0 B7R0.11 C=CCC(C)(C)OC 7a_100011995686_200000210301 [0,0,0,0,0,0|1,0,1]=2 1 B7R0.11 C=CCC(C)(C)O[13CH3] 7a_100011995686_200025704644 [0,0,0,0,0,0|1,0,1]=2 2 B7R0.11 CC(C)(CCBr)O[13CH3] 7a_100000702414_200025704644 [0,0,0,0,0,0|2,0,0]=2 3 B7R0.11 CC(C)(CCl)CO[13CH3] 7a_100011217199_200025704644 [0,0,0,0,0,0|3,0,1]=4 4 B7R0.11 CC(C)(CO)CN[13CH3] 2230a_100020635058_200025704644 [0,0,0,0,0,0|2,0,2]=4 5 B7R0.11 CC(C)(CO)CS[13CH3] 62a_100009813988_200025704644 [0,0,0,0,0,0|3,0,1]=4 6 B7R0.11 CC(C)(CO)CS[13CH3] 62a_200025704644_100009813988 [0,0,0,0,0,0|3,0,1]=4 7 B7R0.11 CCC(C)(C)COC 7a_100000765029_200000210301 [0,0,0,0,0,0|2,0,1]=3 8 B7R0.11 CCC(C)(C)CO[13CH3] 7a_100000765029_200025704644 [0,0,0,0,0,0|2,0,1]=3 9 B7R0.11 CCC(C)(C)OCF 7a_100000210230_100015361967 [0,0,0,0,0,0|4,0,0]=4 10 B7R0.11 CCC(C)(C)SCF 62a_100000032637_100015361967 [0,0,0,0,0,0|4,0,0]=4 11 B7R0.11 CCC(C)(C)SCF 62a_100015361967_100000032637 [0,0,0,0,0,0|4,0,0]=4 12 B7R0.11 CCCC(C)(C)OC 7a_100000748436_200000210301 [0,0,0,0,0,0|1,0,1]=2 13 B7R0.11 CCCC(C)(C)O[13CH3] 7a_100000748436_200025704644 [0,0,0,0,0,0|1,0,1]=2 14 B7R0.11 CCNC(C)(C)CC 2230a_100000211385_100000210202 [0,0,0,0,0,0|3,0,1]=4 15 B7R0.11 CCOC(C)(C)CC 7a_100000210230_100000210202 [0,0,0,0,0,0|3,0,1]=4 16 B7R0.11 CCSC(C)(C)CC 62a_100000032637_100000210202 [0,0,0,0,0,0|3,0,1]=4 17 B7R0.11 CCSC(C)(C)CC 62a_100000210202_100000032637 [0,0,0,0,0,0|3,0,1]=4 18 B7R0.11 CNC(C)(C)COC 2230a_100000752728_200000210301 [0,0,0,0,0,0|2,0,1]=3 19 B7R0.11 CNC(C)(C)CSC 2230a_100000759623_200000210301 [0,0,0,0,0,0|2,0,1]=3 20 B7R0.11 CNC(C)(C)CSC 7a_100000759623_200000210301 [0,0,0,0,0,0|2,0,1]=3 21 B7R0.11 CNCC(C)(C)CO 2230a_100020635058_200000210301 [0,0,0,0,0,0|2,0,2]=4 22 B7R0.11 CNCC(C)(C)CO 34a_100102657272_100009813988 [0,0,0,0,0,0|2,0,2]=4 23 B7R0.11 CNCC(C)(C)CO 7a_106832991635_100009813988 [0,0,0,0,0,0|2,0,2]=4 24 B7R0.11 CNCC(C)(C)OC 2230a_100000763424_200000210301 [0,0,0,0,0,0|0,0,2]=2 25 B7R0.11 CNCC(C)(C)OC 34a_100102657272_100000701081 [0,0,0,0,0,0|0,0,2]=2 26 B7R0.11 CNCC(C)(C)SC 270004a_106832991635_100009845794 [0,0,0,0,0,0|0,1,2]=3 27 B7R0.11 COC(C)(C)CCBr 7a_100000702414_200000210301 [0,0,0,0,0,0|2,0,0]=2 28 B7R0.11 COC(C)(C)CN[13CH3] 2230a_100000763424_200025704644 [0,0,0,0,0,0|0,0,2]=2 29 B7R0.11 COC(C)(C)CSC 62a_100000701081_200000210301 [0,0,0,0,0,0|1,0,1]=2 30 B7R0.11 COC(C)(C)CSC 62a_200000210301_100000701081 [0,0,0,0,0,0|1,0,1]=2 31 B7R0.11 COC(C)(C)CS[13CH3] 62a_100000701081_200025704644 [0,0,0,0,0,0|1,0,1]=2 32 B7R0.11 COC(C)(C)CS[13CH3] 62a_200025704644_100000701081 [0,0,0,0,0,0|1,0,1]=2 33 B7R0.11 COCC(C)(C)CCl 7a_100011217199_200000210301 [0,0,0,0,0,0|3,0,1]=4 34 B7R0.11 COCC(C)(C)CO 34a_100138415774_100009813988 [0,0,0,0,0,0|3,0,1]=4 35 B7R0.11 COCC(C)(C)N[13CH3] 2230a_100000752728_200025704644 [0,0,0,0,0,0|2,0,1]=3 36 B7R0.11 COCC(C)(C)OC 34a_100138415774_100000701081 [0,0,0,0,0,0|1,0,1]=2 37 B7R0.11 CSCC(C)(C)CO 62a_100009813988_200000210301 [0,0,0,0,0,0|3,0,1]=4 38 B7R0.11 CSCC(C)(C)CO 62a_200000210301_100009813988 [0,0,0,0,0,0|3,0,1]=4 39 B7R0.11 CSCC(C)(C)N[13CH3] 2230a_100000759623_200025704644 [0,0,0,0,0,0|2,0,1]=3 40 B7R0.11 CSCC(C)(C)N[13CH3] 7a_100000759623_200025704644 [0,0,0,0,0,0|2,0,1]=3 41 B6R0.1 C#CCC(C)OC 34a_100000685586_200000210301 [1,0,0,0,0,0|1,0,1]=3 42 B6R0.1 C#CCC(C)OC 7a_100000685586_200000210301 [1,0,0,0,0,0|1,0,1]=3 43 B6R0.1 C#CCC(C)O[13CH3] 34a_100000685586_200025704644 [1,0,0,0,0,0|1,0,1]=3 44 B6R0.1 C#CCC(C)O[13CH3] 7a_100000685586_200025704644 [1,0,0,0,0,0|1,0,1]=3 45 B6R0.1 C/C=C/C(C)OC 34a_200102604097_200000210301 [1,0,0,0,0,0|1,0,2]=4 46 B6R0.1 C/C=C/C(C)O[13CH3] 34a_200102604097_200025704644 [1,0,0,0,0,0|1,0,2]=4 47 B6R0.1 C=CC[C@@H](C)OC 34a_100000731007_200000210301 [1,0,0,0,0,0|1,0,1]=3 48 B6R0.1 C=CC[C@@H](C)OC 7a_100000731007_200000210301 [1,0,0,0,0,0|1,0,1]=3 49 B6R0.1 C=CC[C@@H](C)O[13CH3] 34a_100000731007_200025704644 [1,0,0,0,0,0|1,0,1]=3 50 B6R0.1 C=CC[C@@H](C)O[13CH3] 7a_100000731007_200025704644 [1,0,0,0,0,0|1,0,1]=3 51 B6R0.1 CC#CC(C)OC 34a_100011216543_200000210301 [1,0,0,0,0,0|1,0,2]=4 52 B6R0.1 CC#CC(C)O[13CH3] 34a_100011216543_200025704644 [1,0,0,0,0,0|1,0,2]=4 53 B6R0.1 CC(CC#N)S[13CH3] 62a_100009813641_200025704644 [1,0,0,0,0,0|2,1,0]=4 54 B6R0.1 CC(CC#N)S[13CH3] 62a_200025704644_100009813641 [1,0,0,0,0,0|2,1,0]=4 55 B6R0.1 CC(CCBr)O[13CH3] 34a_100012276601_200025704644 [1,0,0,0,0,0|2,0,0]=3 56 B6R0.1 CC(CCO)S[13CH3] 62a_100009893172_200025704644 [1,0,0,0,0,0|2,1,0]=4 57 B6R0.1 CC(CCO)S[13CH3] 62a_200025704644_100009893172 [1,0,0,0,0,0|2,1,0]=4 58 B6R0.1 CCC(C)CNC 2230a_100020588543_200000210301 [1,0,0,0,0,0|1,0,2]=4 59 B6R0.1 CCC(C)CNC 2230a_106832991635_100000748023 [1,0,0,0,0,0|1,0,2]=4 60 B6R0.1 CCC(C)CNC 270004a_106832991635_100000243153 [1,0,0,0,0,0|1,0,2]=4 61 B6R0.1 CCC(C)CNC 34a_100102657272_100000748023 [1,0,0,0,0,0|1,0,2]=4 62 B6R0.1 CCC(C)CNC 7a_106832991635_100000748023 [1,0,0,0,0,0|1,0,2]=4 63 B6R0.1 CCC(C)CN[13CH3] 2230a_100020588543_200025704644 [1,0,0,0,0,0|1,0,2]=4 64 B6R0.1 CCC(C)COC 34a_100138415774_100000748023 [1,0,0,0,0,0|2,0,1]=4 65 B6R0.1 CCC(C)CSC 62a_100000748023_200000210301 [1,0,0,0,0,0|2,0,1]=4 66 B6R0.1 CCC(C)CSC 62a_200000210301_100000748023 [1,0,0,0,0,0|2,0,1]=4 67 B6R0.1 CCC(C)CS[13CH3] 62a_100000748023_200025704644 [1,0,0,0,0,0|2,0,1]=4 68 B6R0.1 CCC(C)CS[13CH3] 62a_200025704644_100000748023 [1,0,0,0,0,0|2,0,1]=4 69 B6R0.1 CCCC(C)NC 2230a_100000741246_200000210301 [1,0,0,0,0,0|2,0,1]=4 70 B6R0.1 CCCC(C)NC 2230a_106832991635_100000766640 [1,0,0,0,0,0|2,0,1]=4 71 B6R0.1 CCCC(C)NC 270004a_106832991635_100000211909 [1,0,0,0,0,0|2,0,1]=4 72 B6R0.1 CCCC(C)NC 34a_100102657272_100000766640 [1,0,0,0,0,0|2,0,1]=4 73 B6R0.1 CCCC(C)NC 7a_106832991635_100000766640 [1,0,0,0,0,0|2,0,1]=4 74 B6R0.1 CCCC(C)N[13CH3] 2230a_100000741246_200025704644 [1,0,0,0,0,0|2,0,1]=4 75 B6R0.1 CCCC(C)OC 34a_100000764384_200000210301 [1,0,0,0,0,0|1,0,1]=3 76 B6R0.1 CCCC(C)OC 34a_100138415774_100000766640 [1,0,0,0,0,0|1,0,1]=3 77 B6R0.1 CCCC(C)OC 7a_100000764384_200000210301 [1,0,0,0,0,0|1,0,1]=3 78 B6R0.1 CCCC(C)O[13CH3] 34a_100000764384_200025704644 [1,0,0,0,0,0|1,0,1]=3 79 B6R0.1 CCCC(C)O[13CH3] 7a_100000764384_200025704644 [1,0,0,0,0,0|1,0,1]=3 80 B6R0.1 CCCC(C)SC 62a_100000766640_200000210301 [1,0,0,0,0,0|1,1,1]=4 81 B6R0.1 CCCC(C)SC 62a_200000210301_100000766640 [1,0,0,0,0,0|1,1,1]=4 82 B6R0.1 CCCC(C)S[13CH3] 62a_100000766640_200025704644 [1,0,0,0,0,0|1,1,1]=4 83 B6R0.1 CCCC(C)S[13CH3] 62a_200025704644_100000766640 [1,0,0,0,0,0|1,1,1]=4 84 B6R0.1 CCSC(C)OC 62a_100000210202_100009879195 [1,0,0,0,0,0|2,0,1]=4 85 B6R0.1 CCSC(C)OC 62a_100009879195_100000210202 [1,0,0,0,0,0|2,0,1]=4 86 B6R0.1 CC[C@H](C)CNC 2230a_106832991635_100009816398 [1,0,0,0,0,0|1,0,2]=4 87 B6R0.1 CC[C@H](C)CNC 34a_100102657272_100009816398 [1,0,0,0,0,0|1,0,2]=4 88 B6R0.1 CC[C@H](C)CNC 7a_106832991635_100009816398 [1,0,0,0,0,0|1,0,2]=4 89 B6R0.1 CC[C@H](C)COC 34a_100138415774_100009816398 [1,0,0,0,0,0|2,0,1]=4 90 B6R0.1 CC[C@H](C)COC 7a_100009816381_200000210301 [1,0,0,0,0,0|2,0,1]=4 91 B6R0.1 CC[C@H](C)CO[13CH3] 7a_100009816381_200025704644 [1,0,0,0,0,0|2,0,1]=4 92 B6R0.1 CC[C@H](C)CSC 62a_100009816398_200000210301 [1,0,0,0,0,0|2,0,1]=4 93 B6R0.1 CC[C@H](C)CSC 62a_200000210301_100009816398 [1,0,0,0,0,0|2,0,1]=4 94 B6R0.1 CC[C@H](C)CS[13CH3] 62a_100009816398_200025704644 [1,0,0,0,0,0|2,0,1]=4 95 B6R0.1 CC[C@H](C)CS[13CH3] 62a_200025704644_100009816398 [1,0,0,0,0,0|2,0,1]=4 96 B6R0.1 CNC(C)CC#N 2230a_106832991635_100009813641 [1,0,0,0,0,0|3,0,0]=4 97 B6R0.1 CNC(C)CC#N 7a_106832991635_100009813641 [1,0,0,0,0,0|3,0,0]=4 98 B6R0.1 CNC(C)CCO 2230a_106832991635_100009893172 [1,0,0,0,0,0|3,0,0]=4 99 B6R0.1 CNC(C)CCO 34a_100102657272_100009893172 [1,0,0,0,0,0|3,0,0]=4 100 B6R0.1 CNC(C)CCO 7a_106832991635_100009893172 [1,0,0,0,0,0|3,0,0]=4 101 B6R0.1 CNC(C)COC 2230a_106832991635_100000765312 [1,0,0,0,0,0|2,0,1]=4 102 B6R0.1 CNC(C)COC 270004a_106832991635_100000749346 [1,0,0,0,0,0|2,0,1]=4 103 B6R0.1 CNC(C)COC 34a_100102657272_100000765312 [1,0,0,0,0,0|2,0,1]=4 104 B6R0.1 CNC(C)COC 7a_106832991635_100000765312 [1,0,0,0,0,0|2,0,1]=4 105 B6R0.1 CNC(C)CSC 270004a_106832991635_100011216314 [1,0,0,0,0,0|2,0,1]=4 106 B6R0.1 CNC[C@@H](C)OC 2230a_100020591295_200000210301 [1,0,0,0,0,0|0,0,2]=3 107 B6R0.1 CN[C@@H](C)CC#N 2230a_100016994482_200000210301 [1,0,0,0,0,0|3,0,0]=4 108 B6R0.1 CN[C@H](C)CCO 2230a_100000706166_200000210301 [1,0,0,0,0,0|3,0,0]=4 109 B6R0.1 CN[C@H](C)CCO 34a_100000706166_200000210301 [1,0,0,0,0,0|3,0,0]=4 110 B6R0.1 CN[C@H](C)COC 2230a_100000764878_200000210301 [1,0,0,0,0,0|2,0,1]=4 111 B6R0.1 COC(C)CCBr 34a_100012276601_200000210301 [1,0,0,0,0,0|2,0,0]=3 112 B6R0.1 COC(C)CCO 34a_100138415774_100009893172 [1,0,0,0,0,0|2,0,0]=3 113 B6R0.1 COC(C)CO[13CH3] 34a_100000690652_200025704644 [1,0,0,0,0,0|1,0,1]=3 114 B6R0.1 COC(C)SCF 62a_100009879195_100015361967 [1,0,0,0,0,0|3,0,0]=4 115 B6R0.1 COC(C)SCF 62a_100015361967_100009879195 [1,0,0,0,0,0|3,0,0]=4 116 B6R0.1 COCC(C)OC 34a_100000690652_200000210301 [1,0,0,0,0,0|1,0,1]=3 117 B6R0.1 COCC(C)OC 34a_100138415774_100000765312 [1,0,0,0,0,0|1,0,1]=3 118 B6R0.1 COCC(C)SC 62a_100000765312_200000210301 [1,0,0,0,0,0|1,1,1]=4 119 B6R0.1 COCC(C)SC 62a_200000210301_100000765312 [1,0,0,0,0,0|1,1,1]=4 120 B6R0.1 COCC(C)S[13CH3] 62a_100000765312_200025704644 [1,0,0,0,0,0|1,1,1]=4 121 B6R0.1 COCC(C)S[13CH3] 62a_200025704644_100000765312 [1,0,0,0,0,0|1,1,1]=4 122 B6R0.1 COC[C@@H](C)N[13CH3] 2230a_100000764878_200025704644 [1,0,0,0,0,0|2,0,1]=4 123 B6R0.1 COC[C@@H](C)OC 34a_100011934205_200000210301 [1,0,0,0,0,0|1,0,1]=3 124 B6R0.1 COC[C@@H](C)O[13CH3] 34a_100011934205_200025704644 [1,0,0,0,0,0|1,0,1]=3 125 B6R0.1 CO[C@H](C)CN[13CH3] 2230a_100020591295_200025704644 [1,0,0,0,0,0|0,0,2]=3 126 B6R0.1 CSC(C)CC#N 62a_100009813641_200000210301 [1,0,0,0,0,0|2,1,0]=4 127 B6R0.1 CSC(C)CC#N 62a_200000210301_100009813641 [1,0,0,0,0,0|2,1,0]=4 128 B6R0.1 CSC(C)CCO 62a_100009893172_200000210301 [1,0,0,0,0,0|2,1,0]=4 129 B6R0.1 CSC(C)CCO 62a_200000210301_100009893172 [1,0,0,0,0,0|2,1,0]=4 130 B6R0.1 C[C@@H](CC#N)N[13CH3] 2230a_100016994482_200025704644 [1,0,0,0,0,0|3,0,0]=4 131 B6R0.1 C[C@H](CCO)N[13CH3] 2230a_100000706166_200025704644 [1,0,0,0,0,0|3,0,0]=4 132 B6R0.1 C[C@H](CCO)N[13CH3] 34a_100000706166_200025704644 [1,0,0,0,0,0|3,0,0]=4 133 B6R0.5 CC(C)(C)CN[13CH3] 2230a_100000743828_200025704644 [1,0,0,0,0,0|0,0,2]=3 134 B6R0.5 CC(C)(C)CS[13CH3] 62a_100011219605_200025704644 [1,0,0,0,0,0|1,0,1]=3 135 B6R0.5 CC(C)(C)CS[13CH3] 62a_200025704644_100011219605 [1,0,0,0,0,0|1,0,1]=3 136 B6R0.5 CC(C)(C)OCF 34a_100015890283_100015361967 [1,0,0,0,0,0|3,0,0]=4 137 B6R0.5 CC(C)(C)OCF 7a_100015890283_100015361967 [1,0,0,0,0,0|3,0,0]=4 138 B6R0.5 CC(C)(C)SCF 62a_100000211941_100015361967 [1,0,0,0,0,0|3,0,0]=4 139 B6R0.5 CC(C)(C)SCF 62a_100015361967_100000211941 [1,0,0,0,0,0|3,0,0]=4 140 B6R0.5 CC(C)(F)CN[13CH3] 2230a_100020643315_200025704644 [1,0,0,0,0,0|1,0,2]=4 141 B6R0.5 CC(C)(F)CO[13CH3] 34a_100000716592_200025704644 [1,0,0,0,0,0|2,0,1]=4 142 B6R0.5 CC(C)(F)CS[13CH3] 62a_100011997219_200025704644 [1,0,0,0,0,0|2,0,1]=4 143 B6R0.5 CC(C)(F)CS[13CH3] 62a_200025704644_100011997219 [1,0,0,0,0,0|2,0,1]=4 144 B6R0.5 CC(C)(O)CN[13CH3] 2230a_100000751335_200025704644 [1,0,0,0,0,0|0,0,2]=3 145 B6R0.5 CC(C)(O)CS[13CH3] 62a_100000764493_200025704644 [1,0,0,0,0,0|1,0,1]=3 146 B6R0.5 CC(C)(O)CS[13CH3] 62a_200025704644_100000764493 [1,0,0,0,0,0|1,0,1]=3 147 B6R0.5 CCNC(C)(C)C 2230a_100000715429_100000210202 [1,0,0,0,0,0|2,0,1]=4 148 B6R0.5 CCOC(C)(C)C 34a_100015890283_100000210202 [1,0,0,0,0,0|2,0,1]=4 149 B6R0.5 CCOC(C)(C)C 34a_100121572206_100000210625 [1,0,0,0,0,0|2,0,1]=4 150 B6R0.5 CCOC(C)(C)C 7a_100015890283_100000210202 [1,0,0,0,0,0|2,0,1]=4 151 B6R0.5 CCSC(C)(C)C 62a_100000210202_100000211941 [1,0,0,0,0,0|2,0,1]=4 152 B6R0.5 CCSC(C)(C)C 62a_100000211941_100000210202 [1,0,0,0,0,0|2,0,1]=4 153 B6R0.5 CNCC(C)(C)C 2230a_100000743828_200000210301 [1,0,0,0,0,0|0,0,2]=3 154 B6R0.5 CNCC(C)(C)C 270004a_106832991635_100011204126 [1,0,0,0,0,0|0,0,2]=3 155 B6R0.5 CNCC(C)(C)C 34a_100102657272_100011219605 [1,0,0,0,0,0|0,0,2]=3 156 B6R0.5 CNCC(C)(C)F 2230a_100020643315_200000210301 [1,0,0,0,0,0|1,0,2]=4 157 B6R0.5 CNCC(C)(C)F 34a_100102657272_100011997219 [1,0,0,0,0,0|1,0,2]=4 158 B6R0.5 CNCC(C)(C)O 2230a_100000751335_200000210301 [1,0,0,0,0,0|0,0,2]=3 159 B6R0.5 CNCC(C)(C)O 34a_100102657272_100000764493 [1,0,0,0,0,0|0,0,2]=3 160 B6R0.5 CNCC(C)(C)O 7a_106832991635_100000764493 [1,0,0,0,0,0|0,0,2]=3 161 B6R0.5 CNC[Si](C)(C)C 2230a_106832991635_100000037933 [1,0,0,0,0,0|0,1,2]=4 162 B6R0.5 CNC[Si](C)(C)C 7a_106832991635_100000233785 [1,0,0,0,0,0|0,1,2]=4 163 B6R0.5 COCC(C)(C)C 34a_100138415774_100011219605 [1,0,0,0,0,0|1,0,1]=3 164 B6R0.5 COCC(C)(C)F 34a_100000716592_200000210301 [1,0,0,0,0,0|2,0,1]=4 165 B6R0.5 COCC(C)(C)F 34a_100138415774_100011997219 [1,0,0,0,0,0|2,0,1]=4 166 B6R0.5 COCC(C)(C)O 34a_100138415774_100000764493 [1,0,0,0,0,0|1,0,1]=3 167 B6R0.5 CSCC(C)(C)C 62a_100011219605_200000210301 [1,0,0,0,0,0|1,0,1]=3 168 B6R0.5 CSCC(C)(C)C 62a_200000210301_100011219605 [1,0,0,0,0,0|1,0,1]=3 169 B6R0.5 CSCC(C)(C)F 62a_100011997219_200000210301 [1,0,0,0,0,0|2,0,1]=4 170 B6R0.5 CSCC(C)(C)F 62a_200000210301_100011997219 [1,0,0,0,0,0|2,0,1]=4 171 B6R0.5 CSCC(C)(C)O 62a_100000764493_200000210301 [1,0,0,0,0,0|1,0,1]=3 172 B6R0.5 CSCC(C)(C)O 62a_200000210301_100000764493 [1,0,0,0,0,0|1,0,1]=3 173 B6R0.5 CSC[N+](C)(C)C 62a_200000036245_200000210301 [1,0,0,0,0,0|2,0,1]=4 174 B6R0.5 CSC[N+](C)(C)C 62a_200000210301_200000036245 [1,0,0,0,0,0|2,0,1]=4 175 B6R0.5 CSC[Si](C)(C)C 62a_100000037933_200000210301 [1,0,0,0,0,0|1,1,1]=4 176 B6R0.5 CSC[Si](C)(C)C 62a_200000210301_100000037933 [1,0,0,0,0,0|1,1,1]=4 177 B6R0.5 C[N+](C)(C)CS[13CH3] 62a_200000036245_200025704644 [1,0,0,0,0,0|2,0,1]=4 178 B6R0.5 C[N+](C)(C)CS[13CH3] 62a_200025704644_200000036245 [1,0,0,0,0,0|2,0,1]=4 179 B6R0.5 C[Si](C)(C)CS[13CH3] 62a_100000037933_200025704644 [1,0,0,0,0,0|1,1,1]=4 180 B6R0.5 C[Si](C)(C)CS[13CH3] 62a_200025704644_100000037933 [1,0,0,0,0,0|1,1,1]=4 181 B6R0.8 C#CC(C)(C)NC 34a_100000054563_200000210301 [1,0,0,0,0,0|1,0,2]=4 182 B6R0.8 C#CC(C)(C)NC 34a_100102657272_100000038118 [1,0,0,0,0,0|1,0,2]=4 183 B6R0.8 C#CC(C)(C)N[13CH3] 34a_100000054563_200025704644 [1,0,0,0,0,0|1,0,2]=4 184 B6R0.8 C#CC(C)(C)OC 34a_100000189450_200000210301 [1,0,0,0,0,0|0,0,2]=3 185 B6R0.8 C#CC(C)(C)OC 34a_100138415774_100000038118 [1,0,0,0,0,0|0,0,2]=3 186 B6R0.8 C#CC(C)(C)OC 7a_100000189450_200000210301 [1,0,0,0,0,0|0,0,2]=3 187 B6R0.8 C#CC(C)(C)O[13CH3] 34a_100000189450_200025704644 [1,0,0,0,0,0|0,0,2]=3 188 B6R0.8 C#CC(C)(C)O[13CH3] 7a_100000189450_200025704644 [1,0,0,0,0,0|0,0,2]=3 189 B6R0.8 C#CC(C)(C)SC 62a_100000038118_200000210301 [1,0,0,0,0,0|0,1,2]=4 190 B6R0.8 C#CC(C)(C)SC 62a_200000210301_100000038118 [1,0,0,0,0,0|0,1,2]=4 191 B6R0.8 C#CC(C)(C)S[13CH3] 62a_100000038118_200025704644 [1,0,0,0,0,0|0,1,2]=4 192 B6R0.8 C#CC(C)(C)S[13CH3] 62a_200025704644_100000038118 [1,0,0,0,0,0|0,1,2]=4 193 B6R0.8 C=CC(C)(C)OC 34a_100011215311_200000210301 [1,0,0,0,0,0|0,0,2]=3 194 B6R0.8 C=CC(C)(C)OC 7a_100011215311_200000210301 [1,0,0,0,0,0|0,0,2]=3 195 B6R0.8 C=CC(C)(C)O[13CH3] 34a_100011215311_200025704644 [1,0,0,0,0,0|0,0,2]=3 196 B6R0.8 C=CC(C)(C)O[13CH3] 7a_100011215311_200025704644 [1,0,0,0,0,0|0,0,2]=3 197 B6R0.8 CC(C)(C#N)O[13CH3] 34a_200015195151_200025704644 [1,0,0,0,0,0|0,0,2]=3 198 B6R0.8 CC(C)(C#N)S[13CH3] 62a_100011162410_200025704644 [1,0,0,0,0,0|0,1,2]=4 199 B6R0.8 CC(C)(C#N)S[13CH3] 62a_200025704644_100011162410 [1,0,0,0,0,0|0,1,2]=4 200 B6R0.8 CC(C)(CCl)O[13CH3] 7a_100000764493_200025704644 [1,0,0,0,0,0|1,0,0]=2 201 B6R0.8 CC(C)(CO)N[13CH3] 2230a_100000210608_200025704644 [1,0,0,0,0,0|2,0,0]=3 202 B6R0.8 CCC(C)(C)NC 2230a_100000211385_200000210301 [1,0,0,0,0,0|1,0,1]=3 203 B6R0.8 CCC(C)(C)NC 7a_106832991635_100000210677 [1,0,0,0,0,0|1,0,1]=3 204 B6R0.8 CCC(C)(C)N[13CH3] 2230a_100000211385_200025704644 [1,0,0,0,0,0|1,0,1]=3 205 B6R0.8 CCC(C)(C)OC 7a_100000210230_200000210301 [1,0,0,0,0,0|0,0,1]=2 206 B6R0.8 CCC(C)(C)O[13CH3] 7a_100000210230_200025704644 [1,0,0,0,0,0|0,0,1]=2 207 B6R0.8 CCC(C)(C)SC 62a_100000032637_200000210301 [1,0,0,0,0,0|0,1,1]=3 208 B6R0.8 CCC(C)(C)SC 62a_200000210301_100000032637 [1,0,0,0,0,0|0,1,1]=3 209 B6R0.8 CCC(C)(C)S[13CH3] 62a_100000032637_200025704644 [1,0,0,0,0,0|0,1,1]=3 210 B6R0.8 CCC(C)(C)S[13CH3] 62a_200025704644_100000032637 [1,0,0,0,0,0|0,1,1]=3 211 B6R0.8 CNC(C)(C)C#N 34a_100102657272_100011162410 [1,0,0,0,0,0|1,0,2]=4 212 B6R0.8 CNC(C)(C)C#N 7a_106832991635_100011162410 [1,0,0,0,0,0|1,0,2]=4 213 B6R0.8 CNC(C)(C)CO 2230a_100000210608_200000210301 [1,0,0,0,0,0|2,0,0]=3 214 B6R0.8 COC(C)(C)C#N 34a_100138415774_100011162410 [1,0,0,0,0,0|0,0,2]=3 215 B6R0.8 COC(C)(C)C#N 34a_200015195151_200000210301 [1,0,0,0,0,0|0,0,2]=3 216 B6R0.8 COC(C)(C)CCl 7a_100000764493_200000210301 [1,0,0,0,0,0|1,0,0]=2 217 B6R0.8 CSC(C)(C)C#N 62a_100011162410_200000210301 [1,0,0,0,0,0|0,1,2]=4 218 B6R0.8 CSC(C)(C)C#N 62a_200000210301_100011162410 [1,0,0,0,0,0|0,1,2]=4 219 B8R0.12 C=CCC(C)(C)C(=O)C 1458a_100000705796_200000210301 [0,1,0,0,0,0|2,0,1]=4 220 B8R0.12 C=CCC(C)(C)C(=O)[13CH3] 1458a_100000705796_200025704644 [0,1,0,0,0,0|2,0,1]=4 221 B8R0.12 CCCC(C)(C)C(=O)C 1458a_100011215034_200000210301 [0,1,0,0,0,0|2,0,1]=4 222 B8R0.12 CCCC(C)(C)C(=O)[13CH3] 1458a_100011215034_200025704644 [0,1,0,0,0,0|2,0,1]=4 223 B8R0.12 COCC(C)(C)N(C)C 2230a_100000734271_200000210301 [0,1,0,0,0,0|2,0,1]=4 224 B8R0.12 COCC(C)(C)N(C)C 269982a_100000734271_200000210301 [0,1,0,0,0,0|2,0,1]=4 225 B8R0.12 COCC(C)(C)N(C)[13CH3] 2230a_100000734271_200025704644 [0,1,0,0,0,0|2,0,1]=4 226 B8R0.12 COCC(C)(C)N(C)[13CH3] 269982a_100000734271_200025704644 [0,1,0,0,0,0|2,0,1]=4 227 B8R0.13 CC(C)(O[13CH3])C(=O)NN 34a_100000061348_200025704644 [0,1,0,0,0,0|1,0,2]=4 228 B8R0.13 CCC(=O)C(C)(C)OC 1458a_100000753492_100000210202 [0,1,0,0,0,0|1,0,2]=4 229 B8R0.13 CNC(=O)C(C)(C)OC 11a_106832991635_100000753492 [0,1,0,0,0,0|0,0,3]=4 230 B8R0.13 CNC(=O)C(C)(C)OC 1626a_100102657272_100000753492 [0,1,0,0,0,0|0,0,3]=4 231 B8R0.13 CNC(=O)C(C)(C)OC 240690a_100102657272_100000753492 [0,1,0,0,0,0|0,0,3]=4 232 B8R0.13 CNC(=O)C(C)(C)OC 34a_100138415774_100000732697 [0,1,0,0,0,0|0,0,3]=4 233 B8R0.13 CNC(=O)C(C)(C)OC 527a_100102657272_100000753492 [0,1,0,0,0,0|0,0,3]=4 234 B8R0.13 COC(=O)C(C)(C)OC 34a_100011217581_200000210301 [0,1,0,0,0,0|1,0,2]=4 235 B8R0.13 COC(=O)C(C)(C)OC 7a_100011217581_200000210301 [0,1,0,0,0,0|1,0,2]=4 236 B8R0.13 COC(=O)C(C)(C)O[13CH3] 34a_100011217581_200025704644 [0,1,0,0,0,0|1,0,2]=4 237 B8R0.13 COC(=O)C(C)(C)O[13CH3] 7a_100011217581_200025704644 [0,1,0,0,0,0|1,0,2]=4 238 B8R0.13 COC(C)(C)C(=O)CF 1458a_100000753492_100015361967 [0,1,0,0,0,0|2,0,1]=4 239 B8R0.13 COC(C)(C)C(=O)NN 34a_100000061348_200000210301 [0,1,0,0,0,0|1,0,2]=4 240 B8R0.25 C#CCNC(C)(C)CC 2230a_100000211385_100000038162 [0,1,0,0,0,0|2,0,1]=4 241 B8R0.25 C#CCOC(C)(C)CC 7a_100000210230_100000038162 [0,1,0,0,0,0|2,0,1]=4 242 B8R0.25 C#CCSC(C)(C)CC 62a_100000038162_100000032637 [0,1,0,0,0,0|2,0,1]=4 243 B8R0.25 C=CC#CC(C)(C)OC 34a_100000015972_200000210301 [0,1,0,0,0,0|1,0,2]=4 244 B8R0.25 C=CC#CC(C)(C)OC 7a_100000015972_200000210301 [0,1,0,0,0,0|1,0,2]=4 245 B8R0.25 C=CC#CC(C)(C)O[13CH3] 34a_100000015972_200025704644 [0,1,0,0,0,0|1,0,2]=4 246 B8R0.25 C=CC#CC(C)(C)O[13CH3] 7a_100000015972_200025704644 [0,1,0,0,0,0|1,0,2]=4 247 B8R0.25 C=CCNC(C)(C)CC 2230a_100000211385_100000210623 [0,1,0,0,0,0|2,0,1]=4 248 B8R0.25 C=CCOC(C)(C)CC 7a_100000210230_100015514636 [0,1,0,0,0,0|2,0,1]=4 249 B8R0.25 C=CCSC(C)(C)CC 62a_100000032637_100000210623 [0,1,0,0,0,0|2,0,1]=4 250 B8R0.25 C=CCSC(C)(C)CC 62a_100000210623_100000032637 [0,1,0,0,0,0|2,0,1]=4 251 B8R0.25 CC(C)(CCCBr)O[13CH3] 7a_100009888830_200025704644 [0,1,0,0,0,0|1,0,1]=3 252 B8R0.25 CCC(C)(C)COCF 7a_100000765029_100015361967 [0,1,0,0,0,0|2,0,1]=4 253 B8R0.25 CCC(C)(C)NCC#N 2230a_100000211385_100011215382 [0,1,0,0,0,0|3,0,0]=4 254 B8R0.25 CCC(C)(C)NCC=O 2230a_100000211385_200015260668 [0,1,0,0,0,0|3,0,0]=4 255 B8R0.25 CCC(C)(C)NCCF 2230a_100000211385_100011217306 [0,1,0,0,0,0|3,0,0]=4 256 B8R0.25 CCC(C)(C)NCCO 2230a_100000211385_100000211926 [0,1,0,0,0,0|3,0,0]=4 257 B8R0.25 