0 B6R0.5 CC(C)(C)CN[13CH3] 2230a_100000743828_200025704644 [0,0,0,0,0,0|3,0,0]=3 1 B6R0.5 CC(C)(C)CS[13CH3] 62a_100011219605_200025704644 [0,0,0,0,0,0|3,0,0]=3 2 B6R0.5 CC(C)(C)CS[13CH3] 62a_200025704644_100011219605 [0,0,0,0,0,0|3,0,0]=3 3 B6R0.5 CC(C)(C)OCF 34a_100015890283_100015361967 [0,0,0,0,0,0|3,0,0]=3 4 B6R0.5 CC(C)(C)OCF 7a_100015890283_100015361967 [0,0,0,0,0,0|3,0,0]=3 5 B6R0.5 CC(C)(C)SCF 62a_100000211941_100015361967 [0,0,0,0,0,0|3,0,0]=3 6 B6R0.5 CC(C)(C)SCF 62a_100015361967_100000211941 [0,0,0,0,0,0|3,0,0]=3 7 B6R0.5 CC(C)(F)CN[13CH3] 2230a_100020643315_200025704644 [0,0,0,0,0,0|4,0,0]=4 8 B6R0.5 CC(C)(F)CO[13CH3] 34a_100000716592_200025704644 [0,0,0,0,0,0|4,0,0]=4 9 B6R0.5 CC(C)(F)CS[13CH3] 62a_100011997219_200025704644 [0,0,0,0,0,0|4,0,0]=4 10 B6R0.5 CC(C)(F)CS[13CH3] 62a_200025704644_100011997219 [0,0,0,0,0,0|4,0,0]=4 11 B6R0.5 CC(C)(O)CN[13CH3] 2230a_100000751335_200025704644 [0,0,0,0,0,0|4,0,0]=4 12 B6R0.5 CC(C)(O)CS[13CH3] 62a_100000764493_200025704644 [0,0,0,0,0,0|4,0,0]=4 13 B6R0.5 CC(C)(O)CS[13CH3] 62a_200025704644_100000764493 [0,0,0,0,0,0|4,0,0]=4 14 B6R0.5 CCNC(C)(C)C 2230a_100000715429_100000210202 [0,0,0,0,0,0|3,0,0]=3 15 B6R0.5 CCOC(C)(C)C 34a_100015890283_100000210202 [0,0,0,0,0,0|3,0,0]=3 16 B6R0.5 CCOC(C)(C)C 34a_100121572206_100000210625 [0,0,0,0,0,0|3,0,0]=3 17 B6R0.5 CCOC(C)(C)C 7a_100015890283_100000210202 [0,0,0,0,0,0|3,0,0]=3 18 B6R0.5 CCSC(C)(C)C 62a_100000210202_100000211941 [0,0,0,0,0,0|3,0,0]=3 19 B6R0.5 CCSC(C)(C)C 62a_100000211941_100000210202 [0,0,0,0,0,0|3,0,0]=3 20 B6R0.5 CNCC(C)(C)C 2230a_100000743828_200000210301 [0,0,0,0,0,0|3,0,0]=3 21 B6R0.5 CNCC(C)(C)C 270004a_106832991635_100011204126 [0,0,0,0,0,0|3,0,0]=3 22 B6R0.5 CNCC(C)(C)C 34a_100102657272_100011219605 [0,0,0,0,0,0|3,0,0]=3 23 B6R0.5 CNCC(C)(C)F 2230a_100020643315_200000210301 [0,0,0,0,0,0|4,0,0]=4 24 B6R0.5 CNCC(C)(C)F 34a_100102657272_100011997219 [0,0,0,0,0,0|4,0,0]=4 25 B6R0.5 CNCC(C)(C)O 2230a_100000751335_200000210301 [0,0,0,0,0,0|4,0,0]=4 26 B6R0.5 CNCC(C)(C)O 34a_100102657272_100000764493 [0,0,0,0,0,0|4,0,0]=4 27 B6R0.5 CNCC(C)(C)O 7a_106832991635_100000764493 [0,0,0,0,0,0|4,0,0]=4 28 B6R0.5 CNC[Si](C)(C)C 2230a_106832991635_100000037933 [0,0,0,0,0,0|3,0,0]=3 29 B6R0.5 CNC[Si](C)(C)C 7a_106832991635_100000233785 [0,0,0,0,0,0|3,0,0]=3 30 B6R0.5 COCC(C)(C)C 34a_100138415774_100011219605 [0,0,0,0,0,0|3,0,0]=3 31 B6R0.5 COCC(C)(C)F 34a_100000716592_200000210301 [0,0,0,0,0,0|4,0,0]=4 32 B6R0.5 COCC(C)(C)F 34a_100138415774_100011997219 [0,0,0,0,0,0|4,0,0]=4 