 B9R0.4 CCCSC(C)CC(C)C 62a_100000731052_100000210303 [1,1,0,0,0,0|1,0,1]=4 1269 B9R0.4 COCNC(C)CC(C)C 2230a_100000692259_100000766300 [1,1,0,0,0,0|2,0,0]=4 1270 B9R0.4 COCSC(C)CC(C)C 62a_100000731052_100000766300 [1,1,0,0,0,0|2,0,0]=4 1271 B9R0.4 COCSC(C)CC(C)C 62a_100000766300_100000731052 [1,1,0,0,0,0|2,0,0]=4 1272 B9R0.4 CSCNC(C)CC(C)C 2230a_100000692259_100011218213 [1,1,0,0,0,0|2,0,0]=4 1273 B9R0.4 CSCOC(C)CC(C)C 34a_100000211805_100011218213 [1,1,0,0,0,0|2,0,0]=4 1274 B9R0.4 CSCSC(C)CC(C)C 62a_100000731052_100011218213 [1,1,0,0,0,0|2,0,0]=4 1275 B9R0.4 CSCSC(C)CC(C)C 62a_100011218213_100000731052 [1,1,0,0,0,0|2,0,0]=4 1276 B9R0.6 C=CCC(C)C(=O)C(C)C 1458a_100011216819_100000210206 [1,1,0,0,0,0|1,0,1]=4 1277 B9R0.6 C=CCN(C)C(C)C(C)C 2230a_100000228512_100000210623 [1,1,0,0,0,0|2,0,0]=4 1278 B9R0.6 C=CCN(C)C(C)C(C)C 269982a_100000228512_100000210623 [1,1,0,0,0,0|2,0,0]=4 1279 B9R0.6 CC(C)C(C)N(C)CC=O 2230a_100000228512_200015260668 [1,1,0,0,0,0|1,0,0]=3 1280 B9R0.6 CC(C)C(C)N(C)CC=O 269982a_100000228512_200015260668 [1,1,0,0,0,0|1,0,0]=3 1281 B9R0.14 C=CCN(CC)CC(C)C 2230a_100000738554_100000210623 [1,1,0,0,0,0|2,0,0]=4 1282 B9R0.14 C=CCN(CC)CC(C)C 269982a_100000738554_100000210623 [1,1,0,0,0,0|2,0,0]=4 1283 B9R0.14 C=CC[C@H](CO)NC(C)C 2230a_100020615467_100000210206 [1,1,0,0,0,0|2,0,0]=4 1284 B9R0.14 CC(C)CC(CN)CO[13CH3] 34a_200000723437_200025704644 [1,1,0,0,0,0|2,0,0]=4 1285 B9R0.14 CC(C)CC(CO)CN[13CH3] 34a_200000723437_200025704644 [1,1,0,0,0,0|2,0,0]=4 1286 B9R0.14 CC(C)C[C@@H](CCO)N[13CH3] 2230a_100161151251_200025704644 [1,1,0,0,0,0|0,0,2]=4 1287 B9R0.14 CC=CC(CC(C)C)OC 34a_100020643927_200000210301 [1,1,0,0,0,0|1,0,1]=4 1288 B9R0.14 CC=CC(CC(C)C)OC 7a_100020643927_200000210301 [1,1,0,0,0,0|1,0,1]=4 1289 B9R0.14 CC=CC(CC(C)C)O[13CH3] 34a_100020643927_200025704644 [1,1,0,0,0,0|1,0,1]=4 1290 B9R0.14 CC=CC(CC(C)C)O[13CH3] 7a_100020643927_200025704644 [1,1,0,0,0,0|1,0,1]=4 1291 B9R0.14 CCC(COC)CC(C)C 34a_100012186708_200000210301 [1,1,0,0,0,0|2,0,0]=4 1292 B9R0.14 CCC(COC)CC(C)C 7a_100012186708_200000210301 [1,1,0,0,0,0|2,0,0]=4 1293 B9R0.14 CCC(CO[13CH3])CC(C)C 34a_100012186708_200025704644 [1,1,0,0,0,0|2,0,0]=4 1294 B9R0.14 CCC(CO[13CH3])CC(C)C 7a_100012186708_200025704644 [1,1,0,0,0,0|2,0,0]=4 1295 B9R0.14 CCCC(CC(C)C)OC 34a_100011351045_200000210301 [1,1,0,0,0,0|1,0,1]=4 1296 B9R0.14 CCCC(CC(C)C)OC 7a_100011351045_200000210301 [1,1,0,0,0,0|1,0,1]=4 1297 B9R0.14 CCCC(CC(C)C)O[13CH3] 34a_100011351045_200025704644 [1,1,0,0,0,0|1,0,1]=4 1298 B9R0.14 CCCC(CC(C)C)O[13CH3] 7a_100011351045_200025704644 [1,1,0,0,0,0|1,0,1]=4 1299 B9R0.14 CCN(CC=O)CC(C)C 2230a_100000738554_200015260668 [1,1,0,0,0,0|1,0,0]=3 1300 B9R0.14 CCN(CC=O)CC(C)C 269982a_100000738554_200015260668 [1,1,0,0,0,0|1,0,0]=3 1301 B9R0.14 CCN(CC=O)C[C@H](C)O 2230a_100000729506_200015260668 [1,1,0,0,0,0|2,0,0]=4 1302 B9R0.14 CCN(CC=O)C[C@H](C)O 269982a_100000729506_200015260668 [1,1,0,0,0,0|2,0,0]=4 1303 B9R0.14 CNCC(CO)CC(C)C 34a_200000723437_200000210301 [1,1,0,0,0,0|2,0,0]=4 1304 B9R0.14 CN[C@H](CCO)CC(C)C 2230a_100161151251_200000210301 [1,1,0,0,0,0|0,0,2]=4 1305 B9R0.14 COCC(CN)CC(C)C 34a_200000723437_200000210301 [1,1,0,0,0,0|2,0,0]=4 1306 B9R0.23 C=CC(=O)C(C)CC(C)C 1458a_100000185746_100000731052 [1,1,0,0,0,0|1,0,1]=4 1307 B9R0.23 C=CC(C)N(C)CC(C)C 269982a_100000747067_100011215867 [1,1,0,0,0,0|2,0,0]=4 1308 B9R0.23 C=C[C@@H](C)[C@@H](C)OC(C)C 34a_100015455354_100000210206 [1,1,0,0,0,0|2,0,0]=4 1309 B9R0.23 C=C[C@@H](C)[C@@H](C)OC(C)C 7a_100015455354_100000210206 [1,1,0,0,0,0|2,0,0]=4 1310 B9R0.34 C=CCN(C)CC(C)CC 2230a_100000225617_100000748023 [1,1,0,0,0,0|2,0,0]=4 1311 B9R0.34 C=CCN(C)CC(C)CC 2230a_100000753921_100000210623 [1,1,0,0,0,0|2,0,0]=4 1312 B9R0.34 C=CCN(C)CC(C)CC 269982a_100000225617_100000748023 [1,1,0,0,0,0|2,0,0]=4 1313 B9R0.34 C=CCN(C)CC(C)CC 269982a_100000753921_100000210623 [1,1,0,0,0,0|2,0,0]=4 1314 B9R0.34 C=CCN(C)CC(C)CC 270004a_100000225617_100000243153 [1,1,0,0,0,0|2,0,0]=4 1315 B9R0.34 C=CCN(C)C[C@@H](C)CC 2230a_100000225617_100009816398 [1,1,0,0,0,0|2,0,0]=4 1316 B9R0.34 C=CCN(C)C[C@@H](C)CC 269982a_100000225617_100009816398 [1,1,0,0,0,0|2,0,0]=4 1317 B9R0.34 C=CCN(C)C[C@@H](C)CO 2230a_100000225617_100000059175 [1,1,0,0,0,0|2,0,0]=4 1318 B9R0.34 C=CCN(C)C[C@@H](C)CO 269982a_100000225617_100000059175 [1,1,0,0,0,0|2,0,0]=4 1319 B9R0.34 C=CC[C@@H](C)OC(C)CC 34a_100000731007_100011215416 [1,1,0,0,0,0|2,0,0]=4 1320 B9R0.34 C=CC[C@@H](C)OC(C)CC 7a_100000731007_100000758301 [1,1,0,0,0,0|2,0,0]=4 1321 B9R0.34 C=CC[C@@H](C)OC(C)CO 34a_100000731007_100012180447 [1,1,0,0,0,0|2,0,0]=4 1322 B9R0.34 C=CC[C@@H](C)OC(C)CO 7a_100000731007_100012180447 [1,1,0,0,0,0|2,0,0]=4 1323 B9R0.34 CCC(C)CN(C)CC=O 2230a_100000753921_200015260668 [1,1,0,0,0,0|1,0,0]=3 1324 B9R0.34 CCC(C)CN(C)CC=O 269982a_100000753921_200015260668 [1,1,0,0,0,0|1,0,0]=3 1325 B9R0.34 CN(CC=O)CC(O)CO 2230a_100011216503_200015260668 [1,1,0,0,0,0|2,0,0]=4 1326 B9R0.34 CN(CC=O)CC(O)CO 269982a_100011216503_200015260668 [1,1,0,0,0,0|2,0,0]=4 1327 B9R0.53 C=C(C)CN(C)CC(C)C 2230a_100000225649_100000210760 [1,1,0,0,0,0|2,0,0]=4 1328 B9R0.53 C=C(C)CN(C)CC(C)C 2230a_100000747067_100000748629 [1,1,0,0,0,0|2,0,0]=4 1329 B9R0.53 C=C(C)CN(C)CC(C)C 269982a_100000225649_100000210624 [1,1,0,0,0,0|2,0,0]=4 1330 B9R0.53 C=C(C)CN(C)CC(C)C 269982a_100000747067_100000748629 [1,1,0,0,0,0|2,0,0]=4 1331 B9R0.53 C=C(C)CN(C)CC(C)C 270004a_100000225649_100000210432 [1,1,0,0,0,0|2,0,0]=4 1332 B9R0.53 C=C(F)CN(C)CC(C)C 2230a_100000747067_100009893438 [1,1,0,0,0,0|2,0,0]=4 1333 B9R0.53 C=C(F)CN(C)CC(C)C 269982a_100000747067_100009893438 [1,1,0,0,0,0|2,0,0]=4 1334 B9R0.53 CC(=O)NC(C)CC(C)C 11a_100000692259_100015343762 [1,1,0,0,0,0|1,0,0]=3 1335 B9R0.53 CC(=O)NC(C)CC(C)C 1626a_100000692259_100015343762 [1,1,0,0,0,0|1,0,0]=3 1336 B9R0.53 CC(=O)NC(C)CC(C)C 240690a_100000692259_100015343762 [1,1,0,0,0,0|1,0,0]=3 1337 B9R0.53 CC(=O)NC(C)CC(C)C 527a_100000692259_100103153847 [1,1,0,0,0,0|1,0,0]=3 1338 B9R0.53 CC(=O)NC(C)CN(C)C 11a_100016992788_100015343762 [1,1,0,0,0,0|2,0,0]=4 1339 B9R0.53 CC(=O)NC(C)CN(C)C 240690a_100016992788_100015343762 [1,1,0,0,0,0|2,0,0]=4 1340 B9R0.53 CC(=O)NC(C)CN(C)C 527a_100016992788_100103153847 [1,1,0,0,0,0|2,0,0]=4 1341 B9R0.53 CC(=O)OC(C)SC(C)C 62a_100000210206_100009818208 [1,1,0,0,0,0|2,0,0]=4 1342 B9R0.53 CC(=O)OC(C)SC(C)C 62a_100009818208_100000210206 [1,1,0,0,0,0|2,0,0]=4 1343 B9R0.53 CC(C)CC(=O)CC(=O)N 1458a_100000210554_100000187820 [1,1,0,0,0,0|1,0,1]=4 1344 B9R0.53 CC(C)CC(=O)CC(=O)N 1458a_100134613110_100000210624 [1,1,0,0,0,0|1,0,1]=4 1345 B9R0.53 CC(C)CC(=O)CC(=O)[O-] 1458a_100000210554_100020667443 [1,1,0,0,0,0|1,0,1]=4 1346 B9R0.53 CC(C)CN(C)CC(=O)N 2230a_100000739694_100000210760 [1,1,0,0,0,0|1,0,0]=3 1347 B9R0.53 CC(C)CN(C)CC(=O)N 2230a_100000747067_100000747473 [1,1,0,0,0,0|1,0,0]=3 1348 B9R0.53 CC(C)CN(C)CC(=O)N 269982a_100000747067_100000187820 [1,1,0,0,0,0|1,0,0]=3 1349 B9R0.53 CC(C)CN(C)CC(=O)N 270004a_100000739694_100000210432 [1,1,0,0,0,0|1,0,0]=3 1350 B9R0.53 CC(C)CN(C)CC(=O)O 269956a_100000746989_100000210760 [1,1,0,0,0,0|1,0,0]=3 1351 B9R0.53 CC(C)CN(C)CC(=O)[O-] 269982a_100000747067_100020667443 [1,1,0,0,0,0|1,0,0]=3 1352 B9R0.53 CC(C)CN(C)C[N+](=O)[O-] 269982a_100000747067_100000761209 [1,1,0,0,0,0|2,0,0]=4 1353 B9R0.53 CC(O)CN(C)CC(=O)N 2230a_100000227577_100000747473 [1,1,0,0,0,0|2,0,0]=4 1354 B9R0.53 CC(O)CN(C)CC(=O)N 2230a_100000739694_100011218427 [1,1,0,0,0,0|2,0,0]=4 1355 B9R0.53 CC(O)CN(C)CC(=O)N 269982a_100000227577_100000187820 [1,1,0,0,0,0|2,0,0]=4 1356 B9R0.53 CC(O)CN(C)CC(=O)O 269956a_100000746989_100011218427 [1,1,0,0,0,0|2,0,0]=4 1357 B9R0.53 CC(O)CN(C)CC(=O)[O-] 269982a_100000227577_100020667443 [1,1,0,0,0,0|2,0,0]=4 1358 B9R0.53 C[C@@H](O)CN(C)CC(=O)N 2230a_100000739694_100009817552 [1,1,0,0,0,0|2,0,0]=4 1359 B9R0.53 C[C@@H](O)CN(C)CC(=O)O 269956a_100000746989_100009817552 [1,1,0,0,0,0|2,0,0]=4 1360 B9R0.58 C=CCC(C)(C)OC(C)C 7a_100011995686_100000210206 [1,1,0,0,0,0|2,0,0]=4 1361 B9R0.3 C=CCCC(=O)C(C)(C)C 1458a_106744555173_100000754431 [1,1,0,0,0,0|1,0,1]=4 1362 B9R0.3 C=CCCN(C)C(C)(C)C 269982a_100011215553_100000754431 [1,1,0,0,0,0|2,0,0]=4 1363 B9R0.3 C=CCCN(C)C(C)(C)C 269982a_100020639649_100000210625 [1,1,0,0,0,0|2,0,0]=4 1364 B9R0.3 C=CCN[C@H](C)C(C)(C)C 2230a_100025703359_100000210623 [1,1,0,0,0,0|2,0,0]=4 1365 B9R0.3 C[C@@H](NCC=O)C(C)(C)C 2230a_100025703359_200015260668 [1,1,0,0,0,0|1,0,0]=3 1366 B9R0.3 C[C@H](NCC=O)C(C)(C)O 2230a_100025708725_200015260668 [1,1,0,0,0,0|2,0,0]=4 1367 B9R0.20 C=CCCNC(C)(C)CC 2230a_100000211385_100000754431 [1,1,0,0,0,0|2,0,0]=4 1368 B9R0.20 C=CCCNC(C)(C)CO 2230a_100000210608_100000754431 [1,1,0,0,0,0|2,0,0]=4 1369 B9R0.20 C=CCCOC(C)(C)CC 7a_100000210230_100000754431 [1,1,0,0,0,0|2,0,0]=4 1370 B9R0.20 C=CCCOC(C)(C)CCl 7a_100000764493_100000754431 [1,1,0,0,0,0|2,0,0]=4 1371 B9R0.20 C=CCCSC(C)(C)CC 62a_100000032637_100000754431 [1,1,0,0,0,0|2,0,0]=4 1372 B9R0.20 C=CCCSC(C)(C)CC 62a_100000754431_100000032637 [1,1,0,0,0,0|2,0,0]=4 1373 B9R0.20 C=CCNCC(C)(C)CO 2230a_100020635058_100000210623 [1,1,0,0,0,0|2,0,0]=4 1374 B9R0.20 C=CCNCC(C)(C)OC 2230a_100000763424_100000210623 [1,1,0,0,0,0|2,0,0]=4 1375 B9R0.20 C=CCNCC(C)(C)SC 270004a_100020586998_100009845794 [1,1,0,0,0,0|2,0,0]=4 1376 B9R0.20 C=CCOCC(C)(C)CC 7a_100000765029_100015514636 [1,1,0,0,0,0|2,0,0]=4 1377 B9R0.20 C=CCOCC(C)(C)CCl 7a_100011217199_100015514636 [1,1,0,0,0,0|2,0,0]=4 1378 B9R0.20 C=CCOCC(C)(C)CO 34a_200000210373_100009813988 [1,1,0,0,0,0|2,0,0]=4 1379 B9R0.20 C=CCOCC(C)(C)OC 34a_200000210373_100000701081 [1,1,0,0,0,0|2,0,0]=4 1380 B9R0.20 C=CCSCC(C)(C)CO 62a_100000210623_100009813988 [1,1,0,0,0,0|2,0,0]=4 1381 B9R0.20 C=CCSCC(C)(C)CO 62a_100009813988_100000210623 [1,1,0,0,0,0|2,0,0]=4 1382 B9R0.20 C=CCSCC(C)(C)OC 62a_100000210623_100000701081 [1,1,0,0,0,0|2,0,0]=4 1383 B9R0.20 C=CCSCC(C)(C)OC 62a_100000701081_100000210623 [1,1,0,0,0,0|2,0,0]=4 1384 B9R0.20 CC(C)(CCl)COCC=O 7a_100011217199_200015260668 [1,1,0,0,0,0|1,0,0]=3 1385 B9R0.20 CC(C)(CO)CCCN[13CH3] 2230a_100000039164_200025704644 [1,1,0,0,0,0|2,0,0]=4 1386 B9R0.20 CC(C)(CO)CNCC=O 2230a_100020635058_200015260668 [1,1,0,0,0,0|1,0,0]=3 1387 B9R0.20 CC(C)(CO)CSCC=O 62a_100009813988_200015260668 [1,1,0,0,0,0|1,0,0]=3 1388 B9R0.20 CC(C)(CO)CSCC=O 62a_200015260668_100009813988 [1,1,0,0,0,0|1,0,0]=3 1389 B9R0.20 CCC(C)(C)COCC=O 7a_100000765029_200015260668 [1,1,0,0,0,0|1,0,0]=3 1390 B9R0.20 CNCCCC(C)(C)CO 2230a_100000039164_200000210301 [1,1,0,0,0,0|2,0,0]=4 1391 B9R0.20 COC(C)(C)CNCC=O 2230a_100000763424_200015260668 [1,1,0,0,0,0|1,0,0]=3 1392 B9R0.20 COC(C)(C)CSCC=O 62a_100000701081_200015260668 [1,1,0,0,0,0|1,0,0]=3 1393 B9R0.20 COC(C)(C)CSCC=O 62a_200015260668_100000701081 [1,1,0,0,0,0|1,0,0]=3 1394 B9R0.21 C=CC(=O)CCC(C)(C)C 1458a_100000185746_100000755188 [1,1,0,0,0,0|1,0,1]=4 1395 B9R0.21 C=CC(C)COC(C)(C)C 34a_100011215527_100000210625 [1,1,0,0,0,0|2,0,0]=4 1396 B9R0.21 C=CC(C)OCC(C)(C)C 34a_100000695699_100011219605 [1,1,0,0,0,0|2,0,0]=4 1397 B9R0.21 C=CC(C)SCC(C)(C)C 62a_100011215867_100011219605 [1,1,0,0,0,0|2,0,0]=4 1398 B9R0.21 C=CC(O)CNC(C)(C)C 2230a_100000715429_100000730141 [1,1,0,0,0,0|2,0,0]=4 1399 B9R0.21 C=CC(O)COC(C)(C)C 34a_100015890283_100000730141 [1,1,0,0,0,0|2,0,0]=4 1400 B9R0.21 C=CC(O)COC(C)(C)C 7a_100015890283_100000730141 [1,1,0,0,0,0|2,0,0]=4 1401 B9R0.21 C=CC(O)CSC(C)(C)C 62a_100000211941_100000730141 [1,1,0,0,0,0|2,0,0]=4 1402 B9R0.21 C=CC(O)CSC(C)(C)C 62a_100000730141_100000211941 [1,1,0,0,0,0|2,0,0]=4 1403 B9R0.21 C=C[C@H](N)COC(C)(C)C 34a_100016989147_100000210625 [1,1,0,0,0,0|2,0,0]=4 1404 B9R0.38 C#CCCCNC(C)(C)C 2230a_100000715429_100000731252 [1,1,0,0,0,0|1,0,1]=4 1405 B9R0.38 C#CCCCNC(C)(C)C 34a_100000718082_100000210625 [1,1,0,0,0,0|1,0,1]=4 1406 B9R0.38 C#CCCCOC(C)(C)C 34a_100000215630_100000210625 [1,1,0,0,0,0|1,0,1]=4 1407 B9R0.38 C#CCCCOC(C)(C)C 34a_100015890283_100000695029 [1,1,0,0,0,0|1,0,1]=4 1408 B9R0.38 C#CCCCOC(C)(C)C 7a_100015890283_100011215417 [1,1,0,0,0,0|1,0,1]=4 1409 B9R0.38 C#CCCCSC(C)(C)C 62a_100000211941_100011215417 [1,1,0,0,0,0|1,0,1]=4 1410 B9R0.38 C#CCCCSC(C)(C)C 62a_100011215417_100000211941 [1,1,0,0,0,0|1,0,1]=4 1411 B9R0.38 C#CCCNCC(C)(C)C 2230a_100000743828_100000688953 [1,1,0,0,0,0|1,0,1]=4 1412 B9R0.38 C#CCCNCC(C)(C)C 34a_100000755551_100011219605 [1,1,0,0,0,0|1,0,1]=4 1413 B9R0.38 C#CCCOCC(C)(C)C 34a_100011215631_100011219605 [1,1,0,0,0,0|1,0,1]=4 1414 B9R0.38 C#CCCSCC(C)(C)C 62a_100000688953_100011219605 [1,1,0,0,0,0|1,0,1]=4 1415 B9R0.38 C#CCCSCC(C)(C)C 62a_100011219605_100000688953 [1,1,0,0,0,0|1,0,1]=4 1416 B9R0.38 C#CCNCCC(C)(C)C 2230a_100000738805_100000038162 [1,1,0,0,0,0|1,0,1]=4 1417 B9R0.38 C#CCNCCC(C)(C)C 34a_100000212058_100000755188 [1,1,0,0,0,0|1,0,1]=4 1418 B9R0.38 C#CCOCCC(C)(C)C 34a_100000210247_100000755188 [1,1,0,0,0,0|1,0,1]=4 1419 B9R0.38 C#CCOCCC(C)(C)C 7a_100000765024_100000038162 [1,1,0,0,0,0|1,0,1]=4 1420 B9R0.38 C#CCSCCC(C)(C)C 62a_100000038162_100000755188 [1,1,0,0,0,0|1,0,1]=4 1421 B9R0.38 C/C=C/CCOC(C)(C)C 34a_100016278192_100000210625 [1,1,0,0,0,0|1,0,1]=4 1422 B9R0.38 C/C=C/COCC(C)(C)C 34a_100016270725_100011219605 [1,1,0,0,0,0|1,0,1]=4 1423 B9R0.38 C/C=C/CSCC(C)(C)C 62a_100011219605_100102629194 [1,1,0,0,0,0|1,0,1]=4 1424 B9R0.38 C/C=C/CSCC(C)(C)C 62a_100102629194_100011219605 [1,1,0,0,0,0|1,0,1]=4 1425 B9R0.38 C=CCCCNC(C)(C)C 2230a_100000715429_100011713584 [1,1,0,0,0,0|1,0,0]=3 1426 B9R0.38 C=CCCCNC(C)(C)C 34a_100000700776_100000210625 [1,1,0,0,0,0|1,0,0]=3 1427 B9R0.38 C=CCCCOC(C)(C)C 34a_100000758997_100000210625 [1,1,0,0,0,0|1,0,0]=3 1428 B9R0.38 C=CCCCOC(C)(C)C 34a_100015890283_100000757094 [1,1,0,0,0,0|1,0,0]=3 1429 B9R0.38 C=CCCCOC(C)(C)C 7a_100015890283_100000757094 [1,1,0,0,0,0|1,0,0]=3 1430 B9R0.38 C=CCCCSC(C)(C)C 62a_100000211941_100000757094 [1,1,0,0,0,0|1,0,0]=3 1431 B9R0.38 C=CCCCSC(C)(C)C 62a_100011713584_100000211941 [1,1,0,0,0,0|1,0,0]=3 1432 B9R0.38 C=CCCNCC(C)(C)C 2230a_100000743828_100000754431 [1,1,0,0,0,0|1,0,0]=3 1433 B9R0.38 C=CCCNCC(C)(C)C 270004a_100015191253_100011204126 [1,1,0,0,0,0|1,0,0]=3 1434 B9R0.38 C=CCCNCC(C)(C)F 2230a_100020643315_100000754431 [1,1,0,0,0,0|2,0,0]=4 1435 B9R0.38 C=CCCNCC(C)(C)O 2230a_100000751335_100000754431 [1,1,0,0,0,0|2,0,0]=4 1436 B9R0.38 C=CCCNC[Si](C)(C)C 2230a_100015191253_100000037933 [1,1,0,0,0,0|1,1,0]=4 1437 B9R0.38 C=CCCOCC(C)(C)C 34a_100011205117_100011219605 [1,1,0,0,0,0|1,0,0]=3 1438 B9R0.38 C=CCCOCC(C)(C)F 34a_100000716592_100000754431 [1,1,0,0,0,0|2,0,0]=4 1439 B9R0.38 C=CCCOCC(C)(C)F 34a_100011205117_100011997219 [1,1,0,0,0,0|2,0,0]=4 1440 B9R0.38 C=CCCOCC(C)(C)O 34a_100011205117_100000764493 [1,1,0,0,0,0|2,0,0]=4 1441 B9R0.38 C=CCCSCC(C)(C)C 62a_100000754431_100011219605 [1,1,0,0,0,0|1,0,0]=3 1442 B9R0.38 C=CCCSCC(C)(C)C 62a_100011219605_100000754431 [1,1,0,0,0,0|1,0,0]=3 1443 B9R0.38 C=CCCSCC(C)(C)F 62a_100000754431_100011997219 [1,1,0,0,0,0|2,0,0]=4 1444 B9R0.38 C=CCCSCC(C)(C)F 62a_100011997219_100000754431 [1,1,0,0,0,0|2,0,0]=4 1445 B9R0.38 C=CCCSCC(C)(C)O 62a_100000754431_100000764493 [1,1,0,0,0,0|2,0,0]=4 1446 B9R0.38 C=CCCSCC(C)(C)O 62a_100000764493_100000754431 [1,1,0,0,0,0|2,0,0]=4 1447 B9R0.38 C=CCCSC[N+](C)(C)C 62a_100000754431_200000036245 [1,1,0,0,0,0|2,0,0]=4 1448 B9R0.38 C=CCCSC[N+](C)(C)C 62a_200000036245_100000754431 [1,1,0,0,0,0|2,0,0]=4 1449 B9R0.38 C=CCCSC[Si](C)(C)C 62a_100000037933_100000754431 [1,1,0,0,0,0|1,1,0]=4 1450 B9R0.38 C=CCCSC[Si](C)(C)C 62a_100000754431_100000037933 [1,1,0,0,0,0|1,1,0]=4 1451 B9R0.38 C=CCNCCC(C)(C)C 2230a_100000738805_100000210623 [1,1,0,0,0,0|1,0,0]=3 1452 B9R0.38 C=CCNCCC(C)(C)C 2230a_100020586998_100000755188 [1,1,0,0,0,0|1,0,0]=3 1453 B9R0.38 C=CCNCCC(C)(C)F 2230a_100016253952_100000210623 [1,1,0,0,0,0|2,0,0]=4 1454 B9R0.38 C=CCNCCC(C)(C)O 2230a_100020586998_100000702414 [1,1,0,0,0,0|2,0,0]=4 1455 B9R0.38 C=CCNCC[Si](C)(C)C 2230a_100020586998_200000733723 [1,1,0,0,0,0|1,1,0]=4 1456 B9R0.38 C=CCOCCC(C)(C)C 34a_200000210373_100000755188 [1,1,0,0,0,0|1,0,0]=3 1457 B9R0.38 C=CCOCCC(C)(C)C 7a_100000765024_100015514636 [1,1,0,0,0,0|1,0,0]=3 1458 B9R0.38 C=CCOCCC(C)(C)O 34a_200000210373_100000702414 [1,1,0,0,0,0|2,0,0]=4 1459 B9R0.38 C=CCOCC[N+](C)(C)C 34a_200000210373_100000085578 [1,1,0,0,0,0|2,0,0]=4 1460 B9R0.38 C=CCOCC[N+](C)(C)C 7a_200020618287_100015514636 [1,1,0,0,0,0|2,0,0]=4 1461 B9R0.38 C=CCOCC[Si](C)(C)C 34a_200000210373_200000733723 [1,1,0,0,0,0|1,1,0]=4 1462 B9R0.38 C=CCOCC[Si](C)(C)C 7a_100000039746_100015514636 [1,1,0,0,0,0|1,1,0]=4 1463 B9R0.38 C=CCSCCC(C)(C)C 62a_100000210623_100000755188 [1,1,0,0,0,0|1,0,0]=3 1464 B9R0.38 C=CCSCCC(C)(C)C 62a_100000755188_100000210623 [1,1,0,0,0,0|1,0,0]=3 1465 B9R0.38 C=CCSCCC(C)(C)O 62a_100000210623_100000702414 [1,1,0,0,0,0|2,0,0]=4 1466 B9R0.38 C=CCSCCC(C)(C)O 62a_100000702414_100000210623 [1,1,0,0,0,0|2,0,0]=4 1467 B9R0.38 C=CCSCC[N+](C)(C)C 62a_100000085578_100000210623 [1,1,0,0,0,0|2,0,0]=4 1468 B9R0.38 C=CCSCC[N+](C)(C)C 62a_100000210623_100000085578 [1,1,0,0,0,0|2,0,0]=4 1469 B9R0.38 C=CCSCC[Si](C)(C)C 62a_100000210623_200000733723 [1,1,0,0,0,0|1,1,0]=4 1470 B9R0.38 C=CCSCC[Si](C)(C)C 62a_200000733723_100000210623 [1,1,0,0,0,0|1,1,0]=4 1471 B9R0.38 C=COCCNC(C)(C)C 2230a_100000715429_100000039644 [1,1,0,0,0,0|2,0,0]=4 1472 B9R0.38 C=COCCOC(C)(C)C 34a_100000033082_100000210625 [1,1,0,0,0,0|2,0,0]=4 1473 B9R0.38 C=COCCOC(C)(C)C 34a_100015890283_100000039644 [1,1,0,0,0,0|2,0,0]=4 1474 B9R0.38 C=COCCOC(C)(C)C 7a_100015890283_100000039644 [1,1,0,0,0,0|2,0,0]=4 1475 B9R0.38 C=COCCSC(C)(C)C 62a_100000039644_100000211941 [1,1,0,0,0,0|2,0,0]=4 1476 B9R0.38 C=COCCSC(C)(C)C 62a_100000211941_100000039644 [1,1,0,0,0,0|2,0,0]=4 1477 B9R0.38 CC(C)(C)CCNCC#N 2230a_100000738805_100011215382 [1,1,0,0,0,0|1,0,1]=4 1478 B9R0.38 CC(C)(C)CCNCC=O 2230a_100000738805_200015260668 [1,1,0,0,0,0|0,0,0]=2 1479 B9R0.38 CC(C)(C)CCNCCF 2230a_100000738805_100011217306 [1,1,0,0,0,0|1,0,1]=4 1480 B9R0.38 CC(C)(C)CCNCCF 34a_100000724931_100000755188 [1,1,0,0,0,0|1,0,1]=4 1481 B9R0.38 CC(C)(C)CCNCCO 2230a_100000738805_100000211926 [1,1,0,0,0,0|0,0,2]=4 1482 B9R0.38 CC(C)(C)CCNCCO 2230a_100016997473_100000755188 [1,1,0,0,0,0|0,0,2]=4 1483 B9R0.38 CC(C)(C)CCNCCO 34a_100016990907_100000755188 [1,1,0,0,0,0|0,0,2]=4 1484 B9R0.38 CC(C)(C)CCOCC#N 7a_100000765024_100011215382 [1,1,0,0,0,0|1,0,1]=4 1485 B9R0.38 CC(C)(C)CCOCC=O 7a_100000765024_200015260668 [1,1,0,0,0,0|0,0,0]=2 1486 B9R0.38 CC(C)(C)CCOCCBr 34a_100000211926_100000755188 [1,1,0,0,0,0|1,0,1]=4 1487 B9R0.38 CC(C)(C)CCOCCF 7a_100000765024_100011217306 [1,1,0,0,0,0|1,0,1]=4 1488 B9R0.38 CC(C)(C)CCOCCN 34a_100000210304_100000755188 [1,1,0,0,0,0|1,0,1]=4 1489 B9R0.38 CC(C)(C)CCOCCO 7a_100000765024_100000211926 [1,1,0,0,0,0|0,0,2]=4 1490 B9R0.38 CC(C)(C)CCSCC#N 62a_100000755188_100011215382 [1,1,0,0,0,0|1,0,1]=4 1491 B9R0.38 CC(C)(C)CCSCC#N 62a_100011215382_100000755188 [1,1,0,0,0,0|1,0,1]=4 1492 B9R0.38 CC(C)(C)CCSCC=O 62a_100000755188_200015260668 [1,1,0,0,0,0|0,0,0]=2 1493 B9R0.38 CC(C)(C)CCSCC=O 62a_200015260668_100000755188 [1,1,0,0,0,0|0,0,0]=2 1494 B9R0.38 CC(C)(C)CCSCCF 62a_100000755188_100011217306 [1,1,0,0,0,0|1,0,1]=4 1495 B9R0.38 CC(C)(C)CCSCCF 62a_100011217306_100000755188 [1,1,0,0,0,0|1,0,1]=4 1496 B9R0.38 CC(C)(C)CCSCCO 62a_100000211926_100000755188 [1,1,0,0,0,0|0,0,2]=4 1497 B9R0.38 CC(C)(C)CCSCCO 62a_100000755188_100000211926 [1,1,0,0,0,0|0,0,2]=4 1498 B9R0.38 CC(C)(C)CNCCC#N 2230a_100000743828_100011215226 [1,1,0,0,0,0|1,0,1]=4 1499 B9R0.38 CC(C)(C)CNCCC#N 270004a_100000720768_100011204126 [1,1,0,0,0,0|1,0,1]=4 1500 B9R0.38 CC(C)(C)CNCCCF 2230a_100000743828_100011934791 [1,1,0,0,0,0|1,0,1]=4 1501 B9R0.38 CC(C)(C)CNCCCF 270004a_100015189416_100011204126 [1,1,0,0,0,0|1,0,1]=4 1502 B9R0.38 CC(C)(C)CNCCCF 34a_100015189416_100011219605 [1,1,0,0,0,0|1,0,1]=4 1503 B9R0.38 CC(C)(C)CNCCCO 2230a_100000743828_100000230001 [1,1,0,0,0,0|0,0,2]=4 1504 B9R0.38 CC(C)(C)CNCCCO 270004a_100000182051_100011204126 [1,1,0,0,0,0|0,0,2]=4 1505 B9R0.38 CC(C)(C)COCCCBr 34a_100011217188_100011219605 [1,1,0,0,0,0|1,0,1]=4 1506 B9R0.38 CC(C)(C)COCCCCl 34a_100000230001_100011219605 [1,1,0,0,0,0|1,0,1]=4 1507 B9R0.38 CC(C)(C)COCCCF 34a_100000759539_100011219605 [1,1,0,0,0,0|1,0,1]=4 1508 B9R0.38 CC(C)(C)COCCCN 34a_100000182051_100011219605 [1,1,0,0,0,0|1,0,1]=4 1509 B9R0.38 CC(C)(C)COCCON 34a_100000700252_100011219605 [1,1,0,0,0,0|2,0,0]=4 1510 B9R0.38 CC(C)(C)CSCCC#N 62a_100011215226_100011219605 [1,1,0,0,0,0|1,0,1]=4 1511 B9R0.38 CC(C)(C)CSCCC#N 62a_100011219605_100011215226 [1,1,0,0,0,0|1,0,1]=4 1512 B9R0.38 CC(C)(C)CSCCCF 62a_100011219605_100011934791 [1,1,0,0,0,0|1,0,1]=4 1513 B9R0.38 CC(C)(C)CSCCCF 62a_100011934791_100011219605 [1,1,0,0,0,0|1,0,1]=4 1514 B9R0.38 CC(C)(C)CSCCCO 62a_100011215043_100011219605 [1,1,0,0,0,0|0,0,2]=4 1515 B9R0.38 CC(C)(C)CSCCCO 62a_100011219605_100011215043 [1,1,0,0,0,0|0,0,2]=4 1516 B9R0.38 CC(C)(C)NCCCC#N 2230a_100000715429_100000687738 [1,1,0,0,0,0|1,0,1]=4 1517 B9R0.38 CC(C)(C)NCCCC=O 2230a_100000715429_200011292268 [1,1,0,0,0,0|0,0,0]=2 1518 B9R0.38 CC(C)(C)NCCCCF 2230a_100000715429_100000729493 [1,1,0,0,0,0|1,0,1]=4 1519 B9R0.38 CC(C)(C)NCCCCO 2230a_100000715429_100000210776 [1,1,0,0,0,0|0,0,2]=4 1520 B9R0.38 CC(C)(C)NCCCCO 34a_100000750430_100000210625 [1,1,0,0,0,0|0,0,2]=4 1521 B9R0.38 CC(C)(C)OCCCC#N 7a_100015890283_100000687738 [1,1,0,0,0,0|1,0,1]=4 1522 B9R0.38 CC(C)(C)OCCCC=O 7a_100015890283_200011292268 [1,1,0,0,0,0|0,0,0]=2 1523 B9R0.38 CC(C)(C)OCCCCBr 34a_100011216708_100000210625 [1,1,0,0,0,0|1,0,1]=4 1524 B9R0.38 CC(C)(C)OCCCCCl 34a_100000210776_100000210625 [1,1,0,0,0,0|1,0,1]=4 1525 B9R0.38 CC(C)(C)OCCCCF 34a_100011995726_100000210625 [1,1,0,0,0,0|1,0,1]=4 1526 B9R0.38 CC(C)(C)OCCCCF 34a_100015890283_100000729493 [1,1,0,0,0,0|1,0,1]=4 1527 B9R0.38 CC(C)(C)OCCCCF 7a_100015890283_100000729493 [1,1,0,0,0,0|1,0,1]=4 1528 B9R0.38 CC(C)(C)OCCCCI 34a_200012148704_100000210625 [1,1,0,0,0,0|1,0,1]=4 1529 B9R0.38 CC(C)(C)OCCCCN 34a_100000750430_100000210625 [1,1,0,0,0,0|1,0,1]=4 1530 B9R0.38 CC(C)(C)OCCCCO 34a_100015890283_100011216708 [1,1,0,0,0,0|0,0,2]=4 1531 B9R0.38 CC(C)(C)OCCCCO 7a_100015890283_100000210776 [1,1,0,0,0,0|0,0,2]=4 1532 B9R0.38 CC(C)(C)OCCCN[13CH3] 2230a_100011250582_200025704644 [1,1,0,0,0,0|2,0,0]=4 1533 B9R0.38 CC(C)(C)SCCCC#N 62a_100000211941_100000687738 [1,1,0,0,0,0|1,0,1]=4 1534 B9R0.38 CC(C)(C)SCCCC#N 62a_100000687738_100000211941 [1,1,0,0,0,0|1,0,1]=4 1535 B9R0.38 CC(C)(C)SCCCC=O 62a_100000211941_200011292268 [1,1,0,0,0,0|0,0,0]=2 1536 B9R0.38 CC(C)(C)SCCCC=O 62a_200011292268_100000211941 [1,1,0,0,0,0|0,0,0]=2 1537 B9R0.38 CC(C)(C)SCCCCF 62a_100000211941_100000729493 [1,1,0,0,0,0|1,0,1]=4 1538 B9R0.38 CC(C)(C)SCCCCF 62a_100000729493_100000211941 [1,1,0,0,0,0|1,0,1]=4 1539 B9R0.38 CC(C)(C)SCCCCO 62a_100000210776_100000211941 [1,1,0,0,0,0|0,0,2]=4 1540 B9R0.38 CC(C)(C)SCCCCO 62a_100000211941_100000210776 [1,1,0,0,0,0|0,0,2]=4 1541 B9R0.38 CC(C)(F)CCNCC=O 2230a_100016253952_200015260668 [1,1,0,0,0,0|1,0,0]=3 1542 B9R0.38 CC(C)(O)CCSCC=O 62a_100000702414_200015260668 [1,1,0,0,0,0|1,0,0]=3 1543 B9R0.38 CC(C)(O)CCSCC=O 62a_200015260668_100000702414 [1,1,0,0,0,0|1,0,0]=3 1544 B9R0.38 CC=CCNCC(C)(C)C 2230a_100000743828_100000070051 [1,1,0,0,0,0|1,0,1]=4 1545 B9R0.38 CC=CCSCC(C)(C)C 62a_100000070051_100011219605 [1,1,0,0,0,0|1,0,1]=4 1546 B9R0.38 CC=CCSCC(C)(C)C 62a_100011219605_100000070051 [1,1,0,0,0,0|1,0,1]=4 1547 B9R0.38 CCCCCNC(C)(C)C 2230a_100000715429_100000210326 [1,1,0,0,0,0|1,0,1]=4 1548 B9R0.38 CCCCCOC(C)(C)C 34a_100000210253_100000210625 [1,1,0,0,0,0|1,0,1]=4 1549 B9R0.38 CCCCCOC(C)(C)C 34a_100015890283_100000718602 [1,1,0,0,0,0|1,0,1]=4 1550 B9R0.38 CCCCCOC(C)(C)C 7a_100015890283_100000210326 [1,1,0,0,0,0|1,0,1]=4 1551 B9R0.38 CCCCCSC(C)(C)C 62a_100000210326_100000211941 [1,1,0,0,0,0|1,0,1]=4 1552 B9R0.38 CCCCCSC(C)(C)C 62a_100000211941_100000210326 [1,1,0,0,0,0|1,0,1]=4 1553 B9R0.38 CCCCNCC(C)(C)C 2230a_100000743828_100000210211 [1,1,0,0,0,0|1,0,1]=4 1554 B9R0.38 CCCCNCC(C)(C)C 270004a_100000102301_100011204126 [1,1,0,0,0,0|1,0,1]=4 1555 B9R0.38 CCCCOCC(C)(C)C 34a_100000210227_100011219605 [1,1,0,0,0,0|1,0,1]=4 1556 B9R0.38 CCCCSCC(C)(C)C 62a_100000210211_100011219605 [1,1,0,0,0,0|1,0,1]=4 1557 B9R0.38 CCCCSCC(C)(C)C 62a_100011219605_100000210210 [1,1,0,0,0,0|1,0,1]=4 1558 B9R0.38 CCCNCCC(C)(C)C 2230a_100000738805_100000210303 [1,1,0,0,0,0|1,0,1]=4 1559 B9R0.38 CCCOCCC(C)(C)C 34a_100000210258_100000755188 [1,1,0,0,0,0|1,0,1]=4 1560 B9R0.38 CCCOCCC(C)(C)C 7a_100000765024_100000210303 [1,1,0,0,0,0|1,0,1]=4 1561 B9R0.38 CCCSCCC(C)(C)C 62a_100000210303_100000755188 [1,1,0,0,0,0|1,0,1]=4 1562 B9R0.38 CCCSCCC(C)(C)C 62a_100000755188_100000210303 [1,1,0,0,0,0|1,0,1]=4 1563 B9R0.38 CNCCCOC(C)(C)C 2230a_100011250582_200000210301 [1,1,0,0,0,0|2,0,0]=4 1564 B9R0.38 CNCCCOC(C)(C)C 34a_100000213112_100000210625 [1,1,0,0,0,0|2,0,0]=4 1565 B9R0.38 COCCCNC(C)(C)C 2230a_100000715429_100000740836 [1,1,0,0,0,0|2,0,0]=4 1566 B9R0.38 COCCCNC(C)(C)C 34a_100150723488_100000210625 [1,1,0,0,0,0|2,0,0]=4 1567 B9R0.38 COCCCOC(C)(C)C 34a_100000740835_100000210625 [1,1,0,0,0,0|2,0,0]=4 1568 B9R0.38 COCCCOC(C)(C)C 34a_100015890283_100000740836 [1,1,0,0,0,0|2,0,0]=4 1569 B9R0.38 COCCCOC(C)(C)C 7a_100015890283_100000740836 [1,1,0,0,0,0|2,0,0]=4 1570 B9R0.38 COCCCSC(C)(C)C 62a_100000211941_100000709357 [1,1,0,0,0,0|2,0,0]=4 1571 B9R0.38 COCCCSC(C)(C)C 62a_100000709357_100000211941 [1,1,0,0,0,0|2,0,0]=4 1572 B9R0.38 COCCNCC(C)(C)C 2230a_100000743828_100011201679 [1,1,0,0,0,0|2,0,0]=4 1573 B9R0.38 COCCNCC(C)(C)C 270004a_100000209980_100011204126 [1,1,0,0,0,0|2,0,0]=4 1574 B9R0.38 COCCOCC(C)(C)C 34a_100000210237_100011219605 [1,1,0,0,0,0|2,0,0]=4 1575 B9R0.38 COCCSCC(C)(C)C 62a_100000233755_100011219605 [1,1,0,0,0,0|2,0,0]=4 1576 B9R0.38 COCCSCC(C)(C)C 62a_100011219605_100000233755 [1,1,0,0,0,0|2,0,0]=4 1577 B9R0.38 COCNCCC(C)(C)C 2230a_100000738805_100000766300 [1,1,0,0,0,0|2,0,0]=4 1578 B9R0.38 COCSCCC(C)(C)C 62a_100000755188_100000766300 [1,1,0,0,0,0|2,0,0]=4 1579 B9R0.38 COCSCCC(C)(C)C 62a_100000766300_100000755188 [1,1,0,0,0,0|2,0,0]=4 1580 B9R0.38 CSCCCOC(C)(C)C 34a_100000690336_100000210625 [1,1,0,0,0,0|2,0,0]=4 1581 B9R0.38 CSCCNCC(C)(C)C 2230a_100000743828_100000751147 [1,1,0,0,0,0|2,0,0]=4 1582 B9R0.38 CSCCNCC(C)(C)C 270004a_100020590264_100011204126 [1,1,0,0,0,0|2,0,0]=4 1583 B9R0.38 CSCCOCC(C)(C)C 34a_100000230434_100011219605 [1,1,0,0,0,0|2,0,0]=4 1584 B9R0.38 CSCCSCC(C)(C)C 62a_100000212216_100011219605 [1,1,0,0,0,0|2,0,0]=4 1585 B9R0.38 CSCCSCC(C)(C)C 62a_100011219605_100000751147 [1,1,0,0,0,0|2,0,0]=4 1586 B9R0.38 CSCNCCC(C)(C)C 2230a_100000738805_100011218213 [1,1,0,0,0,0|2,0,0]=4 1587 B9R0.38 CSCSCCC(C)(C)C 62a_100000755188_100011218213 [1,1,0,0,0,0|2,0,0]=4 1588 B9R0.38 CSCSCCC(C)(C)C 62a_100011218213_100000755188 [1,1,0,0,0,0|2,0,0]=4 1589 B9R0.38 C[N+](C)(C)CCOCC=O 7a_200020618287_200015260668 [1,1,0,0,0,0|1,0,0]=3 1590 B9R0.38 C[N+](C)(C)CCSCC=O 62a_100000085578_200015260668 [1,1,0,0,0,0|1,0,0]=3 1591 B9R0.38 C[N+](C)(C)CCSCC=O 62a_200015260668_100000085578 [1,1,0,0,0,0|1,0,0]=3 1592 B9R0.38 C[Si](C)(C)CCOCC=O 7a_100000039746_200015260668 [1,1,0,0,0,0|0,1,0]=3 1593 B9R0.38 C[Si](C)(C)CCSCC=O 62a_200000733723_200015260668 [1,1,0,0,0,0|0,1,0]=3 1594 B9R0.38 C[Si](C)(C)CCSCC=O 62a_200015260668_200000733723 [1,1,0,0,0,0|0,1,0]=3 1595 B9R0.56 C=C(Br)CCOC(C)(C)C 34a_100009813270_100000210625 [1,1,0,0,0,0|2,0,0]=4 1596 B9R0.56 C=C(C)CCNC(C)(C)C 2230a_100000715429_100000730704 [1,1,0,0,0,0|2,0,0]=4 1597 B9R0.56 C=C(C)CCOC(C)(C)C 34a_100000764851_100000210625 [1,1,0,0,0,0|2,0,0]=4 1598 B9R0.56 C=C(C)CCOC(C)(C)C 34a_100015890283_100000730704 [1,1,0,0,0,0|2,0,0]=4 1599 B9R0.56 C=C(C)CCOC(C)(C)C 7a_100015890283_100000730704 [1,1,0,0,0,0|2,0,0]=4 1600 B9R0.56 C=C(C)CCSC(C)(C)C 62a_100000211941_100000730704 [1,1,0,0,0,0|2,0,0]=4 1601 B9R0.56 C=C(C)CCSC(C)(C)C 62a_100000730704_100000211941 [1,1,0,0,0,0|2,0,0]=4 1602 B9R0.56 C=C(C)CNCC(C)(C)C 2230a_100000743828_100000748629 [1,1,0,0,0,0|2,0,0]=4 1603 B9R0.56 C=C(C)COCC(C)(C)C 34a_100000210245_100011219605 [1,1,0,0,0,0|2,0,0]=4 1604 B9R0.56 C=C(C)CSCC(C)(C)C 62a_100000748629_100011219605 [1,1,0,0,0,0|2,0,0]=4 1605 B9R0.56 C=C(C)CSCC(C)(C)C 62a_100011219605_100000211660 [1,1,0,0,0,0|2,0,0]=4 1606 B9R0.56 C=C(F)CNCC(C)(C)C 2230a_100000743828_100009893438 [1,1,0,0,0,0|2,0,0]=4 1607 B9R0.56 C=C(F)COCC(C)(C)C 34a_200010262243_100011219605 [1,1,0,0,0,0|2,0,0]=4 1608 B9R0.56 C=C(F)CSCC(C)(C)C 62a_100000042424_100011219605 [1,1,0,0,0,0|2,0,0]=4 1609 B9R0.56 C=C(F)CSCC(C)(C)C 62a_100011219605_100000042424 [1,1,0,0,0,0|2,0,0]=4 1610 B9R0.56 CC(=O)CCC[N+](C)(C)C 1458a_100000070787_100016990835 [1,1,0,0,0,0|1,0,0]=3 1611 B9R0.56 CC(=O)CCC[N+](C)(C)C 1458a_100000085584_200000210301 [1,1,0,0,0,0|1,0,0]=3 1612 B9R0.56 CC(=O)CCC[Si](C)(C)C 1458a_100000070787_100011219597 [1,1,0,0,0,0|0,1,0]=3 1613 B9R0.56 CC(=O)CCOC(C)(C)C 34a_100000759926_100000210625 [1,1,0,0,0,0|1,0,0]=3 1614 B9R0.56 CC(=O)CCOC(C)(C)C 7a_100015890283_100000053229 [1,1,0,0,0,0|1,0,0]=3 1615 B9R0.56 CC(=O)CCO[Si](C)(C)C 1458a_100000070787_200000032530 [1,1,0,0,0,0|1,1,0]=4 1616 B9R0.56 CC(=O)CCSC(C)(C)C 62a_100000053229_100000211941 [1,1,0,0,0,0|1,0,0]=3 1617 B9R0.56 CC(=O)CCSC(C)(C)C 62a_100000211941_100000053229 [1,1,0,0,0,0|1,0,0]=3 1618 B9R0.56 CC(=O)COCC(C)(C)C 34a_100000211253_100011219605 [1,1,0,0,0,0|1,0,0]=3 1619 B9R0.56 CC(=O)COCC(C)(C)F 34a_100000211253_100011997219 [1,1,0,0,0,0|2,0,0]=4 1620 B9R0.56 CC(=O)COCC(C)(C)O 34a_100000211253_100000764493 [1,1,0,0,0,0|2,0,0]=4 1621 B9R0.56 CC(=O)NCCC(C)(C)C 11a_100000738805_100015343762 [1,1,0,0,0,0|1,0,0]=3 1622 B9R0.56 CC(=O)NCCC(C)(C)C 1626a_100000738805_100015343762 [1,1,0,0,0,0|1,0,0]=3 1623 B9R0.56 CC(=O)NCCC(C)(C)C 240690a_100000738805_100015343762 [1,1,0,0,0,0|1,0,0]=3 1624 B9R0.56 CC(=O)NCCC(C)(C)C 527a_100000738805_100103153847 [1,1,0,0,0,0|1,0,0]=3 1625 B9R0.56 CC(=O)NCCC(C)(C)F 11a_100016253952_100015343762 [1,1,0,0,0,0|2,0,0]=4 1626 B9R0.56 CC(=O)NCCC(C)(C)F 1626a_100016253952_100015343762 [1,1,0,0,0,0|2,0,0]=4 1627 B9R0.56 CC(=O)NCCC(C)(C)F 240690a_100016253952_100015343762 [1,1,0,0,0,0|2,0,0]=4 1628 B9R0.56 CC(=O)NCCC(C)(C)F 527a_100016253952_100103153847 [1,1,0,0,0,0|2,0,0]=4 1629 B9R0.56 CC(=O)NCCC(C)(C)O 1626a_100000707701_100015343762 [1,1,0,0,0,0|2,0,0]=4 1630 B9R0.56 CC(=O)NCCC(C)(C)O 527a_100000707701_100103153847 [1,1,0,0,0,0|2,0,0]=4 1631 B9R0.56 CC(=O)NCC[N+](C)(C)C 1626a_100000106457_100015343762 [1,1,0,0,0,0|2,0,0]=4 1632 B9R0.56 CC(=O)NCC[N+](C)(C)C 240690a_100000106457_100015343762 [1,1,0,0,0,0|2,0,0]=4 1633 B9R0.56 CC(=O)NCC[N+](C)(C)C 527a_100000106457_100103153847 [1,1,0,0,0,0|2,0,0]=4 1634 B9R0.56 CC(=O)OCOC(C)(C)C 34a_100015890283_100009813279 [1,1,0,0,0,0|2,0,0]=4 1635 B9R0.56 CC(=O)OCSC(C)(C)C 62a_100000076356_100000211941 [1,1,0,0,0,0|2,0,0]=4 1636 B9R0.56 CC(=O)OCSC(C)(C)C 62a_100000211941_100000076356 [1,1,0,0,0,0|2,0,0]=4 1637 B9R0.56 CC(C)(C)CNCC(=O)N 2230a_100000743828_100000747473 [1,1,0,0,0,0|1,0,0]=3 1638 B9R0.56 CC(C)(C)CNCC(=O)O 269956a_100016091260_100011219605 [1,1,0,0,0,0|1,0,0]=3 1639 B9R0.56 CC(C)(C)CSCC(=O)N 62a_100000747473_100011219605 [1,1,0,0,0,0|1,0,0]=3 1640 B9R0.56 CC(C)(C)CSCC(=O)N 62a_100011219605_100000747473 [1,1,0,0,0,0|1,0,0]=3 1641 B9R0.56 CC(C)(C)CSCC(=O)[O-] 62a_100011219605_100020667443 [1,1,0,0,0,0|1,0,0]=3 1642 B9R0.56 CC(C)(C)CSCC(=O)[O-] 62a_100020667443_100011219605 [1,1,0,0,0,0|1,0,0]=3 1643 B9R0.56 CC(C)(C)CSC[N+](=O)[O-] 62a_100011219605_100000761209 [1,1,0,0,0,0|2,0,0]=4 1644 B9R0.56 CC(C)(C)NCCC(=O)N 2230a_100000715429_100000744528 [1,1,0,0,0,0|1,0,0]=3 1645 B9R0.56 CC(C)(C)NOCC(=O)O 269956a_100000106656_100000211941 [1,1,0,0,0,0|2,0,0]=4 1646 B9R0.56 CC(C)(C)OCCC(=O)N 34a_100000757172_100000210625 [1,1,0,0,0,0|1,0,0]=3 1647 B9R0.56 CC(C)(C)OCCC(=O)N 34a_100015890283_100000731001 [1,1,0,0,0,0|1,0,0]=3 1648 B9R0.56 CC(C)(C)OCCC(=O)N 7a_100015890283_100000744528 [1,1,0,0,0,0|1,0,0]=3 1649 B9R0.56 CC(C)(C)SCCC(=O)N 62a_100000211941_100000744528 [1,1,0,0,0,0|1,0,0]=3 1650 B9R0.56 CC(C)(C)SCCC(=O)N 62a_100000744528_100000211941 [1,1,0,0,0,0|1,0,0]=3 1651 B9R0.56 CC(C)(F)CNCC(=O)N 2230a_100020643315_100000747473 [1,1,0,0,0,0|2,0,0]=4 1652 B9R0.56 CC(C)(F)CNCC(=O)O 269956a_100016091260_100011997219 [1,1,0,0,0,0|2,0,0]=4 1653 B9R0.56 CC(C)(F)COCC(=O)N 34a_100000716592_100000187820 [1,1,0,0,0,0|2,0,0]=4 1654 B9R0.56 CC(C)(F)COCC(=O)[O-] 34a_100000716592_100020667443 [1,1,0,0,0,0|2,0,0]=4 1655 B9R0.56 CC(C)(F)CSCC(=O)N 62a_100000747473_100011997219 [1,1,0,0,0,0|2,0,0]=4 1656 B9R0.56 CC(C)(F)CSCC(=O)N 62a_100011997219_100000747473 [1,1,0,0,0,0|2,0,0]=4 1657 B9R0.56 