CCC(C)(C)NCOC 2230a_100000211385_100000766300 [0,1,0,0,0,0|2,0,1]=4 258 B8R0.25 CCC(C)(C)NCSC 2230a_100000211385_100011218213 [0,1,0,0,0,0|2,0,1]=4 259 B8R0.25 CCC(C)(C)OCC#N 7a_100000210230_100011215382 [0,1,0,0,0,0|3,0,0]=4 260 B8R0.25 CCC(C)(C)OCC=O 7a_100000210230_200015260668 [0,1,0,0,0,0|3,0,0]=4 261 B8R0.25 CCC(C)(C)OCCF 7a_100000210230_100011217306 [0,1,0,0,0,0|3,0,0]=4 262 B8R0.25 CCC(C)(C)OCCO 7a_100000210230_100000211926 [0,1,0,0,0,0|3,0,0]=4 263 B8R0.25 CCC(C)(C)SCC#N 62a_100000032637_100011215382 [0,1,0,0,0,0|3,0,0]=4 264 B8R0.25 CCC(C)(C)SCC#N 62a_100011215382_100000032637 [0,1,0,0,0,0|3,0,0]=4 265 B8R0.25 CCC(C)(C)SCC=O 62a_100000032637_200015260668 [0,1,0,0,0,0|3,0,0]=4 266 B8R0.25 CCC(C)(C)SCC=O 62a_200015260668_100000032637 [0,1,0,0,0,0|3,0,0]=4 267 B8R0.25 CCC(C)(C)SCCF 62a_100000032637_100011217306 [0,1,0,0,0,0|3,0,0]=4 268 B8R0.25 CCC(C)(C)SCCF 62a_100011217306_100000032637 [0,1,0,0,0,0|3,0,0]=4 269 B8R0.25 CCC(C)(C)SCCO 62a_100000032637_100000211926 [0,1,0,0,0,0|3,0,0]=4 270 B8R0.25 CCC(C)(C)SCCO 62a_100000211926_100000032637 [0,1,0,0,0,0|3,0,0]=4 271 B8R0.25 CCC(C)(C)SCOC 62a_100000032637_100000766300 [0,1,0,0,0,0|2,0,1]=4 272 B8R0.25 CCC(C)(C)SCOC 62a_100000766300_100000032637 [0,1,0,0,0,0|2,0,1]=4 273 B8R0.25 CCC(C)(C)SCSC 62a_100000032637_100011218213 [0,1,0,0,0,0|2,0,1]=4 274 B8R0.25 CCC(C)(C)SCSC 62a_100011218213_100000032637 [0,1,0,0,0,0|2,0,1]=4 275 B8R0.25 CCCCC(C)(C)OC 7a_100011219641_200000210301 [0,1,0,0,0,0|1,0,1]=3 276 B8R0.25 CCCCC(C)(C)O[13CH3] 7a_100011219641_200025704644 [0,1,0,0,0,0|1,0,1]=3 277 B8R0.25 CCCNC(C)(C)CC 2230a_100000211385_100000210303 [0,1,0,0,0,0|2,0,1]=4 278 B8R0.25 CCCOC(C)(C)CC 7a_100000210230_100000210303 [0,1,0,0,0,0|2,0,1]=4 279 B8R0.25 CCCSC(C)(C)CC 62a_100000032637_100000210303 [0,1,0,0,0,0|2,0,1]=4 280 B8R0.25 CCCSC(C)(C)CC 62a_100000210303_100000032637 [0,1,0,0,0,0|2,0,1]=4 281 B8R0.25 CCNCC(C)(C)OC 2230a_100000763424_100000210202 [0,1,0,0,0,0|0,0,2]=3 282 B8R0.25 CCNCC(C)(C)SC 270004a_100015525214_100009845794 [0,1,0,0,0,0|0,1,2]=4 283 B8R0.25 CCOCC(C)(C)CC 7a_100000765029_100000210202 [0,1,0,0,0,0|2,0,1]=4 284 B8R0.25 CCOCC(C)(C)OC 34a_100121572206_100000701081 [0,1,0,0,0,0|1,0,1]=3 285 B8R0.25 CCSCC(C)(C)OC 62a_100000210202_100000701081 [0,1,0,0,0,0|1,0,1]=3 286 B8R0.25 CCSCC(C)(C)OC 62a_100000701081_100000210202 [0,1,0,0,0,0|1,0,1]=3 287 B8R0.25 COC(C)(C)CCCBr 7a_100009888830_200000210301 [0,1,0,0,0,0|1,0,1]=3 288 B8R0.25 COC(C)(C)CCO[13CH3] 7a_100000699976_200025704644 [0,1,0,0,0,0|1,0,1]=3 289 B8R0.25 COC(C)(C)CSCF 62a_100000701081_100015361967 [0,1,0,0,0,0|1,0,1]=3 290 B8R0.25 COC(C)(C)CSCF 62a_100015361967_100000701081 [0,1,0,0,0,0|1,0,1]=3 291 B8R0.25 COCCC(C)(C)OC 7a_100000699976_200000210301 [0,1,0,0,0,0|1,0,1]=3 292 B8R0.30 C=CCC(C)(C)OCC 7a_100011995686_100000210202 [0,1,0,0,0,0|1,0,1]=3 293 B8R0.30 C=CCC(C)(C)OCF 7a_100011995686_100015361967 [0,1,0,0,0,0|1,0,1]=3 294 B8R0.30 CC(C)(CCBr)OCF 7a_100000702414_100015361967 [0,1,0,0,0,0|2,0,0]=3 295 B8R0.30 CCCC(C)(C)COC 7a_100011995695_200000210301 [0,1,0,0,0,0|1,0,1]=3 296 B8R0.30 CCCC(C)(C)CO[13CH3] 7a_100011995695_200025704644 [0,1,0,0,0,0|1,0,1]=3 297 B8R0.30 CCCC(C)(C)OCC 7a_100000748436_100000210202 [0,1,0,0,0,0|1,0,1]=3 298 B8R0.30 CCCC(C)(C)OCF 7a_100000748436_100015361967 [0,1,0,0,0,0|1,0,1]=3 299 B8R0.30 CCNC(C)(C)COC 2230a_100000752728_100000210202 [0,1,0,0,0,0|2,0,1]=4 300 B8R0.30 CCNC(C)(C)COC 7a_100000747347_200000210301 [0,1,0,0,0,0|2,0,1]=4 301 B8R0.30 CCNC(C)(C)CO[13CH3] 7a_100000747347_200025704644 [0,1,0,0,0,0|2,0,1]=4 302 B8R0.30 CCNC(C)(C)CSC 2230a_100000759623_100000210202 [0,1,0,0,0,0|2,0,1]=4 303 B8R0.30 CCNC(C)(C)CSC 7a_100000759623_100000210202 [0,1,0,0,0,0|2,0,1]=4 304 B8R0.30 CCOC(C)(C)CCBr 7a_100000702414_100000210202 [0,1,0,0,0,0|2,0,0]=3 305 B8R0.30 CCO[Si](C)(C)CSC 62a_200000065227_200000210301 [0,1,0,0,0,0|1,1,1]=4 306 B8R0.30 CCO[Si](C)(C)CSC 62a_200000210301_200000065227 [0,1,0,0,0,0|1,1,1]=4 307 B8R0.30 CCO[Si](C)(C)CS[13CH3] 62a_200000065227_200025704644 [0,1,0,0,0,0|1,1,1]=4 308 B8R0.30 CCO[Si](C)(C)CS[13CH3] 62a_200025704644_200000065227 [0,1,0,0,0,0|1,1,1]=4 309 B8R0.30 CNCC(C)(C)COC 2230a_100000734190_200000210301 [0,1,0,0,0,0|0,0,2]=3 310 B8R0.30 COCC(C)(C)CN[13CH3] 2230a_100000734190_200025704644 [0,1,0,0,0,0|0,0,2]=3 311 B8R0.30 CSCC(C)(C)NCF 7a_100000759623_100015361967 [0,1,0,0,0,0|2,0,1]=4 312 B8R0.31 C=CCC(C)(CC)OC 7a_200011216962_200000210301 [0,1,0,0,0,0|1,0,1]=3 313 B8R0.31 C=CCC(C)(CC)O[13CH3] 7a_200011216962_200025704644 [0,1,0,0,0,0|1,0,1]=3 314 B8R0.31 CCCC(C)(CC)NC 7a_106832991635_200000040151 [0,1,0,0,0,0|2,0,1]=4 315 B8R0.31 CCCC(C)(CC)OC 7a_200011215934_200000210301 [0,1,0,0,0,0|1,0,1]=3 316 B8R0.31 CCCC(C)(CC)O[13CH3] 7a_200011215934_200025704644 [0,1,0,0,0,0|1,0,1]=3 317 B8R0.31 CCCC(C)(CC)SC 62a_200000040151_200000210301 [0,1,0,0,0,0|1,1,1]=4 318 B8R0.31 CCCC(C)(CC)SC 62a_200000210301_200000040151 [0,1,0,0,0,0|1,1,1]=4 319 B8R0.31 CCCC(C)(CC)S[13CH3] 62a_200000040151_200025704644 [0,1,0,0,0,0|1,1,1]=4 320 B8R0.31 CCCC(C)(CC)S[13CH3] 62a_200025704644_200000040151 [0,1,0,0,0,0|1,1,1]=4 321 B8R0.31 CNCC(C)(OC)OC 2230a_100000732740_200000210301 [0,1,0,0,0,0|0,0,2]=3 322 B8R0.31 CNCC(C)(OC)OC 2230a_106832991635_100000064154 [0,1,0,0,0,0|0,0,2]=3 323 B8R0.31 CNCC(C)(OC)OC 34a_100102657272_100000766008 [0,1,0,0,0,0|0,0,2]=3 324 B8R0.31 COC(C)(CN[13CH3])OC 2230a_100000732740_200025704644 [0,1,0,0,0,0|0,0,2]=3 325 B8R0.31 COC(C)(CSC)OC 62a_100000766008_200000210301 [0,1,0,0,0,0|1,0,1]=3 326 B8R0.31 COC(C)(CSC)OC 62a_200000210301_100000766008 [0,1,0,0,0,0|1,0,1]=3 327 B8R0.31 COC(C)(CS[13CH3])OC 62a_100000766008_200025704644 [0,1,0,0,0,0|1,0,1]=3 328 B8R0.31 COC(C)(CS[13CH3])OC 62a_200025704644_100000766008 [0,1,0,0,0,0|1,0,1]=3 329 B8R0.31 COCC(C)(OC)OC 34a_100138415774_100000766008 [0,1,0,0,0,0|1,0,1]=3 330 B8R0.31 CO[Si](C)(CSC)OC 62a_100000067953_200000210301 [0,1,0,0,0,0|1,1,1]=4 331 B8R0.31 CO[Si](C)(CSC)OC 62a_200000210301_100000067953 [0,1,0,0,0,0|1,1,1]=4 332 B8R0.31 CO[Si](C)(CS[13CH3])OC 62a_100000067953_200025704644 [0,1,0,0,0,0|1,1,1]=4 333 B8R0.31 CO[Si](C)(CS[13CH3])OC 62a_200025704644_100000067953 [0,1,0,0,0,0|1,1,1]=4 334 B8R0.34 CC(=O)CC(C)(C)O[13CH3] 7a_100000210262_200025704644 [0,1,0,0,0,0|1,0,1]=3 335 B8R0.34 CC(C)(CC(=O)N)N[13CH3] 2230a_100000763158_200025704644 [0,1,0,0,0,0|3,0,0]=4 336 B8R0.34 CC(C)(CC(=O)O)N[13CH3] 269956a_100000755897_200025704644 [0,1,0,0,0,0|3,0,0]=4 337 B8R0.34 CC(C)CC(C)(C)N[13CH3] 2230a_100011346068_200025704644 [0,1,0,0,0,0|2,0,1]=4 338 B8R0.34 CCC(C)(C)CC(=O)C 1458a_200000763500_200000210301 [0,1,0,0,0,0|2,0,1]=4 339 B8R0.34 CCC(C)(C)CC(=O)[13CH3] 1458a_200000763500_200025704644 [0,1,0,0,0,0|2,0,1]=4 340 B8R0.34 CN(C)CC(C)(C)N[13CH3] 2230a_100015183317_200025704644 [0,1,0,0,0,0|1,0,2]=4 341 B8R0.34 CNC(C)(C)CC(=O)N 2230a_100000763158_200000210301 [0,1,0,0,0,0|3,0,0]=4 342 B8R0.34 CNC(C)(C)CC(=O)O 269956a_100000755897_200000210301 [0,1,0,0,0,0|3,0,0]=4 343 B8R0.34 CNC(C)(C)CC(C)C 2230a_100011346068_200000210301 [0,1,0,0,0,0|2,0,1]=4 344 B8R0.34 CNC(C)(C)CN(C)C 2230a_100015183317_200000210301 [0,1,0,0,0,0|1,0,2]=4 345 B8R0.34 COC(C)(C)CC(=O)C 7a_100000210262_200000210301 [0,1,0,0,0,0|1,0,1]=3 346 B8R0.34 COC(C)(C)CN(C)C 269982a_100102631434_100000701081 [0,1,0,0,0,0|0,0,2]=3 347 B8R0.34 CSC(C)(C)CN(C)C 270004a_100102631434_100009845794 [0,1,0,0,0,0|0,1,2]=4 348 B8R1.19 CC1(CCCN1[13CH3])C 2230a_100000761399_200025704644 [0,0,0,1,0,0|2,0,1]=4 349 B8R1.19 CC1(CCCN1[13CH3])C 269982a_100000761399_200025704644 [0,0,0,1,0,0|2,0,1]=4 350 B8R1.19 CC1(CCCN1[13CH3])C 34a_100000761399_200025704644 [0,0,0,1,0,0|2,0,1]=4 351 B8R1.19 CC1(COCN1[13CH3])C 2230a_100000043020_200025704644 [0,0,0,1,0,0|2,0,1]=4 352 B8R1.19 CC1(COCN1[13CH3])C 269982a_100000043020_200025704644 [0,0,0,1,0,0|2,0,1]=4 353 B8R1.19 CN1CCCC1(C)C 2230a_100000761399_200000210301 [0,0,0,1,0,0|2,0,1]=4 354 B8R1.19 CN1CCCC1(C)C 269982a_100000761399_200000210301 [0,0,0,1,0,0|2,0,1]=4 355 B8R1.19 CN1CCCC1(C)C 34a_100000761399_200000210301 [0,0,0,1,0,0|2,0,1]=4 356 B8R1.19 CN1COCC1(C)C 2230a_100000043020_200000210301 [0,0,0,1,0,0|2,0,1]=4 357 B8R1.19 CN1COCC1(C)C 269982a_100000043020_200000210301 [0,0,0,1,0,0|2,0,1]=4 358 B8R1.28 CC(C)(N[13CH3])C1CC1 2230a_100000695267_200025704644 [0,0,0,1,0,0|2,0,1]=4 359 B8R1.28 CNC(C)(C)C1CC1 2230a_100000695267_200000210301 [0,0,0,1,0,0|2,0,1]=4 360 B8R1.51 CC1(CCN(C1)[13CH3])C 2230a_100000764714_200025704644 [0,0,0,1,0,0|1,0,2]=4 361 B8R1.51 CC1(CCN(C1)[13CH3])C 269982a_100000764714_200025704644 [0,0,0,1,0,0|1,0,2]=4 362 B8R1.51 CN1CCC(C1)(C)C 2230a_100000764714_200000210301 [0,0,0,1,0,0|1,0,2]=4 363 B8R1.51 CN1CCC(C1)(C)C 269982a_100000764714_200000210301 [0,0,0,1,0,0|1,0,2]=4 364 B8R1.52 CC1(CCCC1)O[13CH3] 34a_100000751722_200025704644 [0,0,0,1,0,0|1,0,1]=3 365 B8R1.52 CC1(CCCC1)O[13CH3] 7a_100000751722_200025704644 [0,0,0,1,0,0|1,0,1]=3 366 B8R1.52 CC1(CCOC1)N[13CH3] 2230a_100000693475_200025704644 [0,0,0,1,0,0|2,0,1]=4 367 B8R1.52 CNC1(CCOC1)C 2230a_100000693475_200000210301 [0,0,0,1,0,0|2,0,1]=4 368 B8R1.52 COC1(CCCC1)C 34a_100000751722_200000210301 [0,0,0,1,0,0|1,0,1]=3 369 B8R1.52 COC1(CCCC1)C 7a_100000751722_200000210301 [0,0,0,1,0,0|1,0,1]=3 370 B8R1.62 COC1(CN(C1)C)C 2230a_100000695453_200000210301 [0,0,0,1,0,0|0,0,2]=3 371 B8R1.62 COC1(CN(C1)C)C 269982a_100000695453_200000210301 [0,0,0,1,0,0|0,0,2]=3 372 B8R1.62 COC1(CN(C1)[13CH3])C 2230a_100000695453_200025704644 [0,0,0,1,0,0|0,0,2]=3 373 B8R1.62 COC1(CN(C1)[13CH3])C 269982a_100000695453_200025704644 [0,0,0,1,0,0|0,0,2]=3 374 B8R1.66 CC1(CCC1)CN[13CH3] 2230a_100000706607_200025704644 [0,0,0,1,0,0|1,0,2]=4 375 B8R1.66 CC1(CCC1)CS[13CH3] 62a_100000726658_200025704644 [0,0,0,1,0,0|2,0,1]=4 376 B8R1.66 CC1(CCC1)CS[13CH3] 62a_200025704644_100000726658 [0,0,0,1,0,0|2,0,1]=4 377 B8R1.66 CNCC1(CCC1)C 2230a_100000706607_200000210301 [0,0,0,1,0,0|1,0,2]=4 378 B8R1.66 CNCC1(CCC1)C 2230a_106832991635_100000726658 [0,0,0,1,0,0|1,0,2]=4 379 B8R1.66 CNCC1(CCC1)C 34a_100102657272_100000726658 [0,0,0,1,0,0|1,0,2]=4 380 B8R1.66 CNCC1(CCC1)C 7a_106832991635_100000726658 [0,0,0,1,0,0|1,0,2]=4 