33 B6R0.5 COCC(C)(C)O 34a_100138415774_100000764493 [0,0,0,0,0,0|4,0,0]=4 34 B6R0.5 CSCC(C)(C)C 62a_100011219605_200000210301 [0,0,0,0,0,0|3,0,0]=3 35 B6R0.5 CSCC(C)(C)C 62a_200000210301_100011219605 [0,0,0,0,0,0|3,0,0]=3 36 B6R0.5 CSCC(C)(C)F 62a_100011997219_200000210301 [0,0,0,0,0,0|4,0,0]=4 37 B6R0.5 CSCC(C)(C)F 62a_200000210301_100011997219 [0,0,0,0,0,0|4,0,0]=4 38 B6R0.5 CSCC(C)(C)O 62a_100000764493_200000210301 [0,0,0,0,0,0|4,0,0]=4 39 B6R0.5 CSCC(C)(C)O 62a_200000210301_100000764493 [0,0,0,0,0,0|4,0,0]=4 40 B6R0.5 CSC[N+](C)(C)C 62a_200000036245_200000210301 [0,0,0,0,0,0|2,0,0]=2 41 B6R0.5 CSC[N+](C)(C)C 62a_200000210301_200000036245 [0,0,0,0,0,0|2,0,0]=2 42 B6R0.5 CSC[Si](C)(C)C 62a_100000037933_200000210301 [0,0,0,0,0,0|3,0,0]=3 43 B6R0.5 CSC[Si](C)(C)C 62a_200000210301_100000037933 [0,0,0,0,0,0|3,0,0]=3 44 B6R0.5 C[N+](C)(C)CS[13CH3] 62a_200000036245_200025704644 [0,0,0,0,0,0|2,0,0]=2 45 B6R0.5 C[N+](C)(C)CS[13CH3] 62a_200025704644_200000036245 [0,0,0,0,0,0|2,0,0]=2 46 B6R0.5 C[Si](C)(C)CS[13CH3] 62a_100000037933_200025704644 [0,0,0,0,0,0|3,0,0]=3 47 B6R0.5 C[Si](C)(C)CS[13CH3] 62a_200025704644_100000037933 [0,0,0,0,0,0|3,0,0]=3 48 B5R0.1 C#CCN(C)C 2230a_100000225692_200000210301 [1,0,0,0,0,0|1,0,2]=4 49 B5R0.1 C#CCN(C)C 2230a_100102631434_100000038162 [1,0,0,0,0,0|1,0,2]=4 50 B5R0.1 C#CCN(C)C 34a_100000225692_200000210301 [1,0,0,0,0,0|1,0,2]=4 51 B5R0.1 C#CCN(C)[13CH3] 2230a_100000225692_200025704644 [1,0,0,0,0,0|1,0,2]=4 52 B5R0.1 C#CCN(C)[13CH3] 34a_100000225692_200025704644 [1,0,0,0,0,0|1,0,2]=4 53 B5R0.1 C=CCN(C)C 2230a_100000225617_200000210301 [1,0,0,0,0,0|1,0,2]=4 54 B5R0.1 C=CCN(C)C 2230a_100102631434_100000210623 [1,0,0,0,0,0|1,0,2]=4 55 B5R0.1 C=CCN(C)C 269982a_100000225617_200000210301 [1,0,0,0,0,0|1,0,2]=4 56 B5R0.1 C=CCN(C)C 269982a_100102631434_100000210623 [1,0,0,0,0,0|1,0,2]=4 57 B5R0.1 C=CCN(C)[13CH3] 2230a_100000225617_200025704644 [1,0,0,0,0,0|1,0,2]=4 58 B5R0.1 C=CCN(C)[13CH3] 269982a_100000225617_200025704644 [1,0,0,0,0,0|1,0,2]=4 59 B5R0.1 CC(=O)CCF 1458a_100000070787_100011217306 [1,0,0,0,0,0|3,0,0]=4 60 B5R0.1 CC(=O)CCO 1458a_100000070787_100000211926 [1,0,0,0,0,0|2,0,0]=3 61 B5R0.1 CC(=O)CCO 1458a_100011216618_200000210301 [1,0,0,0,0,0|2,0,0]=3 62 B5R0.1 CC(C)CN[13CH3] 2230a_100000210953_200025704644 [1,0,0,0,0,0|3,0,0]=4 63 B5R0.1 CC(C)CN[13CH3] 34a_100000210953_200025704644 [1,0,0,0,0,0|3,0,0]=4 64 B5R0.1 CC(C)CO[13CH3] 34a_100000210257_200025704644 [1,0,0,0,0,0|3,0,0]=4 65 B5R0.1 CC(C)CS[13CH3] 62a_100000210624_200025704644 [1,0,0,0,0,0|3,0,0]=4 66 B5R0.1 CC(C)CS[13CH3] 62a_200025704644_100000210760 [1,0,0,0,0,0|3,0,0]=4 67 B5R0.1 CC(C)NCF 34a_100138425928_100015361967 [1,0,0,0,0,0|3,0,0]=4 68 B5R0.1 CC(C)OCF 34a_100000212225_100015361967 [1,0,0,0,0,0|3,0,0]=4 69 B5R0.1 CC(C)SCF 62a_100000210206_100015361967 [1,0,0,0,0,0|3,0,0]=4 70 B5R0.1 CC(C)SCF 62a_100015361967_100000210206 [1,0,0,0,0,0|3,0,0]=4 71 B5R0.1 CCCC(=O)C 1458a_100000070787_100000210303 [1,0,0,0,0,0|3,0,0]=4 72 B5R0.1 CCCC(=O)C 1458a_100000211992_200000210301 [1,0,0,0,0,0|3,0,0]=4 73 B5R0.1 CCCC(=O)[13CH3] 1458a_100000211992_200025704644 [1,0,0,0,0,0|3,0,0]=4 74 B5R0.1 CCCN(C)C 2230a_100000747261_200000210301 [1,0,0,0,0,0|1,0,1]=3 75 B5R0.1 CCCN(C)C 2230a_100102631434_100000210303 [1,0,0,0,0,0|1,0,1]=3 76 B5R0.1 CCCN(C)C 269982a_100000747261_200000210301 [1,0,0,0,0,0|1,0,1]=3 77 B5R0.1 CCCN(C)C 269982a_100102631434_100000210303 [1,0,0,0,0,0|1,0,1]=3 78 B5R0.1 CCCN(C)[13CH3] 2230a_100000747261_200025704644 [1,0,0,0,0,0|1,0,1]=3 79 B5R0.1 CCCN(C)[13CH3] 269982a_100000747261_200025704644 [1,0,0,0,0,0|1,0,1]=3 80 B5R0.1 CCNC(C)C 2230a_100015525214_100000210206 [1,0,0,0,0,0|3,0,0]=4 81 B5R0.1 CCNC(C)C 2230a_100138425928_100000210202 [1,0,0,0,0,0|3,0,0]=4 82 B5R0.1 CCNC(C)C 34a_100138425928_100000210202 [1,0,0,0,0,0|3,0,0]=4 83 B5R0.1 CCOC(C)C 34a_100000212225_100000210202 [1,0,0,0,0,0|3,0,0]=4 84 B5R0.1 CCOC(C)C 34a_100121572206_100000210206 [1,0,0,0,0,0|3,0,0]=4 85 B5R0.1 CCSC(C)C 62a_100000210202_100000210206 [1,0,0,0,0,0|3,0,0]=4 86 B5R0.1 CCSC(C)C 62a_100000210206_100000210202 [1,0,0,0,0,0|3,0,0]=4 87 B5R0.1 CN(C)CC#N 2230a_100000748184_200000210301 [1,0,0,0,0,0|1,0,2]=4 88 B5R0.1 CN(C)CC#N 2230a_100102631434_100011215382 [1,0,0,0,0,0|1,0,2]=4 89 B5R0.1 CN(C)CC#N 269982a_100102631434_100011214920 [1,0,0,0,0,0|1,0,2]=4 90 B5R0.1 CN(C)CC=O 2230a_100102631434_200015260668 [1,0,0,0,0,0|0,0,3]=4 91 B5R0.1 CN(C)CC=O 269982a_100102631434_200015260668 [1,0,0,0,0,0|0,0,3]=4 92 B5R0.1 CN(C)CCF 2230a_100102631434_100011217306 [1,0,0,0,0,0|1,0,1]=3 93 B5R0.1 CN(C)CCF 269982a_100102631434_100011217306 [1,0,0,0,0,0|1,0,1]=3 94 B5R0.1 CN(C)CCO 2230a_100000210263_200000210301 [1,0,0,0,0,0|0,0,1]=2 95 B5R0.1 CN(C)CCO 2230a_100102631434_100000211926 [1,0,0,0,0,0|0,0,1]=2 96 B5R0.1 CN(C)CCO 269982a_100000210263_200000210301 [1,0,0,0,0,0|0,0,1]=2 97 B5R0.1 CN(C)CCO 269982a_100102631434_100000211926 [1,0,0,0,0,0|0,0,1]=2 98 B5R0.1 CN([13CH3])CC#N 2230a_100000748184_200025704644 [1,0,0,0,0,0|1,0,2]=4 99 B5R0.1 CN([13CH3])CCO 2230a_100000210263_200025704644 [1,0,0,0,0,0|0,0,1]=2 100 B5R0.1 CN([13CH3])CCO 269982a_100000210263_200025704644 [1,0,0,0,0,0|0,0,1]=2 101 B5R0.1 CNCC(C)C 2230a_100000210953_200000210301 [1,0,0,0,0,0|3,0,0]=4 102 B5R0.1 CNCC(C)C 2230a_106832991635_100000210760 [1,0,0,0,0,0|3,0,0]=4 103 B5R0.1 CNCC(C)C 270004a_106832991635_100000210432 [1,0,0,0,0,0|3,0,0]=4 104 B5R0.1 CNCC(C)C 34a_100000210953_200000210301 [1,0,0,0,0,0|3,0,0]=4 105 B5R0.1 CNCC(C)C 34a_100102657272_100000210624 [1,0,0,0,0,0|3,0,0]=4 106 B5R0.1 CNCC(C)C 7a_106832991635_100000210760 [1,0,0,0,0,0|3,0,0]=4 107 B5R0.1 COCC(C)C 34a_100000210257_200000210301 [1,0,0,0,0,0|3,0,0]=4 108 B5R0.1 COCC(C)C 34a_100138415774_100000210624 [1,0,0,0,0,0|3,0,0]=4 109 B5R0.1 COCN(C)C 2230a_100102631434_100000766300 [1,0,0,0,0,0|2,0,1]=4 110 B5R0.1 COCN(C)C 269982a_100102631434_100000766300 [1,0,0,0,0,0|2,0,1]=4 111 B5R0.1 CSCC(C)C 62a_100000210624_200000210301 [1,0,0,0,0,0|3,0,0]=4 112 B5R0.1 CSCC(C)C 62a_200000210301_100000210760 [1,0,0,0,0,0|3,0,0]=4 113 B5R0.1 CSCN(C)C 2230a_100102631434_100011218213 [1,0,0,0,0,0|2,0,1]=4 114 B5R0.1 CSCN(C)C 269982a_100102631434_100011218213 [1,0,0,0,0,0|2,0,1]=4 115 B5R0.1 [13CH3]C(=O)CCO 1458a_100011216618_200025704644 [1,0,0,0,0,0|2,0,0]=3 116 B5R0.4 CC(C)(C)N[13CH3] 2230a_100000715429_200025704644 [1,0,0,0,0,0|2,0,0]=3 117 B5R0.4 CC(C)(C)O[13CH3] 34a_100015890283_200025704644 [1,0,0,0,0,0|2,0,0]=3 118 B5R0.4 CC(C)(C)O[13CH3] 7a_100015890283_200025704644 [1,0,0,0,0,0|2,0,0]=3 119 B5R0.4 CC(C)(C)S[13CH3] 62a_100000211941_200025704644 [1,0,0,0,0,0|2,0,0]=3 120 B5R0.4 CC(C)(C)S[13CH3] 62a_200025704644_100000211941 [1,0,0,0,0,0|2,0,0]=3 121 B5R0.4 CNC(C)(C)C 2230a_100000715429_200000210301 [1,0,0,0,0,0|2,0,0]=3 122 B5R0.4 CNC(C)(C)C 34a_100102657272_100000210625 [1,0,0,0,0,0|2,0,0]=3 123 B5R0.4 COC(C)(C)C 34a_100015890283_200000210301 [1,0,0,0,0,0|2,0,0]=3 124 B5R0.4 COC(C)(C)C 34a_100138415774_100000210625 [1,0,0,0,0,0|2,0,0]=3 125 B5R0.4 COC(C)(C)C 7a_100015890283_200000210301 [1,0,0,0,0,0|2,0,0]=3 126 B5R0.4 CSC(C)(C)C 62a_100000211941_200000210301 [1,0,0,0,0,0|2,0,0]=3 127 B5R0.4 CSC(C)(C)C 62a_200000210301_100000211941 [1,0,0,0,0,0|2,0,0]=3 128 B7R0.8 C#CCNC(C)(C)C 2230a_100000715429_100000038162 [0,1,0,0,0,0|2,0,1]=4 129 B7R0.8 C#CCNC(C)(C)C 34a_100000212058_100000210625 [0,1,0,0,0,0|2,0,1]=4 130 B7R0.8 C#CCOC(C)(C)C 34a_100000210247_100000210625 [0,1,0,0,0,0|2,0,1]=4 131 B7R0.8 C#CCOC(C)(C)C 34a_100015890283_100000184674 [0,1,0,0,0,0|2,0,1]=4 132 B7R0.8 C#CCOC(C)(C)C 7a_100015890283_100000038162 [0,1,0,0,0,0|2,0,1]=4 133 B7R0.8 C#CCSC(C)(C)C 62a_100000038162_100000211941 [0,1,0,0,0,0|2,0,1]=4 134 B7R0.8 C=CCNC(C)(C)C 2230a_100000715429_100000210623 [0,1,0,0,0,0|2,0,1]=4 135 B7R0.8 C=CCOC(C)(C)C 34a_100015890283_100015514636 [0,1,0,0,0,0|2,0,1]=4 136 B7R0.8 C=CCOC(C)(C)C 34a_200000210373_100000210625 [0,1,0,0,0,0|2,0,1]=4 137 B7R0.8 C=CCOC(C)(C)C 7a_100015890283_100015514636 [0,1,0,0,0,0|2,0,1]=4 138 B7R0.8 C=CCSC(C)(C)C 62a_100000210623_100000211941 [0,1,0,0,0,0|2,0,1]=4 139 B7R0.8 C=CCSC(C)(C)C 62a_100000211941_100000210623 [0,1,0,0,0,0|2,0,1]=4 140 B7R0.8 CC(C)(C)CCN[13CH3] 2230a_100000738805_200025704644 [0,1,0,0,0,0|2,0,0]=3 141 B7R0.8 CC(C)(C)CCO[13CH3] 7a_100000765024_200025704644 [0,1,0,0,0,0|1,0,0]=2 142 B7R0.8 CC(C)(C)CCS[13CH3] 62a_100000755188_200025704644 [0,1,0,0,0,0|1,1,0]=3 143 B7R0.8 CC(C)(C)CCS[13CH3] 62a_200025704644_100000755188 [0,1,0,0,0,0|1,1,0]=3 144 B7R0.8 CC(C)(C)CSCF 62a_100011219605_100015361967 [0,1,0,0,0,0|2,0,0]=3 145 B7R0.8 CC(C)(C)CSCF 62a_100015361967_100011219605 [0,1,0,0,0,0|2,0,0]=3 146 B7R0.8 CC(C)(C)NCC#N 2230a_100000715429_100011215382 [0,1,0,0,0,0|2,0,1]=4 147 B7R0.8 CC(C)(C)NCC=O 2230a_100000715429_200015260668 [0,1,0,0,0,0|1,0,2]=4 148 B7R0.8 CC(C)(C)NCCF 2230a_100000715429_100011217306 [0,1,0,0,0,0|2,0,0]=3 149 B7R0.8 CC(C)(C)NCCF 34a_100000724931_100000210625 [0,1,0,0,0,0|2,0,0]=3 150 B7R0.8 CC(C)(C)NCCO 2230a_100000715429_100000211926 [0,1,0,0,0,0|1,0,0]=2 151 B7R0.8 CC(C)(C)NCCO 34a_100016990907_100000210625 [0,1,0,0,0,0|1,0,0]=2 152 B7R0.8 CC(C)(C)OCC#N 7a_100015890283_100011215382 [0,1,0,0,0,0|2,0,1]=4 153 B7R0.8 CC(C)(C)OCC=O 34a_100015890283_200009817547 [0,1,0,0,0,0|1,0,2]=4 154 B7R0.8 CC(C)(C)OCC=O 7a_100015890283_200015260668 [0,1,0,0,0,0|1,0,2]=4 155 B7R0.8 CC(C)(C)OCCBr 34a_100000211926_100000210625 [0,1,0,0,0,0|2,0,0]=3 156 B7R0.8 CC(C)(C)OCCF 34a_100015890283_100011217306 [0,1,0,0,0,0|2,0,0]=3 157 B7R0.8 CC(C)(C)OCCF 7a_100015890283_100011217306 [0,1,0,0,0,0|2,0,0]=3 158 B7R0.8 CC(C)(C)OCCN 34a_100000210304_100000210625 [0,1,0,0,0,0|2,0,0]=3 159 B7R0.8 CC(C)(C)OCCO 34a_100015890283_100000211926 [0,1,0,0,0,0|1,0,0]=2 160 B7R0.8 CC(C)(C)OCCO 7a_100015890283_100000211926 [0,1,0,0,0,0|1,0,0]=2 161 B7R0.8 CC(C)(C)SCC#N 62a_100000211941_100011215382 [0,1,0,0,0,0|2,0,1]=4 162 B7R0.8 CC(C)(C)SCC#N 62a_100011215382_100000211941 [0,1,0,0,0,0|2,0,1]=4 163 B7R0.8 CC(C)(C)SCC=O 62a_100000211941_200015260668 [0,1,0,0,0,0|1,0,2]=4 164 B7R0.8 CC(C)(C)SCC=O 62a_200015260668_100000211941 [0,1,0,0,0,0|1,0,2]=4 165 B7R0.8 