CC(C)(F)CSCC(=O)[O-] 62a_100011997219_100020667443 [1,1,0,0,0,0|2,0,0]=4 1658 B9R0.56 CC(C)(F)CSCC(=O)[O-] 62a_100020667443_100011997219 [1,1,0,0,0,0|2,0,0]=4 1659 B9R0.56 CC(C)(O)CNCC(=O)N 2230a_100000751335_100000747473 [1,1,0,0,0,0|2,0,0]=4 1660 B9R0.56 CC(C)(O)CNCC(=O)O 269956a_100016091260_100000764493 [1,1,0,0,0,0|2,0,0]=4 1661 B9R0.56 CC(C)(O)CSCC(=O)N 62a_100000747473_100000764493 [1,1,0,0,0,0|2,0,0]=4 1662 B9R0.56 CC(C)(O)CSCC(=O)N 62a_100000764493_100000747473 [1,1,0,0,0,0|2,0,0]=4 1663 B9R0.56 CC(C)(O)CSCC(=O)[O-] 62a_100000764493_100020667443 [1,1,0,0,0,0|2,0,0]=4 1664 B9R0.56 CC(C)(O)CSCC(=O)[O-] 62a_100020667443_100000764493 [1,1,0,0,0,0|2,0,0]=4 1665 B9R0.56 C[N+](C)(C)CCCC(=O)[13CH3] 1458a_100000085584_200025704644 [1,1,0,0,0,0|1,0,0]=3 1666 B9R0.56 C[N+](C)(C)CNCC(=O)O 269956a_100016091260_200000036245 [1,1,0,0,0,0|2,0,0]=4 1667 B9R0.56 C[N+](C)(C)CSCC(=O)N 62a_100000747473_200000036245 [1,1,0,0,0,0|2,0,0]=4 1668 B9R0.56 C[N+](C)(C)CSCC(=O)N 62a_200000036245_100000747473 [1,1,0,0,0,0|2,0,0]=4 1669 B9R0.56 C[N+](C)(C)CSCC(=O)[O-] 62a_100020667443_200000036245 [1,1,0,0,0,0|2,0,0]=4 1670 B9R0.56 C[N+](C)(C)CSCC(=O)[O-] 62a_200000036245_100020667443 [1,1,0,0,0,0|2,0,0]=4 1671 B9R0.56 C[Si](C)(C)CNCC(=O)N 2230a_100000711301_100000037933 [1,1,0,0,0,0|1,1,0]=4 1672 B9R0.56 C[Si](C)(C)CNCC(=O)O 269956a_100016091260_100000037933 [1,1,0,0,0,0|1,1,0]=4 1673 B9R0.56 C[Si](C)(C)CSCC(=O)N 62a_100000037933_100000747473 [1,1,0,0,0,0|1,1,0]=4 1674 B9R0.56 C[Si](C)(C)CSCC(=O)N 62a_100000747473_100000037933 [1,1,0,0,0,0|1,1,0]=4 1675 B9R0.56 C[Si](C)(C)CSCC(=O)[O-] 62a_100000037933_100020667443 [1,1,0,0,0,0|1,1,0]=4 1676 B9R0.56 C[Si](C)(C)CSCC(=O)[O-] 62a_100020667443_100000037933 [1,1,0,0,0,0|1,1,0]=4 1677 B9R0.22 C=CC(C)SC(C)(C)CC 62a_100011215867_100000032637 [1,1,0,0,0,0|1,0,1]=4 1678 B9R0.22 CC(CO)NC(C)(C)CO 2230a_100000210608_100012180447 [1,1,0,0,0,0|1,0,1]=4 1679 B9R0.22 CC(CO)OC(C)(C)CCl 7a_100000764493_100012180447 [1,1,0,0,0,0|1,0,1]=4 1680 B9R0.22 CCC(C)(C)NC(C)CO 2230a_100000211385_100012180447 [1,1,0,0,0,0|1,0,1]=4 1681 B9R0.22 CCC(C)(C)OC(C)CF 7a_100016041109_100000210677 [1,1,0,0,0,0|2,0,0]=4 1682 B9R0.22 CCC(C)(C)OC(C)CO 7a_100000210230_100012180447 [1,1,0,0,0,0|1,0,1]=4 1683 B9R0.22 CCC(C)(C)SC(C)CO 62a_100012180447_100000032637 [1,1,0,0,0,0|1,0,1]=4 1684 B9R0.22 CCC(C)(C)S[C@H](C)CO 62a_100000032637_100016084084 [1,1,0,0,0,0|1,0,1]=4 1685 B9R0.22 CCC(C)(C)S[C@H](C)CO 62a_100016084084_100000032637 [1,1,0,0,0,0|1,0,1]=4 1686 B9R0.22 CCC(C)NC(C)(C)CC 2230a_100000211385_100000758301 [1,1,0,0,0,0|1,0,1]=4 1687 B9R0.22 CCC(C)NC(C)(C)CO 2230a_100000210608_100000758301 [1,1,0,0,0,0|1,0,1]=4 1688 B9R0.22 CCC(C)OC(C)(C)CC 7a_100000210228_100000210677 [1,1,0,0,0,0|1,0,1]=4 1689 B9R0.22 CCC(C)OC(C)(C)CC 7a_100000210230_100000758301 [1,1,0,0,0,0|1,0,1]=4 1690 B9R0.22 CCC(C)OC(C)(C)CCl 7a_100000764493_100000758301 [1,1,0,0,0,0|1,0,1]=4 1691 B9R0.22 CCC(C)SC(C)(C)CC 62a_100000032637_100000758301 [1,1,0,0,0,0|1,0,1]=4 1692 B9R0.22 CCC(C)SC(C)(C)CC 62a_100000758301_100000032637 [1,1,0,0,0,0|1,0,1]=4 1693 B9R0.22 CCN(C)CC(C)(C)CO 2230a_100000732702_100000210202 [1,1,0,0,0,0|1,0,1]=4 1694 B9R0.22 CCN(C)CC(C)(C)CO 269982a_100000732702_100000204670 [1,1,0,0,0,0|1,0,1]=4 1695 B9R0.22 CCN(C)CC(C)(C)OC 269982a_100000225621_100000701081 [1,1,0,0,0,0|1,0,1]=4 1696 B9R0.22 CN(CF)CC(C)(C)CO 269982a_100000732702_100015361967 [1,1,0,0,0,0|2,0,0]=4 1697 B9R0.22 COC(C)(C)CC(C)O[13CH3] 7a_200011252547_200025704644 [1,1,0,0,0,0|1,0,1]=4 1698 B9R0.22 COC(C)CC(C)(C)OC 7a_200011252547_200000210301 [1,1,0,0,0,0|1,0,1]=4 1699 B9R0.25 C=CC(C)N(C)C(C)(C)C 269982a_100011215553_100011215867 [1,1,0,0,0,0|1,0,1]=4 1700 B9R0.25 CC(CO)N(C)C(C)(C)C 269982a_100000693034_100000210625 [1,1,0,0,0,0|1,0,1]=4 1701 B9R0.25 CC(N(C)CF)C(C)(C)C 269982a_100000745498_100015361967 [1,1,0,0,0,0|2,0,0]=4 1702 B9R0.25 CCC(C)C(=O)C(C)(C)C 1458a_106744555173_100000758301 [1,1,0,0,0,0|0,0,2]=4 1703 B9R0.25 CCC(C)N(C)C(C)(C)C 269982a_100000741768_100000210625 [1,1,0,0,0,0|1,0,1]=4 1704 B9R0.25 CCC(C)N(C)C(C)(C)C 269982a_100011215553_100000758301 [1,1,0,0,0,0|1,0,1]=4 1705 B9R0.25 CCN(C)C(C)C(C)(C)C 2230a_100000745498_100000210202 [1,1,0,0,0,0|1,0,1]=4 1706 B9R0.25 CCN(C)C(C)C(C)(C)C 269982a_100000745498_100000204670 [1,1,0,0,0,0|1,0,1]=4 1707 B9R0.25 C[C@H](CO)N(C)C(C)(C)C 269982a_100011215553_100016084084 [1,1,0,0,0,0|1,0,1]=4 1708 B9R0.30 C=CC(C)(C)OC(C)(C)C 34a_100011215311_100000210625 [1,1,0,0,0,0|1,0,1]=4 1709 B9R0.30 CC(C)(C)CC(C)(C)N[13CH3] 2230a_100000211918_200025704644 [1,1,0,0,0,0|1,0,1]=4 1710 B9R0.30 CC(C)(C)CC(C)(C)O[13CH3] 7a_100000065652_200025704644 [1,1,0,0,0,0|1,0,1]=4 1711 B9R0.30 CCC(C)(C)OC(C)(C)C 7a_100015890283_100000210677 [1,1,0,0,0,0|1,0,1]=4 1712 B9R0.30 CCC(C)(C)SC(C)(C)C 62a_100000032637_100000211941 [1,1,0,0,0,0|1,0,1]=4 1713 B9R0.30 CCC(C)(C)SC(C)(C)C 62a_100000211941_100000032637 [1,1,0,0,0,0|1,0,1]=4 1714 B9R0.30 CNC(C)(C)CC(C)(C)C 2230a_100000211918_200000210301 [1,1,0,0,0,0|1,0,1]=4 1715 B9R0.30 COC(C)(C)CC(C)(C)C 7a_100000065652_200000210301 [1,1,0,0,0,0|1,0,1]=4 1716 B9R0.52 C=CC(CC)OC(C)(C)C 34a_100000766422_100000210625 [1,1,0,0,0,0|1,0,1]=4 1717 B9R0.52 C=C[C@@H](CO)NC(C)(C)C 34a_100016989147_100000210625 [1,1,0,0,0,0|1,0,1]=4 1718 B9R0.52 CC(C)(C)NC(C=O)C=O 2230a_100000715429_100000736813 [1,1,0,0,0,0|1,0,1]=4 1719 B9R0.52 CC(C)(C)OC(C=O)C=O 34a_100015890283_100000736813 [1,1,0,0,0,0|1,0,1]=4 1720 B9R0.52 CC(C)(C)OC(CF)CF 34a_100000032261_100000210625 [1,1,0,0,0,0|2,0,0]=4 1721 B9R0.52 CC(C)(C)OC(CN)CN 34a_100000031598_100000210625 [1,1,0,0,0,0|2,0,0]=4 1722 B9R0.52 CC(C)(C)O[C@@H](CF)CCl 34a_100015614560_100000210625 [1,1,0,0,0,0|2,0,0]=4 1723 B9R0.52 CC(C)(C)SC(C=O)C=O 62a_100000211941_100000736813 [1,1,0,0,0,0|1,0,1]=4 1724 B9R0.52 CC(C)(C)SC(C=O)C=O 62a_100000736813_100000211941 [1,1,0,0,0,0|1,0,1]=4 1725 B9R0.52 CCC(CC)OC(C)(C)C 7a_100015890283_100000210505 [1,1,0,0,0,0|1,0,1]=4 1726 B9R0.52 CCC(CC)SC(C)(C)C 62a_100000210505_100000211941 [1,1,0,0,0,0|1,0,1]=4 1727 B9R0.52 CCC(CC)SC(C)(C)C 62a_100000211941_100000210505 [1,1,0,0,0,0|1,0,1]=4 1728 B9R0.52 CCN(CC)CC(C)(C)C 2230a_100000732750_100000210202 [1,1,0,0,0,0|1,0,1]=4 1729 B9R0.52 CCN(CC)CC(C)(C)C 269956a_100000042499_100011219605 [1,1,0,0,0,0|1,0,1]=4 1730 B9R0.52 CCN(CC)CC(C)(C)C 269982a_100000732750_100000204670 [1,1,0,0,0,0|1,0,1]=4 1731 B9R0.52 CCN(CC)CC(C)(C)C 270004a_100000724800_100011204126 [1,1,0,0,0,0|1,0,1]=4 1732 B9R0.52 CCN(CF)CC(C)(C)C 269982a_100000732750_100015361967 [1,1,0,0,0,0|1,0,1]=4 1733 B9R0.57 CC(=O)C(C)NC(C)(C)C 2230a_100000715429_100009814033 [1,1,0,0,0,0|1,0,0]=3 1734 B9R0.57 CC(=O)C(C)OC(C)(C)C 34a_100000212229_100000210625 [1,1,0,0,0,0|1,0,0]=3 1735 B9R0.57 CC(=O)C(C)OC(C)(C)C 7a_100015890283_100000179758 [1,1,0,0,0,0|1,0,0]=3 1736 B9R0.57 CC(=O)C(C)SC(C)(C)C 62a_100000211941_100009814033 [1,1,0,0,0,0|1,0,0]=3 1737 B9R0.57 CC(=O)C(C)SC(C)(C)C 62a_100009814033_100000211941 [1,1,0,0,0,0|1,0,0]=3 1738 B9R0.57 CC(=O)N(C)CC(C)(C)C 11a_100000742839_100015343762 [1,1,0,0,0,0|1,0,0]=3 1739 B9R0.57 CC(=O)N(C)CC(C)(C)C 1626a_100000742839_100015343762 [1,1,0,0,0,0|1,0,0]=3 1740 B9R0.57 CC(=O)N(C)CC(C)(C)C 240690a_100000742839_100015343762 [1,1,0,0,0,0|1,0,0]=3 1741 B9R0.57 CC(=O)N(C)CC(C)(C)C 527a_100000742839_100103153847 [1,1,0,0,0,0|1,0,0]=3 1742 B9R0.57 CC(=O)N(C)CC(C)(C)O 1626a_100000755907_100015343762 [1,1,0,0,0,0|2,0,0]=4 1743 B9R0.57 CC(=O)N(C)CC(C)(C)O 240690a_100000755907_100015343762 [1,1,0,0,0,0|2,0,0]=4 1744 B9R0.57 CC(=O)N(C)CC(C)(C)O 527a_100000755907_100103153847 [1,1,0,0,0,0|2,0,0]=4 1745 B9R0.57 CC(=O)N(C)C[Si](C)(C)C 11a_200020589227_100015343762 [1,1,0,0,0,0|1,1,0]=4 1746 B9R0.57 CC(=O)N(C)C[Si](C)(C)C 1626a_200020589227_100015343762 [1,1,0,0,0,0|1,1,0]=4 1747 B9R0.57 CC(=O)N(C)C[Si](C)(C)C 240690a_200020589227_100015343762 [1,1,0,0,0,0|1,1,0]=4 1748 B9R0.57 CC(=O)N(C)C[Si](C)(C)C 527a_200020589227_100103153847 [1,1,0,0,0,0|1,1,0]=4 1749 B9R0.57 CC(C)(C)NC(F)C(=O)N 2230a_100000715429_100009813875 [1,1,0,0,0,0|2,0,0]=4 1750 B9R0.57 CC(C)(C)OC(F)C(=O)N 34a_100015890283_100009813875 [1,1,0,0,0,0|2,0,0]=4 1751 B9R0.57 CC(C)(C)OC(F)C(=O)N 7a_100015890283_100009813875 [1,1,0,0,0,0|2,0,0]=4 1752 B9R0.57 CC(C)(C)OC(F)C(=O)[O-] 34a_100015890283_100020610796 [1,1,0,0,0,0|2,0,0]=4 1753 B9R0.57 CC(C)(C)SC(F)C(=O)N 62a_100000211941_100009813875 [1,1,0,0,0,0|2,0,0]=4 1754 B9R0.57 CC(C)(C)SC(F)C(=O)N 62a_100009813875_100000211941 [1,1,0,0,0,0|2,0,0]=4 1755 B9R0.57 CC(C)(C)SC(F)C(=O)[O-] 62a_100000211941_100020610796 [1,1,0,0,0,0|2,0,0]=4 1756 B9R0.57 CC(C)(C)SC(F)C(=O)[O-] 62a_100020610796_100000211941 [1,1,0,0,0,0|2,0,0]=4 1757 B9R0.57 CC(C)N(C)CC(C)(C)C 2230a_100000742839_100000210206 [1,1,0,0,0,0|1,0,1]=4 1758 B9R0.57 CC(C)N(C)CC(C)(C)C 2230a_107254826865_200000210301 [1,1,0,0,0,0|1,0,1]=4 1759 B9R0.57 CC(C)N(C)CC(C)(C)C 269982a_100000742839_100000210206 [1,1,0,0,0,0|1,0,1]=4 1760 B9R0.57 CC(C)N(C)CC(C)(C)C 269982a_107254826865_200000210301 [1,1,0,0,0,0|1,0,1]=4 1761 B9R0.57 CC(C)N(C)CC(C)(C)C 270004a_200000211004_100011204126 [1,1,0,0,0,0|1,0,1]=4 1762 B9R0.57 CC(C)N([13CH3])CC(C)(C)C 2230a_107254826865_200025704644 [1,1,0,0,0,0|1,0,1]=4 1763 B9R0.57 CC(C)N([13CH3])CC(C)(C)C 269982a_107254826865_200025704644 [1,1,0,0,0,0|1,0,1]=4 1764 B9R0.57 CC(NC(C)(C)C)C(=O)N 2230a_100000715429_100000702099 [1,1,0,0,0,0|1,0,0]=3 1765 B9R0.57 CC(OC(C)(C)C)C(=O)N 34a_100015890283_100000702099 [1,1,0,0,0,0|1,0,0]=3 1766 B9R0.57 CC(OC(C)(C)C)C(=O)N 7a_100015890283_100000702099 [1,1,0,0,0,0|1,0,0]=3 1767 B9R0.57 CC(SC(C)(C)C)C(=O)N 62a_100000211941_100000702099 [1,1,0,0,0,0|1,0,0]=3 1768 B9R0.57 CC(SC(C)(C)C)C(=O)N 62a_100000702099_100000211941 [1,1,0,0,0,0|1,0,0]=3 1769 B9R0.57 C[C@@H](NC(C)(C)C)C(=O)N 34a_100000119354_100000210625 [1,1,0,0,0,0|1,0,0]=3 1770 B9R0.57 C[C@@H](OC(C)(C)C)C(=O)N 34a_100000731257_100000210625 [1,1,0,0,0,0|1,0,0]=3 1771 B9R0.57 C[C@H](NC(C)(C)C)C(=O)O 269956a_100000743915_100000211941 [1,1,0,0,0,0|1,0,0]=3 1772 B9R0.9 C=CCN(CC)C(C)(C)C 2230a_100011200764_100000210623 [0,1,0,0,1,0|2,0,0]=4 1773 B9R0.9 C=CCN(CC)C(C)(C)C 2230a_100025770937_100000210202 [0,1,0,0,1,0|2,0,0]=4 1774 B9R0.9 C=CCN(CC)C(C)(C)C 269982a_100011200764_100000210623 [0,1,0,0,1,0|2,0,0]=4 1775 B9R0.9 C=CCN(CC)C(C)(C)C 269982a_100025770937_100000204670 [0,1,0,0,1,0|2,0,0]=4 1776 B9R0.9 C=CCN(CF)C(C)(C)C 269982a_100025770937_100015361967 [0,1,0,0,1,0|2,0,0]=4 1777 B9R0.9 CCCC(OC)C(C)(C)C 7a_200011216373_200000210301 [0,1,0,0,1,0|1,0,1]=4 1778 B9R0.9 CCCC(O[13CH3])C(C)(C)C 7a_200011216373_200025704644 [0,1,0,0,1,0|1,0,1]=4 1779 B9R0.9 CCN(CC=O)C(C)(C)C 2230a_100011200764_200015260668 [0,1,0,0,1,0|1,0,0]=3 1780 B9R0.9 CCN(CC=O)C(C)(C)C 269982a_100011200764_200015260668 [0,1,0,0,1,0|1,0,0]=3 1781 B9R0.10 C=C(C)CN(C)C(C)(C)C 269982a_100000225649_100000210625 [0,1,0,0,1,0|2,0,0]=4 1782 B9R0.10 C=C(C)CN(C)C(C)(C)C 269982a_100011215553_100000748629 [0,1,0,0,1,0|2,0,0]=4 1783 B9R0.10 C=C(F)CN(C)C(C)(C)C 269982a_100011215553_100009893438 [0,1,0,0,1,0|2,0,0]=4 1784 B9R0.10 CC(=CC(=O)[13CH3])C(C)(C)C 1458a_100020591210_200025704644 [0,1,0,0,1,0|0,0,2]=4 1785 B9R0.10 CC(=O)C=C(C)C(C)(C)C 1458a_100020591210_200000210301 [0,1,0,0,1,0|0,0,2]=4 1786 B9R0.10 CC(=O)CC(=O)C(C)(C)C 1458a_100000070787_100000210923 [0,1,0,0,1,0|1,0,1]=4 1787 B9R0.10 CC(=O)N[C@@H](C)C(C)(C)O 11a_100025708725_100015343762 [0,1,0,0,1,0|2,0,0]=4 1788 B9R0.10 CC(=O)N[C@@H](C)C(C)(C)O 1626a_100025708725_100015343762 [0,1,0,0,1,0|2,0,0]=4 1789 B9R0.10 CC(=O)N[C@@H](C)C(C)(C)O 240690a_100025708725_100015343762 [0,1,0,0,1,0|2,0,0]=4 1790 B9R0.10 CC(=O)N[C@@H](C)C(C)(C)O 527a_100025708725_100103153847 [0,1,0,0,1,0|2,0,0]=4 1791 B9R0.10 CC(=O)N[C@H](C)C(C)(C)C 11a_100025703359_100015343762 [0,1,0,0,1,0|1,0,0]=3 1792 B9R0.10 CC(=O)N[C@H](C)C(C)(C)C 1626a_100025703359_100015343762 [0,1,0,0,1,0|1,0,0]=3 1793 B9R0.10 CC(=O)N[C@H](C)C(C)(C)C 240690a_100025703359_100015343762 [0,1,0,0,1,0|1,0,0]=3 1794 B9R0.10 CC(=O)N[C@H](C)C(C)(C)C 527a_100025703359_100103153847 [0,1,0,0,1,0|1,0,0]=3 1795 B9R0.10 CC(C)(C)C(=O)CC(=O)N 1458a_106744555173_100000187820 [0,1,0,0,1,0|1,0,1]=4 1796 B9R0.10 CC(C)(C)C(=O)CC(=O)[O-] 1458a_106744555173_100020667443 [0,1,0,0,1,0|1,0,1]=4 1797 B9R0.10 CC(C)(C)N([13CH3])CC(=O)O 269956a_100000745166_200025704644 [0,1,0,0,1,0|1,0,0]=3 1798 B9R0.10 CN(CC(=O)N)C(C)(C)C 269982a_100011215553_100000187820 [0,1,0,0,1,0|1,0,0]=3 1799 B9R0.10 CN(CC(=O)O)C(C)(C)C 269956a_100000745166_200000210301 [0,1,0,0,1,0|1,0,0]=3 1800 B9R0.10 CN(CC(=O)O)C(C)(C)C 269956a_100000746989_100000211941 [0,1,0,0,1,0|1,0,0]=3 1801 B9R0.10 CN(CC(=O)[O-])C(C)(C)C 269982a_100011215553_100020667443 [0,1,0,0,1,0|1,0,0]=3 1802 B9R0.10 CN(C[N+](=O)[O-])C(C)(C)C 269982a_100011215553_100000761209 [0,1,0,0,1,0|2,0,0]=4 1803 B9R0.19 C=CCN(C)C(C)(C)CC 2230a_200000755171_100000210623 [0,1,0,0,1,0|2,0,0]=4 1804 B9R0.19 C=CCN(C)C(C)(C)CC 269982a_100000225617_100000032637 [0,1,0,0,1,0|2,0,0]=4 1805 B9R0.19 C=CCN(C)C(C)(C)CC 269982a_200000755171_100000210623 [0,1,0,0,1,0|2,0,0]=4 1806 B9R0.19 C=CCN(C)C(C)(C)CO 269982a_100015204102_100000210623 [0,1,0,0,1,0|2,0,0]=4 1807 B9R0.19 CCC(C)(C)N(C)CC=O 2230a_200000755171_200015260668 [0,1,0,0,1,0|1,0,0]=3 1808 B9R0.19 CCC(C)(C)N(C)CC=O 269982a_200000755171_200015260668 [0,1,0,0,1,0|1,0,0]=3 1809 B9R0.19 CCCC(C)C(C)(C)OC 7a_200011218223_200000210301 [0,1,0,0,1,0|1,0,1]=4 1810 B9R0.19 CCCC(C)C(C)(C)O[13CH3] 7a_200011218223_200025704644 [0,1,0,0,1,0|1,0,1]=4 1811 B9R0.19 CN(CC=O)C(C)(C)CO 269982a_100015204102_200015260668 [0,1,0,0,1,0|1,0,0]=3 1812 B11R0.54 C=CCN(C)CC(=O)C(C)(C)C 269982a_100000225617_100000210923 [0,1,0,0,0,1|2,0,0]=4 1813 B11R0.54 CC(CC#N)N[C@H](C)C(C)(C)C 2230a_100025703359_100009813641 [0,1,0,0,0,1|1,0,1]=4 1814 B11R0.54 CC(CCO)N[C@H](C)C(C)(C)C 2230a_100025703359_100009893172 [0,1,0,0,0,1|0,0,2]=4 1815 B11R0.54 CCCC(C)CC(=O)C(C)(C)C 1458a_106744555173_100011216630 [0,1,0,0,0,1|1,0,1]=4 1816 B11R0.54 CCCC(C)CN(C)C(C)(C)C 269982a_100011215553_100011216630 [0,1,0,0,0,1|1,0,1]=4 1817 B11R0.54 CCCC(C)CN(C)C(C)(C)C 270004a_100011215553_100000243154 [0,1,0,0,0,1|1,0,1]=4 1818 B11R0.54 CCCC(C)N[C@H](C)C(C)(C)C 2230a_100025703359_100000766640 [0,1,0,0,0,1|1,0,1]=4 1819 B11R0.54 CCCC(C)N[C@H](C)C(C)(C)C 270004a_100025703359_100000211909 [0,1,0,0,0,1|1,0,1]=4 1820 B11R0.54 COCC(C)N[C@H](C)C(C)(C)C 2230a_100025703359_100000765312 [0,1,0,0,0,1|2,0,0]=4 1821 B11R0.54 COCC(C)N[C@H](C)C(C)(C)C 270004a_100025703359_100000749346 [0,1,0,0,0,1|2,0,0]=4 1822 B11R0.54 CSCC(C)N[C@H](C)C(C)(C)C 270004a_100025703359_100011216314 [0,1,0,0,0,1|2,0,0]=4 1823 B11R0.82 C#CCOC(C)COC(C)(C)C 34a_200000093152_100000210625 [0,1,0,0,0,1|1,0,1]=4 1824 B11R0.82 C#CCOC(C)COC(C)(C)C 7a_100011215624_100000038162 [0,1,0,0,0,1|1,0,1]=4 1825 B11R0.82 C=CCCC(C)NCC(C)(C)C 270004a_100000743828_100000762624 [0,1,0,0,0,1|1,0,0]=3 1826 B11R0.82 C=CCCC(C)NCC(C)(C)F 270004a_100020643315_100000762624 [0,1,0,0,0,1|2,0,0]=4 1827 B11R0.82 C=CCCC(C)NCC(C)(C)O 270004a_100000751335_100000762624 [0,1,0,0,0,1|2,0,0]=4 1828 B11R0.82 C=CCCC(C)OCC(C)(C)C 34a_100000765329_100011219605 [0,1,0,0,0,1|1,0,0]=3 1829 B11R0.82 C=CCCC(C)OCC(C)(C)F 34a_100000765329_100011997219 [0,1,0,0,0,1|2,0,0]=4 1830 B11R0.82 C=CCCC(C)OCC(C)(C)O 34a_100000765329_100000764493 [0,1,0,0,0,1|2,0,0]=4 1831 B11R0.82 C=CCCC(C)OCC(C)(C)O 7a_100000765329_100000764493 [0,1,0,0,0,1|2,0,0]=4 1832 B11R0.82 C=CCCC(C)OC[Si](C)(C)C 7a_100000765329_100000233785 [0,1,0,0,0,1|1,1,0]=4 1833 B11R0.82 C=CCCN(C)CCC(C)(C)C 2230a_100020639649_100000755188 [0,1,0,0,0,1|2,0,0]=4 1834 B11R0.82 C=CCCN(C)CCC(C)(C)C 269982a_100020639649_100000755188 [0,1,0,0,0,1|2,0,0]=4 1835 B11R0.82 C=CCNC(C)CSC(C)(C)C 270004a_100020586998_100000175412 [0,1,0,0,0,1|1,0,0]=3 1836 B11R0.82 C=CCOC(C)COC(C)(C)C 7a_100011215624_100015514636 [0,1,0,0,0,1|1,0,0]=3 1837 B11R0.82 CC(C#C[Si](C)(C)C)OCC=O 7a_100000035768_200015260668 [0,1,0,0,0,1|0,1,1]=4 1838 B11R0.82 CC(CCCCl)OCC(C)(C)C 34a_200000718107_100011219605 [0,1,0,0,0,1|1,0,1]=4 1839 B11R0.82 CC(COC(C)(C)C)OCC#N 7a_100011215624_100011215382 [0,1,0,0,0,1|1,0,1]=4 1840 B11R0.82 CC(COC(C)(C)C)OCC=O 7a_100011215624_200015260668 [0,1,0,0,0,1|0,0,0]=2 1841 B11R0.82 CC(COC(C)(C)C)OCCF 7a_100011215624_100011217306 [0,1,0,0,0,1|1,0,1]=4 1842 B11R0.82 CC(COC(C)(C)C)OCCO 