381 B8R1.66 COCC1(CCC1)C 34a_100138415774_100000726658 [0,0,0,1,0,0|2,0,1]=4 382 B8R1.66 CSCC1(CCC1)C 62a_100000726658_200000210301 [0,0,0,1,0,0|2,0,1]=4 383 B8R1.66 CSCC1(CCC1)C 62a_200000210301_100000726658 [0,0,0,1,0,0|2,0,1]=4 384 B8R1.82 CCCC1(CC1)NC 2230a_100015185929_200000210301 [0,0,0,1,0,0|2,0,1]=4 385 B8R1.82 CCCC1(CC1)N[13CH3] 2230a_100015185929_200025704644 [0,0,0,1,0,0|2,0,1]=4 386 B5R0.1 CC(C)CN[13CH3] 2230a_100000210953_200025704644 [2,0,0,0,0,0|0,0,2]=4 387 B5R0.1 CC(C)CN[13CH3] 34a_100000210953_200025704644 [2,0,0,0,0,0|0,0,2]=4 388 B5R0.1 CC(C)CO[13CH3] 34a_100000210257_200025704644 [2,0,0,0,0,0|1,0,1]=4 389 B5R0.1 CC(C)CS[13CH3] 62a_100000210624_200025704644 [2,0,0,0,0,0|1,0,1]=4 390 B5R0.1 CC(C)CS[13CH3] 62a_200025704644_100000210760 [2,0,0,0,0,0|1,0,1]=4 391 B5R0.1 CC(O)CN[13CH3] 2230a_100000210904_200025704644 [2,0,0,0,0,0|0,0,2]=4 392 B5R0.1 CC(O)CN[13CH3] 34a_100000210904_200025704644 [2,0,0,0,0,0|0,0,2]=4 393 B5R0.1 CC(O)CS[13CH3] 62a_100011218427_200025704644 [2,0,0,0,0,0|1,0,1]=4 394 B5R0.1 CC(O)CS[13CH3] 62a_200025704644_100011218427 [2,0,0,0,0,0|1,0,1]=4 395 B5R0.1 CNCC(C)C 2230a_100000210953_200000210301 [2,0,0,0,0,0|0,0,2]=4 396 B5R0.1 CNCC(C)C 2230a_106832991635_100000210760 [2,0,0,0,0,0|0,0,2]=4 397 B5R0.1 CNCC(C)C 270004a_106832991635_100000210432 [2,0,0,0,0,0|0,0,2]=4 398 B5R0.1 CNCC(C)C 34a_100000210953_200000210301 [2,0,0,0,0,0|0,0,2]=4 399 B5R0.1 CNCC(C)C 34a_100102657272_100000210624 [2,0,0,0,0,0|0,0,2]=4 400 B5R0.1 CNCC(C)C 7a_106832991635_100000210760 [2,0,0,0,0,0|0,0,2]=4 401 B5R0.1 CNCC(C)O 2230a_100000210904_200000210301 [2,0,0,0,0,0|0,0,2]=4 402 B5R0.1 CNCC(C)O 2230a_106832991635_100011218427 [2,0,0,0,0,0|0,0,2]=4 403 B5R0.1 CNCC(C)O 34a_100000210904_200000210301 [2,0,0,0,0,0|0,0,2]=4 404 B5R0.1 CNCC(C)O 34a_100102657272_100011218427 [2,0,0,0,0,0|0,0,2]=4 405 B5R0.1 CNCC(C)O 7a_106832991635_100011218427 [2,0,0,0,0,0|0,0,2]=4 406 B5R0.1 CNC[C@@H](C)O 2230a_106832991635_100009817552 [2,0,0,0,0,0|0,0,2]=4 407 B5R0.1 CNC[C@@H](C)O 34a_100102657272_100009817552 [2,0,0,0,0,0|0,0,2]=4 408 B5R0.1 CNC[C@@H](C)O 7a_106832991635_100009817552 [2,0,0,0,0,0|0,0,2]=4 409 B5R0.1 COCC(C)C 34a_100000210257_200000210301 [2,0,0,0,0,0|1,0,1]=4 410 B5R0.1 COCC(C)C 34a_100138415774_100000210624 [2,0,0,0,0,0|1,0,1]=4 411 B5R0.1 COCC(C)O 34a_100138415774_100011218427 [2,0,0,0,0,0|1,0,1]=4 412 B5R0.1 COC[C@@H](C)O 34a_100138415774_100009817552 [2,0,0,0,0,0|1,0,1]=4 413 B5R0.1 CSCC(C)C 62a_100000210624_200000210301 [2,0,0,0,0,0|1,0,1]=4 414 B5R0.1 CSCC(C)C 62a_200000210301_100000210760 [2,0,0,0,0,0|1,0,1]=4 415 B5R0.1 CSCC(C)O 62a_100011218427_200000210301 [2,0,0,0,0,0|1,0,1]=4 416 B5R0.1 CSCC(C)O 62a_200000210301_100011218427 [2,0,0,0,0,0|1,0,1]=4 417 B5R0.1 CSC[C@@H](C)O 62a_100009817552_200000210301 [2,0,0,0,0,0|1,0,1]=4 418 B5R0.1 CSC[C@@H](C)O 62a_200000210301_100009817552 [2,0,0,0,0,0|1,0,1]=4 419 B5R0.1 C[C@@H](O)CS[13CH3] 62a_100009817552_200025704644 [2,0,0,0,0,0|1,0,1]=4 420 B5R0.1 C[C@@H](O)CS[13CH3] 62a_200025704644_100009817552 [2,0,0,0,0,0|1,0,1]=4 421 B5R0.2 C#CCCOC 34a_100011215631_200000210301 [2,0,0,0,0,0|1,0,1]=4 422 B5R0.2 C#CCCOC 34a_100138415774_100000688953 [2,0,0,0,0,0|1,0,1]=4 423 B5R0.2 C#CCCO[13CH3] 34a_100011215631_200025704644 [2,0,0,0,0,0|1,0,1]=4 424 B5R0.2 C=CCCOC 34a_100011205117_200000210301 [2,0,0,0,0,0|1,0,1]=4 425 B5R0.2 C=CCCOC 34a_100138415774_100000754431 [2,0,0,0,0,0|1,0,1]=4 426 B5R0.2 C=CCCO[13CH3] 34a_100011205117_200025704644 [2,0,0,0,0,0|1,0,1]=4 427 B5R0.2 CCCCOC 34a_100000210227_200000210301 [2,0,0,0,0,0|1,0,1]=4 428 B5R0.2 CCCCOC 34a_100138415774_100000210210 [2,0,0,0,0,0|1,0,1]=4 429 B5R0.2 CCCCOC 7a_100000210227_200000210301 [2,0,0,0,0,0|1,0,1]=4 430 B5R0.2 CCCCO[13CH3] 34a_100000210227_200025704644 [2,0,0,0,0,0|1,0,1]=4 431 B5R0.2 CCCCO[13CH3] 7a_100000210227_200025704644 [2,0,0,0,0,0|1,0,1]=4 432 B5R0.2 CNCCOC 2230a_100000209980_200000210301 [2,0,0,0,0,0|0,0,2]=4 433 B5R0.2 CNCCOC 2230a_106832991635_100011201679 [2,0,0,0,0,0|0,0,2]=4 434 B5R0.2 CNCCOC 34a_100102657272_100011201679 [2,0,0,0,0,0|0,0,2]=4 435 B5R0.2 CNCCOC 7a_106832991635_100000233755 [2,0,0,0,0,0|0,0,2]=4 436 B5R0.2 COCCCBr 34a_100011217188_200000210301 [2,0,0,0,0,0|2,0,0]=4 437 B5R0.2 COCCCCl 34a_100000230001_200000210301 [2,0,0,0,0,0|2,0,0]=4 438 B5R0.2 COCCCF 34a_100000759539_200000210301 [2,0,0,0,0,0|2,0,0]=4 439 B5R0.2 COCCCF 34a_100138415774_100011934791 [2,0,0,0,0,0|2,0,0]=4 440 B5R0.2 COCCCN 34a_100000182051_200000210301 [2,0,0,0,0,0|2,0,0]=4 441 B5R0.2 COCCCO 34a_100138415774_100000230001 [2,0,0,0,0,0|2,0,0]=4 442 B5R0.2 COCCN[13CH3] 2230a_100000209980_200025704644 [2,0,0,0,0,0|0,0,2]=4 443 B5R0.2 COCCOC 34a_100000210237_200000210301 [2,0,0,0,0,0|1,0,1]=4 444 B5R0.2 COCCOC 34a_100138415774_100011201679 [2,0,0,0,0,0|1,0,1]=4 445 B5R0.2 COCCON 34a_100000700252_200000210301 [2,0,0,0,0,0|2,0,0]=4 446 B5R0.2 COCCO[13CH3] 34a_100000210237_200025704644 [2,0,0,0,0,0|1,0,1]=4 447 B5R0.2 COCCSC 34a_100000230434_200000210301 [2,0,0,0,0,0|1,0,1]=4 448 B5R0.2 COCCSC 34a_100138415774_100000212216 [2,0,0,0,0,0|1,0,1]=4 449 B5R0.2 COCCSC 62a_100000233755_200000210301 [2,0,0,0,0,0|1,0,1]=4 450 B5R0.2 COCCSC 62a_200000210301_100000233755 [2,0,0,0,0,0|1,0,1]=4 451 B5R0.2 COCCSC 7a_100000230434_200000210301 [2,0,0,0,0,0|1,0,1]=4 452 B5R0.2 COCCS[13CH3] 62a_100000233755_200025704644 [2,0,0,0,0,0|1,0,1]=4 453 B5R0.2 COCCS[13CH3] 62a_200025704644_100000233755 [2,0,0,0,0,0|1,0,1]=4 454 B5R0.2 CSCCO[13CH3] 34a_100000230434_200025704644 [2,0,0,0,0,0|1,0,1]=4 455 B5R0.2 CSCCO[13CH3] 7a_100000230434_200025704644 [2,0,0,0,0,0|1,0,1]=4 456 B5R0.2 [13CH3]OCCCBr 34a_100011217188_200025704644 [2,0,0,0,0,0|2,0,0]=4 457 B5R0.2 [13CH3]OCCCCl 34a_100000230001_200025704644 [2,0,0,0,0,0|2,0,0]=4 458 B5R0.2 [13CH3]OCCCF 34a_100000759539_200025704644 [2,0,0,0,0,0|2,0,0]=4 459 B5R0.2 [13CH3]OCCCN 34a_100000182051_200025704644 [2,0,0,0,0,0|2,0,0]=4 460 B5R0.2 [13CH3]OCCON 34a_100000700252_200025704644 [2,0,0,0,0,0|2,0,0]=4 461 B5R0.3 C#CC(C)OC 34a_100138415774_200000035995 [2,0,0,0,0,0|0,0,2]=4 462 B5R0.3 C#C[C@@H](C)OC 34a_100009815206_200000210301 [2,0,0,0,0,0|0,0,2]=4 463 B5R0.3 C#C[C@@H](C)OC 7a_100009815206_200000210301 [2,0,0,0,0,0|0,0,2]=4 464 B5R0.3 C#C[C@@H](C)O[13CH3] 34a_100009815206_200025704644 [2,0,0,0,0,0|0,0,2]=4 465 B5R0.3 C#C[C@@H](C)O[13CH3] 7a_100009815206_200025704644 [2,0,0,0,0,0|0,0,2]=4 466 B5R0.3 C=CC(C)OC 34a_100000695699_200000210301 [2,0,0,0,0,0|0,0,2]=4 467 B5R0.3 C=CC(C)O[13CH3] 34a_100000695699_200025704644 [2,0,0,0,0,0|0,0,2]=4 468 B5R0.3 CC(C#N)O[13CH3] 34a_100011218135_200025704644 [2,0,0,0,0,0|0,0,2]=4 469 B5R0.3 CC(CF)O[13CH3] 34a_100016041109_200025704644 [2,0,0,0,0,0|1,0,0]=3 470 B5R0.3 CC(CF)O[13CH3] 7a_100016041109_200025704644 [2,0,0,0,0,0|1,0,0]=3 471 B5R0.3 CC(CN)O[13CH3] 34a_100000210904_200025704644 [2,0,0,0,0,0|0,0,1]=3 472 B5R0.3 CC(CO)S[13CH3] 62a_100012180447_200025704644 [2,0,0,0,0,0|1,1,0]=4 473 B5R0.3 CCC(C)NC 2230a_100000209981_200000210301 [2,0,0,0,0,0|1,0,1]=4 474 B5R0.3 CCC(C)NC 2230a_106832991635_100000758301 [2,0,0,0,0,0|1,0,1]=4 475 B5R0.3 CCC(C)NC 34a_100102657272_100011215416 [2,0,0,0,0,0|1,0,1]=4 476 B5R0.3 CCC(C)NC 7a_106832991635_100000758301 [2,0,0,0,0,0|1,0,1]=4 477 B5R0.3 CCC(C)N[13CH3] 2230a_100000209981_200025704644 [2,0,0,0,0,0|1,0,1]=4 478 B5R0.3 CCC(C)OC 34a_100138415774_100011215416 [2,0,0,0,0,0|0,0,1]=3 479 B5R0.3 CCC(C)OC 7a_100000210228_200000210301 [2,0,0,0,0,0|0,0,1]=3 480 B5R0.3 CCC(C)O[13CH3] 7a_100000210228_200025704644 [2,0,0,0,0,0|0,0,1]=3 481 B5R0.3 CCC(C)SC 62a_100000758301_200000210301 [2,0,0,0,0,0|0,1,1]=4 482 B5R0.3 CCC(C)SC 62a_200000210301_100000758301 [2,0,0,0,0,0|0,1,1]=4 483 B5R0.3 CCC(C)S[13CH3] 62a_100000758301_200025704644 [2,0,0,0,0,0|0,1,1]=4 484 B5R0.3 CCC(C)S[13CH3] 62a_200025704644_100000758301 [2,0,0,0,0,0|0,1,1]=4 485 B5R0.3 CNC(C)CO 2230a_106832991635_100012180447 [2,0,0,0,0,0|2,0,0]=4 486 B5R0.3 CNC(C)CO 34a_100102657272_100012180447 [2,0,0,0,0,0|2,0,0]=4 487 B5R0.3 CNC(C)CO 7a_106832991635_100012180447 [2,0,0,0,0,0|2,0,0]=4 488 B5R0.3 CN[C@H](C)CO 2230a_100000737577_200000210301 [2,0,0,0,0,0|2,0,0]=4 489 B5R0.3 COC(C)C#N 34a_100011218135_200000210301 [2,0,0,0,0,0|0,0,2]=4 490 B5R0.3 COC(C)CF 34a_100016041109_200000210301 [2,0,0,0,0,0|1,0,0]=3 491 B5R0.3 COC(C)CF 7a_100016041109_200000210301 [2,0,0,0,0,0|1,0,0]=3 492 B5R0.3 COC(C)CN 34a_100000210904_200000210301 [2,0,0,0,0,0|0,0,1]=3 493 B5R0.3 COC(C)CO 34a_100138415774_100012180447 [2,0,0,0,0,0|1,0,0]=3 494 B5R0.3 COC(C)SC 62a_100009879195_200000210301 [2,0,0,0,0,0|1,0,1]=4 495 B5R0.3 COC(C)SC 62a_200000210301_100009879195 [2,0,0,0,0,0|1,0,1]=4 496 B5R0.3 COC(C)S[13CH3] 62a_100009879195_200025704644 [2,0,0,0,0,0|1,0,1]=4 497 B5R0.3 COC(C)S[13CH3] 62a_200025704644_100009879195 [2,0,0,0,0,0|1,0,1]=4 498 B5R0.3 CSC(C)CO 62a_100012180447_200000210301 [2,0,0,0,0,0|1,1,0]=4 499 B5R0.3 CS[C@H](C)CO 62a_100016084084_200000210301 [2,0,0,0,0,0|1,1,0]=4 500 B5R0.3 CS[C@H](C)CO 62a_200000210301_100016084084 [2,0,0,0,0,0|1,1,0]=4 501 B5R0.3 C[C@H](CO)N[13CH3] 2230a_100000737577_200025704644 [2,0,0,0,0,0|2,0,0]=4 502 B5R0.3 C[C@H](CO)S[13CH3] 62a_100016084084_200025704644 [2,0,0,0,0,0|1,1,0]=4 503 B5R0.3 C[C@H](CO)S[13CH3] 62a_200025704644_100016084084 [2,0,0,0,0,0|1,1,0]=4 504 B5R0.4 CC(C)(C)N[13CH3] 2230a_100000715429_200025704644 [2,0,0,0,0,0|1,0,0]=3 505 B5R0.4 CC(C)(C)O[13CH3] 34a_100015890283_200025704644 [2,0,0,0,0,0|0,0,0]=2 506 B5R0.4 CC(C)(C)O[13CH3] 7a_100015890283_200025704644 [2,0,0,0,0,0|0,0,0]=2 507 B5R0.4 CC(C)(C)S[13CH3] 62a_100000211941_200025704644 [2,0,0,0,0,0|0,1,0]=3 508 B5R0.4 CC(C)(C)S[13CH3] 62a_200025704644_100000211941 [2,0,0,0,0,0|0,1,0]=3 509 B5R0.4 CNC(C)(C)C 2230a_100000715429_200000210301 [2,0,0,0,0,0|1,0,0]=3 510 B5R0.4 CNC(C)(C)C 34a_100102657272_100000210625 [2,0,0,0,0,0|1,0,0]=3 511 B5R0.4 COC(C)(C)C 34a_100015890283_200000210301 [2,0,0,0,0,0|0,0,0]=2 512 B5R0.4 COC(C)(C)C 34a_100138415774_100000210625 [2,0,0,0,0,0|0,0,0]=2 513 B5R0.4 COC(C)(C)C 7a_100015890283_200000210301 [2,0,0,0,0,0|0,0,0]=2 514 B5R0.4 CSC(C)(C)C 62a_100000211941_200000210301 [2,0,0,0,0,0|0,1,0]=3 