CC(C)(C)SCCF 62a_100000211941_100011217306 [0,1,0,0,0,0|2,0,0]=3 166 B7R0.8 CC(C)(C)SCCF 62a_100011217306_100000211941 [0,1,0,0,0,0|2,0,0]=3 167 B7R0.8 CC(C)(C)SCCO 62a_100000211926_100000211941 [0,1,0,0,0,0|1,0,0]=2 168 B7R0.8 CC(C)(C)SCCO 62a_100000211941_100000211926 [0,1,0,0,0,0|1,0,0]=2 169 B7R0.8 CC(C)(F)CCN[13CH3] 2230a_100016253952_200025704644 [0,1,0,0,0,0|3,0,0]=4 170 B7R0.8 CC(C)(F)COCF 34a_100000716592_100015361967 [0,1,0,0,0,0|3,0,0]=4 171 B7R0.8 CC(C)(F)CSCF 62a_100011997219_100015361967 [0,1,0,0,0,0|3,0,0]=4 172 B7R0.8 CC(C)(F)CSCF 62a_100015361967_100011997219 [0,1,0,0,0,0|3,0,0]=4 173 B7R0.8 CC(C)(O)CCS[13CH3] 62a_100000702414_200025704644 [0,1,0,0,0,0|2,1,0]=4 174 B7R0.8 CC(C)(O)CCS[13CH3] 62a_200025704644_100000702414 [0,1,0,0,0,0|2,1,0]=4 175 B7R0.8 CC(C)(O)CSCF 62a_100000764493_100015361967 [0,1,0,0,0,0|3,0,0]=4 176 B7R0.8 CC(C)(O)CSCF 62a_100015361967_100000764493 [0,1,0,0,0,0|3,0,0]=4 177 B7R0.8 CCCNC(C)(C)C 2230a_100000715429_100000210303 [0,1,0,0,0,0|2,0,0]=3 178 B7R0.8 CCCOC(C)(C)C 34a_100000210258_100000210625 [0,1,0,0,0,0|2,0,0]=3 179 B7R0.8 CCCOC(C)(C)C 34a_100015890283_100000210303 [0,1,0,0,0,0|2,0,0]=3 180 B7R0.8 CCCOC(C)(C)C 7a_100015890283_100000210303 [0,1,0,0,0,0|2,0,0]=3 181 B7R0.8 CCCSC(C)(C)C 62a_100000210303_100000211941 [0,1,0,0,0,0|2,0,0]=3 182 B7R0.8 CCCSC(C)(C)C 62a_100000211941_100000210303 [0,1,0,0,0,0|2,0,0]=3 183 B7R0.8 CCNCC(C)(C)C 2230a_100000743828_100000210202 [0,1,0,0,0,0|2,0,0]=3 184 B7R0.8 CCNCC(C)(C)C 270004a_100015525214_100011204126 [0,1,0,0,0,0|2,0,0]=3 185 B7R0.8 CCNCC(C)(C)F 2230a_100020643315_100000210202 [0,1,0,0,0,0|3,0,0]=4 186 B7R0.8 CCNCC(C)(C)O 2230a_100000751335_100000210202 [0,1,0,0,0,0|3,0,0]=4 187 B7R0.8 CCNC[Si](C)(C)C 2230a_100015525214_100000037933 [0,1,0,0,0,0|2,0,0]=3 188 B7R0.8 CCOCC(C)(C)C 34a_100121572206_100011219605 [0,1,0,0,0,0|2,0,0]=3 189 B7R0.8 CCOCC(C)(C)F 34a_100000716592_100000210202 [0,1,0,0,0,0|3,0,0]=4 190 B7R0.8 CCOCC(C)(C)F 34a_100121572206_100011997219 [0,1,0,0,0,0|3,0,0]=4 191 B7R0.8 CCOCC(C)(C)O 34a_100121572206_100000764493 [0,1,0,0,0,0|3,0,0]=4 192 B7R0.8 CCSCC(C)(C)C 62a_100000210202_100011219605 [0,1,0,0,0,0|2,0,0]=3 193 B7R0.8 CCSCC(C)(C)C 62a_100011219605_100000210202 [0,1,0,0,0,0|2,0,0]=3 194 B7R0.8 CCSCC(C)(C)F 62a_100000210202_100011997219 [0,1,0,0,0,0|3,0,0]=4 195 B7R0.8 CCSCC(C)(C)F 62a_100011997219_100000210202 [0,1,0,0,0,0|3,0,0]=4 196 B7R0.8 CCSCC(C)(C)O 62a_100000210202_100000764493 [0,1,0,0,0,0|3,0,0]=4 197 B7R0.8 CCSCC(C)(C)O 62a_100000764493_100000210202 [0,1,0,0,0,0|3,0,0]=4 198 B7R0.8 CCSC[N+](C)(C)C 62a_100000210202_200000036245 [0,1,0,0,0,0|1,0,0]=2 199 B7R0.8 CCSC[N+](C)(C)C 62a_200000036245_100000210202 [0,1,0,0,0,0|1,0,0]=2 200 B7R0.8 CCSC[Si](C)(C)C 62a_100000037933_100000210202 [0,1,0,0,0,0|2,0,0]=3 201 B7R0.8 CCSC[Si](C)(C)C 62a_100000210202_100000037933 [0,1,0,0,0,0|2,0,0]=3 202 B7R0.8 CNCCC(C)(C)C 2230a_100000738805_200000210301 [0,1,0,0,0,0|2,0,0]=3 203 B7R0.8 CNCCC(C)(C)C 2230a_106832991635_100000755188 [0,1,0,0,0,0|2,0,0]=3 204 B7R0.8 CNCCC(C)(C)C 34a_100102657272_100000755188 [0,1,0,0,0,0|2,0,0]=3 205 B7R0.8 CNCCC(C)(C)C 7a_106832991635_100000755188 [0,1,0,0,0,0|2,0,0]=3 206 B7R0.8 CNCCC(C)(C)F 2230a_100016253952_200000210301 [0,1,0,0,0,0|3,0,0]=4 207 B7R0.8 CNCCC(C)(C)O 2230a_106832991635_100000702414 [0,1,0,0,0,0|3,0,0]=4 208 B7R0.8 CNCCC(C)(C)O 34a_100102657272_100000702414 [0,1,0,0,0,0|3,0,0]=4 209 B7R0.8 CNCCC(C)(C)O 7a_106832991635_100000702414 [0,1,0,0,0,0|3,0,0]=4 210 B7R0.8 CNCC[N+](C)(C)C 34a_100102657272_100000085578 [0,1,0,0,0,0|1,0,0]=2 211 B7R0.8 CNCC[N+](C)(C)C 7a_106832991635_100000085578 [0,1,0,0,0,0|1,0,0]=2 212 B7R0.8 CNCC[Si](C)(C)C 2230a_106832991635_200000733723 [0,1,0,0,0,0|2,0,0]=3 213 B7R0.8 CNCC[Si](C)(C)C 34a_100102657272_200000733723 [0,1,0,0,0,0|2,0,0]=3 214 B7R0.8 CNCC[Si](C)(C)C 7a_106832991635_200000733723 [0,1,0,0,0,0|2,0,0]=3 215 B7R0.8 COCCC(C)(C)C 34a_100138415774_100000755188 [0,1,0,0,0,0|1,0,0]=2 216 B7R0.8 COCCC(C)(C)C 7a_100000765024_200000210301 [0,1,0,0,0,0|1,0,0]=2 217 B7R0.8 COCCC(C)(C)O 34a_100138415774_100000702414 [0,1,0,0,0,0|2,0,0]=3 218 B7R0.8 COCCS(=O)(=O)C 34a_100000211924_200000210301 [0,1,0,0,0,0|3,0,0]=4 219 B7R0.8 COCCS(=O)(=O)C 34a_100138415774_100000731031 [0,1,0,0,0,0|3,0,0]=4 220 B7R0.8 COCCS(=O)(=O)C 7a_100000211924_200000210301 [0,1,0,0,0,0|3,0,0]=4 221 B7R0.8 COCC[N+](C)(C)C 34a_100138415774_100000085578 [0,1,0,0,0,0|0,0,0]=1 222 B7R0.8 COCC[N+](C)(C)C 7a_200020618287_200000210301 [0,1,0,0,0,0|0,0,0]=1 223 B7R0.8 COCC[Si](C)(C)C 34a_100138415774_200000733723 [0,1,0,0,0,0|1,0,0]=2 224 B7R0.8 COCC[Si](C)(C)C 7a_100000039746_200000210301 [0,1,0,0,0,0|1,0,0]=2 225 B7R0.8 COCNC(C)(C)C 2230a_100000715429_100000766300 [0,1,0,0,0,0|2,0,0]=3 226 B7R0.8 COCSC(C)(C)C 62a_100000211941_100000766300 [0,1,0,0,0,0|2,0,0]=3 227 B7R0.8 COCSC(C)(C)C 62a_100000766300_100000211941 [0,1,0,0,0,0|2,0,0]=3 228 B7R0.8 CS(=O)(=O)CCO[13CH3] 34a_100000211924_200025704644 [0,1,0,0,0,0|3,0,0]=4 229 B7R0.8 CS(=O)(=O)CCO[13CH3] 7a_100000211924_200025704644 [0,1,0,0,0,0|3,0,0]=4 