7a_100011215624_100000211926 [0,1,0,0,0,1|0,0,2]=4 1843 B11R0.82 CC(CSC(C)(C)C)NCCO 270004a_100000210304_100000175412 [0,1,0,0,0,1|0,0,2]=4 1844 B11R0.82 CCCCC(C)COC(C)(C)C 34a_100011995851_100000210625 [0,1,0,0,0,1|1,0,1]=4 1845 B11R0.82 CCCCC(C)NCC(C)(C)C 2230a_100000743828_200011215066 [0,1,0,0,0,1|1,0,1]=4 1846 B11R0.82 CCCCC(C)NCC(C)(C)C 270004a_100000126638_100011204126 [0,1,0,0,0,1|1,0,1]=4 1847 B11R0.82 CCCCC(C)NCC(C)(C)C 270004a_100000743828_100000210087 [0,1,0,0,0,1|1,0,1]=4 1848 B11R0.82 CCCCC(C)OCC(C)(C)C 34a_100000687866_100011219605 [0,1,0,0,0,1|1,0,1]=4 1849 B11R0.82 CCCCC(C)SCC(C)(C)C 62a_100011219605_200011215066 [0,1,0,0,0,1|1,0,1]=4 1850 B11R0.82 CCCCC(C)SCC(C)(C)C 62a_200011215066_100011219605 [0,1,0,0,0,1|1,0,1]=4 1851 B11R0.82 CCCNC(C)CSC(C)(C)C 270004a_100020643023_100000175412 [0,1,0,0,0,1|1,0,1]=4 1852 B11R0.82 CCCOC(C)CNC(C)(C)C 34a_100015185124_100000210625 [0,1,0,0,0,1|1,0,1]=4 1853 B11R0.82 CCCOC(C)COC(C)(C)C 7a_100011215624_100000210303 [0,1,0,0,0,1|1,0,1]=4 1854 B11R0.82 CCOCC(C)OCC(C)(C)C 34a_100000718985_100011219605 [0,1,0,0,0,1|1,0,1]=4 1855 B11R0.82 CCSCC(C)NCC(C)(C)C 270004a_100000743828_200011216171 [0,1,0,0,0,1|1,0,1]=4 1856 B11R0.82 COCCC(C)NCC(C)(C)C 270004a_100000743828_100000742357 [0,1,0,0,0,1|0,0,2]=4 1857 B11R0.82 COCO[C@H](C)COC(C)(C)C 34a_100016172286_100000210625 [0,1,0,0,0,1|2,0,0]=4 1858 B11R0.82 CSCCC(C)NCC(C)(C)C 270004a_100000743828_100011217047 [0,1,0,0,0,1|0,1,1]=4 1859 B11R0.82 C[C@H](CCCO)CNC(C)(C)C 34a_100160569302_100000210625 [0,1,0,0,0,1|0,0,2]=4 1860 B11R0.170 C#CC(C)(C)OCC(C)CC=C 34a_100009832082_100000038118 [0,1,0,0,0,1|1,0,1]=4 1861 B11R0.170 C#CCC(C)OCC(C)(C)CO 34a_100000685586_100009813988 [0,1,0,0,0,1|1,0,1]=4 1862 B11R0.170 C#CCC(C)OCC(C)(C)CO 7a_100000685586_100009813988 [0,1,0,0,0,1|1,0,1]=4 1863 B11R0.170 C#CCC(C)OCC(C)(C)OC 34a_100000685586_100000701081 [0,1,0,0,0,1|1,0,1]=4 1864 B11R0.170 C/C=C/C(C)OCC(C)(C)CO 34a_200102604097_100009813988 [0,1,0,0,0,1|1,0,1]=4 1865 B11R0.170 C/C=C/C(C)OCC(C)(C)OC 34a_200102604097_100000701081 [0,1,0,0,0,1|1,0,1]=4 1866 B11R0.170 C=CCC(C)COC(C)(C)C#N 34a_100009832082_100011162410 [0,1,0,0,0,1|1,0,1]=4 1867 B11R0.170 C=CCC(C)COC(C)(C)C#N 7a_100009832082_100011162410 [0,1,0,0,0,1|1,0,1]=4 1868 B11R0.170 C=CCC(C)COC(C)(C)CC 7a_100009832082_100000210677 [0,1,0,0,0,1|1,0,0]=3 1869 B11R0.170 C=CC[C@@H](C)OCC(C)(C)CO 34a_100000731007_100009813988 [0,1,0,0,0,1|1,0,0]=3 1870 B11R0.170 C=CC[C@@H](C)OCC(C)(C)CO 7a_100000731007_100009813988 [0,1,0,0,0,1|1,0,0]=3 1871 B11R0.170 C=CC[C@@H](C)OCC(C)(C)OC 34a_100000731007_100000701081 [0,1,0,0,0,1|1,0,0]=3 1872 B11R0.170 CC(CC#N)NCC(C)(C)CO 2230a_100020635058_100009813641 [0,1,0,0,0,1|1,0,1]=4 1873 B11R0.170 CC(CC#N)OCC(C)(C)CCl 7a_100011217199_100009813641 [0,1,0,0,0,1|1,0,1]=4 1874 B11R0.170 CC(CC#N)SCC(C)(C)CO 62a_100009813641_100009813988 [0,1,0,0,0,1|1,0,1]=4 1875 B11R0.170 CC(CC#N)SCC(C)(C)CO 62a_100009813988_100009813641 [0,1,0,0,0,1|1,0,1]=4 1876 B11R0.170 CC(CCBr)OCC(C)(C)CO 34a_100012276601_100009813988 [0,1,0,0,0,1|1,0,1]=4 1877 B11R0.170 CC(CCO)NCC(C)(C)CO 2230a_100020635058_100009893172 [0,1,0,0,0,1|0,0,2]=4 1878 B11R0.170 CC(CCO)OCC(C)(C)CCl 7a_100011217199_100009893172 [0,1,0,0,0,1|0,0,2]=4 1879 B11R0.170 CC(CCO)SCC(C)(C)CO 62a_100009813988_100009893172 [0,1,0,0,0,1|0,0,2]=4 1880 B11R0.170 CC(CCO)SCC(C)(C)CO 62a_100009893172_100009813988 [0,1,0,0,0,1|0,0,2]=4 1881 B11R0.170 CCC(C)(C)COC(C)CC#N 7a_100000765029_100009813641 [0,1,0,0,0,1|1,0,1]=4 1882 B11R0.170 CCC(C)(C)COC(C)CCO 7a_100000765029_100009893172 [0,1,0,0,0,1|0,0,2]=4 1883 B11R0.170 CCC(C)(C)COC(C)COC 7a_100000765029_100000765312 [0,1,0,0,0,1|2,0,0]=4 1884 B11R0.170 CCCC(C)CNC(C)(C)CC 2230a_100000211385_100011216630 [0,1,0,0,0,1|1,0,1]=4 1885 B11R0.170 CCCC(C)CNC(C)(C)CC 270004a_100000211385_100000243154 [0,1,0,0,0,1|1,0,1]=4 1886 B11R0.170 CCCC(C)CNC(C)(C)CO 2230a_100000210608_100011216630 [0,1,0,0,0,1|1,0,1]=4 1887 B11R0.170 CCCC(C)CNC(C)(C)CO 270004a_100000210608_100000243154 [0,1,0,0,0,1|1,0,1]=4 1888 B11R0.170 CCCC(C)COC(C)(C)CC 7a_100000210230_100011216630 [0,1,0,0,0,1|1,0,1]=4 1889 B11R0.170 CCCC(C)COC(C)(C)CC 7a_100000688023_100000210677 [0,1,0,0,0,1|1,0,1]=4 1890 B11R0.170 CCCC(C)COC(C)(C)CCl 7a_100000764493_100011216630 [0,1,0,0,0,1|1,0,1]=4 1891 B11R0.170 CCCC(C)CSC(C)(C)CC 62a_100000032637_100011216630 [0,1,0,0,0,1|1,0,1]=4 1892 B11R0.170 CCCC(C)CSC(C)(C)CC 62a_100011216630_100000032637 [0,1,0,0,0,1|1,0,1]=4 1893 B11R0.170 CCCC(C)NCC(C)(C)CO 2230a_100020635058_100000766640 [0,1,0,0,0,1|1,0,1]=4 1894 B11R0.170 CCCC(C)NCC(C)(C)CO 270004a_100020635058_100000211909 [0,1,0,0,0,1|1,0,1]=4 1895 B11R0.170 CCCC(C)NCC(C)(C)OC 2230a_100000763424_100000766640 [0,1,0,0,0,1|1,0,1]=4 1896 B11R0.170 CCCC(C)NCC(C)(C)OC 270004a_100000763424_100000211909 [0,1,0,0,0,1|1,0,1]=4 1897 B11R0.170 CCCC(C)NCC(C)(C)SC 270004a_100000741246_100009845794 [0,1,0,0,0,1|1,0,1]=4 1898 B11R0.170 CCCC(C)OCC(C)(C)CC 7a_100000765029_100000766640 [0,1,0,0,0,1|1,0,1]=4 1899 B11R0.170 CCCC(C)OCC(C)(C)CCl 7a_100011217199_100000766640 [0,1,0,0,0,1|1,0,1]=4 1900 B11R0.170 CCCC(C)OCC(C)(C)CO 34a_100000764384_100009813988 [0,1,0,0,0,1|1,0,1]=4 1901 B11R0.170 CCCC(C)OCC(C)(C)CO 7a_100000764384_100009813988 [0,1,0,0,0,1|1,0,1]=4 1902 B11R0.170 CCCC(C)OCC(C)(C)OC 34a_100000764384_100000701081 [0,1,0,0,0,1|1,0,1]=4 1903 B11R0.170 CCCC(C)SCC(C)(C)CO 62a_100000766640_100009813988 [0,1,0,0,0,1|1,0,1]=4 1904 B11R0.170 CCCC(C)SCC(C)(C)CO 62a_100009813988_100000766640 [0,1,0,0,0,1|1,0,1]=4 1905 B11R0.170 CCCC(C)SCC(C)(C)OC 62a_100000701081_100000766640 [0,1,0,0,0,1|1,0,1]=4 1906 B11R0.170 CCCC(C)SCC(C)(C)OC 62a_100000766640_100000701081 [0,1,0,0,0,1|1,0,1]=4 1907 B11R0.170 COC(C)(C)CNC(C)CC#N 2230a_100000763424_100009813641 [0,1,0,0,0,1|1,0,1]=4 1908 B11R0.170 COC(C)(C)CNC(C)CCO 2230a_100000763424_100009893172 [0,1,0,0,0,1|0,0,2]=4 1909 B11R0.170 COC(C)(C)CNC(C)CSC 270004a_100000763424_100011216314 [0,1,0,0,0,1|2,0,0]=4 1910 B11R0.170 COC(C)(C)CN[C@H](C)CCO 34a_100000706166_100000701081 [0,1,0,0,0,1|0,0,2]=4 1911 B11R0.170 COC(C)(C)COC(C)CCBr 34a_100012276601_100000701081 [0,1,0,0,0,1|1,0,1]=4 1912 B11R0.170 COC(C)(C)CSC(C)CC#N 62a_100000701081_100009813641 [0,1,0,0,0,1|1,0,1]=4 1913 B11R0.170 COC(C)(C)CSC(C)CC#N 62a_100009813641_100000701081 [0,1,0,0,0,1|1,0,1]=4 1914 B11R0.170 COC(C)(C)CSC(C)CCO 62a_100000701081_100009893172 [0,1,0,0,0,1|0,0,2]=4 1915 B11R0.170 COC(C)(C)CSC(C)CCO 62a_100009893172_100000701081 [0,1,0,0,0,1|0,0,2]=4 1916 B11R0.170 COCC(C)NCC(C)(C)CO 2230a_100020635058_100000765312 [0,1,0,0,0,1|2,0,0]=4 1917 B11R0.170 COCC(C)NCC(C)(C)CO 270004a_100020635058_100000749346 [0,1,0,0,0,1|2,0,0]=4 1918 B11R0.170 COCC(C)NCC(C)(C)OC 2230a_100000763424_100000765312 [0,1,0,0,0,1|2,0,0]=4 1919 B11R0.170 COCC(C)NCC(C)(C)OC 270004a_100000763424_100000749346 [0,1,0,0,0,1|2,0,0]=4 1920 B11R0.170 COCC(C)OCC(C)(C)CCl 7a_100011217199_100000765312 [0,1,0,0,0,1|2,0,0]=4 1921 B11R0.170 COCC(C)SCC(C)(C)CO 62a_100000765312_100009813988 [0,1,0,0,0,1|2,0,0]=4 1922 B11R0.170 COCC(C)SCC(C)(C)CO 62a_100009813988_100000765312 [0,1,0,0,0,1|2,0,0]=4 1923 B11R0.170 COCC(C)SCC(C)(C)OC 62a_100000701081_100000765312 [0,1,0,0,0,1|2,0,0]=4 1924 B11R0.170 COCC(C)SCC(C)(C)OC 62a_100000765312_100000701081 [0,1,0,0,0,1|2,0,0]=4 1925 B11R0.170 COC[C@@H](C)NCC(C)(C)SC 270004a_100000764878_100009845794 [0,1,0,0,0,1|2,0,0]=4 1926 B11R0.170 COC[C@@H](C)OCC(C)(C)CO 34a_100011934205_100009813988 [0,1,0,0,0,1|2,0,0]=4 1927 B11R0.170 COC[C@@H](C)OCC(C)(C)OC 34a_100011934205_100000701081 [0,1,0,0,0,1|2,0,0]=4 1928 B11R0.170 CSC(C)(C)CN[C@H](C)CCO 270004a_100000706166_100009845794 [0,1,0,0,0,1|0,0,2]=4 1929 B11R0.170 CSCC(C)NCC(C)(C)CO 270004a_100020635058_100011216314 [0,1,0,0,0,1|2,0,0]=4 1930 B11R0.170 C[C@H](CCO)NCC(C)(C)CO 34a_100000706166_100009813988 [0,1,0,0,0,1|0,0,2]=4 1931 B11R0.186 C=CCC(C)C(=O)C[Si](C)(C)C 1458a_100011216819_100000233785 [0,1,0,0,0,1|1,1,0]=4 1932 B11R0.186 C=CCC(C)C(=O)NC(C)(C)C 11a_100000715429_100011216819 [0,1,0,0,0,1|1,0,1]=4 1933 B11R0.186 C=CCC(C)C(=O)NC(C)(C)C 1626a_100000715429_100011216819 [0,1,0,0,0,1|1,0,1]=4 1934 B11R0.186 C=CCC(C)C(=O)NC(C)(C)C 240690a_100000715429_100011216819 [0,1,0,0,0,1|1,0,1]=4 1935 B11R0.186 C=CCC(C)C(=O)NC(C)(C)C 527a_100000715429_100011216819 [0,1,0,0,0,1|1,0,1]=4 1936 B11R0.186 C=CCN(C)C(=O)CC(C)(C)C 11a_100000225617_100000211214 [0,1,0,0,0,1|2,0,0]=4 1937 B11R0.186 C=CCN(C)C(=O)CC(C)(C)C 1626a_100000225617_100000211214 [0,1,0,0,0,1|2,0,0]=4 1938 B11R0.186 C=CCN(C)C(=O)CC(C)(C)C 240690a_100000225617_100000211214 [0,1,0,0,0,1|2,0,0]=4 1939 B11R0.186 C=CCN(C)C(=O)CC(C)(C)C 527a_100000225617_100000211214 [0,1,0,0,0,1|2,0,0]=4 1940 B11R0.186 CC(CC#N)C(=O)CC(C)(C)C 1458a_100000211214_100009813641 [0,1,0,0,0,1|1,0,1]=4 1941 B11R0.186 CC(CC#N)N(C)CC(C)(C)C 2230a_100000742839_100009813641 [0,1,0,0,0,1|1,0,1]=4 1942 B11R0.186 CC(CC#N)N(C)CC(C)(C)C 269982a_100000742839_100009813641 [0,1,0,0,0,1|1,0,1]=4 1943 B11R0.186 CC(CCO)C(=O)CC(C)(C)C 1458a_100000211214_100009893172 [0,1,0,0,0,1|0,0,2]=4 1944 B11R0.186 CC(CCO)N(C)CC(C)(C)C 2230a_100000742839_100009893172 [0,1,0,0,0,1|0,0,2]=4 1945 B11R0.186 CC(CCO)N(C)CC(C)(C)C 269982a_100000742839_100009893172 [0,1,0,0,0,1|0,0,2]=4 1946 B11R0.186 CC(CCO)N(C)CC(C)(C)C 270004a_100000731037_100011204126 [0,1,0,0,0,1|0,0,2]=4 1947 B11R0.186 CCCC(C)C(=O)CC(C)(C)C 1458a_100000211214_100000766640 [0,1,0,0,0,1|1,0,1]=4 1948 B11R0.186 CCCC(C)C(C)OC(C)(C)C 34a_100000708338_100000210625 [0,1,0,0,0,1|1,0,1]=4 1949 B11R0.186 CCCC(C)N(C)CC(C)(C)C 2230a_100000742839_100000766640 [0,1,0,0,0,1|1,0,1]=4 1950 B11R0.186 CCCC(C)N(C)CC(C)(C)C 269982a_100000742839_100000766640 [0,1,0,0,0,1|1,0,1]=4 1951 B11R0.186 CCCC(C)N(C)CC(C)(C)C 270004a_100000742839_100000211909 [0,1,0,0,0,1|1,0,1]=4 1952 B11R0.186 COCC(C)C(=O)CC(C)(C)C 1458a_100000211214_100000765312 [0,1,0,0,0,1|2,0,0]=4 1953 B11R0.186 COCC(C)N(C)CC(C)(C)C 2230a_100000742839_100000765312 [0,1,0,0,0,1|2,0,0]=4 1954 B11R0.186 COCC(C)N(C)CC(C)(C)C 269982a_100000742839_100000765312 [0,1,0,0,0,1|2,0,0]=4 1955 B11R0.186 COCC(C)N(C)CC(C)(C)C 270004a_100000742839_100000749346 [0,1,0,0,0,1|2,0,0]=4 1956 B11R0.186 CSCC(C)N(C)CC(C)(C)C 270004a_100000742839_100011216314 [0,1,0,0,0,1|2,0,0]=4 1957 B11R0.196 C#CCC(CC)OCC(C)(C)C 34a_200011217983_100011219605 [0,1,0,0,0,1|1,0,1]=4 1958 B11R0.196 C=CCC(C=C)OCC(C)(C)C 34a_100000038011_100011219605 [0,1,0,0,0,1|1,0,1]=4 1959 B11R0.196 C=CC[C@H](CO)NCC(C)(C)C 270004a_100020615467_100011204126 [0,1,0,0,0,1|1,0,0]=3 1960 B11R0.196 C=CC[C@H](CO)NC[Si](C)(C)C 2230a_100020615467_100000037933 [0,1,0,0,0,1|1,1,0]=4 1961 B11R0.196 CCC(COC)NCC(C)(C)C 270004a_100000743828_100000757811 [0,1,0,0,0,1|2,0,0]=4 1962 B11R0.196 CCC(COC)NCC(C)(C)C 270004a_100000757820_100011204126 [0,1,0,0,0,1|2,0,0]=4 1963 B11R0.196 CCCC(CC)NCC(C)(C)C 270004a_100000743828_100000687865 [0,1,0,0,0,1|1,0,1]=4 1964 B11R0.196 CCCC(CC)NCC(C)(C)C 270004a_100000747048_100011204126 [0,1,0,0,0,1|1,0,1]=4 1965 B11R0.196 CCCC(CC)OCC(C)(C)C 34a_100000687864_100011219605 [0,1,0,0,0,1|1,0,1]=4 1966 B11R0.196 CCCC(CC)SCC(C)(C)C 62a_100011219200_100011219605 [0,1,0,0,0,1|1,0,1]=4 1967 B11R0.196 CCCC(CC)SCC(C)(C)C 62a_100011219605_100011219200 [0,1,0,0,0,1|1,0,1]=4 1968 B11R0.196 CCC[C@@H](CO)NCC(C)(C)C 34a_100000732646_100011219605 [0,1,0,0,0,1|1,0,1]=4 1969 B11R0.196 CC[C@H](CC#N)NCC(C)(C)C 270004a_200009818565_100011204126 [0,1,0,0,0,1|1,0,1]=4 1970 B11R0.196 COCC(CCl)OCC(C)(C)C 34a_100011215053_100011219605 [0,1,0,0,0,1|2,0,0]=4 1971 B11R0.196 COCC(CN)OCC(C)(C)C 34a_100000756049_100011219605 [0,1,0,0,0,1|2,0,0]=4 1972 B11R0.196 COCC(CO)NCC(C)(C)C 270004a_100000724102_100011204126 [0,1,0,0,0,1|2,0,0]=4 1973 B11R0.196 COCC(CO)NCC(C)(C)C 34a_100000724102_100011219605 [0,1,0,0,0,1|2,0,0]=4 1974 B11R0.250 C=CCC(C)(C)OCC(C)(C)O 7a_100011995686_100000764493 [0,1,0,0,0,1|2,0,0]=4 1975 B11R0.250 C=CCC(C)(C)OC[Si](C)(C)C 7a_100011995686_100000233785 [0,1,0,0,0,1|1,1,0]=4 1976 B11R0.250 C=CC[Si](C)(C)CNC(C)(C)C 2230a_100000715429_100000046978 [0,1,0,0,0,1|1,1,0]=4 1977 B11R0.250 C=CC[Si](C)(C)COC(C)(C)C 7a_100015890283_100000046978 [0,1,0,0,0,1|1,1,0]=4 1978 B11R0.250 C=CC[Si](C)(C)CSC(C)(C)C 62a_100000046978_100000211941 [0,1,0,0,0,1|1,1,0]=4 1979 B11R0.250 C=CC[Si](C)(C)CSC(C)(C)C 62a_100000211941_100000046978 [0,1,0,0,0,1|1,1,0]=4 1980 B11R0.250 CC(C)(C)CNC(C)(C)CCO 270004a_100000763138_100011204126 [0,1,0,0,0,1|0,0,2]=4 1981 B11R0.250 COCC(C)(C)NCC(C)(C)C 270004a_100000752728_100011204126 [0,1,0,0,0,1|2,0,0]=4 1982 B11R0.250 CSCC(C)(C)NCC(C)(C)C 270004a_100000759623_100011204126 [0,1,0,0,0,1|2,0,0]=4 1983 B11R0.290 C/C=C(\C)/C(C)NCC(C)(C)C 269862a_100000743828_100020675665 [0,1,0,0,0,1|1,0,1]=4 1984 B11R0.290 C=C[C@@H](C)[C@@H](C)OCC(C)(C)C 34a_100015455354_100011219605 [0,1,0,0,0,1|1,0,0]=3 1985 B11R0.290 C=C[C@@H](C)[C@@H](C)OCC(C)(C)F 34a_100015455354_100011997219 [0,1,0,0,0,1|2,0,0]=4 1986 B11R0.290 C=C[C@@H](C)[C@@H](C)OCC(C)(C)O 34a_100015455354_100000764493 [0,1,0,0,0,1|2,0,0]=4 1987 B11R0.290 C=C[C@@H](C)[C@@H](C)OCC(C)(C)O 7a_100015455354_100000764493 [0,1,0,0,0,1|2,0,0]=4 1988 B11R0.290 C=C[C@@H](C)[C@@H](C)OC[Si](C)(C)C 7a_100015455354_100000233785 [0,1,0,0,0,1|1,1,0]=4 1989 B11R0.290 CCC(C)C(C)NCC(C)(C)C 269862a_100000743828_100000210599 [0,1,0,0,0,1|1,0,1]=4 1990 B11R0.290 CCC(C)C(C)NCC(C)(C)C 270004a_100000743828_100000210599 [0,1,0,0,0,1|1,0,1]=4 1991 B11R0.337 C=C(C)CN(C)CCC(C)(C)C 2230a_100000225649_100000755188 [0,1,0,0,0,1|2,0,0]=4 1992 B11R0.337 C=C(C)CN(C)CCC(C)(C)C 269982a_100000225649_100000755188 [0,1,0,0,0,1|2,0,0]=4 1993 B11R0.337 CC(=CC(C)OCC(C)(C)C)C 34a_100000717055_100011219605 [0,1,0,0,0,1|1,0,1]=4 1994 B11R0.337 CC(=O)CC(=O)OCC(C)(C)C 1458a_100000070787_200010402935 [0,1,0,0,0,1|1,0,1]=4 1995 B11R0.337 CC(=O)OC(C)SCC(C)(C)C 62a_100009818208_100011219605 [0,1,0,0,0,1|1,0,0]=3 1996 B11R0.337 CC(=O)OC(C)SCC(C)(C)C 62a_100011219605_100009818208 [0,1,0,0,0,1|1,0,0]=3 1997 B11R0.337 CC(=O)OC(C)SCC(C)(C)F 62a_100009818208_100011997219 [0,1,0,0,0,1|2,0,0]=4 1998 B11R0.337 CC(=O)OC(C)SCC(C)(C)F 62a_100011997219_100009818208 [0,1,0,0,0,1|2,0,0]=4 1999 B11R0.337 CC(=O)OC(C)SCC(C)(C)O 62a_100000764493_100009818208 [0,1,0,0,0,1|2,0,0]=4 2000 B11R0.337 CC(=O)OC(C)SCC(C)(C)O 62a_100009818208_100000764493 [0,1,0,0,0,1|2,0,0]=4 2001 B11R0.337 CC(=O)OC(C)SC[N+](C)(C)C 62a_100009818208_200000036245 [0,1,0,0,0,1|2,0,0]=4 2002 B11R0.337 CC(=O)OC(C)SC[N+](C)(C)C 62a_200000036245_100009818208 [0,1,0,0,0,1|2,0,0]=4 2003 B11R0.337 CC(=O)OC(C)SC[Si](C)(C)C 62a_100000037933_100009818208 [0,1,0,0,0,1|1,1,0]=4 2004 B11R0.337 CC(=O)OC(C)SC[Si](C)(C)C 62a_100009818208_100000037933 [0,1,0,0,0,1|1,1,0]=4 2005 B11R0.337 CC(C)(C)CCC(=O)CC(=O)N 1458a_100000757465_100000187820 [0,1,0,0,0,1|1,0,1]=4 2006 B11R0.337 CC(C)(C)CCC(=O)CC(=O)N 1458a_100134613110_100000755188 [0,1,0,0,0,1|1,0,1]=4 2007 B11R0.337 CC(C)(C)CCC(=O)CC(=O)[O-] 1458a_100000757465_100020667443 [0,1,0,0,0,1|1,0,1]=4 2008 B11R0.337 CC(C)(C)CNC(=O)CC(=O)N 240690a_100000743828_100134613110 [0,1,0,0,0,1|1,0,1]=4 2009 B11R0.337 CC(C)(C)CNC(=O)CC(=O)N 527a_100000743828_100134613110 [0,1,0,0,0,1|1,0,1]=4 2010 B11R0.337 CC(C)(C)NCC(O)CC(=O)O 269956a_100011218706_100000211941 [0,1,0,0,0,1|1,0,0]=3 2011 B11R0.337 CC(C)(C)OCC(=O)CC(=O)N 1458a_100000686494_100000187820 [0,1,0,0,0,1|1,0,1]=4 2012 B11R0.337 CC(C)(C)OCC(=O)CC(=O)[O-] 1458a_100000686494_100020667443 [0,1,0,0,0,1|1,0,1]=4 2013 B11R0.337 CC(C)CC(C)NCC(C)(C)C 2230a_100000743828_100000731052 [0,1,0,0,0,1|1,0,1]=4 2014 B11R0.337 CC(C)CC(C)NCC(C)(C)C 270004a_100000692259_100011204126 [0,1,0,0,0,1|1,0,1]=4 2015 B11R0.337 CC(C)CC(C)OCC(C)(C)C 34a_100000211805_100011219605 [0,1,0,0,0,1|1,0,1]=4 2016 B11R0.337 CC(C)CC(C)SCC(C)(C)C 62a_100000731052_100011219605 [0,1,0,0,0,1|1,0,1]=4 2017 B11R0.337 CC(C)CC(C)SCC(C)(C)C 62a_100011219605_100000731052 [0,1,0,0,0,1|1,0,1]=4 2018 B11R0.337 CC(CN(C)C)SCC(C)(C)C 62a_100011219605_100020606517 [0,1,0,0,0,1|2,0,0]=4 2019 B11R0.337 CC(CN(C)C)SCC(C)(C)C 62a_100020606517_100011219605 [0,1,0,0,0,1|2,0,0]=4 2020 B11R0.337 CC(CNC(C)(C)C)CN(C)C 2230a_100000715429_100015348159 [0,1,0,0,0,1|2,0,0]=4 2021 B11R0.337 CC(COC(C)(C)C)CN(C)C 7a_100015890283_100015348159 [0,1,0,0,0,1|2,0,0]=4 2022 B11R0.337 CC(CSC(C)(C)C)CN(C)C 62a_100000211941_100015348159 [0,1,0,0,0,1|2,0,0]=4 2023 B11R0.337 CC(CSC(C)(C)C)CN(C)C 62a_100015348159_100000211941 [0,1,0,0,0,1|2,0,0]=4 2024 B11R0.337 CN(CCC(C)(C)C)CC(=O)N 2230a_100000739694_100000755188 [0,1,0,0,0,1|1,0,0]=3 2025 B11R0.337 CN(CCC(C)(C)C)CC(=O)O 269956a_100000746989_100000755188 [0,1,0,0,0,1|1,0,0]=3 2026 B11R0.337 CN(CCC(C)(C)O)CC(=O)N 2230a_100000739694_100000702414 [0,1,0,0,0,1|2,0,0]=4 2027 B11R0.337 CN(CCC(C)(C)O)CC(=O)O 269956a_100000746989_100000702414 [0,1,0,0,0,1|2,0,0]=4 2028 B11R0.337 CN(CC[N+](C)(C)C)CC(=O)O 269956a_100000746989_100000085578 [0,1,0,0,0,1|2,0,0]=4 2029 B11R0.337 CN(CC[Si](C)(C)C)CC(=O)N 2230a_100000739694_200000733723 [0,1,0,0,0,1|1,1,0]=4 2030 B11R0.337 CN(CC[Si](C)(C)C)CC(=O)O 269956a_100000746989_200000733723 [0,1,0,0,0,1|1,1,0]=4 2031 B11R0.10 C=CC[C@@H](C)OC(C)(C)C(=O)C 7a_100000731007_100000075568 [0,2,0,0,0,0|2,0,0]=4 2032 B11R0.83 C#CCOC(C)CC(C)(C)OC 7a_200011252547_100000038162 [0,2,0,0,0,0|1,0,1]=4 2033 B11R0.83 C/C=C/CN(C)CC(C)(C)CO 269982a_100000732702_100102629194 [0,2,0,0,0,0|2,0,0]=4 2034 B11R0.83 C=CCCC(C)NC(C)(C)CC 270004a_100000211385_100000762624 [0,2,0,0,0,0|2,0,0]=4 2035 B11R0.83 C=CCCC(C)NC(C)(C)CO 270004a_100000210608_100000762624 [0,2,0,0,0,0|2,0,0]=4 2036 B11R0.83 C=CCCC(C)OC(C)(C)CC 7a_100000765329_100000210677 [0,2,0,0,0,0|2,0,0]=4 2037 B11R0.83 C=CCCN(C)CC(C)(C)CO 2230a_100000732702_100000754431 [0,2,0,0,0,0|2,0,0]=4 2038 B11R0.83 C=CCCN(C)CC(C)(C)CO 269982a_100000732702_100000754431 [0,2,0,0,0,0|2,0,0]=4 2039 B11R0.83 C=CCCN(C)CC(C)(C)OC 269982a_100020639649_100000701081 [0,2,0,0,0,0|2,0,0]=4 2040 B11R0.83 C=CCCN(C)CC(C)(C)SC 270004a_100020639649_100009845794 [0,2,0,0,0,0|2,0,0]=4 2041 B11R0.83 C=CCOC(C)CC(C)(C)OC 7a_200011252547_100015514636 [0,2,0,0,0,0|1,0,0]=3 2042 B11R0.83 CC=CCN(C)CC(C)(C)CO 2230a_100000732702_100000070051 [0,2,0,0,0,0|2,0,0]=4 2043 B11R0.83 CCCOC(C)CC(C)(C)OC 7a_200011252547_100000210303 [0,2,0,0,0,0|1,0,1]=4 2044 B11R0.83 COC(C)(C)CC(C)OCC#N 7a_200011252547_100011215382 [0,2,0,0,0,0|1,0,1]=4 2045 B11R0.83 COC(C)(C)CC(C)OCC=O 7a_200011252547_200015260668 [0,2,0,0,0,0|0,0,0]=2 2046 B11R0.83 COC(C)(C)CC(C)OCCF 7a_200011252547_100011217306 [0,2,0,0,0,0|1,0,1]=4 2047 B11R0.83 COC(C)(C)CC(C)OCCO 7a_200011252547_100000211926 [0,2,0,0,0,0|0,0,2]=4 2048 B11R0.209 C=CC(C)N(C)CC(C)(C)CO 269982a_100000732702_100011215867 [0,2,0,0,0,0|2,0,0]=4 2049 B11R0.209 C=C[C@@H](C)[C@@H](C)OC(C)(C)CC 7a_100015455354_100000210677 [0,2,0,0,0,0|2,0,0]=4 2050 B11R0.251 C=CCC(C)(C)OC(C)(C)CC 7a_100011995686_100000210677 [0,2,0,0,0,0|2,0,0]=4 2051 B11R0.300 C=C(C)CN(C)CC(C)(C)CO 2230a_100000732702_100000748629 [0,2,0,0,0,0|2,0,0]=4 2052 B11R0.300 C=C(C)CN(C)CC(C)(C)CO 269982a_100000732702_100000748629 [0,2,0,0,0,0|2,0,0]=4 2053 B11R0.300 C=C(C)CN(C)CC(C)(C)OC 269982a_100000225649_100000701081 [0,2,0,0,0,0|2,0,0]=4 2054 B11R0.300 C=C(C)CN(C)CC(C)(C)SC 270004a_100000225649_100009845794 [0,2,0,0,0,0|2,0,0]=4 2055 B11R0.300 C=C(F)CN(C)CC(C)(C)CO 2230a_100000732702_100009893438 [0,2,0,0,0,0|2,0,0]=4 2056 B11R0.300 C=C(F)CN(C)CC(C)(C)CO 269982a_100000732702_100009893438 [0,2,0,0,0,0|2,0,0]=4 2057 B11R0.300 CC(=O)OC(C)CC(C)(C)O[13CH3] 7a_100103282973_200025704644 [0,2,0,0,0,0|1,0,0]=3 2058 B11R0.300 CCC(C)(C)CC(=O)CC(=O)N 1458a_200000763500_100000187820 [0,2,0,0,0,0|1,0,1]=4 2059 B11R0.300 CCC(C)(C)CC(=O)CC(=O)[O-] 1458a_200000763500_100020667443 [0,2,0,0,0,0|1,0,1]=4 2060 B11R0.300 CCC(C)(C)SC(C)OC(=O)C 62a_100000032637_100009818208 [0,2,0,0,0,0|2,0,0]=4 2061 B11R0.300 CCC(C)(C)SC(C)OC(=O)C 62a_100009818208_100000032637 [0,2,0,0,0,0|2,0,0]=4 2062 B11R0.300 CN(CC(=O)N)CC(C)(C)CO 2230a_100000732702_100000747473 [0,2,0,0,0,0|1,0,0]=3 2063 B11R0.300 CN(CC(=O)N)CC(C)(C)CO 269982a_100000732702_100000187820 [0,2,0,0,0,0|1,0,0]=3 2064 B11R0.300 CN(CC(=O)O)CC(C)(C)CO 269956a_100000746989_100009813988 [0,2,0,0,0,0|1,0,0]=3 2065 B11R0.300 CN(CC(=O)[O-])CC(C)(C)CO 269982a_100000732702_100020667443 [0,2,0,0,0,0|1,0,0]=3 2066 B11R0.300 CN(C[N+](=O)[O-])CC(C)(C)CO 269982a_100000732702_100000761209 [0,2,0,0,0,0|2,0,0]=4 2067 B11R0.300 COC(C)(C)CC(C)OC(=O)C 7a_100103282973_200000210301 [0,2,0,0,0,0|1,0,0]=3 2068 B11R0.300 COC(C)(C)CN(C)CC(=O)O 269956a_100000746989_100000701081 [0,2,0,0,0,0|1,0,0]=3 2069 B11R0.300 CSC(C)(C)CN(C)CC(=O)N 270004a_100000739694_100009845794 [0,2,0,0,0,0|1,0,0]=3 2070 B11R0.354 C=CCN(C)CC(C)(OC)OC 2230a_100000225617_100000064154 [0,2,0,0,0,0|2,0,0]=4 2071 B11R0.354 C=CCN(C)CC(C)(OC)OC 269982a_100000225617_100000766008 [0,2,0,0,0,0|2,0,0]=4 2072 B11R0.354 C=CC[C@@H](C)OC(C)(CC)CC 7a_100000731007_100009817345 [0,2,0,0,0,0|2,0,0]=4 2073 B11R0.16 C=CCC(OC(C)(C)C)C(C)C 34a_200011216146_100000210625 [0,2,0,0,0,0|2,0,0]=4 2074 B11R0.16 C=CCN(CC(C)(C)C)C(C)C 2230a_107254826865_100000210623 [0,2,0,0,0,0|2,0,0]=4 2075 B11R0.16 C=CCN(CC(C)(C)C)C(C)C 269982a_107254826865_100000210623 [0,2,0,0,0,0|2,0,0]=4 2076 B11R0.16 C=CCN(CC(C)(C)C)C(C)C 270004a_100000742772_100011204126 [0,2,0,0,0,0|2,0,0]=4 2077 B11R0.16 CC(C)N(CC=O)CC(C)(C)C 2230a_107254826865_200015260668 [0,2,0,0,0,0|1,0,0]=3 2078 B11R0.16 CC(C)N(CC=O)CC(C)(C)C 269982a_107254826865_200015260668 [0,2,0,0,0,0|1,0,0]=3 2079 B11R0.95 C#CCN(CC=C)CC(C)(C)C 270004a_100000731024_100011204126 [0,2,0,0,0,0|2,0,0]=4 2080 B11R0.95 C#CCN(CC=C)CC(C)(C)C 34a_100000731024_100011219605 [0,2,0,0,0,0|2,0,0]=4 2081 B11R0.95 C=CCC(CCC)OC(C)(C)C 34a_100011215139_100000210625 [0,2,0,0,0,0|2,0,0]=4 2082 B11R0.95 C=CCN(CC=C)CC(C)(C)C 270004a_100000210471_100011204126 [0,2,0,0,0,0|2,0,0]=4 2083 B11R0.95 C=CCN(CCC)CC(C)(C)C 2230a_107254831479_100000210623 [0,2,0,0,0,0|2,0,0]=4 2084 B11R0.95 C=CCN(CCC)CC(C)(C)C 269982a_107254831479_100000210623 [0,2,0,0,0,0|2,0,0]=4 2085 B11R0.95 C=CCN(CCO)CC(C)(C)C 2230a_100000752879_100000210623 [0,2,0,0,0,0|2,0,0]=4 2086 B11R0.95 C=CCN(CCO)CC(C)(C)C 269982a_100000752879_100000210623 [0,2,0,0,0,0|2,0,0]=4 2087 B11R0.95 CC(C)(C)CN(CC=O)CCO 2230a_100000752879_200015260668 [0,2,0,0,0,0|1,0,0]=3 2088 B11R0.95 CC(C)(C)CN(CC=O)CCO 269982a_100000752879_200015260668 [0,2,0,0,0,0|1,0,0]=3 2089 B11R0.95 CCCN(CC=O)CC(C)(C)C 2230a_107254831479_200015260668 [0,2,0,0,0,0|1,0,0]=3 2090 B11R0.95 CCCN(CC=O)CC(C)(C)C 269982a_107254831479_200015260668 [0,2,0,0,0,0|1,0,0]=3 2091 B11R0.123 C=CC(C)N(CC)CC(C)(C)C 269982a_100000732750_100011215867 [0,2,0,0,0,0|2,0,0]=4 2092 B11R0.190 C/C=C/CN(CC)CC(C)(C)C 269982a_100000732750_100102629194 [0,2,0,0,0,0|2,0,0]=4 2093 B11R0.190 C=CCCN(CC)CC(C)(C)C 2230a_100000732750_100000754431 [0,2,0,0,0,0|2,0,0]=4 2094 B11R0.190 C=CCCN(CC)CC(C)(C)C 269982a_100000732750_100000754431 [0,2,0,0,0,0|2,0,0]=4 2095 B11R0.190 CC=CCN(CC)CC(C)(C)C 2230a_100000732750_100000070051 [0,2,0,0,0,0|2,0,0]=4 2096 B11R0.274 C=C(C)CN(CC)CC(C)(C)C 2230a_100000732750_100000748629 [0,2,0,0,0,0|2,0,0]=4 2097 B11R0.274 C=C(C)CN(CC)CC(C)(C)C 269982a_100000732750_100000748629 [0,2,0,0,0,0|2,0,0]=4 2098 B11R0.274 C=C(C)CN(CC)CC(C)(C)C 270004a_100000211296_100011204126 [0,2,0,0,0,0|2,0,0]=4 2099 B11R0.274 C=C(F)CN(CC)CC(C)(C)C 2230a_100000732750_100009893438 [0,2,0,0,0,0|2,0,0]=4 2100 B11R0.274 C=C(F)CN(CC)CC(C)(C)C 269982a_100000732750_100009893438 [0,2,0,0,0,0|2,0,0]=4 2101 B11R0.274 CC(C)(C)CN(CO)CC(=O)[O-] 269956a_100016989150_100011219605 [0,2,0,0,0,0|1,0,0]=3 2102 B11R0.274 CC(C)(C)N[C@H](CO)CC(=O)O 269956a_100009816507_100000211941 [0,2,0,0,0,0|1,0,0]=3 2103 B11R0.274 CC(C)(F)CN(CO)CC(=O)[O-] 269956a_100016989150_100011997219 [0,2,0,0,0,0|2,0,0]=4 2104 B11R0.274 CC(C)(O)CN(CO)CC(=O)[O-] 269956a_100016989150_100000764493 [0,2,0,0,0,0|2,0,0]=4 2105 B11R0.274 CCN(CC(=O)N)CC(C)(C)C 2230a_100000732750_100000747473 [0,2,0,0,0,0|1,0,0]=3 2106 B11R0.274 CCN(CC(=O)N)CC(C)(C)C 269982a_100000732750_100000187820 [0,2,0,0,0,0|1,0,0]=3 2107 B11R0.274 CCN(CC(=O)N)CC(C)(C)O 2230a_100000755687_100000747473 [0,2,0,0,0,0|2,0,0]=4 2108 B11R0.274 CCN(CC(=O)N)CC(C)(C)O 269982a_100000755687_100000187820 [0,2,0,0,0,0|2,0,0]=4 2109 B11R0.274 CCN(CC(=O)O)CC(C)(C)C 269956a_100000746405_100011219605 [0,2,0,0,0,0|1,0,0]=3 2110 B11R0.274 CCN(CC(=O)O)CC(C)(C)F 269956a_100000746405_100011997219 [0,2,0,0,0,0|2,0,0]=4 2111 B11R0.274 CCN(CC(=O)O)CC(C)(C)O 269956a_100000746405_100000764493 [0,2,0,0,0,0|2,0,0]=4 2112 B11R0.274 CCN(CC(=O)O)C[N+](C)(C)C 269956a_100000746405_200000036245 [0,2,0,0,0,0|2,0,0]=4 2113 B11R0.274 CCN(CC(=O)O)C[Si](C)(C)C 269956a_100000746405_100000037933 [0,2,0,0,0,0|1,1,0]=4 2114 B11R0.274 CCN(CC(=O)[O-])CC(C)(C)C 269982a_100000732750_100020667443 [0,2,0,0,0,0|1,0,0]=3 2115 B11R0.274 CCN(CC(=O)[O-])CC(C)(C)O 269982a_100000755687_100020667443 [0,2,0,0,0,0|2,0,0]=4 2116 B11R0.274 CCN(C[N+](=O)[O-])CC(C)(C)C 269982a_100000732750_100000761209 [0,2,0,0,0,0|2,0,0]=4 2117 B11R0.274 CC[C@H](CC(=O)O)NC(C)(C)C 269956a_100016995926_100000211941 [0,2,0,0,0,0|1,0,0]=3 2118 B11R0.274 C[N+](C)(C)CN(CO)CC(=O)[O-] 269956a_100016989150_200000036245 [0,2,0,0,0,0|2,0,0]=4 2119 B11R0.274 C[Si](C)(C)CN(CO)CC(=O)[O-] 269956a_100016989150_100000037933 [0,2,0,0,0,0|1,1,0]=4 2120 B11R0.34 C=C(C)CCN(C)CC(C)(C)C 2230a_100000742839_100000730704 [0,2,0,0,0,0|2,0,0]=4 2121 B11R0.34 C=C(C)CCN(C)CC(C)(C)C 269982a_100000742839_100000730704 [0,2,0,0,0,0|2,0,0]=4 2122 B11R0.34 C=C(C)CN[C@@H](C)CC(C)(C)C 2230a_106358413534_100000748629 [0,2,0,0,0,0|1,0,0]=3 2123 B11R0.34 C=C(C)COC(C)CC(C)(C)C 7a_200011218616_100000748629 [0,2,0,0,0,0|1,0,0]=3 2124 B11R0.34 C=C(F)CN[C@@H](C)CC(C)(C)C 2230a_106358413534_100009893438 [0,2,0,0,0,0|1,0,0]=3 2125 B11R0.34 C=C(F)COC(C)CC(C)(C)C 7a_200011218616_100000042424 [0,2,0,0,0,0|1,0,0]=3 2126 B11R0.34 CC(=CCN(C)CC(C)(C)C)C 2230a_100000742839_100000761012 [0,2,0,0,0,0|2,0,0]=4 2127 B11R0.34 CC(=CCN(C)CC(C)(C)C)C 269982a_100000742839_100000761012 [0,2,0,0,0,0|2,0,0]=4 2128 B11R0.34 CC(=O)CCN(C)CC(C)(C)C 269982a_100000742839_100000053229 [0,2,0,0,0,0|1,0,0]=3 2129 B11R0.34 CC(=O)CCN(C)CC(C)(C)O 269982a_100000755907_100000053229 [0,2,0,0,0,0|2,0,0]=4 2130 B11R0.34 CC(=O)CCN(C)C[Si](C)(C)C 269982a_200020589227_100000053229 [0,2,0,0,0,0|1,1,0]=4 2131 B11R0.34 CC(=O)CNC(=O)CC(C)(C)C 1458a_100000744057_200000210301 [0,2,0,0,0,0|1,0,1]=4 2132 B11R0.34 CC(=O)COC(=O)CC(C)(C)C 1458a_100000070787_200010999194 [0,2,0,0,0,0|1,0,1]=4 2133 B11R0.34 CC(=O)OCN(C)CC(C)(C)C 269982a_100000742839_100000076356 [0,2,0,0,0,0|1,0,0]=3 2134 B11R0.34 CC(=O)OCN(C)CC(C)(C)O 269982a_100000755907_100000076356 [0,2,0,0,0,0|2,0,0]=4 2135 B11R0.34 CC(=O)OCN(C)C[Si](C)(C)C 269982a_200020589227_100000076356 [0,2,0,0,0,0|1,1,0]=4 2136 B11R0.34 CC(C)(C)CC(=O)NCC(=O)N 11a_100000711301_100000211214 [0,2,0,0,0,0|1,0,1]=4 2137 B11R0.34 CC(C)(C)CC(=O)NCC(=O)N 240690a_100000711301_100000211214 [0,2,0,0,0,0|1,0,1]=4 2138 B11R0.34 CC(C)(C)CC(=O)NCC(=O)N 527a_100000711301_100000211214 [0,2,0,0,0,0|1,0,1]=4 2139 B11R0.34 CC(C)(C)CC(=O)NCC(=O)[13CH3] 1458a_100000744057_200025704644 [0,2,0,0,0,0|1,0,1]=4 2140 B11R0.34 CC(C)CN[C@@H](C)CC(C)(C)C 2230a_106358413534_100000210760 [0,2,0,0,0,0|1,0,1]=4 2141 B11R0.34 CC(C)CN[C@@H](C)CC(C)(C)C 270004a_106358413534_100000210432 [0,2,0,0,0,0|1,0,1]=4 2142 B11R0.34 CC(C)COC(C)CC(C)(C)C 7a_200011218616_100000210760 [0,2,0,0,0,0|1,0,1]=4 2143 B11R0.34 CC(CC(C)(C)C)OCC(=O)N 7a_200011218616_100000187820 [0,2,0,0,0,0|0,0,0]=2 2144 B11R0.34 CC(CC(C)(C)C)OCC(F)F 7a_200011218616_100011934356 [0,2,0,0,0,0|1,0,1]=4 2145 B11R0.34 CC(CC(C)(C)C)OC[C@@H](C)O 7a_200011218616_100009817552 [0,2,0,0,0,0|0,0,2]=4 2146 B11R0.34 CC(COC(C)C)CC(C)(C)C 7a_200011215325_100000210206 [0,2,0,0,0,0|1,0,1]=4 2147 B11R0.34 CC(O)CN[C@@H](C)CC(C)(C)C 2230a_106358413534_100011218427 [0,2,0,0,0,0|0,0,2]=4 2148 B11R0.34 CC(O)COC(C)CC(C)(C)C 7a_200011218616_100011218427 [0,2,0,0,0,0|0,0,2]=4 2149 B11R0.34 CN(CCC(=O)N)CC(C)(C)C 2230a_100000742839_100000744528 [0,2,0,0,0,0|1,0,0]=3 2150 B11R0.34 CN(CCC(=O)N)CC(C)(C)C 269982a_100000742839_100000744528 [0,2,0,0,0,0|1,0,0]=3 2151 B11R0.34 CN(CCC(=O)N)CC(C)(C)C 270004a_100000730477_100011204126 [0,2,0,0,0,0|1,0,0]=3 2152 B11R0.34 CN(CCC(=O)N)CC(C)(C)O 2230a_100000755907_100000744528 [0,2,0,0,0,0|2,0,0]=4 2153 B11R0.34 CN(CCC(=O)N)CC(C)(C)O 269982a_100000755907_100000744528 [0,2,0,0,0,0|2,0,0]=4 2154 B11R0.34 CN(CCC(=O)N)C[Si](C)(C)C 2230a_100000730477_100000037933 [0,2,0,0,0,0|1,1,0]=4 2155 B11R0.34 CN(CCC(=O)N)C[Si](C)(C)C 269982a_200020589227_100000744528 [0,2,0,0,0,0|1,1,0]=4 2156 B11R0.34 C[C@@H](CC(C)(C)C)NCC(=O)N 2230a_106358413534_100000747473 [0,2,0,0,0,0|0,0,0]=2 2157 B11R0.34 C[C@@H](CC(C)(C)C)NCC(F)F 2230a_106358413534_100011934356 [0,2,0,0,0,0|1,0,1]=4 2158 B11R0.34 C[C@@H](O)CN[C@@H](C)CC(C)(C)C 2230a_106358413534_100009817552 [0,2,0,0,0,0|0,0,2]=4 2159 B11R0.71 C/C=C/CN(C)C(C)C(C)(C)C 269982a_100000745498_100102629194 [0,2,0,0,0,0|2,0,0]=4 2160 B11R0.71 C=CCCC(C)N(C)C(C)(C)C 270004a_100011215553_100000762624 [0,2,0,0,0,0|2,0,0]=4 2161 B11R0.71 C=CCCN(C)C(C)C(C)(C)C 2230a_100000745498_100000754431 [0,2,0,0,0,0|2,0,0]=4 2162 B11R0.71 C=CCCN(C)C(C)C(C)(C)C 269982a_100000745498_100000754431 [0,2,0,0,0,0|2,0,0]=4 2163 B11R0.71 C=CCNC(C)C(=O)C(C)(C)C 2230a_100020586998_100009893019 [0,2,0,0,0,0|1,0,1]=4 2164 B11R0.71 C=CCSC(C)C(=O)C(C)(C)C 62a_100000210623_100009893019 [0,2,0,0,0,0|1,0,1]=4 2165 B11R0.71 C=CCSC(C)C(=O)C(C)(C)C 62a_100009893019_100000210623 [0,2,0,0,0,0|1,0,1]=4 2166 B11R0.71 CC(SCC=O)C(=O)C(C)(C)C 62a_100009893019_200015260668 [0,2,0,0,0,0|0,0,1]=3 2167 B11R0.71 CC(SCC=O)C(=O)C(C)(C)C 62a_200015260668_100009893019 [0,2,0,0,0,0|0,0,1]=3 2168 B11R0.71 CC=CCN(C)C(C)C(C)(C)C 2230a_100000745498_100000070051 [0,2,0,0,0,0|2,0,0]=4 2169 B11R0.119 C#CC(=O)CC(O)C[N+](C)(C)C 1458a_100000211873_100000032816 [0,2,0,0,0,0|2,0,0]=4 2170 B11R0.119 C=C(C#N)CN(C)CC(C)(C)C 2230a_100000742839_100000694840 [0,2,0,0,0,0|2,0,0]=4 2171 B11R0.119 C=C(C#N)CN(C)CC(C)(C)C 269982a_100000742839_100000694840 [0,2,0,0,0,0|2,0,0]=4 2172 B11R0.119 C=CC(=O)CC(O)C[N+](C)(C)C 1458a_100000185746_100000032816 [0,2,0,0,0,0|2,0,0]=4 2173 B11R0.119 C=CC(=O)N[C@@H](C)CC(C)(C)C 1626a_106358413534_100000185746 [0,2,0,0,0,0|1,0,0]=3 2174 B11R0.119 C=CC(=O)N[C@@H](C)CC(C)(C)C 240690a_106358413534_200121576911 [0,2,0,0,0,0|1,0,0]=3 2175 B11R0.119 C=CC(O)CN(C)CC(C)(C)C 2230a_100000742839_100000730141 [0,2,0,0,0,0|2,0,0]=4 2176 B11R0.119 CC(C#N)N[C@@H](C)CC(C)(C)C 2230a_106358413534_100000184139 [0,2,0,0,0,0|1,0,1]=4 2177 B11R0.119 CC(C#N)OC(C)CC(C)(C)C 7a_200011218616_100000703298 [0,2,0,0,0,0|1,0,1]=4 2178 B11R0.119 CC(CC(=O)CF)CC(C)(C)C 1458a_100000239893_100015361967 [0,2,0,0,0,0|0,0,0]=2 2179 B11R0.119 CC(CO)N[C@@H](C)CC(C)(C)C 2230a_106358413534_100012180447 [0,2,0,0,0,0|0,0,2]=4 2180 B11R0.119 CC(CO)OC(C)CC(C)(C)C 7a_200011218616_100012180447 [0,2,0,0,0,0|0,0,2]=4 2181 B11R0.119 CCC(=O)CC(=O)CC(C)(C)C 1458a_100000211214_100000747405 [0,2,0,0,0,0|1,0,1]=4 2182 B11R0.119 CCC(=O)CC(C)CC(C)(C)C 1458a_100000239893_100000210202 [0,2,0,0,0,0|0,0,0]=2 2183 B11R0.119 CCC(=O)CC(O)C[N+](C)(C)C 1458a_100000210414_100000032816 [0,2,0,0,0,0|2,0,0]=4 2184 B11R0.119 CCC(=O)CN(C)CC(C)(C)C 269982a_100000742839_100000747405 [0,2,0,0,0,0|1,0,0]=3 2185 B11R0.119 CCC(=O)CN(C)CC(C)(C)O 269982a_100000755907_100000747405 [0,2,0,0,0,0|2,0,0]=4 2186 B11R0.119 CCC(=O)CN(C)C[Si](C)(C)C 269982a_200020589227_100000747405 [0,2,0,0,0,0|1,1,0]=4 2187 B11R0.119 CCC(=O)C[C@@H](O)C[N+](C)(C)C 1458a_100000004043_100000210202 [0,2,0,0,0,0|2,0,0]=4 2188 B11R0.119 CCC(=O)N[C@@H](C)CC(C)(C)C 11a_106358413534_100000210414 [0,2,0,0,0,0|1,0,0]=3 2189 B11R0.119 CCC(=O)N[C@@H](C)CC(C)(C)C 1626a_106358413534_100000210414 [0,2,0,0,0,0|1,0,0]=3 2190 B11R0.119 CCC(=O)N[C@@H](C)CC(C)(C)C 240690a_106358413534_100000210414 [0,2,0,0,0,0|1,0,0]=3 2191 B11R0.119 CCC(=O)N[C@@H](C)CC(C)(C)C 527a_106358413534_100000210414 [0,2,0,0,0,0|1,0,0]=3 2192 B11R0.119 CCC(C)N[C@@H](C)CC(C)(C)C 2230a_106358413534_100000758301 [0,2,0,0,0,0|1,0,1]=4 2193 B11R0.119 CCC(C)OC(C)CC(C)(C)C 7a_200011218616_100000758301 [0,2,0,0,0,0|1,0,1]=4 2194 B11R0.119 CNC(=O)CC(=O)CC(C)(C)C 1458a_100000211214_100000183359 [0,2,0,0,0,0|1,0,1]=4 2195 B11R0.119 CNC(=O)CC(C)CC(C)(C)C 11a_106832991635_100000239893 [0,2,0,0,0,0|0,0,0]=2 2196 B11R0.119 CNC(=O)CC(C)CC(C)(C)C 1626a_100102657272_100000239893 [0,2,0,0,0,0|0,0,0]=2 2197 B11R0.119 CNC(=O)CC(C)CC(C)(C)C 240690a_100102657272_100000239893 [0,2,0,0,0,0|0,0,0]=2 2198 B11R0.119 CNC(=O)CC(C)CC(C)(C)C 527a_100102657272_100000239893 [0,2,0,0,0,0|0,0,0]=2 2199 B11R0.119 CNC(=O)CN(C)CC(C)(C)C 2230a_100000742839_100000183359 [0,2,0,0,0,0|1,0,0]=3 2200 B11R0.119 CNC(=O)CN(C)CC(C)(C)C 269982a_100000742839_100000183359 [0,2,0,0,0,0|1,0,0]=3 2201 B11R0.119 CNC(=O)CN(C)CC(C)(C)C 270004a_100000189611_100011204126 [0,2,0,0,0,0|1,0,0]=3 2202 B11R0.119 CNC(=O)CN(C)CC(C)(C)O 2230a_100000755907_100000183359 [0,2,0,0,0,0|2,0,0]=4 2203 B11R0.119 CNC(=O)CN(C)CC(C)(C)O 269982a_100000755907_100000183359 [0,2,0,0,0,0|2,0,0]=4 2204 B11R0.119 CNC(=O)CN(C)C[Si](C)(C)C 2230a_100000189611_100000037933 [0,2,0,0,0,0|1,1,0]=4 2205 B11R0.119 CNC(=O)CN(C)C[Si](C)(C)C 269982a_200020589227_100000183359 [0,2,0,0,0,0|1,1,0]=4 2206 B11R0.119 CNC(=O)C[C@@H](O)C[N+](C)(C)C 1626a_100102657272_100000004043 [0,2,0,0,0,0|2,0,0]=4 2207 B11R0.119 CNC(=O)C[C@@H](O)C[N+](C)(C)C 240690a_100102657272_100000004043 [0,2,0,0,0,0|2,0,0]=4 2208 B11R0.119 CNC(=O)N[C@@H](C)CC(C)(C)C 2708a_100102657272_106358413534 [0,2,0,0,0,0|1,0,0]=3 2209 B11R0.119 CNC(=O)N[C@@H](C)CC(C)(C)C 2708a_106358413534_106832991635 [0,2,0,0,0,0|1,0,0]=3 2210 B11R0.119 CNC(=O)N[C@@H](C)CC(C)(C)C 273464a_100102657272_106358413534 [0,2,0,0,0,0|1,0,0]=3 2211 B11R0.119 CNC(=O)N[C@@H](C)CC(C)(C)C 273464a_106358413534_100102657272 [0,2,0,0,0,0|1,0,0]=3 2212 B11R0.119 CNC(=O)N[C@@H](C)CC(C)(C)C 512a_106358413534_100102657272 [0,2,0,0,0,0|1,0,0]=3 2213 B11R0.119 CNC(=O)N[C@@H](C)CC(C)(C)C 512a_106832991638_106358413534 [0,2,0,0,0,0|1,0,0]=3 2214 B11R0.119 COC(=O)CC(=O)CC(C)(C)C 1458a_100000211214_100000747449 [0,2,0,0,0,0|1,0,1]=4 2215 B11R0.119 COC(=O)CC(C)NC(C)(C)C 2230a_100000715429_100009817358 [0,2,0,0,0,0|1,0,0]=3 2216 B11R0.119 COC(=O)CC(C)OC(C)(C)C 34a_100015890283_100009817358 [0,2,0,0,0,0|1,0,0]=3 2217 B11R0.119 COC(=O)CC(C)OC(C)(C)C 7a_100015890283_100009817358 [0,2,0,0,0,0|1,0,0]=3 2218 B11R0.119 COC(=O)CC(C)SC(C)(C)C 62a_100000211941_100009817358 [0,2,0,0,0,0|1,0,0]=3 2219 B11R0.119 COC(=O)CC(C)SC(C)(C)C 62a_100009817358_100000211941 [0,2,0,0,0,0|1,0,0]=3 2220 B11R0.119 COC(=O)CN(C)CC(C)(C)C 2230a_100000742839_100000747449 [0,2,0,0,0,0|1,0,0]=3 2221 B11R0.119 COC(=O)CN(C)CC(C)(C)C 269982a_100000742839_100000747449 [0,2,0,0,0,0|1,0,0]=3 2222 B11R0.119 COC(=O)CN(C)CC(C)(C)C 270004a_100000198492_100011204126 [0,2,0,0,0,0|1,0,0]=3 2223 B11R0.119 COC(=O)CN(C)CC(C)(C)O 2230a_100000755907_100000747449 [0,2,0,0,0,0|2,0,0]=4 2224 B11R0.119 COC(=O)CN(C)CC(C)(C)O 269982a_100000755907_100000747449 [0,2,0,0,0,0|2,0,0]=4 2225 B11R0.119 COC(=O)CN(C)C[Si](C)(C)C 2230a_100000198492_100000037933 [0,2,0,0,0,0|1,1,0]=4 2226 B11R0.119 COC(=O)CN(C)C[Si](C)(C)C 269982a_200020589227_100000747449 [0,2,0,0,0,0|1,1,0]=4 2227 B11R0.119 C[C@@H](CC(C)(C)C)NC(=O)CO 240690a_106358413534_100000210174 [0,2,0,0,0,0|1,0,0]=3 2228 B11R0.119 C[C@@H](CC(C)(C)C)NC(=O)CO 527a_106358413534_100000210174 [0,2,0,0,0,0|1,0,0]=3 2229 B11R0.119 C[N+](C)(C)CC(O)CC(=O)CO 1458a_100000210174_100000032816 [0,2,0,0,0,0|2,0,0]=4 2230 B11R0.119 C[N+](C)(C)C[C@H](O)CC(=O)CF 1458a_100000004043_100015361967 [0,2,0,0,0,0|2,0,0]=4 2231 B11R0.165 C#CCCN[C@@H](C)CC(C)(C)C 2230a_106358413534_100000688953 [0,2,0,0,0,0|1,0,1]=4 2232 B11R0.165 C#CCCOC(C)CC(C)(C)C 7a_200011218616_100000688953 [0,2,0,0,0,0|1,0,1]=4 2233 B11R0.165 C#CCOCC(C)CC(C)(C)C 7a_200011215325_100000038162 [0,2,0,0,0,0|1,0,1]=4 2234 B11R0.165 C/C=C/COC(C)CC(C)(C)C 7a_200011218616_100102629194 [0,2,0,0,0,0|1,0,0]=3 2235 B11R0.165 C=CCCCN(C)CC(C)(C)C 2230a_100000742839_100011713584 [0,2,0,0,0,0|2,0,0]=4 2236 B11R0.165 C=CCCCN(C)CC(C)(C)C 269982a_100000742839_100000757094 [0,2,0,0,0,0|2,0,0]=4 2237 B11R0.165 C=CCCN[C@@H](C)CC(C)(C)C 2230a_106358413534_100000754431 [0,2,0,0,0,0|1,0,0]=3 2238 B11R0.165 C=CCCOC(C)CC(C)(C)C 7a_200011218616_100000754431 [0,2,0,0,0,0|1,0,0]=3 2239 B11R0.165 C=CCOCC(C)CC(C)(C)C 7a_200011215325_100015514636 [0,2,0,0,0,0|1,0,0]=3 2240 B11R0.165 C=COCCN(C)CC(C)(C)C 2230a_100000742839_100000039644 [0,2,0,0,0,0|2,0,0]=4 2241 B11R0.165 C=COCCN(C)CC(C)(C)C 269982a_100000742839_100000039644 [0,2,0,0,0,0|2,0,0]=4 2242 B11R0.165 CC#CCN[C@@H](C)CC(C)(C)C 2230a_106358413534_100000748600 [0,2,0,0,0,0|1,0,1]=4 2243 B11R0.165 CC#CCOC(C)CC(C)(C)C 7a_200011218616_100000748600 [0,2,0,0,0,0|1,0,1]=4 2244 B11R0.165 CC(CC(C)(C)C)OCCC#N 7a_200011218616_100000184422 [0,2,0,0,0,0|1,0,1]=4 2245 B11R0.165 CC(CC(C)(C)C)OCCCF 7a_200011218616_100011934791 [0,2,0,0,0,0|1,0,1]=4 2246 B11R0.165 CC(CC(C)(C)C)OCCCO 7a_200011218616_100011215043 [0,2,0,0,0,0|0,0,2]=4 2247 B11R0.165 CC(CCOCF)CC(C)(C)C 7a_200011215431_100015361967 [0,2,0,0,0,0|0,0,2]=4 2248 B11R0.165 CC(COCC#N)CC(C)(C)C 7a_200011215325_100011215382 [0,2,0,0,0,0|1,0,1]=4 2249 B11R0.165 CC(COCC=O)CC(C)(C)C 7a_200011215325_200015260668 [0,2,0,0,0,0|0,0,0]=2 2250 B11R0.165 CC(COCCF)CC(C)(C)C 7a_200011215325_100011217306 [0,2,0,0,0,0|1,0,1]=4 2251 B11R0.165 CC(COCCO)CC(C)(C)C 7a_200011215325_100000211926 [0,2,0,0,0,0|0,0,2]=4 2252 B11R0.165 CC/C=C\CN(C)CC(C)(C)C 2230a_100000742839_100103147603 [0,2,0,0,0,0|2,0,0]=4 2253 B11R0.165 CC/C=C\CN(C)CC(C)(C)C 269982a_100000742839_100103147603 [0,2,0,0,0,0|2,0,0]=4 2254 B11R0.165 CC=CCN[C@@H](C)CC(C)(C)C 2230a_106358413534_100000070051 [0,2,0,0,0,0|1,0,0]=3 2255 B11R0.165 CC=CCOC(C)CC(C)(C)C 7a_200011218616_100000070051 [0,2,0,0,0,0|1,0,0]=3 2256 B11R0.165 CCCCN[C@@H](C)CC(C)(C)C 2230a_106358413534_100000210211 [0,2,0,0,0,0|1,0,1]=4 2257 B11R0.165 CCCCOC(C)CC(C)(C)C 7a_200011218616_100000210211 [0,2,0,0,0,0|1,0,1]=4 2258 B11R0.165 CCCOCC(C)CC(C)(C)C 7a_200011215325_100000210303 [0,2,0,0,0,0|1,0,1]=4 2259 B11R0.165 CCOCCC(C)CC(C)(C)C 7a_200011215431_100000210202 [0,2,0,0,0,0|0,0,2]=4 2260 B11R0.165 CN(CCCC=O)CC(C)(C)C 2230a_100000742839_200011292268 [0,2,0,0,0,0|1,0,0]=3 2261 B11R0.165 CN(CCCC=O)CC(C)(C)C 269982a_100000742839_200011292268 [0,2,0,0,0,0|1,0,0]=3 2262 B11R0.165 CN(CCCC=O)CC(C)(C)O 2230a_100000755907_200011292268 [0,2,0,0,0,0|2,0,0]=4 2263 B11R0.165 CN(CCCC=O)CC(C)(C)O 269982a_100000755907_200011292268 [0,2,0,0,0,0|2,0,0]=4 2264 B11R0.165 CN(CCCC=O)C[Si](C)(C)C 269982a_200020589227_200011292268 [0,2,0,0,0,0|1,1,0]=4 2265 B11R0.165 COCCN[C@@H](C)CC(C)(C)C 2230a_106358413534_100011201679 [0,2,0,0,0,0|0,0,2]=4 2266 B11R0.165 COCCOC(C)CC(C)(C)C 7a_200011218616_100000233755 [0,2,0,0,0,0|0,0,2]=4 2267 B11R0.165 CSCCN[C@@H](C)CC(C)(C)C 2230a_106358413534_100000751147 [0,2,0,0,0,0|0,1,1]=4 2268 B11R0.165 CSCCOC(C)CC(C)(C)C 7a_200011218616_100000212216 [0,2,0,0,0,0|0,1,1]=4 2269 B11R0.165 C[C@@H](CC(C)(C)C)NCCC#N 2230a_106358413534_100011215226 [0,2,0,0,0,0|1,0,1]=4 2270 B11R0.165 C[C@@H](CC(C)(C)C)NCCCF 2230a_106358413534_100011934791 [0,2,0,0,0,0|1,0,1]=4 2271 B11R0.165 C[C@@H](CC(C)(C)C)NCCCO 2230a_106358413534_100000230001 [0,2,0,0,0,0|0,0,2]=4 2272 B11R0.165 C[N+](C)(C)CC(O)CSCC=O 62a_100000032816_200015260668 [0,2,0,0,0,0|2,0,0]=4 2273 B11R0.165 C[N+](C)(C)CC(O)CSCC=O 62a_200015260668_100000032816 [0,2,0,0,0,0|2,0,0]=4 2274 B11R0.245 C#CCNC(C)(C)CC(C)(C)C 2230a_100000211918_100000038162 [0,2,0,0,0,0|1,0,1]=4 2275 B11R0.245 C#CCOC(C)(C)CC(C)(C)C 7a_100000065652_100000038162 [0,2,0,0,0,0|1,0,1]=4 2276 B11R0.245 C=CCNC(C)(C)CC(C)(C)C 2230a_100000211918_100000210623 [0,2,0,0,0,0|1,0,0]=3 2277 B11R0.245 C=CCOC(C)(C)CC(C)(C)C 7a_100000065652_100015514636 [0,2,0,0,0,0|1,0,0]=3 2278 B11R0.245 CC(C)(C)CC(C)(C)NCC#N 2230a_100000211918_100011215382 [0,2,0,0,0,0|1,0,1]=4 2279 B11R0.245 CC(C)(C)CC(C)(C)NCC=O 2230a_100000211918_200015260668 [0,2,0,0,0,0|0,0,0]=2 2280 B11R0.245 CC(C)(C)CC(C)(C)NCCF 2230a_100000211918_100011217306 [0,2,0,0,0,0|1,0,1]=4 2281 B11R0.245 CC(C)(C)CC(C)(C)NCCO 2230a_100000211918_100000211926 [0,2,0,0,0,0|0,0,2]=4 2282 B11R0.245 CC(C)(C)CC(C)(C)OCC#N 7a_100000065652_100011215382 [0,2,0,0,0,0|1,0,1]=4 2283 B11R0.245 CC(C)(C)CC(C)(C)OCC=O 7a_100000065652_200015260668 [0,2,0,0,0,0|0,0,0]=2 2284 B11R0.245 CC(C)(C)CC(C)(C)OCCF 7a_100000065652_100011217306 [0,2,0,0,0,0|1,0,1]=4 2285 B11R0.245 CC(C)(C)CC(C)(C)OCCO 7a_100000065652_100000211926 [0,2,0,0,0,0|0,0,2]=4 2286 B11R0.245 CCCNC(C)(C)CC(C)(C)C 2230a_100000211918_100000210303 [0,2,0,0,0,0|1,0,1]=4 2287 B11R0.245 CCCOC(C)(C)CC(C)(C)C 7a_100000065652_100000210303 [0,2,0,0,0,0|1,0,1]=4 2288 B11R0.245 COCNC(C)(C)CC(C)(C)C 2230a_100000211918_100000766300 [0,2,0,0,0,0|2,0,0]=4 2289 B11R0.245 CSCNC(C)(C)CC(C)(C)C 2230a_100000211918_100011218213 [0,2,0,0,0,0|2,0,0]=4 2290 B11R0.51 C=C(C)CN(C)C(C)C(C)(C)C 2230a_100000745498_100000748629 [0,2,0,0,0,0|2,0,0]=4 2291 B11R0.51 C=C(C)CN(C)C(C)C(C)(C)C 269982a_100000745498_100000748629 [0,2,0,0,0,0|2,0,0]=4 2292 B11R0.51 C=C(F)CN(C)C(C)C(C)(C)C 2230a_100000745498_100009893438 [0,2,0,0,0,0|2,0,0]=4 2293 B11R0.51 C=C(F)CN(C)C(C)C(C)(C)C 269982a_100000745498_100009893438 [0,2,0,0,0,0|2,0,0]=4 2294 B11R0.51 CC(=O)OC(C)C(=O)C(C)(C)C 1458a_106744555173_100009818208 [0,2,0,0,0,0|1,0,1]=4 2295 B11R0.51 CC(=O)OC(C)N(C)C(C)(C)C 269982a_100011215553_100009818208 [0,2,0,0,0,0|2,0,0]=4 2296 B11R0.51 CC(C)(C)[C@H](O)C(=O)CC(=O)N 1458a_100009816492_100000187820 [0,2,0,0,0,0|1,0,1]=4 2297 B11R0.51 CC(C)(C)[C@H](O)C(=O)CC(=O)[O-] 1458a_100009816492_100020667443 [0,2,0,0,0,0|1,0,1]=4 2298 B11R0.51 CC(N(C)CC(=O)N)C(C)(C)C 2230a_100000745498_100000747473 [0,2,0,0,0,0|1,0,0]=3 2299 B11R0.51 CC(N(C)CC(=O)N)C(C)(C)C 269982a_100000745498_100000187820 [0,2,0,0,0,0|1,0,0]=3 2300 B11R0.51 CC(N(C)CC(=O)[O-])C(C)(C)C 269982a_100000745498_100020667443 [0,2,0,0,0,0|1,0,0]=3 2301 B11R0.51 CC(N(C)C[N+](=O)[O-])C(C)(C)C 269982a_100000745498_100000761209 [0,2,0,0,0,0|2,0,0]=4 2302 B11R0.51 CN(CC(=O)N)C(=O)C(C)(C)C 11a_100000739694_106744555173 [0,2,0,0,0,0|1,0,1]=4 2303 B11R0.51 CN(CC(=O)N)C(=O)C(C)(C)C 527a_100000739694_106744555173 [0,2,0,0,0,0|1,0,1]=4 2304 B11R0.208 CC(=O)C[Si](C)(C)C[Si](C)(C)C 1458a_100000070787_200000011523 [0,2,0,0,0,0|0,2,0]=4 2305 B11R0.208 CC(=O)NC(C)(C)CC(C)(C)C 11a_100000211918_100015343762 [0,2,0,0,0,0|1,0,0]=3 2306 B11R0.208 CC(=O)NC(C)(C)CC(C)(C)C 1626a_100000211918_100015343762 [0,2,0,0,0,0|1,0,0]=3 2307 B11R0.208 CC(=O)NC(C)(C)CC(C)(C)C 240690a_100000211918_100015343762 [0,2,0,0,0,0|1,0,0]=3 2308 B11R0.208 CC(=O)NC(C)(C)CC(C)(C)C 527a_100000211918_100103153847 [0,2,0,0,0,0|1,0,0]=3 2309 B11R0.208 CC(C)(C)NC(C)(C)CC(=O)O 269956a_100000755897_100000211941 [0,2,0,0,0,0|1,0,0]=3 2310 B11R0.308 CC(=O)C(C)C(=O)CC(C)(C)C 1458a_100000211214_100000179758 [0,2,0,0,0,0|1,0,1]=4 2311 B11R0.308 CC(=O)C(C)N(C)CC(C)(C)C 2230a_100000742839_100009814033 [0,2,0,0,0,0|1,0,0]=3 2312 B11R0.308 CC(=O)C(C)N(C)CC(C)(C)C 269982a_100000742839_100009814033 [0,2,0,0,0,0|1,0,0]=3 2313 B11R0.308 CC(=O)C(C)N(C)CC(C)(C)O 2230a_100000755907_100009814033 [0,2,0,0,0,0|2,0,0]=4 2314 B11R0.308 CC(=O)C(C)N(C)CC(C)(C)O 269982a_100000755907_100009814033 [0,2,0,0,0,0|2,0,0]=4 2315 B11R0.308 CC(=O)C(C)N(C)C[Si](C)(C)C 269982a_200020589227_100009814033 [0,2,0,0,0,0|1,1,0]=4 2316 B11R0.308 CC(C(=O)N)C(=O)CC(C)(C)C 1458a_100000211214_100000702099 [0,2,0,0,0,0|1,0,1]=4 2317 B11R0.308 CC(C(=O)N)N(C)CC(C)(C)C 2230a_100000742839_100000702099 [0,2,0,0,0,0|1,0,0]=3 2318 B11R0.308 CC(C(=O)N)N(C)CC(C)(C)C 269982a_100000742839_100000184083 [0,2,0,0,0,0|1,0,0]=3 2319 B11R0.308 CC(C(=O)N)N(C)CC(C)(C)O 2230a_100000755907_100000702099 [0,2,0,0,0,0|2,0,0]=4 2320 B11R0.308 CC(C(=O)N)N(C)CC(C)(C)O 269982a_100000755907_100000184083 [0,2,0,0,0,0|2,0,0]=4 2321 B11R0.308 CC(C(=O)N)N(C)C[Si](C)(C)C 269982a_200020589227_100000184083 [0,2,0,0,0,0|1,1,0]=4 2322 B11R0.308 CC(C(=O)O)N(C)CC(C)(C)C 269956a_100000749554_100011219605 [0,2,0,0,0,0|1,0,0]=3 2323 B11R0.308 CC(C(=O)O)N(C)CC(C)(C)F 269956a_100000749554_100011997219 [0,2,0,0,0,0|2,0,0]=4 2324 B11R0.308 CC(C(=O)O)N(C)CC(C)(C)O 269956a_100000749554_100000764493 [0,2,0,0,0,0|2,0,0]=4 2325 B11R0.308 CC(C(=O)O)N(C)C[N+](C)(C)C 269956a_100000749554_200000036245 [0,2,0,0,0,0|2,0,0]=4 2326 B11R0.308 CC(C(=O)O)N(C)C[Si](C)(C)C 269956a_100000749554_100000037933 [0,2,0,0,0,0|1,1,0]=4 2327 B11R0.308 CC(C)(C)CC(=O)C(F)C(=O)N 1458a_100000211214_100009813875 [0,2,0,0,0,0|1,0,1]=4 2328 B11R0.308 CC(C)(C)CC(=O)C(F)C(=O)[O-] 1458a_100000211214_100020610796 [0,2,0,0,0,0|1,0,1]=4 2329 B11R0.308 CC(OC(C)(C)C)C(C)[N+](=O)[O-] 34a_200000034949_100000210625 [0,2,0,0,0,0|2,0,0]=4 2330 B11R0.308 CN(CC(C)(C)C)C(=O)C(=O)N 240690a_100000742839_100011215815 [0,2,0,0,0,0|1,0,1]=4 2331 B11R0.308 CN(CC(C)(C)C)C(F)C(=O)N 2230a_100000742839_100009813875 [0,2,0,0,0,0|1,0,0]=3 2332 B11R0.308 CN(CC(C)(C)C)C(F)C(=O)N 269982a_100000742839_100009813875 [0,2,0,0,0,0|1,0,0]=3 2333 B11R0.308 CN(CC(C)(C)O)C(F)C(=O)N 2230a_100000755907_100009813875 [0,2,0,0,0,0|2,0,0]=4 2334 B11R0.308 CN(CC(C)(C)O)C(F)C(=O)N 269982a_100000755907_100009813875 [0,2,0,0,0,0|2,0,0]=4 2335 B11R0.308 CN(C[Si](C)(C)C)C(F)C(=O)N 269982a_200020589227_100009813875 [0,2,0,0,0,0|1,1,0]=4 2336 B11R0.308 C[C@@H](OC(C)(C)C)[C@H](N)C(=O)N 34a_100000003557_100000210625 [0,2,0,0,0,0|1,0,0]=3 2337 B11R0.359 C[C@@H](CC(C)(C)C)NS(=O)(=O)C 40a_106358413534_100000738038 [0,2,0,0,0,0|2,0,0]=4 2338 B11R0.64 C=CC(C)N(C)C(C)C(C)(C)C 269982a_100000745498_100011215867 [0,2,0,0,0,0|2,0,0]=4 2339 B11R0.172 CN(CC(C)(C)C)C(C=O)C=O 2230a_100000742839_100000736813 [0,2,0,0,0,0|1,0,0]=3 2340 B11R0.172 CN(CC(C)(C)O)C(C=O)C=O 2230a_100000755907_100000736813 [0,2,0,0,0,0|2,0,0]=4 2341 B11R0.322 C=CC(F)(F)N(C)CC(C)(C)C 269982a_100000742839_100009814244 [0,2,0,0,0,0|2,0,0]=4 2342 B9R1.7 C=CCN1CC[C@H](C1)C 2230a_100016987628_100000210623 [1,0,0,1,0,0|2,0,0]=4 2343 B9R1.7 C=CCN1CC[C@H](C1)C 269982a_100016987628_100000210623 [1,0,0,1,0,0|2,0,0]=4 2344 B9R1.7 C=CCN1CC[C@H](C1)C 34a_100016987628_100015514636 [1,0,0,1,0,0|2,0,0]=4 2345 B9R1.7 C[C@@H]1CCN(C1)CC=O 2230a_100016987628_200015260668 [1,0,0,1,0,0|1,0,0]=3 2346 B9R1.7 C[C@@H]1CCN(C1)CC=O 269982a_100016987628_200015260668 [1,0,0,1,0,0|1,0,0]=3 2347 B9R1.7 C[C@@H]1CCN(C1)CC=O 34a_100016987628_200009817547 [1,0,0,1,0,0|1,0,0]=3 2348 B9R1.7 O=CCN1CCC(C1)O 2230a_100011215560_200015260668 [1,0,0,1,0,0|2,0,0]=4 2349 B9R1.7 O=CCN1CCC(C1)O 269982a_100011215560_200015260668 [1,0,0,1,0,0|2,0,0]=4 2350 B9R1.7 O=CCN1CC[C@@H](C1)F 2230a_100015203821_200015260668 [1,0,0,1,0,0|2,0,0]=4 2351 B9R1.7 O=CCN1CC[C@@H](C1)F 269982a_100015203821_200015260668 [1,0,0,1,0,0|2,0,0]=4 2352 B9R1.7 O=CCN1CC[C@@H](C1)F 34a_100015203821_200009817547 [1,0,0,1,0,0|2,0,0]=4 2353 B9R1.13 CC(C)CN1CC=CC1 269982a_100015195280_100000210624 [1,0,0,1,0,0|2,0,0]=4 2354 B9R1.13 CC(C)NC1CC=CC1 2230a_100015188752_100000210206 [1,0,0,1,0,0|2,0,0]=4 2355 B9R1.34 CC1CC(CN(C1)C)C 2230a_100000210448_200000210301 [1,0,0,1,0,0|2,0,0]=4 2356 B9R1.34 CC1CC(CN(C1)C)C 269982a_100000210448_200000210301 [1,0,0,1,0,0|2,0,0]=4 2357 B9R1.34 CC1CC(CN(C1)C)C 34a_100000210448_200000210301 [1,0,0,1,0,0|2,0,0]=4 2358 B9R1.34 CC1CC(CN(C1)[13CH3])C 2230a_100000210448_200025704644 [1,0,0,1,0,0|2,0,0]=4 2359 B9R1.34 CC1CC(CN(C1)[13CH3])C 269982a_100000210448_200025704644 [1,0,0,1,0,0|2,0,0]=4 2360 B9R1.34 CC1CC(CN(C1)[13CH3])C 34a_100000210448_200025704644 [1,0,0,1,0,0|2,0,0]=4 2361 B9R1.53 C=C1CC(C1)NC(C)C 2230a_100132301982_100000210206 [1,0,0,1,0,0|2,0,0]=4 2362 B9R1.53 CC(=O)CC1CC(=O)C1 1458a_100000070787_100009874392 [1,0,0,1,0,0|1,0,1]=4 2363 B9R1.53 CC(C)CC1CN(C1)C 2230a_214813039686_200000210301 [1,0,0,1,0,0|2,0,0]=4 2364 B9R1.53 CC(C)CC1CN(C1)C 269982a_214813039686_200000210301 [1,0,0,1,0,0|2,0,0]=4 2365 B9R1.53 CC(C)CC1CN(C1)C 34a_214813039686_200000210301 [1,0,0,1,0,0|2,0,0]=4 2366 B9R1.53 CC(C)CC1CN(C1)[13CH3] 2230a_214813039686_200025704644 [1,0,0,1,0,0|2,0,0]=4 2367 B9R1.53 CC(C)CC1CN(C1)[13CH3] 269982a_214813039686_200025704644 [1,0,0,1,0,0|2,0,0]=4 2368 B9R1.53 CC(C)CC1CN(C1)[13CH3] 34a_214813039686_200025704644 [1,0,0,1,0,0|2,0,0]=4 2369 B9R1.53 CC(C)SC1CC(=O)C1 62a_100009894365_100000210206 [1,0,0,1,0,0|1,0,0]=3 2370 B9R1.53 CN(C)CC1CC(=O)C1 2230a_100102631434_100009874392 [1,0,0,1,0,0|1,0,0]=3 2371 B9R1.53 CN(C)CC1CC(=O)C1 269982a_100102631434_100009874392 [1,0,0,1,0,0|1,0,0]=3 2372 B9R1.75 C=CCN(C)CC1CC1 2230a_100000225617_100000742324 [1,0,0,1,0,0|2,0,0]=4 2373 B9R1.75 C=CCN(C)CC1CC1 2230a_100000741881_100000210623 [1,0,0,1,0,0|2,0,0]=4 2374 B9R1.75 C=CCN(C)CC1CC1 269982a_100000225617_100000756562 [1,0,0,1,0,0|2,0,0]=4 2375 B9R1.75 C=CCN(C)CC1CC1 269982a_100000741881_100000210623 [1,0,0,1,0,0|2,0,0]=4 2376 B9R1.75 C=CC[C@@H](C)OC1CC1 