515 B5R0.4 CSC(C)(C)C 62a_200000210301_100000211941 [2,0,0,0,0,0|0,1,0]=3 516 B7R0.2 CC(C)CC(C)O[13CH3] 34a_100000211805_200025704644 [1,1,0,0,0,0|1,0,1]=4 517 B7R0.2 CC(C)CC(C)O[13CH3] 7a_100000211805_200025704644 [1,1,0,0,0,0|1,0,1]=4 518 B7R0.2 COC(C)CC(C)C 34a_100000211805_200000210301 [1,1,0,0,0,0|1,0,1]=4 519 B7R0.2 COC(C)CC(C)C 34a_100138415774_100000731052 [1,1,0,0,0,0|1,0,1]=4 520 B7R0.2 COC(C)CC(C)C 7a_100000211805_200000210301 [1,1,0,0,0,0|1,0,1]=4 521 B7R0.3 C#CCSC(C)OC 62a_100000038162_100009879195 [1,1,0,0,0,0|1,0,1]=4 522 B7R0.3 C=CCCC(C)OC 34a_100000765329_200000210301 [1,1,0,0,0,0|1,0,1]=4 523 B7R0.3 C=CCCC(C)OC 7a_100000765329_200000210301 [1,1,0,0,0,0|1,0,1]=4 524 B7R0.3 C=CCCC(C)O[13CH3] 34a_100000765329_200025704644 [1,1,0,0,0,0|1,0,1]=4 525 B7R0.3 C=CCCC(C)O[13CH3] 7a_100000765329_200025704644 [1,1,0,0,0,0|1,0,1]=4 526 B7R0.3 C=CCSC(C)OC 62a_100000210623_100009879195 [1,1,0,0,0,0|1,0,1]=4 527 B7R0.3 C=CCSC(C)OC 62a_100009879195_100000210623 [1,1,0,0,0,0|1,0,1]=4 528 B7R0.3 CC(CCCCl)O[13CH3] 34a_200000718107_200025704644 [1,1,0,0,0,0|1,0,1]=4 529 B7R0.3 CC(CCCCl)O[13CH3] 7a_200000718107_200025704644 [1,1,0,0,0,0|1,0,1]=4 530 B7R0.3 CCCCC(C)OC 34a_100000687866_200000210301 [1,1,0,0,0,0|1,0,1]=4 531 B7R0.3 CCCCC(C)OC 34a_100138415774_200011215066 [1,1,0,0,0,0|1,0,1]=4 532 B7R0.3 CCCCC(C)OC 7a_100000687866_200000210301 [1,1,0,0,0,0|1,0,1]=4 533 B7R0.3 CCCCC(C)O[13CH3] 34a_100000687866_200025704644 [1,1,0,0,0,0|1,0,1]=4 534 B7R0.3 CCCCC(C)O[13CH3] 7a_100000687866_200025704644 [1,1,0,0,0,0|1,0,1]=4 535 B7R0.3 CCCSC(C)OC 62a_100000210303_100009879195 [1,1,0,0,0,0|1,0,1]=4 536 B7R0.3 CCCSC(C)OC 62a_100009879195_100000210303 [1,1,0,0,0,0|1,0,1]=4 537 B7R0.3 CCNC[C@@H](C)OC 2230a_100020591295_100000210202 [1,1,0,0,0,0|0,0,2]=4 538 B7R0.3 CCOCC(C)OC 34a_100000690652_100000210202 [1,1,0,0,0,0|1,0,1]=4 539 B7R0.3 CCOCC(C)OC 34a_100000718985_200000210301 [1,1,0,0,0,0|1,0,1]=4 540 B7R0.3 CCOCC(C)OC 7a_100000718985_200000210301 [1,1,0,0,0,0|1,0,1]=4 541 B7R0.3 CCOCC(C)O[13CH3] 34a_100000718985_200025704644 [1,1,0,0,0,0|1,0,1]=4 542 B7R0.3 CCOCC(C)O[13CH3] 7a_100000718985_200025704644 [1,1,0,0,0,0|1,0,1]=4 543 B7R0.3 COC(C)CCCCl 34a_200000718107_200000210301 [1,1,0,0,0,0|1,0,1]=4 544 B7R0.3 COC(C)CCCCl 7a_200000718107_200000210301 [1,1,0,0,0,0|1,0,1]=4 545 B7R0.3 COC(C)CCO[13CH3] 7a_100000764861_200025704644 [1,1,0,0,0,0|1,0,1]=4 546 B7R0.3 COC(C)COCF 34a_100000690652_100015361967 [1,1,0,0,0,0|1,0,1]=4 547 B7R0.3 COC(C)SCC#N 62a_100009879195_100011215382 [1,1,0,0,0,0|2,0,0]=4 548 B7R0.3 COC(C)SCC#N 62a_100011215382_100009879195 [1,1,0,0,0,0|2,0,0]=4 549 B7R0.3 COC(C)SCC=O 62a_100009879195_200015260668 [1,1,0,0,0,0|2,0,0]=4 550 B7R0.3 COC(C)SCC=O 62a_200015260668_100009879195 [1,1,0,0,0,0|2,0,0]=4 551 B7R0.3 COC(C)SCCF 62a_100009879195_100011217306 [1,1,0,0,0,0|2,0,0]=4 552 B7R0.3 COC(C)SCCF 62a_100011217306_100009879195 [1,1,0,0,0,0|2,0,0]=4 553 B7R0.3 COC(C)SCCO 62a_100000211926_100009879195 [1,1,0,0,0,0|2,0,0]=4 554 B7R0.3 COC(C)SCCO 62a_100009879195_100000211926 [1,1,0,0,0,0|2,0,0]=4 555 B7R0.3 COC(C)SCSC 62a_100009879195_100011218213 [1,1,0,0,0,0|1,0,1]=4 556 B7R0.3 COC(C)SCSC 62a_100011218213_100009879195 [1,1,0,0,0,0|1,0,1]=4 557 B7R0.3 COCCC(C)OC 7a_100000764861_200000210301 [1,1,0,0,0,0|1,0,1]=4 558 B7R0.3 COCSC(C)OC 62a_100000766300_100009879195 [1,1,0,0,0,0|1,0,1]=4 559 B7R0.3 COCSC(C)OC 62a_100009879195_100000766300 [1,1,0,0,0,0|1,0,1]=4 560 B7R0.7 C#CCC(C)OCC 34a_100000685586_100000210202 [1,1,0,0,0,0|1,0,1]=4 561 B7R0.7 C#CCC(C)OCC 7a_100000685586_100000210202 [1,1,0,0,0,0|1,0,1]=4 562 B7R0.7 C#CCC(C)OCF 34a_100000685586_100015361967 [1,1,0,0,0,0|1,0,1]=4 563 B7R0.7 C#CCC(C)OCF 7a_100000685586_100015361967 [1,1,0,0,0,0|1,0,1]=4 564 B7R0.7 C=CCC(C)COC 34a_100009832082_200000210301 [1,1,0,0,0,0|1,0,1]=4 565 B7R0.7 C=CCC(C)COC 7a_100009832082_200000210301 [1,1,0,0,0,0|1,0,1]=4 566 B7R0.7 C=CCC(C)CO[13CH3] 34a_100009832082_200025704644 [1,1,0,0,0,0|1,0,1]=4 567 B7R0.7 C=CCC(C)CO[13CH3] 7a_100009832082_200025704644 [1,1,0,0,0,0|1,0,1]=4 568 B7R0.7 C=CC[C@@H](C)OCC 34a_100000731007_100000210202 [1,1,0,0,0,0|1,0,1]=4 569 B7R0.7 C=CC[C@@H](C)OCC 7a_100000731007_100000210202 [1,1,0,0,0,0|1,0,1]=4 570 B7R0.7 C=CC[C@@H](C)OCF 34a_100000731007_100015361967 [1,1,0,0,0,0|1,0,1]=4 571 B7R0.7 C=CC[C@@H](C)OCF 7a_100000731007_100015361967 [1,1,0,0,0,0|1,0,1]=4 572 B7R0.7 CC(CCBr)OCF 34a_100012276601_100015361967 [1,1,0,0,0,0|2,0,0]=4 573 B7R0.7 CC(CCN)CO[13CH3] 34a_106354213184_200025704644 [1,1,0,0,0,0|2,0,0]=4 574 B7R0.7 CCCC(C)COC 34a_100000688023_200000210301 [1,1,0,0,0,0|1,0,1]=4 575 B7R0.7 CCCC(C)COC 34a_100138415774_100011216630 [1,1,0,0,0,0|1,0,1]=4 576 B7R0.7 CCCC(C)COC 7a_100000688023_200000210301 [1,1,0,0,0,0|1,0,1]=4 577 B7R0.7 CCCC(C)CO[13CH3] 34a_100000688023_200025704644 [1,1,0,0,0,0|1,0,1]=4 578 B7R0.7 CCCC(C)CO[13CH3] 7a_100000688023_200025704644 [1,1,0,0,0,0|1,0,1]=4 579 B7R0.7 CCCC(C)OCC 34a_100000764384_100000210202 [1,1,0,0,0,0|1,0,1]=4 580 B7R0.7 CCCC(C)OCC 34a_100121572206_100000766640 [1,1,0,0,0,0|1,0,1]=4 581 B7R0.7 CCCC(C)OCC 7a_100000764384_100000210202 [1,1,0,0,0,0|1,0,1]=4 582 B7R0.7 CCCC(C)OCF 34a_100000764384_100015361967 [1,1,0,0,0,0|1,0,1]=4 583 B7R0.7 CCCC(C)OCF 7a_100000764384_100015361967 [1,1,0,0,0,0|1,0,1]=4 584 B7R0.7 CCOC(C)CCBr 34a_100012276601_100000210202 [1,1,0,0,0,0|2,0,0]=4 585 B7R0.7 CCOC(C)CCO 34a_100121572206_100009893172 [1,1,0,0,0,0|2,0,0]=4 586 B7R0.7 CCOC(C)COC 34a_100121572206_100000765312 [1,1,0,0,0,0|1,0,1]=4 587 B7R0.7 CCO[C@H](C)COC 34a_100011934205_100000210202 [1,1,0,0,0,0|1,0,1]=4 588 B7R0.7 COCC(C)CCN 34a_106354213184_200000210301 [1,1,0,0,0,0|2,0,0]=4 589 B7R0.7 COC[C@@H](C)OCF 34a_100011934205_100015361967 [1,1,0,0,0,0|1,0,1]=4 590 B7R0.10 C=C[C@@H](C)[C@@H](C)OC 34a_100015455354_200000210301 [1,1,0,0,0,0|1,0,1]=4 591 B7R0.10 C=C[C@@H](C)[C@@H](C)OC 7a_100015455354_200000210301 [1,1,0,0,0,0|1,0,1]=4 592 B7R0.10 C=C[C@@H](C)[C@@H](C)O[13CH3] 34a_100015455354_200025704644 [1,1,0,0,0,0|1,0,1]=4 593 B7R0.10 C=C[C@@H](C)[C@@H](C)O[13CH3] 7a_100015455354_200025704644 [1,1,0,0,0,0|1,0,1]=4 594 B7R0.10 CCC(C)C(C)OC 7a_100011215189_200000210301 [1,1,0,0,0,0|1,0,1]=4 595 B7R0.10 CCC(C)C(C)O[13CH3] 7a_100011215189_200025704644 [1,1,0,0,0,0|1,0,1]=4 596 B7R0.12 C#CCC(CC)OC 34a_200011217983_200000210301 [1,1,0,0,0,0|1,0,1]=4 597 B7R0.12 C#CCC(CC)OC 7a_200011217983_200000210301 [1,1,0,0,0,0|1,0,1]=4 598 B7R0.12 C#CCC(CC)O[13CH3] 34a_200011217983_200025704644 [1,1,0,0,0,0|1,0,1]=4 599 B7R0.12 C#CCC(CC)O[13CH3] 7a_200011217983_200025704644 [1,1,0,0,0,0|1,0,1]=4 600 B7R0.12 CCC(COC)OC 34a_100011934954_200000210301 [1,1,0,0,0,0|1,0,1]=4 601 B7R0.12 CCC(COC)OC 7a_100011934954_200000210301 [1,1,0,0,0,0|1,0,1]=4 602 B7R0.12 CCC(COC)OC 7a_200011214946_200000210301 [1,1,0,0,0,0|1,0,1]=4 603 B7R0.12 CCC(COC)O[13CH3] 7a_200011214946_200025704644 [1,1,0,0,0,0|1,0,1]=4 604 B7R0.12 CCC(CO[13CH3])OC 34a_100011934954_200025704644 [1,1,0,0,0,0|1,0,1]=4 605 B7R0.12 CCC(CO[13CH3])OC 7a_100011934954_200025704644 [1,1,0,0,0,0|1,0,1]=4 606 B7R0.12 CCCC(CC)OC 34a_100000687864_200000210301 [1,1,0,0,0,0|1,0,1]=4 607 B7R0.12 CCCC(CC)OC 7a_100000687864_200000210301 [1,1,0,0,0,0|1,0,1]=4 608 B7R0.12 CCCC(CC)O[13CH3] 34a_100000687864_200025704644 [1,1,0,0,0,0|1,0,1]=4 609 B7R0.12 CCCC(CC)O[13CH3] 7a_100000687864_200025704644 [1,1,0,0,0,0|1,0,1]=4 610 B7R0.12 CNCC(OC)OC 2230a_106832991635_100000751394 [1,1,0,0,0,0|0,0,2]=4 611 B7R0.12 CNCC(OC)OC 270004a_106832991635_100000752162 [1,1,0,0,0,0|0,0,2]=4 612 B7R0.12 CNCC(OC)OC 34a_100102657272_100000211822 [1,1,0,0,0,0|0,0,2]=4 613 B7R0.12 CNCC(OC)OC 7a_106832991635_100000751394 [1,1,0,0,0,0|0,0,2]=4 614 B7R0.12 COC(CO[13CH3])OC 34a_100011216393_200025704644 [1,1,0,0,0,0|1,0,1]=4 615 B7R0.12 COC(CSC)OC 62a_100000751394_200000210301 [1,1,0,0,0,0|1,0,1]=4 616 B7R0.12 COC(CSC)OC 62a_200000210301_100000751394 [1,1,0,0,0,0|1,0,1]=4 617 B7R0.12 COC(CS[13CH3])OC 62a_100000751394_200025704644 [1,1,0,0,0,0|1,0,1]=4 618 B7R0.12 COC(CS[13CH3])OC 62a_200025704644_100000751394 [1,1,0,0,0,0|1,0,1]=4 619 B7R0.12 COCC(CCl)OC 34a_100011215053_200000210301 [1,1,0,0,0,0|1,0,1]=4 620 B7R0.12 COCC(CCl)O[13CH3] 34a_100011215053_200025704644 [1,1,0,0,0,0|1,0,1]=4 621 B7R0.12 COCC(CN)OC 34a_100000756049_200000210301 [1,1,0,0,0,0|1,0,1]=4 622 B7R0.12 COCC(CN)O[13CH3] 34a_100000756049_200025704644 [1,1,0,0,0,0|1,0,1]=4 623 B7R0.12 COCC(OC)OC 34a_100011216393_200000210301 [1,1,0,0,0,0|1,0,1]=4 624 B7R0.12 COCC(OC)OC 34a_100138415774_100000211822 [1,1,0,0,0,0|1,0,1]=4 625 B7R0.8 C#CCNC(C)(C)C 2230a_100000715429_100000038162 [1,1,0,0,0,0|1,0,1]=4 626 B7R0.8 C#CCNC(C)(C)C 34a_100000212058_100000210625 [1,1,0,0,0,0|1,0,1]=4 627 B7R0.8 C#CCOC(C)(C)C 34a_100000210247_100000210625 [1,1,0,0,0,0|1,0,1]=4 628 B7R0.8 C#CCOC(C)(C)C 34a_100015890283_100000184674 [1,1,0,0,0,0|1,0,1]=4 629 B7R0.8 C#CCOC(C)(C)C 7a_100015890283_100000038162 [1,1,0,0,0,0|1,0,1]=4 630 B7R0.8 C#CCSC(C)(C)C 62a_100000038162_100000211941 [1,1,0,0,0,0|1,0,1]=4 631 B7R0.8 C=CCNC(C)(C)C 2230a_100000715429_100000210623 [1,1,0,0,0,0|1,0,1]=4 632 B7R0.8 C=CCOC(C)(C)C 34a_100015890283_100015514636 [1,1,0,0,0,0|1,0,1]=4 633 B7R0.8 C=CCOC(C)(C)C 34a_200000210373_100000210625 [1,1,0,0,0,0|1,0,1]=4 634 B7R0.8 C=CCOC(C)(C)C 7a_100015890283_100015514636 [1,1,0,0,0,0|1,0,1]=4 635 B7R0.8 C=CCSC(C)(C)C 62a_100000210623_100000211941 [1,1,0,0,0,0|1,0,1]=4 636 B7R0.8 C=CCSC(C)(C)C 62a_100000211941_100000210623 [1,1,0,0,0,0|1,0,1]=4 637 B7R0.8 CC(C)(C)CCN[13CH3] 2230a_100000738805_200025704644 [1,1,0,0,0,0|0,0,2]=4 638 B7R0.8 CC(C)(C)CCO[13CH3] 7a_100000765024_200025704644 [1,1,0,0,0,0|1,0,1]=4 639 B7R0.8 CC(C)(C)CCS[13CH3] 62a_100000755188_200025704644 [1,1,0,0,0,0|1,0,1]=4 640 B7R0.8 CC(C)(C)CCS[13CH3] 62a_200025704644_100000755188 [1,1,0,0,0,0|1,0,1]=4 641 B7R0.8 CC(C)(C)CSCF 62a_100011219605_100015361967 [1,1,0,0,0,0|1,0,1]=4 642 B7R0.8 CC(C)(C)CSCF 62a_100015361967_100011219605 [1,1,0,0,0,0|1,0,1]=4 643 B7R0.8 CC(C)(C)NCC#N 2230a_100000715429_100011215382 [1,1,0,0,0,0|2,0,0]=4 644 B7R0.8 CC(C)(C)NCC=O 2230a_100000715429_200015260668 [1,1,0,0,0,0|2,0,0]=4 