34a_100000731007_100000211595 [1,0,0,1,0,0|2,0,0]=4 2377 B9R1.75 CN(CC=O)CC1CC1 2230a_100000741881_200015260668 [1,0,0,1,0,0|1,0,0]=3 2378 B9R1.75 CN(CC=O)CC1CC1 269982a_100000741881_200015260668 [1,0,0,1,0,0|1,0,0]=3 2379 B9R1.136 C=CCN1CC(C1)(C)C 2230a_100000753659_100000210623 [1,0,0,1,0,0|2,0,0]=4 2380 B9R1.136 C=CCN1CC(C1)(C)C 269982a_100000753659_100000210623 [1,0,0,1,0,0|2,0,0]=4 2381 B9R1.136 CC1(CN(C1)CC=O)C 2230a_100000753659_200015260668 [1,0,0,1,0,0|1,0,0]=3 2382 B9R1.136 CC1(CN(C1)CC=O)C 269982a_100000753659_200015260668 [1,0,0,1,0,0|1,0,0]=3 2383 B9R1.136 CC1(CN(C1)CC=O)F 2230a_100000696199_200015260668 [1,0,0,1,0,0|2,0,0]=4 2384 B9R1.136 CC1(CN(C1)CC=O)F 269982a_100000696199_200015260668 [1,0,0,1,0,0|2,0,0]=4 2385 B9R1.136 CC1(CN(C1)CC=O)O 2230a_100000718560_200015260668 [1,0,0,1,0,0|2,0,0]=4 2386 B9R1.136 CC1(CN(C1)CC=O)O 269982a_100000718560_200015260668 [1,0,0,1,0,0|2,0,0]=4 2387 B9R1.99 C=CCCNC1(CC1)C 2230a_100000757604_100000754431 [1,0,0,1,0,0|2,0,0]=4 2388 B9R1.99 C=CCCOC1(CC1)C 7a_100011725673_100000754431 [1,0,0,1,0,0|2,0,0]=4 2389 B9R1.99 C=CCNCC1(CC1)C 2230a_100000766693_100000210623 [1,0,0,1,0,0|2,0,0]=4 2390 B9R1.99 C=CCOCC1(CC1)C 7a_100000698024_100015514636 [1,0,0,1,0,0|2,0,0]=4 2391 B9R1.99 CC1(CC1)CNCC=O 2230a_100000766693_200015260668 [1,0,0,1,0,0|1,0,0]=3 2392 B9R1.99 CC1(CC1)COCC=O 7a_100000698024_200015260668 [1,0,0,1,0,0|1,0,0]=3 2393 B9R1.99 CC1(CO1)CSCC=O 62a_100000760498_200015260668 [1,0,0,1,0,0|2,0,0]=4 2394 B9R1.99 CC1(CO1)CSCC=O 62a_200015260668_100000760498 [1,0,0,1,0,0|2,0,0]=4 2395 B9R1.99 O=CCNCC1(CC1)O 2230a_100011936951_200015260668 [1,0,0,1,0,0|2,0,0]=4 2396 B9R1.99 O=CCOCC1(CC1)F 34a_200000703853_200009817547 [1,0,0,1,0,0|2,0,0]=4 2397 B9R1.99 O=CCOCC1(CC1)F 7a_200000703853_200015260668 [1,0,0,1,0,0|2,0,0]=4 2398 B9R1.133 CNC1CCC(C1)(C)C 270004a_106832991635_100000759959 [1,0,0,1,0,0|2,0,0]=4 2399 B9R1.113 CC(CO)NC1(CC1)C 2230a_100000757604_100012180447 [1,0,0,1,0,0|1,0,1]=4 2400 B9R1.113 CC(CO)OC1(CC1)C 7a_100011725673_100012180447 [1,0,0,1,0,0|1,0,1]=4 2401 B9R1.113 CCC(C)NC1(CC1)C 2230a_100000757604_100000758301 [1,0,0,1,0,0|1,0,1]=4 2402 B9R1.113 CCC(C)OC1(CC1)C 7a_100011725673_100000758301 [1,0,0,1,0,0|1,0,1]=4 2403 B11R1.82 C=CCN1CCC(CC1)(C)C 2230a_100000750138_100000210623 [0,0,0,1,0,1|2,0,0]=4 2404 B11R1.82 C=CCN1CCC(CC1)(C)C 269982a_100000750138_100000210623 [0,0,0,1,0,1|2,0,0]=4 2405 B11R1.82 CC1(CCN(CC1)CC=O)C 2230a_100000750138_200015260668 [0,0,0,1,0,1|1,0,0]=3 2406 B11R1.82 CC1(CCN(CC1)CC=O)C 269982a_100000750138_200015260668 [0,0,0,1,0,1|1,0,0]=3 2407 B11R1.82 CC1(CCN(CC1)CC=O)O 2230a_100000690209_200015260668 [0,0,0,1,0,1|2,0,0]=4 2408 B11R1.82 CC1(CCN(CC1)CC=O)O 269982a_100000690209_200015260668 [0,0,0,1,0,1|2,0,0]=4 2409 B11R1.82 C[Si]1(CCN(CC1)CC=O)C 2230a_100025715224_200015260668 [0,0,0,1,0,1|1,1,0]=4 2410 B11R1.82 C[Si]1(CCN(CC1)CC=O)C 269982a_100025715224_200015260668 [0,0,0,1,0,1|1,1,0]=4 2411 B11R1.105 CC1CCCC1OC(C)(C)C 34a_100011216460_100000210625 [0,0,0,1,0,1|1,0,1]=4 2412 B11R1.105 C[C@@H]1CCCN1CC(C)(C)C 270004a_100015189458_100011204126 [0,0,0,1,0,1|1,0,1]=4 2413 B11R1.105 C[C@@H]1CCCN1CC(C)(C)C 34a_100015189458_100011219605 [0,0,0,1,0,1|1,0,1]=4 2414 B11R1.105 C[C@@H]1CNC[C@@H]1OC(C)(C)C 34a_200015306588_100000210625 [0,0,0,1,0,1|2,0,0]=4 2415 B11R1.105 C[C@H]1CCCN1CC(C)(C)C 270004a_100020605311_100011204126 [0,0,0,1,0,1|1,0,1]=4 2416 B11R1.122 CC(C)(C)N1CC(C1)CC#N 269982a_206645079572_100000210625 [0,0,0,1,0,1|1,0,1]=4 2417 B11R1.122 CC(C)(O)C1CN(C1)CC=O 269982a_100000708124_200015260668 [0,0,0,1,0,1|2,0,0]=4 2418 B11R1.122 CC(C)(O)C1CN(C1)CC=O 34a_100000708124_200009817547 [0,0,0,1,0,1|2,0,0]=4 2419 B11R1.122 COCC1CN(C1)C(C)(C)C 269982a_100016993750_100000210625 [0,0,0,1,0,1|2,0,0]=4 2420 B11R1.122 COCC1CN(C1)C(C)(C)C 34a_100016993750_100000210625 [0,0,0,1,0,1|2,0,0]=4 2421 B11R1.155 C[C@H]1CCCN(C1)C(C)(C)C 269982a_100000717927_100000210625 [0,0,0,1,0,1|1,0,1]=4 2422 B11R1.155 C[C@H]1CCCN(C1)C(C)(C)C 34a_100000717927_100000210625 [0,0,0,1,0,1|1,0,1]=4 2423 B11R1.338 C=CC[C@@H](C)OCC1(CO1)C 34a_100000731007_100000760498 [0,0,0,1,0,1|2,0,0]=4 2424 B11R1.338 CC(CC#N)NCC1(CC1)C 2230a_100000766693_100009813641 [0,0,0,1,0,1|1,0,1]=4 2425 B11R1.338 CC(CC#N)OCC1(CC1)C 7a_100000698024_100009813641 [0,0,0,1,0,1|1,0,1]=4 2426 B11R1.338 CC(CCO)NCC1(CC1)C 2230a_100000766693_100009893172 [0,0,0,1,0,1|0,0,2]=4 2427 B11R1.338 CC(CCO)OCC1(CC1)C 7a_100000698024_100009893172 [0,0,0,1,0,1|0,0,2]=4 2428 B11R1.338 CCCC(C)CNC1(CC1)C 2230a_100000757604_100011216630 [0,0,0,1,0,1|1,0,1]=4 2429 B11R1.338 CCCC(C)COC1(CC1)C 7a_100011725673_100011216630 [0,0,0,1,0,1|1,0,1]=4 2430 B11R1.338 CCCC(C)NCC1(CC1)C 2230a_100000766693_100000766640 [0,0,0,1,0,1|1,0,1]=4 2431 B11R1.338 CCCC(C)NCC1(CC1)C 270004a_100000766693_100000211909 [0,0,0,1,0,1|1,0,1]=4 2432 B11R1.338 CCCC(C)OCC1(CC1)C 7a_100000698024_100000766640 [0,0,0,1,0,1|1,0,1]=4 2433 B11R1.338 COCC(C)NCC1(CC1)C 2230a_100000766693_100000765312 [0,0,0,1,0,1|2,0,0]=4 2434 B11R1.338 COCC(C)NCC1(CC1)C 270004a_100000766693_100000749346 [0,0,0,1,0,1|2,0,0]=4 2435 B11R1.338 COCC(C)OCC1(CC1)C 7a_100000698024_100000765312 [0,0,0,1,0,1|2,0,0]=4 2436 B11R1.338 CSCC(C)NCC1(CC1)C 270004a_100000766693_100011216314 [0,0,0,1,0,1|2,0,0]=4 2437 B11R1.510 CC(C)(C)CCN1CC=CC1 269982a_100015195280_100000755188 [0,0,0,1,0,1|2,0,0]=4 2438 B11R1.510 CC(C)(C)CNC1CC=CC1 270004a_100015188752_100011204126 [0,0,0,1,0,1|1,0,0]=3 2439 B11R1.510 CC(C)(C)CNC1CCCC1 2230a_100000743828_100000179811 [0,0,0,1,0,1|1,0,1]=4 2440 B11R1.510 CC(C)(C)CNC1CCCC1 270004a_100000211070_100011204126 [0,0,0,1,0,1|1,0,1]=4 2441 B11R1.510 CC(C)(C)CNC1CCCC1 270004a_100000743828_100000210133 [0,0,0,1,0,1|1,0,1]=4 2442 B11R1.510 CC(C)(C)CNC1CCCC1 34a_100000211070_100011219605 [0,0,0,1,0,1|1,0,1]=4 2443 B11R1.510 CC(C)(C)CNC1CCOC1 2230a_100000743828_100000731011 [0,0,0,1,0,1|0,0,2]=4 2444 B11R1.510 CC(C)(C)CNC1CCOC1 270004a_100000743828_100000752484 [0,0,0,1,0,1|0,0,2]=4 2445 B11R1.510 CC(C)(C)CNC1CCSC1 270004a_100000743828_100000212027 [0,0,0,1,0,1|0,1,1]=4 2446 B11R1.510 CC(C)(C)CN[C@@H]1CCOC1 270004a_200015188469_100011204126 [0,0,0,1,0,1|0,0,2]=4 2447 B11R1.510 CC(C)(C)CN[C@H]1CCOC1 270004a_100015188467_100011204126 [0,0,0,1,0,1|0,0,2]=4 2448 B11R1.510 CC(C)(C)CN[C@H]1CCOC1 34a_100015188467_100011219605 [0,0,0,1,0,1|0,0,2]=4 2449 B11R1.510 CC(C)(C)COC1CCCC1 34a_100000210269_100011219605 [0,0,0,1,0,1|1,0,1]=4 2450 B11R1.510 CC(C)(C)CO[C@H]1CCOC1 34a_100000717292_100011219605 [0,0,0,1,0,1|0,0,2]=4 2451 B11R1.510 CC(C)(C)CSC1CCCC1 62a_100011217020_100011219605 [0,0,0,1,0,1|1,0,1]=4 2452 B11R1.510 CC(C)(C)CSC1CCCC1 62a_100011219605_100000179811 [0,0,0,1,0,1|1,0,1]=4 2453 B11R1.510 CC(C)(C)CSC1CCOC1 62a_100011219605_100000690089 [0,0,0,1,0,1|0,0,2]=4 2454 B11R1.510 CC(C)(C)NCC1CCCC1 2230a_100000715429_100000740388 [0,0,0,1,0,1|1,0,1]=4 2455 B11R1.510 CC(C)(C)NCC1CCCC1 34a_100000737975_100000210625 [0,0,0,1,0,1|1,0,1]=4 2456 B11R1.510 CC(C)(C)NCC1CCOC1 2230a_100000715429_100000702531 [0,0,0,1,0,1|0,0,2]=4 2457 B11R1.510 CC(C)(C)NCC1CCOC1 34a_100000737293_100000210625 [0,0,0,1,0,1|0,0,2]=4 2458 B11R1.510 CC(C)(C)OCC1CC=CC1 34a_100000688395_100000210625 [0,0,0,1,0,1|1,0,0]=3 2459 B11R1.510 CC(C)(C)OCC1CCCC1 34a_100000742336_100000210625 [0,0,0,1,0,1|1,0,1]=4 2460 B11R1.510 CC(C)(C)OCC1CCCC1 34a_100015890283_100000740388 [0,0,0,1,0,1|1,0,1]=4 2461 B11R1.510 CC(C)(C)OCC1CCCC1 7a_100015890283_100000740388 [0,0,0,1,0,1|1,0,1]=4 2462 B11R1.510 CC(C)(C)OCC1CCNC1 34a_100000748654_100000210625 [0,0,0,1,0,1|1,0,1]=4 2463 B11R1.510 CC(C)(C)OCC1CCOC1 34a_100000740260_100000210625 [0,0,0,1,0,1|0,0,2]=4 2464 B11R1.510 CC(C)(C)OCC1CCOC1 34a_100015890283_100011261433 [0,0,0,1,0,1|0,0,2]=4 2465 B11R1.510 CC(C)(C)OCC1CCOC1 7a_100015890283_100000702531 [0,0,0,1,0,1|0,0,2]=4 2466 B11R1.510 CC(C)(C)SCC1CCCC1 62a_100000211941_100000740388 [0,0,0,1,0,1|1,0,1]=4 2467 B11R1.510 CC(C)(C)SCC1CCCC1 62a_100000740388_100000211941 [0,0,0,1,0,1|1,0,1]=4 2468 B11R1.510 CC(C)(C)SCC1CCOC1 62a_100000211941_100000702531 [0,0,0,1,0,1|0,0,2]=4 2469 B11R1.510 CC(C)(C)SCC1CCOC1 62a_100000702531_100000211941 [0,0,0,1,0,1|0,0,2]=4 2470 B11R1.510 C[Si](C)(C)CNC1CC=CC1 2230a_100015188752_100000037933 [0,0,0,1,0,1|1,1,0]=4 2471 B11R1.577 C=C1CC(C1)CNC(C)(C)C 34a_100102567296_100000210625 [0,0,0,1,0,1|1,0,0]=3 2472 B11R1.577 C=C1CC(C1)COC(C)(C)C 34a_100011011225_100000210625 [0,0,0,1,0,1|1,0,0]=3 2473 B11R1.577 C=C1CC(C1)NCC(C)(C)C 270004a_100132301982_100011204126 [0,0,0,1,0,1|1,0,0]=3 2474 B11R1.577 C=C1CC(C1)NC[Si](C)(C)C 2230a_100132301982_100000037933 [0,0,0,1,0,1|1,1,0]=4 2475 B11R1.577 CC(C)(C)CNC1CC(C1)F 270004a_100016993743_100011204126 [0,0,0,1,0,1|1,0,1]=4 2476 B11R1.577 CC(C)(C)CN[C@H]1C[C@@H](C1)O 270004a_100020629032_100011204126 [0,0,0,1,0,1|0,0,2]=4 2477 B11R1.577 CC(C)(C)CSC1CC(=O)C1 62a_100009894365_100011219605 [0,0,0,1,0,1|0,0,0]=2 2478 B11R1.577 CC(C)(C)NCC1CC(=O)C1 2230a_100000715429_100009874392 [0,0,0,1,0,1|0,0,0]=2 2479 B11R1.577 CC(C)(C)OCC1CC(=O)C1 34a_100000101936_100000210625 [0,0,0,1,0,1|0,0,0]=2 2480 B11R1.577 CC(C)(C)OCC1CC(=O)C1 7a_100015890283_100009874392 [0,0,0,1,0,1|0,0,0]=2 2481 B11R1.577 CC(C)(C)OCC1CC(C1)Cl 34a_100009874164_100000210625 [0,0,0,1,0,1|1,0,1]=4 2482 B11R1.577 CC(C)(C)SCC1CC(=O)C1 62a_100000211941_100009874392 [0,0,0,1,0,1|0,0,0]=2 2483 B11R1.577 CC(C)(C)SCC1CC(=O)C1 62a_100009874392_100000211941 [0,0,0,1,0,1|0,0,0]=2 2484 B11R1.577 CC(C)(F)CSC1CC(=O)C1 62a_100009894365_100011997219 [0,0,0,1,0,1|1,0,0]=3 2485 B11R1.577 CC(C)(O)CSC1CC(=O)C1 62a_100009894365_100000764493 [0,0,0,1,0,1|1,0,0]=3 2486 B11R1.577 CN1CC(C1)NCC(C)(C)C 270004a_100015196640_100011204126 [0,0,0,1,0,1|2,0,0]=4 2487 B11R1.577 C[N+](C)(C)CSC1CC(=O)C1 62a_100009894365_200000036245 [0,0,0,1,0,1|1,0,0]=3 2488 B11R1.577 C[Si](C)(C)CSC1CC(=O)C1 62a_100009894365_100000037933 [0,0,0,1,0,1|0,1,0]=3 2489 B11R1.821 CC(CC#N)N1CC(C1)(C)C 2230a_100000753659_100009813641 [0,0,0,1,0,1|1,0,1]=4 2490 B11R1.821 CC(CC#N)N1CC(C1)(C)C 269982a_100000753659_100009813641 [0,0,0,1,0,1|1,0,1]=4 2491 B11R1.821 CC(CCO)N1CC(C1)(C)C 2230a_100000753659_100009893172 [0,0,0,1,0,1|0,0,2]=4 2492 B11R1.821 CC(CCO)N1CC(C1)(C)C 269982a_100000753659_100009893172 [0,0,0,1,0,1|0,0,2]=4 2493 B11R1.821 CCCC(C)N1CC(C1)(C)C 2230a_100000753659_100000766640 [0,0,0,1,0,1|1,0,1]=4 2494 B11R1.821 CCCC(C)N1CC(C1)(C)C 269982a_100000753659_100000766640 [0,0,0,1,0,1|1,0,1]=4 2495 B11R1.821 CCCC(C)N1CC(C1)(C)C 270004a_100000753659_100000211909 [0,0,0,1,0,1|1,0,1]=4 2496 B11R1.821 COCC(C)N1CC(C1)(C)C 2230a_100000753659_100000765312 [0,0,0,1,0,1|2,0,0]=4 2497 B11R1.821 COCC(C)N1CC(C1)(C)C 269982a_100000753659_100000765312 [0,0,0,1,0,1|2,0,0]=4 2498 B11R1.821 COCC(C)N1CC(C1)(C)C 270004a_100000753659_100000749346 [0,0,0,1,0,1|2,0,0]=4 2499 B11R1.821 CSCC(C)N1CC(C1)(C)C 270004a_100000753659_100011216314 [0,0,0,1,0,1|2,0,0]=4 2500 B11R1.1296 CC(C)(C)CNC1(CCC1)C 270004a_100000692455_100011204126 [0,0,0,1,0,1|1,0,1]=4 2501 B11R1.1296 CC(C)(C)CNC1(CCC1)C 34a_100000692455_100011219605 [0,0,0,1,0,1|1,0,1]=4 2502 B11R1.1296 CC(C)(C)CNC1(COC1)C 270004a_100000732644_100011204126 [0,0,0,1,0,1|2,0,0]=4 2503 B11R1.1296 CC(C)(C)COC1(CCC1)C 34a_100000759064_100011219605 [0,0,0,1,0,1|1,0,1]=4 2504 B11R1.1296 CC1(CCC1)CNC(C)(C)C 2230a_100000715429_100000726658 [0,0,0,1,0,1|1,0,1]=4 2505 B11R1.1296 CC1(CCC1)COC(C)(C)C 34a_100015890283_100000726658 [0,0,0,1,0,1|1,0,1]=4 2506 B11R1.1296 CC1(CCC1)COC(C)(C)C 7a_100015890283_100000726658 [0,0,0,1,0,1|1,0,1]=4 2507 B11R1.1296 CC1(CCC1)CSC(C)(C)C 62a_100000211941_100000726658 [0,0,0,1,0,1|1,0,1]=4 2508 B11R1.1296 CC1(CCC1)CSC(C)(C)C 62a_100000726658_100000211941 [0,0,0,1,0,1|1,0,1]=4 2509 B11R1.1296 CC1(COC1)CNC(C)(C)C 2230a_100000715429_100000066812 [0,0,0,1,0,1|2,0,0]=4 2510 B11R1.1296 CC1(COC1)COC(C)(C)C 34a_100015890283_100009817586 [0,0,0,1,0,1|2,0,0]=4 2511 B11R1.1296 CC1(COC1)COC(C)(C)C 7a_100015890283_100009817586 [0,0,0,1,0,1|2,0,0]=4 2512 B11R1.1296 CC1(COC1)CSC(C)(C)C 62a_100000211941_100009817586 [0,0,0,1,0,1|2,0,0]=4 2513 B11R1.1296 CC1(COC1)CSC(C)(C)C 62a_100009817586_100000211941 [0,0,0,1,0,1|2,0,0]=4 2514 B11R1.1296 CC1(CSC1)COC(C)(C)C 34a_100000732658_100000210625 [0,0,0,1,0,1|2,0,0]=4 2515 B11R1.1417 CC(NCC(C)(C)C)C1CC1 269862a_100000743828_100000210639 [0,0,0,1,0,1|1,0,1]=4 2516 B11R1.1417 CC(NCC(C)(C)C)C1CC1 270004a_100000700016_100011204126 [0,0,0,1,0,1|1,0,1]=4 2517 B11R1.1417 CC(NCC(C)(C)C)C1CC1 34a_100000700016_100011219605 [0,0,0,1,0,1|1,0,1]=4 2518 B11R1.1417 CC(NCC(C)(C)C)C1CO1 270004a_100000743828_100000031964 [0,0,0,1,0,1|0,0,2]=4 2519 B11R1.1417 CC(OCC(C)(C)C)C1CC1 34a_100000744524_100011219605 [0,0,0,1,0,1|1,0,1]=4 2520 B11R1.136 COC(C)(C)CN1CC=CC1 269982a_100015195280_100000701081 [0,1,0,1,0,0|2,0,0]=4 2521 B11R1.138 C#CC(C)(C)SC1CC(=O)C1 62a_100009894365_100000038118 [0,1,0,1,0,0|1,0,1]=4 2522 B11R1.138 CC(C)(C#N)SC1CC(=O)C1 62a_100009894365_100011162410 [0,1,0,1,0,0|1,0,1]=4 2523 B11R1.138 CCC(C)(C)SC1CC(=O)C1 62a_100009894365_100000032637 [0,1,0,1,0,0|1,0,0]=3 2524 B11R1.342 C=CCN1CCCC(C1)(C)C 2230a_100000716857_100000210623 [0,1,0,1,0,0|2,0,0]=4 2525 B11R1.342 C=CCN1CCCC(C1)(C)C 269982a_100000716857_100000210623 [0,1,0,1,0,0|2,0,0]=4 2526 B11R1.342 C=CCN1CCCC(C1)(C)C 34a_100000716857_100015514636 [0,1,0,1,0,0|2,0,0]=4 2527 B11R1.342 C=CCN1CCOC(C1)(C)C 2230a_100000738910_100000210623 [0,1,0,1,0,0|2,0,0]=4 2528 B11R1.342 C=CCN1CCOC(C1)(C)C 269982a_100000738910_100000210623 [0,1,0,1,0,0|2,0,0]=4 2529 B11R1.342 C=CCN1CCOC(C1)(C)C 34a_100000738910_100015514636 [0,1,0,1,0,0|2,0,0]=4 2530 B11R1.342 CC1(CCCN(C1)CC=O)C 2230a_100000716857_200015260668 [0,1,0,1,0,0|1,0,0]=3 2531 B11R1.342 CC1(CCCN(C1)CC=O)C 269982a_100000716857_200015260668 [0,1,0,1,0,0|1,0,0]=3 2532 B11R1.342 CC1(CCCN(C1)CC=O)C 34a_100000716857_200009817547 [0,1,0,1,0,0|1,0,0]=3 2533 B11R1.342 CC1(CCCN(C1)CC=O)O 2230a_100000695535_200015260668 [0,1,0,1,0,0|2,0,0]=4 2534 B11R1.342 CC1(CCCN(C1)CC=O)O 269982a_100000695535_200015260668 [0,1,0,1,0,0|2,0,0]=4 2535 B11R1.342 CC1(CN(CCO1)CC=O)C 2230a_100000738910_200015260668 [0,1,0,1,0,0|1,0,0]=3 2536 B11R1.342 CC1(CN(CCO1)CC=O)C 269982a_100000738910_200015260668 [0,1,0,1,0,0|1,0,0]=3 2537 B11R1.342 CC1(CN(CCO1)CC=O)C 34a_100000738910_200009817547 [0,1,0,1,0,0|1,0,0]=3 2538 B11R1.342 CNCC1CCOC(C1)(C)C 269862a_106832991636_100011361580 [0,1,0,1,0,0|2,0,0]=4 2539 B11R1.342 CNCC1CCOC(C1)(C)C 270004a_106832991635_100011361580 [0,1,0,1,0,0|2,0,0]=4 2540 B11R1.840 C=CCN(C)CC1(CCC1)C 2230a_100000225617_100000726658 [0,1,0,1,0,0|2,0,0]=4 2541 B11R1.840 C=CCN(C)CC1(CCC1)C 269982a_100000225617_100000726658 [0,1,0,1,0,0|2,0,0]=4 2542 B11R1.840 C=CCN(C)CC1(COC1)C 2230a_100000225617_100000066812 [0,1,0,1,0,0|2,0,0]=4 2543 B11R1.840 C=CCN(C)CC1(COC1)C 2230a_114948340825_100000210623 [0,1,0,1,0,0|2,0,0]=4 2544 B11R1.840 C=CCN(C)CC1(COC1)C 269982a_114948340825_100000210623 [0,1,0,1,0,0|2,0,0]=4 2545 B11R1.840 CN(CC=O)CC1(COC1)C 2230a_114948340825_200015260668 [0,1,0,1,0,0|1,0,0]=3 2546 B11R1.840 CN(CC=O)CC1(COC1)C 269982a_114948340825_200015260668 [0,1,0,1,0,0|1,0,0]=3 2547 B11R1.1004 C=CCN(C)CC1(CC1)CO 2230a_100138557128_100000210623 [0,1,0,1,0,0|2,0,0]=4 2548 B11R1.1004 C=CCN(C)CC1(CC1)CO 269982a_100138557128_100000210623 [0,1,0,1,0,0|2,0,0]=4 2549 B11R1.1004 CN(CC=O)CC1(CC1)CO 2230a_100138557128_200015260668 [0,1,0,1,0,0|1,0,0]=3 2550 B11R1.1004 CN(CC=O)CC1(CC1)CO 269982a_100138557128_200015260668 [0,1,0,1,0,0|1,0,0]=3 2551 B11R1.10 CC1=CC(CC(C1)(C)C)O[13CH3] 34a_100000211225_200025704644 [0,1,0,1,0,0|1,0,1]=4 2552 B11R1.10 CC1CC(CC(C1)(C)C)N[13CH3] 2230a_100011207991_200025704644 [0,1,0,1,0,0|1,0,1]=4 2553 B11R1.10 CNC1C=C(CC(C1)(C)C)C 270004a_106832991635_100000211104 [0,1,0,1,0,0|1,0,1]=4 2554 B11R1.10 CNC1C=C(CC(C1)(C)C)N 270004a_106832991635_100000185931 [0,1,0,1,0,0|1,0,1]=4 2555 B11R1.10 CNC1CC(CC(C1)(C)C)C 2230a_100011207991_200000210301 [0,1,0,1,0,0|1,0,1]=4 2556 B11R1.10 CNC1CC(CC(C1)(C)C)C 270004a_106832991635_100000209998 [0,1,0,1,0,0|1,0,1]=4 2557 B11R1.10 COC1C=C(CC(C1)(C)C)C 34a_100000211225_200000210301 [0,1,0,1,0,0|1,0,1]=4 2558 B11R1.76 CC(C)(C)OC1CCC(=O)C1 34a_100012614533_100000210625 [0,1,0,1,0,0|1,0,0]=3 2559 B11R1.76 CC(C)(C)OC1CNC(=O)C1 34a_100000690082_100000210625 [0,1,0,1,0,0|1,0,0]=3 2560 B11R1.76 CC(C)(C)OC1COC(=O)O1 34a_100015890283_100000032252 [0,1,0,1,0,0|2,0,0]=4 2561 B11R1.76 CC(C)(C)SC1COC(=O)O1 62a_100000211941_100000032252 [0,1,0,1,0,0|2,0,0]=4 2562 B11R1.76 C[Si](C)(C)CN1CNC(=O)C1 2230a_200000708111_100000037933 [0,1,0,1,0,0|1,1,0]=4 2563 B11R1.184 CCNC1CC(CC1C)(C)C 270004a_100015525214_100000720090 [0,1,0,1,0,0|1,0,1]=4 2564 B11R1.509 CC(C)(C)CN1CC=CCC1 270004a_100000698166_100011204126 [0,1,0,1,0,0|2,0,0]=4 2565 B11R1.509 CC(C)(C)CN1CC=CCC1 34a_100000698166_100011219605 [0,1,0,1,0,0|2,0,0]=4 2566 B11R1.509 CC(C)(C)OC1CC=CCC1 34a_100000073881_100000210625 [0,1,0,1,0,0|2,0,0]=4 2567 B11R1.213 C/C=C/CN1CCC(C1)(C)C 269982a_100000764714_100102629194 [0,1,0,1,0,0|2,0,0]=4 2568 B11R1.213 C=CCCN1CCC(C1)(C)C 2230a_100000764714_100000754431 [0,1,0,1,0,0|2,0,0]=4 2569 B11R1.213 C=CCCN1CCC(C1)(C)C 269982a_100000764714_100000754431 [0,1,0,1,0,0|2,0,0]=4 2570 B11R1.213 C=CCNC1CCC(C1)(C)C 270004a_100020586998_100000759959 [0,1,0,1,0,0|1,0,0]=3 2571 B11R1.213 CC1(CCC(C1)NCCO)C 270004a_100000210304_100000759959 [0,1,0,1,0,0|0,0,2]=4 2572 B11R1.213 CC=CCN1CCC(C1)(C)C 2230a_100000764714_100000070051 [0,1,0,1,0,0|2,0,0]=4 2573 B11R1.213 CCCNC1CCC(C1)(C)C 270004a_100020643023_100000759959 [0,1,0,1,0,0|1,0,1]=4 2574 B11R1.213 O=CCNC1CCC(C1)(F)F 2230a_100000689000_200015260668 [0,1,0,1,0,0|2,0,0]=4 2575 B11R1.213 O=CCNC1CCC(C1)(F)F 34a_100000689000_200009817547 [0,1,0,1,0,0|2,0,0]=4 2576 B11R1.488 CC1CC(CC1N(C)C)(C)C 270004a_100102631434_100000720090 [0,1,0,1,0,0|2,0,0]=4 2577 B11R1.710 C=C(C)CN1CCC(C1)(C)C 2230a_100000764714_100000748629 [0,1,0,1,0,0|2,0,0]=4 2578 B11R1.710 C=C(C)CN1CCC(C1)(C)C 269982a_100000764714_100000748629 [0,1,0,1,0,0|2,0,0]=4 2579 B11R1.710 C=C(F)CN1CCC(C1)(C)C 2230a_100000764714_100009893438 [0,1,0,1,0,0|2,0,0]=4 2580 B11R1.710 C=C(F)CN1CCC(C1)(C)C 269982a_100000764714_100009893438 [0,1,0,1,0,0|2,0,0]=4 2581 B11R1.710 CC(=O)CC1COC(O1)(C)C 1458a_100000070787_100000198056 [0,1,0,1,0,0|2,0,0]=4 2582 B11R1.710 CC(=O)C[C@H]1COC(O1)(C)C 1458a_100000070787_100015422573 [0,1,0,1,0,0|2,0,0]=4 2583 B11R1.710 CC1(CCN(C1)CC(=O)N)C 2230a_100000764714_100000747473 [0,1,0,1,0,0|1,0,0]=3 2584 B11R1.710 CC1(CCN(C1)CC(=O)N)C 269982a_100000764714_100000187820 [0,1,0,1,0,0|1,0,0]=3 2585 B11R1.710 CC1(CCN(C1)CC(=O)N)O 2230a_100000718628_100000747473 [0,1,0,1,0,0|2,0,0]=4 2586 B11R1.710 CC1(CCN(C1)CC(=O)N)O 269982a_100000718628_100000187820 [0,1,0,1,0,0|2,0,0]=4 2587 B11R1.710 CC1(CCN(C1)CC(=O)[O-])C 269982a_100000764714_100020667443 [0,1,0,1,0,0|1,0,0]=3 2588 B11R1.710 CC1(CCN(C1)CC(=O)[O-])O 269982a_100000718628_100020667443 [0,1,0,1,0,0|2,0,0]=4 2589 B11R1.710 CC1(CCN(C1)C[N+](=O)[O-])C 269982a_100000764714_100000761209 [0,1,0,1,0,0|2,0,0]=4 2590 B11R1.728 CC1(CC1)CC(=O)CC(=O)N 1458a_100000112800_100000187820 [0,1,0,1,0,0|1,0,1]=4 2591 B11R1.728 CC1(CC1)CC(=O)CC(=O)[O-] 1458a_100000112800_100020667443 [0,1,0,1,0,0|1,0,1]=4 2592 B11R1.728 CN(CC(=O)O)CC1(CO1)C 269956a_100000746989_100000760498 [0,1,0,1,0,0|2,0,0]=4 2593 B11R1.1263 CC1(C[C@@H]1C(=O)CC(=O)N)C 1458a_100000692687_100000187820 [0,1,0,1,0,0|1,0,1]=4 2594 B11R1.1263 CC1(C[C@@H]1C(=O)CC(=O)[O-])C 1458a_100000692687_100020667443 [0,1,0,1,0,0|1,0,1]=4 2595 B11R1.1314 CC(C)(C)NC1CS(=O)(=O)C1 34a_100000695474_100000210625 [0,1,0,1,0,0|2,0,0]=4 2596 B11R1.1314 CC(C)(C)OC1CS(=O)(=O)C1 34a_100000072295_100000210625 [0,1,0,1,0,0|2,0,0]=4 2597 B11R1.866 C=CC(C)N1CCC(C1)(C)C 269982a_100000764714_100011215867 [0,1,0,1,0,0|2,0,0]=4 2598 B11R1.665 CN(C1CC(=O)C1)C(C)(C)C 269982a_100011215553_100009894365 [0,1,0,1,0,0|1,0,0]=3 2599 B11R1.761 C=CCN1CCC(C1C)(C)C 2230a_100102837566_100000210623 [0,1,0,1,0,0|2,0,0]=4 2600 B11R1.761 C=CCN1CCC(C1C)(C)C 269982a_100102837566_100000210623 [0,1,0,1,0,0|2,0,0]=4 2601 B11R1.761 C=CCN1CCC(C1C)(C)C 34a_100102837566_100015514636 [0,1,0,1,0,0|2,0,0]=4 2602 B11R1.761 CC1N(CCC1(C)C)CC=O 2230a_100102837566_200015260668 [0,1,0,1,0,0|1,0,0]=3 2603 B11R1.761 CC1N(CCC1(C)C)CC=O 269982a_100102837566_200015260668 [0,1,0,1,0,0|1,0,0]=3 2604 B11R1.761 CC1N(CCC1(C)C)CC=O 34a_100102837566_200009817547 [0,1,0,1,0,0|1,0,0]=3 2605 B11R2.1244 C=CCN1CCC2(C1)CC2 2230a_100000697357_100000210623 [0,0,0,2,0,0|2,0,0]=4 2606 B11R2.1244 C=CCN1CCC2(C1)CC2 269982a_100000697357_100000210623 [0,0,0,2,0,0|2,0,0]=4 2607 B11R2.1244 C=CCN1CCC2(C1)CC2 34a_100000697357_100015514636 [0,0,0,2,0,0|2,0,0]=4 2608 B11R2.1244 O=CCN1CCC2(C1)CC2 2230a_100000697357_200015260668 [0,0,0,2,0,0|1,0,0]=3 2609 B11R2.1244 O=CCN1CCC2(C1)CC2 269982a_100000697357_200015260668 [0,0,0,2,0,0|1,0,0]=3 2610 B11R2.1244 O=CCN1CCC2(C1)CC2 34a_100000697357_200009817547 [0,0,0,2,0,0|1,0,0]=3 2611 B7R0.5 C=CCN(C)C(C)C 2230a_100000225617_100000210206 [1,0,0,0,1,0|2,0,0]=4 2612 B7R0.5 C=CCN(C)C(C)C 2230a_100000742772_200000210301 [1,0,0,0,1,0|2,0,0]=4 2613 B7R0.5 C=CCN(C)C(C)C 269982a_100000225617_100000210206 [1,0,0,0,1,0|2,0,0]=4 2614 B7R0.5 C=CCN(C)C(C)C 269982a_100000742772_200000210301 [1,0,0,0,1,0|2,0,0]=4 2615 B7R0.5 C=CCN(C)C(C)C 269982a_200000211004_100000210623 [1,0,0,0,1,0|2,0,0]=4 2616 B7R0.5 C=CCN([13CH3])C(C)C 2230a_100000742772_200025704644 [1,0,0,0,1,0|2,0,0]=4 2617 B7R0.5 C=CCN([13CH3])C(C)C 269982a_100000742772_200025704644 [1,0,0,0,1,0|2,0,0]=4 2618 B7R0.5 CC(C)N(C)CC=O 269982a_200000211004_200015260668 [1,0,0,0,1,0|1,0,0]=3 2619 B7R0.14 CCN(C)C(C)(C)C 2230a_100011200764_200000210301 [1,0,0,0,1,0|1,0,1]=4 2620 B7R0.14 CCN(C)C(C)(C)C 269982a_100000225621_100000210625 [1,0,0,0,1,0|1,0,1]=4 2621 B7R0.14 CCN(C)C(C)(C)C 269982a_100011200764_200000210301 [1,0,0,0,1,0|1,0,1]=4 2622 B7R0.14 CCN(C)C(C)(C)C 269982a_100011215553_100000204670 [1,0,0,0,1,0|1,0,1]=4 2623 B7R0.14 CCN([13CH3])C(C)(C)C 2230a_100011200764_200025704644 [1,0,0,0,1,0|1,0,1]=4 2624 B7R0.14 CCN([13CH3])C(C)(C)C 269982a_100011200764_200025704644 [1,0,0,0,1,0|1,0,1]=4 2625 B7R0.14 CN(CF)C(C)(C)C 269982a_100011215553_100015361967 [1,0,0,0,1,0|2,0,0]=4 2626 B7R0.14 CN[C@H](C)C(C)(C)C 2230a_100025703359_200000210301 [1,0,0,0,1,0|1,0,1]=4 2627 B7R0.14 C[C@@H](N[13CH3])C(C)(C)C 2230a_100025703359_200025704644 [1,0,0,0,1,0|1,0,1]=4 2628 B9R0.48 C#CCC(C)OCC(C)C 34a_100000685586_100000210624 [1,0,0,0,0,1|1,0,1]=4 2629 B9R0.48 C#CCC(C)OCC(C)C 7a_100000685586_100000210760 [1,0,0,0,0,1|1,0,1]=4 2630 B9R0.48 C/C=C/C(C)OCC(C)C 34a_200102604097_100000210624 [1,0,0,0,0,1|1,0,1]=4 2631 B9R0.48 C=CCC(C)COC(C)C 34a_100009832082_100000210206 [1,0,0,0,0,1|1,0,0]=3 2632 B9R0.48 C=CCC(C)COC(C)C 7a_100009832082_100000210206 [1,0,0,0,0,1|1,0,0]=3 2633 B9R0.48 C=CCN(C)CCC(C)C 2230a_100000225617_100000210312 [1,0,0,0,0,1|2,0,0]=4 2634 B9R0.48 C=CCN(C)CCC(C)C 2230a_100000742789_100000210623 [1,0,0,0,0,1|2,0,0]=4 2635 B9R0.48 C=CCN(C)CCC(C)C 269982a_100000225617_100000210312 [1,0,0,0,0,1|2,0,0]=4 2636 B9R0.48 C=CCN(C)CCC(C)C 269982a_100000742789_100000210623 [1,0,0,0,0,1|2,0,0]=4 2637 B9R0.48 C=CCN(C)COC(C)C 2230a_100000225617_100000709892 [1,0,0,0,0,1|2,0,0]=4 2638 B9R0.48 C=CCN(C)COC(C)C 269982a_100000225617_100000709892 [1,0,0,0,0,1|2,0,0]=4 2639 B9R0.48 C=CC[C@@H](C)OCC(C)C 34a_100000731007_100000210624 [1,0,0,0,0,1|1,0,0]=3 2640 B9R0.48 C=CC[C@@H](C)OCC(C)C 7a_100000731007_100000210760 [1,0,0,0,0,1|1,0,0]=3 2641 B9R0.48 C=CC[C@@H](C)OCC(C)O 34a_100000731007_100011218427 [1,0,0,0,0,1|2,0,0]=4 2642 B9R0.48 C=CC[C@@H](C)OCC(C)O 7a_100000731007_100011218427 [1,0,0,0,0,1|2,0,0]=4 2643 B9R0.48 C=CC[C@@H](C)OC[C@@H](C)O 34a_100000731007_100009817552 [1,0,0,0,0,1|2,0,0]=4 2644 B9R0.48 C=CC[C@@H](C)OC[C@@H](C)O 7a_100000731007_100009817552 [1,0,0,0,0,1|2,0,0]=4 2645 B9R0.48 C=CC[C@@H](N)COC(C)C 34a_100020615467_100000210206 [1,0,0,0,0,1|2,0,0]=4 2646 B9R0.48 CC(C)CCN(C)CC=O 2230a_100000742789_200015260668 [1,0,0,0,0,1|1,0,0]=3 2647 B9R0.48 CC(C)CCN(C)CC=O 269982a_100000742789_200015260668 [1,0,0,0,0,1|1,0,0]=3 2648 B9R0.48 CC(C)CNC(C)CC#N 2230a_100000210953_100009813641 [1,0,0,0,0,1|1,0,1]=4 2649 B9R0.48 CC(C)CNC(C)CCO 2230a_100000210953_100009893172 [1,0,0,0,0,1|0,0,2]=4 2650 B9R0.48 CC(C)CNC(C)CCO 34a_100000210953_100009893172 [1,0,0,0,0,1|0,0,2]=4 2651 B9R0.48 CC(C)CN[C@@H](C)CC#N 2230a_100016994482_100000210760 [1,0,0,0,0,1|1,0,1]=4 2652 B9R0.48 CC(C)CN[C@H](C)CCO 2230a_100000706166_100000210760 [1,0,0,0,0,1|0,0,2]=4 2653 B9R0.48 CC(C)CN[C@H](C)CCO 270004a_100000706166_100000210432 [1,0,0,0,0,1|0,0,2]=4 2654 B9R0.48 CC(C)CN[C@H](C)CCO 34a_100000706166_100000210624 [1,0,0,0,0,1|0,0,2]=4 2655 B9R0.48 CC(C)COC(C)CCBr 34a_100012276601_100000210624 [1,0,0,0,0,1|1,0,1]=4 2656 B9R0.48 CC(C)COC(C)CCO 34a_100000210257_100009893172 [1,0,0,0,0,1|0,0,2]=4 2657 B9R0.48 CC(C)CSC(C)CC#N 62a_100000210624_100009813641 [1,0,0,0,0,1|1,0,1]=4 2658 B9R0.48 CC(C)CSC(C)CC#N 62a_100009813641_100000210760 [1,0,0,0,0,1|1,0,1]=4 2659 B9R0.48 CC(C)CSC(C)CCO 62a_100000210624_100009893172 [1,0,0,0,0,1|0,0,2]=4 2660 B9R0.48 CC(C)CSC(C)CCO 62a_100009893172_100000210760 [1,0,0,0,0,1|0,0,2]=4 2661 B9R0.48 CC(CCN)COC(C)C 34a_106354213184_100000210206 [1,0,0,0,0,1|1,0,1]=4 2662 B9R0.48 CCCC(C)CNC(C)C 2230a_100138425928_100011216630 [1,0,0,0,0,1|1,0,1]=4 2663 B9R0.48 CCCC(C)CNC(C)C 34a_100138425928_100011216630 [1,0,0,0,0,1|1,0,1]=4 2664 B9R0.48 CCCC(C)COC(C)C 34a_100000212225_100011216630 [1,0,0,0,0,1|1,0,1]=4 2665 B9R0.48 CCCC(C)COC(C)C 34a_100000688023_100000210206 [1,0,0,0,0,1|1,0,1]=4 2666 B9R0.48 CCCC(C)COC(C)C 7a_100000688023_100000210206 [1,0,0,0,0,1|1,0,1]=4 2667 B9R0.48 CCCC(C)CSC(C)C 62a_100000210206_100011216630 [1,0,0,0,0,1|1,0,1]=4 2668 B9R0.48 CCCC(C)CSC(C)C 62a_100011216630_100000210206 [1,0,0,0,0,1|1,0,1]=4 2669 B9R0.48 CCCC(C)NCC(C)C 2230a_100000210953_100000766640 [1,0,0,0,0,1|1,0,1]=4 2670 B9R0.48 CCCC(C)NCC(C)C 2230a_100000741246_100000210760 [1,0,0,0,0,1|1,0,1]=4 2671 B9R0.48 CCCC(C)NCC(C)C 270004a_100000210953_100000211909 [1,0,0,0,0,1|1,0,1]=4 2672 B9R0.48 CCCC(C)NCC(C)C 270004a_100000741246_100000210432 [1,0,0,0,0,1|1,0,1]=4 2673 B9R0.48 CCCC(C)NCC(C)C 34a_100000210953_100000766640 [1,0,0,0,0,1|1,0,1]=4 2674 B9R0.48 CCCC(C)OCC(C)C 34a_100000210257_100000766640 [1,0,0,0,0,1|1,0,1]=4 2675 B9R0.48 CCCC(C)OCC(C)C 34a_100000764384_100000210624 [1,0,0,0,0,1|1,0,1]=4 2676 B9R0.48 CCCC(C)OCC(C)C 7a_100000764384_100000210760 [1,0,0,0,0,1|1,0,1]=4 2677 B9R0.48 CCCC(C)SCC(C)C 62a_100000210624_100000766640 [1,0,0,0,0,1|1,0,1]=4 2678 B9R0.48 CCCC(C)SCC(C)C 62a_100000766640_100000210760 [1,0,0,0,0,1|1,0,1]=4 2679 B9R0.48 CN(C)CCN(C)CC=O 269982a_100000225618_200015260668 [1,0,0,0,0,1|2,0,0]=4 2680 B9R0.48 COCC(C)NCC(C)C 2230a_100000210953_100000765312 [1,0,0,0,0,1|2,0,0]=4 2681 B9R0.48 COCC(C)NCC(C)C 270004a_100000210953_100000749346 [1,0,0,0,0,1|2,0,0]=4 2682 B9R0.48 COCC(C)NCC(C)C 34a_100000210953_100000765312 [1,0,0,0,0,1|2,0,0]=4 2683 B9R0.48 COCC(C)OCC(C)C 34a_100000210257_100000765312 [1,0,0,0,0,1|2,0,0]=4 2684 B9R0.48 COCC(C)SCC(C)C 62a_100000210624_100000765312 [1,0,0,0,0,1|2,0,0]=4 2685 B9R0.48 COCC(C)SCC(C)C 62a_100000765312_100000210760 [1,0,0,0,0,1|2,0,0]=4 2686 B9R0.48 COC[C@@H](C)NCC(C)C 2230a_100000764878_100000210760 [1,0,0,0,0,1|2,0,0]=4 2687 B9R0.48 COC[C@@H](C)NCC(C)C 270004a_100000764878_100000210432 [1,0,0,0,0,1|2,0,0]=4 2688 B9R0.48 COC[C@@H](C)OCC(C)C 34a_100011934205_100000210624 [1,0,0,0,0,1|2,0,0]=4 2689 B9R0.48 CSCC(C)NCC(C)C 270004a_100000210953_100011216314 [1,0,0,0,0,1|2,0,0]=4 2690 B11R0.180 C#CCC(C)OCCC(C)(C)C 34a_100000685586_100000755188 [0,0,0,0,0,2|1,0,1]=4 2691 B11R0.180 C#CCC(C)OCCC(C)(C)C 7a_100000685586_100000755188 [0,0,0,0,0,2|1,0,1]=4 2692 B11R0.180 C/C=C/C(C)OCCC(C)(C)C 34a_200102604097_100000755188 [0,0,0,0,0,2|1,0,1]=4 2693 B11R0.180 C=CCC(C)COCC(C)(C)C 34a_100009832082_100011219605 [0,0,0,0,0,2|1,0,0]=3 2694 B11R0.180 C=CCC(C)COCC(C)(C)F 34a_100009832082_100011997219 [0,0,0,0,0,2|2,0,0]=4 2695 B11R0.180 C=CCC(C)COCC(C)(C)O 34a_100009832082_100000764493 [0,0,0,0,0,2|2,0,0]=4 2696 B11R0.180 C=CCC(C)COCC(C)(C)O 7a_100009832082_100000764493 [0,0,0,0,0,2|2,0,0]=4 2697 B11R0.180 C=CCC(C)COC[Si](C)(C)C 7a_100009832082_100000233785 [0,0,0,0,0,2|1,1,0]=4 2698 B11R0.180 C=CCN(C)CCOC(C)(C)C 2230a_100000690421_100000210623 [0,0,0,0,0,2|2,0,0]=4 2699 B11R0.180 C=CCN(C)CCOC(C)(C)C 269982a_100000690421_100000210623 [0,0,0,0,0,2|2,0,0]=4 2700 B11R0.180 C=CC[C@@H](C)OCCC(C)(C)C 34a_100000731007_100000755188 [0,0,0,0,0,2|1,0,0]=3 2701 B11R0.180 C=CC[C@@H](C)OCCC(C)(C)C 7a_100000731007_100000755188 [0,0,0,0,0,2|1,0,0]=3 2702 B11R0.180 C=CC[C@@H](C)OCCC(C)(C)O 34a_100000731007_100000702414 [0,0,0,0,0,2|2,0,0]=4 2703 B11R0.180 C=CC[C@@H](C)OCCC(C)(C)O 7a_100000731007_100000702414 [0,0,0,0,0,2|2,0,0]=4 2704 B11R0.180 C=CC[C@@H](C)OCC[N+](C)(C)C 34a_100000731007_100000085578 [0,0,0,0,0,2|2,0,0]=4 2705 B11R0.180 C=CC[C@@H](C)OCC[N+](C)(C)C 7a_100000731007_100000085578 [0,0,0,0,0,2|2,0,0]=4 2706 B11R0.180 C=CC[C@@H](C)OCC[Si](C)(C)C 34a_100000731007_200000733723 [0,0,0,0,0,2|1,1,0]=4 2707 B11R0.180 C=CC[C@@H](C)OCC[Si](C)(C)C 7a_100000731007_200000733723 [0,0,0,0,0,2|1,1,0]=4 2708 B11R0.180 C=CC[C@@H](N)COCC(C)(C)C 34a_100020615467_100011219605 [0,0,0,0,0,2|2,0,0]=4 2709 B11R0.180 CC(CC#N)NCCC(C)(C)C 2230a_100000738805_100009813641 [0,0,0,0,0,2|1,0,1]=4 2710 B11R0.180 CC(CC#N)OCCC(C)(C)C 7a_100000765024_100009813641 [0,0,0,0,0,2|1,0,1]=4 2711 B11R0.180 CC(CC#N)SCCC(C)(C)C 62a_100000755188_100009813641 [0,0,0,0,0,2|1,0,1]=4 2712 B11R0.180 CC(CC#N)SCCC(C)(C)C 62a_100009813641_100000755188 [0,0,0,0,0,2|1,0,1]=4 2713 B11R0.180 CC(CCBr)OCCC(C)(C)C 34a_100012276601_100000755188 [0,0,0,0,0,2|1,0,1]=4 2714 B11R0.180 CC(CCN)COCC(C)(C)C 34a_106354213184_100011219605 [0,0,0,0,0,2|1,0,1]=4 2715 B11R0.180 CC(CCO)NCCC(C)(C)C 2230a_100000738805_100009893172 [0,0,0,0,0,2|0,0,2]=4 2716 B11R0.180 CC(CCO)OCCC(C)(C)C 7a_100000765024_100009893172 [0,0,0,0,0,2|0,0,2]=4 2717 B11R0.180 CC(CCO)SCCC(C)(C)C 62a_100000755188_100009893172 [0,0,0,0,0,2|0,0,2]=4 2718 B11R0.180 CC(CCO)SCCC(C)(C)C 62a_100009893172_100000755188 [0,0,0,0,0,2|0,0,2]=4 2719 B11R0.180 CCCC(C)CCOC(C)(C)C 34a_100011217855_100000210625 [0,0,0,0,0,2|1,0,1]=4 2720 B11R0.180 CCCC(C)CNCC(C)(C)C 2230a_100000743828_100011216630 [0,0,0,0,0,2|1,0,1]=4 2721 B11R0.180 CCCC(C)CNCC(C)(C)C 270004a_100000743828_100000243154 [0,0,0,0,0,2|1,0,1]=4 2722 B11R0.180 CCCC(C)COCC(C)(C)C 34a_100000688023_100011219605 [0,0,0,0,0,2|1,0,1]=4 2723 B11R0.180 CCCC(C)CSCC(C)(C)C 62a_100011216630_100011219605 [0,0,0,0,0,2|1,0,1]=4 2724 B11R0.180 CCCC(C)CSCC(C)(C)C 62a_100011219605_100011216630 [0,0,0,0,0,2|1,0,1]=4 2725 B11R0.180 CCCC(C)NCCC(C)(C)C 2230a_100000738805_100000766640 [0,0,0,0,0,2|1,0,1]=4 2726 B11R0.180 CCCC(C)NCCC(C)(C)C 2230a_100000741246_100000755188 [0,0,0,0,0,2|1,0,1]=4 2727 B11R0.180 CCCC(C)NCCC(C)(C)C 270004a_100000738805_100000211909 [0,0,0,0,0,2|1,0,1]=4 2728 B11R0.180 CCCC(C)OCCC(C)(C)C 34a_100000764384_100000755188 [0,0,0,0,0,2|1,0,1]=4 2729 B11R0.180 CCCC(C)OCCC(C)(C)C 7a_100000764384_100000755188 [0,0,0,0,0,2|1,0,1]=4 2730 B11R0.180 CCCC(C)OCCC(C)(C)C 7a_100000765024_100000766640 [0,0,0,0,0,2|1,0,1]=4 2731 B11R0.180 CCCC(C)SCCC(C)(C)C 62a_100000755188_100000766640 [0,0,0,0,0,2|1,0,1]=4 2732 B11R0.180 CCCC(C)SCCC(C)(C)C 62a_100000766640_100000755188 [0,0,0,0,0,2|1,0,1]=4 2733 B11R0.180 CN(CC=O)CCOC(C)(C)C 2230a_100000690421_200015260668 [0,0,0,0,0,2|1,0,0]=3 2734 B11R0.180 CN(CC=O)CCOC(C)(C)C 269982a_100000690421_200015260668 [0,0,0,0,0,2|1,0,0]=3 2735 B11R0.180 COCC(C)NCCC(C)(C)C 2230a_100000738805_100000765312 [0,0,0,0,0,2|2,0,0]=4 2736 B11R0.180 COCC(C)NCCC(C)(C)C 270004a_100000738805_100000749346 [0,0,0,0,0,2|2,0,0]=4 2737 B11R0.180 COCC(C)OCCC(C)(C)C 7a_100000765024_100000765312 [0,0,0,0,0,2|2,0,0]=4 2738 B11R0.180 COCC(C)SCCC(C)(C)C 62a_100000755188_100000765312 [0,0,0,0,0,2|2,0,0]=4 2739 B11R0.180 COCC(C)SCCC(C)(C)C 62a_100000765312_100000755188 [0,0,0,0,0,2|2,0,0]=4 2740 B11R0.180 COC[C@@H](C)NCCC(C)(C)C 2230a_100000764878_100000755188 [0,0,0,0,0,2|2,0,0]=4 2741 B11R0.180 COC[C@@H](C)OCCC(C)(C)C 34a_100011934205_100000755188 [0,0,0,0,0,2|2,0,0]=4 2742 B11R0.180 CSCC(C)NCCC(C)(C)C 270004a_100000738805_100011216314 [0,0,0,0,0,2|2,0,0]=4 2743 B11R0.180 C[C@@H](CC#N)NCCC(C)(C)C 2230a_100016994482_100000755188 [0,0,0,0,0,2|1,0,1]=4 2744 B11R0.180 C[C@H](CCO)NCCC(C)(C)C 2230a_100000706166_100000755188 [0,0,0,0,0,2|0,0,2]=4 2745 B11R0.180 C[C@H](CCO)NCCC(C)(C)C 34a_100000706166_100000755188 [0,0,0,0,0,2|0,0,2]=4