645 B7R0.8 CC(C)(C)NCCF 2230a_100000715429_100011217306 [1,1,0,0,0,0|2,0,0]=4 646 B7R0.8 CC(C)(C)NCCF 34a_100000724931_100000210625 [1,1,0,0,0,0|2,0,0]=4 647 B7R0.8 CC(C)(C)NCCO 2230a_100000715429_100000211926 [1,1,0,0,0,0|2,0,0]=4 648 B7R0.8 CC(C)(C)NCCO 34a_100016990907_100000210625 [1,1,0,0,0,0|2,0,0]=4 649 B7R0.8 CC(C)(C)OCC#N 7a_100015890283_100011215382 [1,1,0,0,0,0|2,0,0]=4 650 B7R0.8 CC(C)(C)OCC=O 34a_100015890283_200009817547 [1,1,0,0,0,0|2,0,0]=4 651 B7R0.8 CC(C)(C)OCC=O 7a_100015890283_200015260668 [1,1,0,0,0,0|2,0,0]=4 652 B7R0.8 CC(C)(C)OCCBr 34a_100000211926_100000210625 [1,1,0,0,0,0|2,0,0]=4 653 B7R0.8 CC(C)(C)OCCF 34a_100015890283_100011217306 [1,1,0,0,0,0|2,0,0]=4 654 B7R0.8 CC(C)(C)OCCF 7a_100015890283_100011217306 [1,1,0,0,0,0|2,0,0]=4 655 B7R0.8 CC(C)(C)OCCN 34a_100000210304_100000210625 [1,1,0,0,0,0|2,0,0]=4 656 B7R0.8 CC(C)(C)OCCO 34a_100015890283_100000211926 [1,1,0,0,0,0|2,0,0]=4 657 B7R0.8 CC(C)(C)OCCO 7a_100015890283_100000211926 [1,1,0,0,0,0|2,0,0]=4 658 B7R0.8 CC(C)(C)SCC#N 62a_100000211941_100011215382 [1,1,0,0,0,0|2,0,0]=4 659 B7R0.8 CC(C)(C)SCC#N 62a_100011215382_100000211941 [1,1,0,0,0,0|2,0,0]=4 660 B7R0.8 CC(C)(C)SCC=O 62a_100000211941_200015260668 [1,1,0,0,0,0|2,0,0]=4 661 B7R0.8 CC(C)(C)SCC=O 62a_200015260668_100000211941 [1,1,0,0,0,0|2,0,0]=4 662 B7R0.8 CC(C)(C)SCCF 62a_100000211941_100011217306 [1,1,0,0,0,0|2,0,0]=4 663 B7R0.8 CC(C)(C)SCCF 62a_100011217306_100000211941 [1,1,0,0,0,0|2,0,0]=4 664 B7R0.8 CC(C)(C)SCCO 62a_100000211926_100000211941 [1,1,0,0,0,0|2,0,0]=4 665 B7R0.8 CC(C)(C)SCCO 62a_100000211941_100000211926 [1,1,0,0,0,0|2,0,0]=4 666 B7R0.8 CC(C)(O)CCS[13CH3] 62a_100000702414_200025704644 [1,1,0,0,0,0|1,0,1]=4 667 B7R0.8 CC(C)(O)CCS[13CH3] 62a_200025704644_100000702414 [1,1,0,0,0,0|1,0,1]=4 668 B7R0.8 CC(C)(O)CSCF 62a_100000764493_100015361967 [1,1,0,0,0,0|1,0,1]=4 669 B7R0.8 CC(C)(O)CSCF 62a_100015361967_100000764493 [1,1,0,0,0,0|1,0,1]=4 670 B7R0.8 CCCNC(C)(C)C 2230a_100000715429_100000210303 [1,1,0,0,0,0|1,0,1]=4 671 B7R0.8 CCCOC(C)(C)C 34a_100000210258_100000210625 [1,1,0,0,0,0|1,0,1]=4 672 B7R0.8 CCCOC(C)(C)C 34a_100015890283_100000210303 [1,1,0,0,0,0|1,0,1]=4 673 B7R0.8 CCCOC(C)(C)C 7a_100015890283_100000210303 [1,1,0,0,0,0|1,0,1]=4 674 B7R0.8 CCCSC(C)(C)C 62a_100000210303_100000211941 [1,1,0,0,0,0|1,0,1]=4 675 B7R0.8 CCCSC(C)(C)C 62a_100000211941_100000210303 [1,1,0,0,0,0|1,0,1]=4 676 B7R0.8 CCNCC(C)(C)C 2230a_100000743828_100000210202 [1,1,0,0,0,0|0,0,2]=4 677 B7R0.8 CCNCC(C)(C)C 270004a_100015525214_100011204126 [1,1,0,0,0,0|0,0,2]=4 678 B7R0.8 CCNCC(C)(C)O 2230a_100000751335_100000210202 [1,1,0,0,0,0|0,0,2]=4 679 B7R0.8 CCOCC(C)(C)C 34a_100121572206_100011219605 [1,1,0,0,0,0|1,0,1]=4 680 B7R0.8 CCOCC(C)(C)O 34a_100121572206_100000764493 [1,1,0,0,0,0|1,0,1]=4 681 B7R0.8 CCSCC(C)(C)C 62a_100000210202_100011219605 [1,1,0,0,0,0|1,0,1]=4 682 B7R0.8 CCSCC(C)(C)C 62a_100011219605_100000210202 [1,1,0,0,0,0|1,0,1]=4 683 B7R0.8 CCSCC(C)(C)O 62a_100000210202_100000764493 [1,1,0,0,0,0|1,0,1]=4 684 B7R0.8 CCSCC(C)(C)O 62a_100000764493_100000210202 [1,1,0,0,0,0|1,0,1]=4 685 B7R0.8 CNCCC(C)(C)C 2230a_100000738805_200000210301 [1,1,0,0,0,0|0,0,2]=4 686 B7R0.8 CNCCC(C)(C)C 2230a_106832991635_100000755188 [1,1,0,0,0,0|0,0,2]=4 687 B7R0.8 CNCCC(C)(C)C 34a_100102657272_100000755188 [1,1,0,0,0,0|0,0,2]=4 688 B7R0.8 CNCCC(C)(C)C 7a_106832991635_100000755188 [1,1,0,0,0,0|0,0,2]=4 689 B7R0.8 CNCCC(C)(C)O 2230a_106832991635_100000702414 [1,1,0,0,0,0|0,0,2]=4 690 B7R0.8 CNCCC(C)(C)O 34a_100102657272_100000702414 [1,1,0,0,0,0|0,0,2]=4 691 B7R0.8 CNCCC(C)(C)O 7a_106832991635_100000702414 [1,1,0,0,0,0|0,0,2]=4 692 B7R0.8 COCCC(C)(C)C 34a_100138415774_100000755188 [1,1,0,0,0,0|1,0,1]=4 693 B7R0.8 COCCC(C)(C)C 7a_100000765024_200000210301 [1,1,0,0,0,0|1,0,1]=4 694 B7R0.8 COCCC(C)(C)O 34a_100138415774_100000702414 [1,1,0,0,0,0|1,0,1]=4 695 B7R0.8 COCNC(C)(C)C 2230a_100000715429_100000766300 [1,1,0,0,0,0|1,0,1]=4 696 B7R0.8 COCSC(C)(C)C 62a_100000211941_100000766300 [1,1,0,0,0,0|1,0,1]=4 697 B7R0.8 COCSC(C)(C)C 62a_100000766300_100000211941 [1,1,0,0,0,0|1,0,1]=4 698 B7R0.8 CSCCC(C)(C)C 62a_100000755188_200000210301 [1,1,0,0,0,0|1,0,1]=4 699 B7R0.8 CSCCC(C)(C)C 62a_200000210301_100000755188 [1,1,0,0,0,0|1,0,1]=4 700 B7R0.8 CSCCC(C)(C)O 62a_100000702414_200000210301 [1,1,0,0,0,0|1,0,1]=4 701 B7R0.8 CSCCC(C)(C)O 62a_200000210301_100000702414 [1,1,0,0,0,0|1,0,1]=4 702 B7R0.8 CSCNC(C)(C)C 2230a_100000715429_100011218213 [1,1,0,0,0,0|1,0,1]=4 703 B7R0.8 CSCOC(C)(C)C 34a_100015890283_100011218213 [1,1,0,0,0,0|1,0,1]=4 704 B7R0.8 CSCSC(C)(C)C 62a_100000211941_100011218213 [1,1,0,0,0,0|1,0,1]=4 705 B7R0.8 CSCSC(C)(C)C 62a_100011218213_100000211941 [1,1,0,0,0,0|1,0,1]=4 706 B7R0.9 CC(=O)CC(C)(C)C 1458a_100000211214_200000210301 [1,1,0,0,0,0|1,0,1]=4 707 B7R0.9 CC(=O)CC(C)(C)O 1458a_100000693243_200000210301 [1,1,0,0,0,0|1,0,1]=4 708 B7R0.9 CC(C)(C)CC(=O)[13CH3] 1458a_100000211214_200025704644 [1,1,0,0,0,0|1,0,1]=4 709 B7R0.9 CC(C)(O)CC(=O)[13CH3] 1458a_100000693243_200025704644 [1,1,0,0,0,0|1,0,1]=4 710 B7R0.9 CN(C)CC(C)(C)C 2230a_100000742839_200000210301 [1,1,0,0,0,0|0,0,2]=4 711 B7R0.9 CN(C)CC(C)(C)C 269982a_100000742839_200000210301 [1,1,0,0,0,0|0,0,2]=4 712 B7R0.9 CN(C)CC(C)(C)C 270004a_100102631434_100011204126 [1,1,0,0,0,0|0,0,2]=4 713 B7R0.9 CN(C)CC(C)(C)O 2230a_100000755907_200000210301 [1,1,0,0,0,0|0,0,2]=4 714 B7R0.9 CN(C)CC(C)(C)O 269982a_100000755907_200000210301 [1,1,0,0,0,0|0,0,2]=4 715 B7R0.9 CN([13CH3])CC(C)(C)C 2230a_100000742839_200025704644 [1,1,0,0,0,0|0,0,2]=4 716 B7R0.9 CN([13CH3])CC(C)(C)C 269982a_100000742839_200025704644 [1,1,0,0,0,0|0,0,2]=4 717 B7R0.9 CN([13CH3])CC(C)(C)O 2230a_100000755907_200025704644 [1,1,0,0,0,0|0,0,2]=4 718 B7R0.9 CN([13CH3])CC(C)(C)O 269982a_100000755907_200025704644 [1,1,0,0,0,0|0,0,2]=4 719 B7R0.14 CNC(C)C(C)(C)O 269862a_106832991636_100000747739 [1,1,0,0,0,0|0,0,2]=4 720 B7R0.14 CN[C@@H](C)C(C)(C)O 2230a_100025708725_200000210301 [1,1,0,0,0,0|0,0,2]=4 721 B7R0.14 CN[C@H](C)C(C)(C)C 2230a_100025703359_200000210301 [1,1,0,0,0,0|0,0,2]=4 722 B7R0.14 C[C@@H](N[13CH3])C(C)(C)C 2230a_100025703359_200025704644 [1,1,0,0,0,0|0,0,2]=4 723 B7R0.14 C[C@H](N[13CH3])C(C)(C)O 2230a_100025708725_200025704644 [1,1,0,0,0,0|0,0,2]=4 724 B7R0.13 CC(=O)C(C)(C)CF 1458a_100000138116_200000210301 [1,1,0,0,0,0|2,0,0]=4 725 B7R0.13 CC(=O)C(C)(C)CO 1458a_100000749806_200000210301 [1,1,0,0,0,0|2,0,0]=4 726 B7R0.13 CC(=O)C(C)(C)O[13CH3] 34a_100000747739_200025704644 [1,1,0,0,0,0|0,0,2]=4 727 B7R0.13 CC(=O)C(C)(C)O[13CH3] 7a_100000747739_200025704644 [1,1,0,0,0,0|0,0,2]=4 728 B7R0.13 CC(C)(CF)C(=O)[13CH3] 1458a_100000138116_200025704644 [1,1,0,0,0,0|2,0,0]=4 729 B7R0.13 CC(C)(CO)C(=O)[13CH3] 1458a_100000749806_200025704644 [1,1,0,0,0,0|2,0,0]=4 730 B7R0.13 CC(C)(O[13CH3])C(=O)N 34a_100011626353_200025704644 [1,1,0,0,0,0|0,0,2]=4 731 B7R0.13 CC(C)(O[13CH3])C(=O)N 7a_100011626353_200025704644 [1,1,0,0,0,0|0,0,2]=4 732 B7R0.13 CC(C)C(C)(C)N[13CH3] 2230a_200160471154_200025704644 [1,1,0,0,0,0|1,0,1]=4 733 B7R0.13 CC(C)C(C)(C)O[13CH3] 7a_100011215261_200025704644 [1,1,0,0,0,0|0,0,1]=3 734 B7R0.13 CCC(C)(C)C(=O)C 1458a_100000749717_200000210301 [1,1,0,0,0,0|1,0,1]=4 735 B7R0.13 CCC(C)(C)C(=O)[13CH3] 1458a_100000749717_200025704644 [1,1,0,0,0,0|1,0,1]=4 736 B7R0.13 CCC(C)(C)N(C)C 2230a_200000755171_200000210301 [1,1,0,0,0,0|1,0,1]=4 737 B7R0.13 CCC(C)(C)N(C)C 269982a_100102631434_100000032637 [1,1,0,0,0,0|1,0,1]=4 738 B7R0.13 CCC(C)(C)N(C)C 269982a_200000755171_200000210301 [1,1,0,0,0,0|1,0,1]=4 739 B7R0.13 CCC(C)(C)N(C)[13CH3] 2230a_200000755171_200025704644 [1,1,0,0,0,0|1,0,1]=4 740 B7R0.13 CCC(C)(C)N(C)[13CH3] 269982a_200000755171_200025704644 [1,1,0,0,0,0|1,0,1]=4 741 B7R0.13 CN(C)C(C)(C)CO 269982a_100015204102_200000210301 [1,1,0,0,0,0|2,0,0]=4 742 B7R0.13 CN([13CH3])C(C)(C)CO 269982a_100015204102_200025704644 [1,1,0,0,0,0|2,0,0]=4 743 B7R0.13 CNC(C)(C)C(C)C 2230a_200160471154_200000210301 [1,1,0,0,0,0|1,0,1]=4 744 B7R0.13 COC(C)(C)C(=O)C 1458a_100000753492_200000210301 [1,1,0,0,0,0|0,0,2]=4 745 B7R0.13 COC(C)(C)C(=O)C 34a_100000747739_200000210301 [1,1,0,0,0,0|0,0,2]=4 746 B7R0.13 COC(C)(C)C(=O)C 7a_100000747739_200000210301 [1,1,0,0,0,0|0,0,2]=4 747 B7R0.13 COC(C)(C)C(=O)N 34a_100011626353_200000210301 [1,1,0,0,0,0|0,0,2]=4 748 B7R0.13 COC(C)(C)C(=O)N 34a_100138415774_100000702505 [1,1,0,0,0,0|0,0,2]=4 749 B7R0.13 COC(C)(C)C(=O)N 7a_100011626353_200000210301 [1,1,0,0,0,0|0,0,2]=4 750 B7R0.13 COC(C)(C)C(=O)[13CH3] 1458a_100000753492_200025704644 [1,1,0,0,0,0|0,0,2]=4 751 B7R0.13 COC(C)(C)C(C)C 7a_100011215261_200000210301 [1,1,0,0,0,0|0,0,1]=3 752 B7R0.18 C#CC(C)(CC)OC 34a_100000686493_200000210301 [1,1,0,0,0,0|0,0,2]=4 753 B7R0.18 C#CC(C)(CC)OC 7a_100000686493_200000210301 [1,1,0,0,0,0|0,0,2]=4 754 B7R0.18 C#CC(C)(CC)O[13CH3] 34a_100000686493_200025704644 [1,1,0,0,0,0|0,0,2]=4 755 B7R0.18 C#CC(C)(CC)O[13CH3] 7a_100000686493_200025704644 [1,1,0,0,0,0|0,0,2]=4 756 B7R0.18 CCC(C)(C#N)OC 7a_100000760259_200000210301 [1,1,0,0,0,0|0,0,2]=4 757 B7R0.18 CCC(C)(C#N)O[13CH3] 7a_100000760259_200025704644 [1,1,0,0,0,0|0,0,2]=4 758 B7R0.18 CCC(C)(CC)NC 7a_106832991635_100009817345 [1,1,0,0,0,0|1,0,1]=4 759 B7R0.18 CCC(C)(CC)OC 7a_100000755174_200000210301 [1,1,0,0,0,0|0,0,1]=3 760 B7R0.18 CCC(C)(CC)O[13CH3] 7a_100000755174_200025704644 [1,1,0,0,0,0|0,0,1]=3 761 B7R0.18 CCC(C)(CC)SC 62a_100009817345_200000210301 [1,1,0,0,0,0|0,1,1]=4 762 B7R0.18 CCC(C)(CC)SC 62a_200000210301_100009817345 [1,1,0,0,0,0|0,1,1]=4 763 B7R0.18 CCC(C)(CC)S[13CH3] 62a_100009817345_200025704644 [1,1,0,0,0,0|0,1,1]=4 764 B7R0.18 CCC(C)(CC)S[13CH3] 62a_200025704644_100009817345 [1,1,0,0,0,0|0,1,1]=4 765 B9R0.60 COC(=O)C(C)(C)CO[13CH3] 34a_100000709632_200025704644 [0,2,0,0,0,0|1,0,1]=4 766 B9R0.60 COC(=O)C(C)(C)CO[13CH3] 7a_100000709632_200025704644 [0,2,0,0,0,0|1,0,1]=4 767 B9R0.60 COC(=O)C(C)(C)CSC 62a_100000684552_200000210301 [0,2,0,0,0,0|1,0,1]=4 768 B9R0.60 COC(=O)C(C)(C)CSC 62a_200000210301_100000684552 [0,2,0,0,0,0|1,0,1]=4 769 B9R0.60 COC(=O)C(C)(C)CS[13CH3] 62a_100000684552_200025704644 [0,2,0,0,0,0|1,0,1]=4 770 B9R0.60 COC(=O)C(C)(C)CS[13CH3] 62a_200025704644_100000684552 [0,2,0,0,0,0|1,0,1]=4 771 B9R0.60 COCC(C)(C)C(=O)OC 34a_100000709632_200000210301 [0,2,0,0,0,0|1,0,1]=4 772 B9R0.60 COCC(C)(C)C(=O)OC 7a_100000709632_200000210301 [0,2,0,0,0,0|1,0,1]=4 773 B9R0.19 C#CCC(=O)C(C)(C)OC 1458a_100000753492_100000184674 [0,2,0,0,0,0|1,0,1]=4 774 B9R0.19 C=CCC(=O)C(C)(C)OC 1458a_100000753492_100000210623 [0,2,0,0,0,0|1,0,1]=4 775 B9R0.19 CCCC(=O)C(C)(C)OC 1458a_100000753492_100000210303 [0,2,0,0,0,0|1,0,1]=4 776 B9R0.19 CCCC(C)C(C)(C)OC 7a_200011218223_200000210301 [0,2,0,0,0,0|1,0,1]=4 777 B9R0.19 CCCC(C)C(C)(C)O[13CH3] 7a_200011218223_200025704644 [0,2,0,0,0,0|1,0,1]=4 778 B9R0.19 COC(C)(C)C(=O)CC#N 1458a_100000753492_100011214920 [0,2,0,0,0,0|2,0,0]=4 779 B9R0.19 COC(C)(C)C(=O)CCF 1458a_100000753492_100011217306 [0,2,0,0,0,0|2,0,0]=4 780 B9R0.19 COC(C)(C)C(=O)CCO 1458a_100000753492_100000211926 [0,2,0,0,0,0|2,0,0]=4 781 B9R0.69 CCC(C)C(C)(CC)OC 7a_200011218298_200000210301 [0,2,0,0,0,0|1,0,1]=4 782 B9R0.69 CCC(C)C(C)(CC)O[13CH3] 7a_200011218298_200025704644 [0,2,0,0,0,0|1,0,1]=4 783 B9R0.20 C#CCNCC(C)(C)OC 2230a_100000763424_100000038162 [0,2,0,0,0,0|0,0,2]=4 784 B9R0.20 C#CCNCC(C)(C)OC 34a_100000212058_100000701081 [0,2,0,0,0,0|0,0,2]=4 785 B9R0.20 C#CCOCC(C)(C)OC 34a_100000210247_100000701081 [0,2,0,0,0,0|1,0,1]=4 786 B9R0.20 C#CCSCC(C)(C)OC 62a_100000038162_100000701081 [0,2,0,0,0,0|1,0,1]=4 787 B9R0.20 C=CCC#CC(C)(C)OC 34a_200000070682_200000210301 [0,2,0,0,0,0|1,0,1]=4 788 B9R0.20 C=CCC#CC(C)(C)OC 7a_200000070682_200000210301 [0,2,0,0,0,0|1,0,1]=4 789 B9R0.20 C=CCC#CC(C)(C)O[13CH3] 34a_200000070682_200025704644 [0,2,0,0,0,0|1,0,1]=4 790 B9R0.20 C=CCC#CC(C)(C)O[13CH3] 7a_200000070682_200025704644 [0,2,0,0,0,0|1,0,1]=4 791 B9R0.20 C=CCNCC(C)(C)OC 2230a_100000763424_100000210623 [0,2,0,0,0,0|0,0,2]=4 792 B9R0.20 C=CCOCC(C)(C)OC 34a_200000210373_100000701081 [0,2,0,0,0,0|1,0,1]=4 793 B9R0.20 C=CCSCC(C)(C)OC 62a_100000210623_100000701081 [0,2,0,0,0,0|1,0,1]=4 794 B9R0.20 C=CCSCC(C)(C)OC 62a_100000701081_100000210623 [0,2,0,0,0,0|1,0,1]=4 795 B9R0.20 CCCNCC(C)(C)OC 2230a_100000763424_100000210303 [0,2,0,0,0,0|0,0,2]=4 796 B9R0.20 CCCOCC(C)(C)OC 34a_100000210258_100000701081 [0,2,0,0,0,0|1,0,1]=4 797 B9R0.20 CCCSCC(C)(C)OC 62a_100000210303_100000701081 [0,2,0,0,0,0|1,0,1]=4 798 B9R0.20 CCCSCC(C)(C)OC 62a_100000701081_100000210303 [0,2,0,0,0,0|1,0,1]=4 799 B9R0.20 CCOCCC(C)(C)OC 7a_100000699976_100000210202 [0,2,0,0,0,0|1,0,1]=4 800 B9R0.20 COC(C)(C)CCOCF 7a_100000699976_100015361967 [0,2,0,0,0,0|1,0,1]=4 801 B9R0.20 COC(C)(C)CNCC#N 2230a_100000763424_100011215382 [0,2,0,0,0,0|0,0,2]=4 802 B9R0.20 COC(C)(C)CNCC=O 2230a_100000763424_200015260668 [0,2,0,0,0,0|0,0,2]=4 803 B9R0.20 COC(C)(C)CNCCF 2230a_100000763424_100011217306 [0,2,0,0,0,0|0,0,2]=4 804 B9R0.20 COC(C)(C)CNCCF 34a_100000724931_100000701081 [0,2,0,0,0,0|0,0,2]=4 805 B9R0.20 COC(C)(C)CNCCO 2230a_100000763424_100000211926 [0,2,0,0,0,0|0,0,2]=4 806 B9R0.20 COC(C)(C)CNCCO 34a_100016990907_100000701081 [0,2,0,0,0,0|0,0,2]=4 807 B9R0.20 COC(C)(C)CNCSC 2230a_100000763424_100011218213 [0,2,0,0,0,0|0,0,2]=4 808 B9R0.20 COC(C)(C)COCCBr 34a_100000211926_100000701081 [0,2,0,0,0,0|1,0,1]=4 809 B9R0.20 COC(C)(C)COCCN 34a_100000210304_100000701081 [0,2,0,0,0,0|1,0,1]=4 810 B9R0.20 COC(C)(C)CSCC#N 62a_100000701081_100011215382 [0,2,0,0,0,0|1,0,1]=4 811 B9R0.20 COC(C)(C)CSCC#N 62a_100011215382_100000701081 [0,2,0,0,0,0|1,0,1]=4 812 B9R0.20 COC(C)(C)CSCC=O 62a_100000701081_200015260668 [0,2,0,0,0,0|1,0,1]=4 813 B9R0.20 COC(C)(C)CSCC=O 62a_200015260668_100000701081 [0,2,0,0,0,0|1,0,1]=4 814 B9R0.20 COC(C)(C)CSCCF 62a_100000701081_100011217306 [0,2,0,0,0,0|1,0,1]=4 815 B9R0.20 COC(C)(C)CSCCF 62a_100011217306_100000701081 [0,2,0,0,0,0|1,0,1]=4 816 B9R0.20 COC(C)(C)CSCCO 62a_100000211926_100000701081 [0,2,0,0,0,0|1,0,1]=4 817 B9R0.20 COC(C)(C)CSCCO 62a_100000701081_100000211926 [0,2,0,0,0,0|1,0,1]=4 818 B9R0.20 COC(C)(C)CSCSC 62a_100000701081_100011218213 [0,2,0,0,0,0|1,0,1]=4 819 B9R0.20 COC(C)(C)CSCSC 62a_100011218213_100000701081 [0,2,0,0,0,0|1,0,1]=4 820 B9R0.20 COCNCC(C)(C)OC 2230a_100000763424_100000766300 [0,2,0,0,0,0|0,0,2]=4 821 B9R0.20 COCSCC(C)(C)OC 62a_100000701081_100000766300 [0,2,0,0,0,0|1,0,1]=4 822 B9R0.20 COCSCC(C)(C)OC 62a_100000766300_100000701081 [0,2,0,0,0,0|1,0,1]=4 823 B9R0.22 CCN(C)CC(C)(C)OC 269982a_100000225621_100000701081 [0,2,0,0,0,0|0,0,2]=4 824 B9R0.22 COC(=O)CC(C)(C)OC 7a_100015205050_200000210301 [0,2,0,0,0,0|1,0,1]=4 825 B9R0.22 COC(=O)CC(C)(C)O[13CH3] 7a_100015205050_200025704644 [0,2,0,0,0,0|1,0,1]=4 826 B9R0.22 COC(C)(C)CC(C)O[13CH3] 7a_200011252547_200025704644 [0,2,0,0,0,0|1,0,1]=4 827 B9R0.22 COC(C)CC(C)(C)OC 7a_200011252547_200000210301 [0,2,0,0,0,0|1,0,1]=4 828 B9R0.64 CC(C)CCC(C)(C)O[13CH3] 7a_200011218267_200025704644 [0,2,0,0,0,0|1,0,1]=4 829 B9R0.64 COC(C)(C)CCC(C)C 34a_100138415774_200000037585 [0,2,0,0,0,0|1,0,1]=4 830 B9R0.64 COC(C)(C)CCC(C)C 7a_200011218267_200000210301 [0,2,0,0,0,0|1,0,1]=4 831 B9R0.64 COC(C)(C)CNC(=O)C 11a_100000763424_100015343762 [0,2,0,0,0,0|0,0,2]=4 832 B9R0.64 COC(C)(C)CNC(=O)C 1626a_100000763424_100015343762 [0,2,0,0,0,0|0,0,2]=4 833 B9R0.64 COC(C)(C)CNC(=O)C 240690a_100000763424_100015343762 [0,2,0,0,0,0|0,0,2]=4 834 B9R0.64 COC(C)(C)CNC(=O)C 527a_100000763424_100103153847 [0,2,0,0,0,0|0,0,2]=4 835 B9R0.64 COC(C)(C)CNC(C)C 2230a_100000763424_100000210206 [0,2,0,0,0,0|0,0,2]=4 836 B9R0.64 COC(C)(C)CNC(C)C 34a_100138425928_100000701081 [0,2,0,0,0,0|0,0,2]=4 837 B9R0.64 COC(C)(C)COC(C)C 34a_100000212225_100000701081 [0,2,0,0,0,0|1,0,1]=4 838 B9R0.64 COC(C)(C)CSC(C)C 62a_100000210206_100000701081 [0,2,0,0,0,0|1,0,1]=4 839 B9R0.64 COC(C)(C)CSC(C)C 62a_100000701081_100000210206 [0,2,0,0,0,0|1,0,1]=4 840 B9R0.66 C#CCNC(C)(C)COC 2230a_100000752728_100000038162 [0,2,0,0,0,0|1,0,1]=4 841 B9R0.66 C#CCOC(C)(C)CC=C 7a_100011995686_100000038162 [0,2,0,0,0,0|1,0,1]=4 842 B9R0.66 C#CCOC(C)(C)CCBr 7a_100000702414_100000038162 [0,2,0,0,0,0|2,0,0]=4 843 B9R0.66 C#CCOC(C)(C)CCC 7a_100000748436_100000038162 [0,2,0,0,0,0|1,0,1]=4 844 B9R0.66 C=CCC(C)(C)OCC#N 7a_100011995686_100011215382 [0,2,0,0,0,0|1,0,1]=4 845 B9R0.66 C=CCC(C)(C)OCC=O 7a_100011995686_200015260668 [0,2,0,0,0,0|1,0,1]=4 846 B9R0.66 C=CCC(C)(C)OCCC 7a_100011995686_100000210303 [0,2,0,0,0,0|1,0,1]=4 847 B9R0.66 C=CCC(C)(C)OCCF 7a_100011995686_100011217306 [0,2,0,0,0,0|1,0,1]=4 848 B9R0.66 C=CCC(C)(C)OCCO 7a_100011995686_100000211926 [0,2,0,0,0,0|1,0,1]=4 849 B9R0.66 C=CCNC(C)(C)COC 2230a_100000752728_100000210623 [0,2,0,0,0,0|1,0,1]=4 850 B9R0.66 C=CCOC(C)(C)CC=C 7a_100011995686_100015514636 [0,2,0,0,0,0|1,0,1]=4 851 B9R0.66 C=CCOC(C)(C)CCBr 7a_100000702414_100015514636 [0,2,0,0,0,0|2,0,0]=4 852 B9R0.66 C=CCOC(C)(C)CCC 7a_100000748436_100015514636 [0,2,0,0,0,0|1,0,1]=4 853 B9R0.66 CC(C)(CCBr)OCC#N 7a_100000702414_100011215382 [0,2,0,0,0,0|2,0,0]=4 854 B9R0.66 CC(C)(CCBr)OCC=O 7a_100000702414_200015260668 [0,2,0,0,0,0|2,0,0]=4 855 B9R0.66 CC(C)(CCBr)OCCF 7a_100000702414_100011217306 [0,2,0,0,0,0|2,0,0]=4 856 B9R0.66 CC(C)(CCBr)OCCO 7a_100000702414_100000211926 [0,2,0,0,0,0|2,0,0]=4 857 B9R0.66 CC(C)(CCCBr)OCF 7a_100009888830_100015361967 [0,2,0,0,0,0|1,0,1]=4 858 B9R0.66 CCCC(C)(C)COCC 7a_100011995695_100000210202 [0,2,0,0,0,0|1,0,1]=4 859 B9R0.66 CCCC(C)(C)COCF 7a_100011995695_100015361967 [0,2,0,0,0,0|1,0,1]=4 860 B9R0.66 CCCC(C)(C)OCC#N 7a_100000748436_100011215382 [0,2,0,0,0,0|1,0,1]=4 861 B9R0.66 CCCC(C)(C)OCC=O 7a_100000748436_200015260668 [0,2,0,0,0,0|1,0,1]=4 862 B9R0.66 CCCC(C)(C)OCCF 7a_100000748436_100011217306 [0,2,0,0,0,0|1,0,1]=4 863 B9R0.66 CCCC(C)(C)OCCO 7a_100000748436_100000211926 [0,2,0,0,0,0|1,0,1]=4 864 B9R0.66 CCCCC(C)(C)COC 7a_200011995781_200000210301 [0,2,0,0,0,0|1,0,1]=4 865 B9R0.66 CCCCC(C)(C)CO[13CH3] 7a_200011995781_200025704644 [0,2,0,0,0,0|1,0,1]=4 866 B9R0.66 CCCCC(C)(C)OCC 7a_100011219641_100000210202 [0,2,0,0,0,0|1,0,1]=4 867 B9R0.66 CCCCC(C)(C)OCF 7a_100011219641_100015361967 [0,2,0,0,0,0|1,0,1]=4 868 B9R0.66 CCCNC(C)(C)COC 2230a_100000752728_100000210303 [0,2,0,0,0,0|1,0,1]=4 869 B9R0.66 CCCOC(C)(C)CCBr 7a_100000702414_100000210303 [0,2,0,0,0,0|2,0,0]=4 870 B9R0.66 CCCOC(C)(C)CCC 7a_100000748436_100000210303 [0,2,0,0,0,0|1,0,1]=4 871 B9R0.66 CCNCC(C)(C)COC 2230a_100000734190_100000210202 [0,2,0,0,0,0|0,0,2]=4 872 B9R0.66 CCOC(C)(C)CCCBr 7a_100009888830_100000210202 [0,2,0,0,0,0|1,0,1]=4 873 B9R0.66 COCC(C)(C)NCC#N 2230a_100000752728_100011215382 [0,2,0,0,0,0|2,0,0]=4 874 B9R0.66 COCC(C)(C)NCC=O 2230a_100000752728_200015260668 [0,2,0,0,0,0|2,0,0]=4 875 B9R0.66 COCC(C)(C)NCCF 2230a_100000752728_100011217306 [0,2,0,0,0,0|2,0,0]=4 876 B9R0.66 COCC(C)(C)NCCO 2230a_100000752728_100000211926 [0,2,0,0,0,0|2,0,0]=4 877 B9R0.66 COCC(C)(C)NCSC 2230a_100000752728_100011218213 [0,2,0,0,0,0|1,0,1]=4 878 B9R0.66 COCNC(C)(C)COC 2230a_100000752728_100000766300 [0,2,0,0,0,0|1,0,1]=4 879 B9R0.66 COCNC(C)(C)CSC 2230a_100000759623_100000766300 [0,2,0,0,0,0|1,0,1]=4 880 B9R0.67 CCCCC(C)(CC)OC 7a_200011218725_200000210301 [0,2,0,0,0,0|1,0,1]=4 881 B9R0.67 CCCCC(C)(CC)O[13CH3] 7a_200011218725_200025704644 [0,2,0,0,0,0|1,0,1]=4 882 B9R0.67 CCNCC(C)(OC)OC 2230a_100000732740_100000210202 [0,2,0,0,0,0|0,0,2]=4 883 B9R0.67 CCNCC(C)(OC)OC 2230a_100015525214_100000064154 [0,2,0,0,0,0|0,0,2]=4 884 B9R0.67 CCOCC(C)(OC)OC 34a_100121572206_100000766008 [0,2,0,0,0,0|1,0,1]=4 885 B9R0.67 CCSCC(C)(OC)OC 62a_100000210202_100000766008 [0,2,0,0,0,0|1,0,1]=4 886 B9R0.67 CCSCC(C)(OC)OC 62a_100000766008_100000210202 [0,2,0,0,0,0|1,0,1]=4 887 B9R0.67 COC(C)(CSCF)OC 62a_100000766008_100015361967 [0,2,0,0,0,0|1,0,1]=4 888 B9R0.67 COC(C)(CSCF)OC 62a_100015361967_100000766008 [0,2,0,0,0,0|1,0,1]=4 889 B9R0.58 C=CCC(C)(C)OC(C)C 7a_100011995686_100000210206 [0,2,0,0,0,0|1,0,1]=4 890 B9R0.58 CC(=O)CC(C)(C)OCF 7a_100000210262_100015361967 [0,2,0,0,0,0|1,0,1]=4 891 B9R0.58 CC(C)OC(C)(C)CCBr 7a_100000702414_100000210206 [0,2,0,0,0,0|2,0,0]=4 892 B9R0.58 CCCC(C)(C)OC(C)C 7a_100000748436_100000210206 [0,2,0,0,0,0|1,0,1]=4 893 B9R0.58 CCOC(C)(C)CC(=O)C 7a_100000210262_100000210202 [0,2,0,0,0,0|1,0,1]=4 894 B9R0.59 C=CCC(C)(CC)OCC 7a_200011216962_100000210202 [0,2,0,0,0,0|1,0,1]=4 895 B9R0.59 C=CCC(C)(CC)OCF 7a_200011216962_100015361967 [0,2,0,0,0,0|1,0,1]=4 896 B9R0.59 C=CCC(C)(CC=C)OC 7a_100000036548_200000210301 [0,2,0,0,0,0|1,0,1]=4 897 B9R0.59 C=CCC(C)(CC=C)O[13CH3] 7a_100000036548_200025704644 [0,2,0,0,0,0|1,0,1]=4 898 B9R0.59 CCCC(C)(CC)OCC 7a_200011215934_100000210202 [0,2,0,0,0,0|1,0,1]=4 899 B9R0.59 CCCC(C)(CC)OCF 7a_200011215934_100015361967 [0,2,0,0,0,0|1,0,1]=4 900 B9R0.59 CCCC(C)(CCC)OC 7a_200011219694_200000210301 [0,2,0,0,0,0|1,0,1]=4 901 B9R0.59 CCCC(C)(CCC)O[13CH3] 7a_200011219694_200025704644 [0,2,0,0,0,0|1,0,1]=4 902 B9R0.62 C=CCC(CC)(CC)OC 7a_200011218178_200000210301 [0,2,0,0,0,0|1,0,1]=4 903 B9R0.62 C=CCC(CC)(CC)O[13CH3] 7a_200011218178_200025704644 [0,2,0,0,0,0|1,0,1]=4 904 B9R0.62 CCCC(CC)(CC)OC 7a_200011217480_200000210301 [0,2,0,0,0,0|1,0,1]=4 905 B9R0.62 CCCC(CC)(CC)O[13CH3] 7a_200011217480_200025704644 [0,2,0,0,0,0|1,0,1]=4 906 B9R0.62 CNCC(OC)(OC)OC 34a_100102657272_100000037187 [0,2,0,0,0,0|0,0,2]=4 907 B9R0.62 COC(CSC)(OC)OC 62a_100000037187_200000210301 [0,2,0,0,0,0|1,0,1]=4 908 B9R0.62 COC(CSC)(OC)OC 62a_200000210301_100000037187 [0,2,0,0,0,0|1,0,1]=4 909 B9R0.62 COC(CS[13CH3])(OC)OC 62a_100000037187_200025704644 [0,2,0,0,0,0|1,0,1]=4 910 B9R0.62 COC(CS[13CH3])(OC)OC 62a_200025704644_100000037187 [0,2,0,0,0,0|1,0,1]=4 911 B9R0.62 COCC(OC)(OC)OC 34a_100138415774_100000037187 [0,2,0,0,0,0|1,0,1]=4 912 B9R0.63 CCC(C)(CC(C)C)OC 7a_200011215086_200000210301 [0,2,0,0,0,0|1,0,1]=4 913 B9R0.63 CCC(C)(CC(C)C)O[13CH3] 7a_200011215086_200025704644 [0,2,0,0,0,0|1,0,1]=4 914 B9R0.63 COC(C)(CN(C)C)OC 2230a_100102631434_100000064154 [0,2,0,0,0,0|0,0,2]=4 915 B9R0.63 COC(C)(CN(C)C)OC 269982a_100102631434_100000766008 [0,2,0,0,0,0|0,0,2]=4 916 B9R0.30 CC(C)(C)CC(C)(C)O[13CH3] 7a_100000065652_200025704644 [0,2,0,0,0,0|1,0,1]=4 917 B9R0.30 COC(C)(C)CC(C)(C)C 7a_100000065652_200000210301 [0,2,0,0,0,0|1,0,1]=4 918 B7R1.1 COC1CCCC1 34a_100000210269_200000210301 [1,0,0,1,0,0|1,0,1]=4 919 B7R1.1 COC1CCCC1 34a_100138415774_100000179811 [1,0,0,1,0,0|1,0,1]=4 920 B7R1.1 COC1CCCC1 7a_100000210269_200000210301 [1,0,0,1,0,0|1,0,1]=4 921 B7R1.1 COC1CCOC1 34a_100138415774_100000690089 [1,0,0,1,0,0|1,0,1]=4 922 B7R1.1 COC1CCSC1 7a_100011232664_200000210301 [1,0,0,1,0,0|1,0,1]=4 923 B7R1.1 CO[C@H]1CCOC1 34a_100000717292_200000210301 [1,0,0,1,0,0|1,0,1]=4 924 B7R1.1 [13CH3]OC1CCCC1 34a_100000210269_200025704644 [1,0,0,1,0,0|1,0,1]=4 925 B7R1.1 [13CH3]OC1CCCC1 7a_100000210269_200025704644 [1,0,0,1,0,0|1,0,1]=4 926 B7R1.1 [13CH3]OC1CCSC1 7a_100011232664_200025704644 [1,0,0,1,0,0|1,0,1]=4 927 B7R1.1 [13CH3]O[C@H]1CCOC1 34a_100000717292_200025704644 [1,0,0,1,0,0|1,0,1]=4 928 B7R1.6 CNCC1CCO1 2230a_106832991635_100000103362 [1,0,0,1,0,0|0,0,2]=4 929 B7R1.6 CNCC1CCO1 34a_100102657272_100000103362 [1,0,0,1,0,0|0,0,2]=4 930 B7R1.6 CNCC1CCO1 7a_106832991635_100000103362 [1,0,0,1,0,0|0,0,2]=4 931 B7R1.6 CNC[C@@H]1CCO1 2230a_100020831831_200000210301 [1,0,0,1,0,0|0,0,2]=4 932 B7R1.6 CNC[C@@H]1CCO1 34a_100020831831_200000210301 [1,0,0,1,0,0|0,0,2]=4 933 B7R1.6 COCC1CCO1 34a_100000039022_200000210301 [1,0,0,1,0,0|1,0,1]=4 934 B7R1.6 COCC1CCO1 34a_100138415774_100000103362 [1,0,0,1,0,0|1,0,1]=4 935 B7R1.6 CSCC1CCO1 62a_100000103362_200000210301 [1,0,0,1,0,0|1,0,1]=4 936 B7R1.6 CSCC1CCO1 62a_200000210301_100000103362 [1,0,0,1,0,0|1,0,1]=4 937 B7R1.6 [13CH3]NC[C@@H]1CCO1 2230a_100020831831_200025704644 [1,0,0,1,0,0|0,0,2]=4 938 B7R1.6 [13CH3]NC[C@@H]1CCO1 34a_100020831831_200025704644 [1,0,0,1,0,0|0,0,2]=4 939 B7R1.6 [13CH3]OCC1CCO1 34a_100000039022_200025704644 [1,0,0,1,0,0|1,0,1]=4 940 B7R1.6 [13CH3]SCC1CCO1 62a_100000103362_200025704644 [1,0,0,1,0,0|1,0,1]=4 941 B7R1.6 [13CH3]SCC1CCO1 62a_200025704644_100000103362 [1,0,0,1,0,0|1,0,1]=4 942 B7R1.10 COC1CN(C1)C 269982a_100000755009_200000210301 [1,0,0,1,0,0|0,0,2]=4 943 B7R1.10 COC1CN(C1)[13CH3] 269982a_100000755009_200025704644 [1,0,0,1,0,0|0,0,2]=4 944 B7R1.21 CC1(CO1)CS[13CH3] 62a_100000760498_200025704644 [1,0,0,1,0,0|1,0,1]=4 945 B7R1.21 CC1(CO1)CS[13CH3] 62a_200025704644_100000760498 [1,0,0,1,0,0|1,0,1]=4 946 B7R1.21 CNCC1(CO1)C 34a_100102657272_100000760498 [1,0,0,1,0,0|0,0,2]=4 947 B7R1.21 COCC1(CO1)C 34a_100138415774_100000760498 [1,0,0,1,0,0|1,0,1]=4 948 B7R1.21 CSCC1(CO1)C 62a_100000760498_200000210301 [1,0,0,1,0,0|1,0,1]=4 949 B7R1.21 CSCC1(CO1)C 62a_200000210301_100000760498 [1,0,0,1,0,0|1,0,1]=4 950 B7R1.22 CC(O[13CH3])C1CC1 34a_100000744524_200025704644 [1,0,0,1,0,0|1,0,1]=4 951 B7R1.22 CC(O[13CH3])C1CC1 7a_100000744524_200025704644 [1,0,0,1,0,0|1,0,1]=4 952 B7R1.22 COC(C)C1CC1 34a_100000744524_200000210301 [1,0,0,1,0,0|1,0,1]=4 953 B7R1.22 COC(C)C1CC1 7a_100000744524_200000210301 [1,0,0,1,0,0|1,0,1]=4 954 B7R1.25 CC1(CCC1)O[13CH3] 34a_100000759064_200025704644 [1,0,0,1,0,0|1,0,1]=4 955 B7R1.25 CC1(CCC1)O[13CH3] 7a_100000759064_200025704644 [1,0,0,1,0,0|1,0,1]=4 956 B7R1.25 CC1(CSC1)O[13CH3] 7a_100016018533_200025704644 [1,0,0,1,0,0|1,0,1]=4 957 B7R1.25 COC1(CCC1)C 34a_100000759064_200000210301 [1,0,0,1,0,0|1,0,1]=4 958 B7R1.25 COC1(CCC1)C 7a_100000759064_200000210301 [1,0,0,1,0,0|1,0,1]=4 959 B7R1.25 COC1(CSC1)C 7a_100016018533_200000210301 [1,0,0,1,0,0|1,0,1]=4 960 B7R1.16 CC1(CN(C1)[13CH3])C 2230a_100000753659_200025704644 [1,0,0,1,0,0|0,0,2]=4 961 B7R1.16 CC1(CN(C1)[13CH3])C 269982a_100000753659_200025704644 [1,0,0,1,0,0|0,0,2]=4 962 B7R1.16 CC1(CN(C1)[13CH3])O 2230a_100000718560_200025704644 [1,0,0,1,0,0|0,0,2]=4 963 B7R1.16 CC1(CN(C1)[13CH3])O 269982a_100000718560_200025704644 [1,0,0,1,0,0|0,0,2]=4 964 B7R1.16 CN1CC(C1)(C)C 2230a_100000753659_200000210301 [1,0,0,1,0,0|0,0,2]=4 965 B7R1.16 CN1CC(C1)(C)C 269982a_100000753659_200000210301 [1,0,0,1,0,0|0,0,2]=4 966 B7R1.16 CN1CC(C1)(C)O 2230a_100000718560_200000210301 [1,0,0,1,0,0|0,0,2]=4 967 B7R1.16 CN1CC(C1)(C)O 269982a_100000718560_200000210301 [1,0,0,1,0,0|0,0,2]=4 968 B7R1.29 CCC1(CC1)NC 2230a_100000732774_200000210301 [1,0,0,1,0,0|1,0,1]=4 969 B7R1.29 CCC1(CC1)N[13CH3] 2230a_100000732774_200025704644 [1,0,0,1,0,0|1,0,1]=4 970 B7R1.29 CNC1(CC1)CF 2230a_100000054953_200000210301 [1,0,0,1,0,0|2,0,0]=4 971 B7R1.29 CNC1(CC1)CF 34a_100000054953_200000210301 [1,0,0,1,0,0|2,0,0]=4 972 B7R1.29 COC1(CC1)C#N 34a_100138415774_100009889376 [1,0,0,1,0,0|0,0,2]=4 973 B7R1.29 [13CH3]NC1(CC1)CF 2230a_100000054953_200025704644 [1,0,0,1,0,0|2,0,0]=4 974 B7R1.29 [13CH3]NC1(CC1)CF 34a_100000054953_200025704644 [1,0,0,1,0,0|2,0,0]=4 975 B9R1.24 CC1(CCCC1O[13CH3])C 34a_100000726220_200025704644 [0,1,0,1,0,0|1,0,1]=4 976 B9R1.24 CC1(CCCC1O[13CH3])C 7a_100000726220_200025704644 [0,1,0,1,0,0|1,0,1]=4 977 B9R1.24 COC1CCCC1(C)C 34a_100000726220_200000210301 [0,1,0,1,0,0|1,0,1]=4 978 B9R1.24 COC1CCCC1(C)C 7a_100000726220_200000210301 [0,1,0,1,0,0|1,0,1]=4 979 B9R1.202 CO[C@@]1(CCC[C@H]1N)C 34a_100015977457_200000210301 [0,1,0,1,0,0|1,0,1]=4 980 B9R1.202 C[C@]1(CCC[C@H]1N)O[13CH3] 34a_100015977457_200025704644 [0,1,0,1,0,0|1,0,1]=4 981 B9R1.118 CC1(CCCCC1)O[13CH3] 34a_100011215885_200025704644 [0,1,0,1,0,0|1,0,1]=4 982 B9R1.118 CC1(CCCCC1)O[13CH3] 7a_100011215885_200025704644 [0,1,0,1,0,0|1,0,1]=4 983 B9R1.118 CC1(CCOCC1)O[13CH3] 34a_100011827762_200025704644 [0,1,0,1,0,0|1,0,1]=4 984 B9R1.118 CC1(CCOCC1)O[13CH3] 7a_100011827762_200025704644 [0,1,0,1,0,0|1,0,1]=4 985 B9R1.118 CC1(CCSCC1)O[13CH3] 34a_200011004327_200025704644 [0,1,0,1,0,0|1,0,1]=4 986 B9R1.118 CC1(CCSCC1)O[13CH3] 7a_200011004327_200025704644 [0,1,0,1,0,0|1,0,1]=4 987 B9R1.118 COC1(CCCCC1)C 34a_100011215885_200000210301 [0,1,0,1,0,0|1,0,1]=4 988 B9R1.118 COC1(CCCCC1)C 7a_100011215885_200000210301 [0,1,0,1,0,0|1,0,1]=4 989 B9R1.118 COC1(CCOCC1)C 34a_100011827762_200000210301 [0,1,0,1,0,0|1,0,1]=4 990 B9R1.118 COC1(CCOCC1)C 7a_100011827762_200000210301 [0,1,0,1,0,0|1,0,1]=4 991 B9R1.118 COC1(CCSCC1)C 34a_200011004327_200000210301 [0,1,0,1,0,0|1,0,1]=4 992 B9R1.118 COC1(CCSCC1)C 7a_200011004327_200000210301 [0,1,0,1,0,0|1,0,1]=4 993 B9R1.207 CCN1CC(C1)(C)OC 2230a_100000695453_100000210202 [0,1,0,1,0,0|0,0,2]=4 994 B9R1.207 CCN1CC(C1)(C)OC 269982a_100000695453_100000204670 [0,1,0,1,0,0|0,0,2]=4 995 B9R1.207 COC1(CN(C1)CF)C 269982a_100000695453_100015361967 [0,1,0,1,0,0|0,0,2]=4 996 B9R1.66 CC1(CN(CCO1)[13CH3])C 2230a_100000738910_200025704644 [0,1,0,1,0,0|0,0,2]=4 997 B9R1.66 CC1(CN(CCO1)[13CH3])C 269982a_100000738910_200025704644 [0,1,0,1,0,0|0,0,2]=4 998 B9R1.66 CC1(CN(CCO1)[13CH3])C 34a_100000738910_200025704644 [0,1,0,1,0,0|0,0,2]=4 999 B9R1.66 CN1CCOC(C1)(C)C 2230a_100000738910_200000210301 [0,1,0,1,0,0|0,0,2]=4 1000 B9R1.66 CN1CCOC(C1)(C)C 269982a_100000738910_200000210301 [0,1,0,1,0,0|0,0,2]=4 1001 B9R1.66 CN1CCOC(C1)(C)C 34a_100000738910_200000210301 [0,1,0,1,0,0|0,0,2]=4 1002 B9R1.134 CC1(CCCC1)OCF 34a_100000751722_100015361967 [0,1,0,1,0,0|1,0,1]=4 1003 B9R1.134 CC1(CCCC1)OCF 7a_100000751722_100015361967 [0,1,0,1,0,0|1,0,1]=4 1004 B9R1.134 CC1(OCCO1)CN[13CH3] 2230a_100000691740_200025704644 [0,1,0,1,0,0|0,0,2]=4 1005 B9R1.134 CC1(OCCO1)CS[13CH3] 62a_100009818610_200025704644 [0,1,0,1,0,0|1,0,1]=4 1006 B9R1.134 CC1(OCCO1)CS[13CH3] 62a_200025704644_100009818610 [0,1,0,1,0,0|1,0,1]=4 1007 B9R1.134 CCOC1(CCCC1)C 34a_100000751722_100000210202 [0,1,0,1,0,0|1,0,1]=4 1008 B9R1.134 CCOC1(CCCC1)C 7a_100000751722_100000210202 [0,1,0,1,0,0|1,0,1]=4 1009 B9R1.134 CNCC1(OCCO1)C 2230a_100000691740_200000210301 [0,1,0,1,0,0|0,0,2]=4 1010 B9R1.134 CSCC1(OCCO1)C 62a_100009818610_200000210301 [0,1,0,1,0,0|1,0,1]=4 1011 B9R1.134 CSCC1(OCCO1)C 62a_200000210301_100009818610 [0,1,0,1,0,0|1,0,1]=4 1012 B9R1.182 COCC1(CC1)CC#N 34a_100138415774_100012181299 [0,1,0,1,0,0|2,0,0]=4 1013 B9R1.182 COCC1(CC1)CC#N 7a_100000763549_200000210301 [0,1,0,1,0,0|2,0,0]=4 1014 B9R1.182 [13CH3]OCC1(CC1)CC#N 7a_100000763549_200025704644 [0,1,0,1,0,0|2,0,0]=4 1015 B9R1.204 CCC1(CCCC1)OC 7a_100000752416_200000210301 [0,1,0,1,0,0|1,0,1]=4 1016 B9R1.204 CCC1(CCCC1)O[13CH3] 7a_100000752416_200025704644 [0,1,0,1,0,0|1,0,1]=4 1017 B9R1.204 COC1(CCCC1)CN 34a_100000737848_200000210301 [0,1,0,1,0,0|1,0,1]=4 1018 B9R1.204 [13CH3]OC1(CCCC1)CN 34a_100000737848_200025704644 [0,1,0,1,0,0|1,0,1]=4