230 B7R0.8 CS(=O)(=O)NCCO 40a_100000210304_100000738038 [0,1,0,0,0,0|3,0,0]=4 231 B7R0.8 CSCCC(C)(C)C 62a_100000755188_200000210301 [0,1,0,0,0,0|1,1,0]=3 232 B7R0.8 CSCCC(C)(C)C 62a_200000210301_100000755188 [0,1,0,0,0,0|1,1,0]=3 233 B7R0.8 CSCCC(C)(C)O 62a_100000702414_200000210301 [0,1,0,0,0,0|2,1,0]=4 234 B7R0.8 CSCCC(C)(C)O 62a_200000210301_100000702414 [0,1,0,0,0,0|2,1,0]=4 235 B7R0.8 CSCC[N+](C)(C)C 62a_100000085578_200000210301 [0,1,0,0,0,0|0,1,0]=2 236 B7R0.8 CSCC[N+](C)(C)C 62a_200000210301_100000085578 [0,1,0,0,0,0|0,1,0]=2 237 B7R0.8 CSCC[Si](C)(C)C 62a_200000210301_200000733723 [0,1,0,0,0,0|1,1,0]=3 238 B7R0.8 CSCC[Si](C)(C)C 62a_200000733723_200000210301 [0,1,0,0,0,0|1,1,0]=3 239 B7R0.8 CSCNC(C)(C)C 2230a_100000715429_100011218213 [0,1,0,0,0,0|2,1,0]=4 240 B7R0.8 CSCOC(C)(C)C 34a_100015890283_100011218213 [0,1,0,0,0,0|2,1,0]=4 241 B7R0.8 CSCSC(C)(C)C 62a_100000211941_100011218213 [0,1,0,0,0,0|2,1,0]=4 242 B7R0.8 CSCSC(C)(C)C 62a_100011218213_100000211941 [0,1,0,0,0,0|2,1,0]=4 243 B7R0.8 C[N+](C)(C)CCO[13CH3] 7a_200020618287_200025704644 [0,1,0,0,0,0|0,0,0]=1 244 B7R0.8 C[N+](C)(C)CCS[13CH3] 62a_100000085578_200025704644 [0,1,0,0,0,0|0,1,0]=2 245 B7R0.8 C[N+](C)(C)CCS[13CH3] 62a_200025704644_100000085578 [0,1,0,0,0,0|0,1,0]=2 246 B7R0.8 C[N+](C)(C)CSCF 62a_100015361967_200000036245 [0,1,0,0,0,0|1,0,0]=2 247 B7R0.8 C[N+](C)(C)CSCF 62a_200000036245_100015361967 [0,1,0,0,0,0|1,0,0]=2 248 B7R0.8 C[Si](C)(C)CCO[13CH3] 7a_100000039746_200025704644 [0,1,0,0,0,0|1,0,0]=2 249 B7R0.8 C[Si](C)(C)CCS[13CH3] 62a_200000733723_200025704644 [0,1,0,0,0,0|1,1,0]=3 250 B7R0.8 C[Si](C)(C)CCS[13CH3] 62a_200025704644_200000733723 [0,1,0,0,0,0|1,1,0]=3 251 B7R0.8 C[Si](C)(C)CSCF 62a_100000037933_100015361967 [0,1,0,0,0,0|2,0,0]=3 252 B7R0.8 C[Si](C)(C)CSCF 62a_100015361967_100000037933 [0,1,0,0,0,0|2,0,0]=3 253 B7R0.9 CC(=O)CC(C)(C)C 1458a_100000211214_200000210301 [0,1,0,0,0,0|1,0,2]=4 254 B7R0.9 CC(=O)C[N+](C)(C)C 1458a_100000033712_200000210301 [0,1,0,0,0,0|0,0,2]=3 255 B7R0.9 CC(=O)C[Si](C)(C)C 1458a_100000070787_100000233785 [0,1,0,0,0,0|1,0,2]=4 256 B7R0.9 CC(=O)C[Si](C)(C)C 1458a_100011218504_200000210301 [0,1,0,0,0,0|1,0,2]=4 257 B7R0.9 CC(C)(C)CC(=O)[13CH3] 1458a_100000211214_200025704644 [0,1,0,0,0,0|1,0,2]=4 258 B7R0.9 CC(C)NC(C)(C)C 2230a_100000715429_100000210206 [0,1,0,0,0,0|3,0,0]=4 259 B7R0.9 CC(C)NC(C)(C)C 34a_100138425928_100000210625 [0,1,0,0,0,0|3,0,0]=4 260 B7R0.9 CC(C)OC(C)(C)C 34a_100000212225_100000210625 [0,1,0,0,0,0|3,0,0]=4 261 B7R0.9 CC(C)OC(C)(C)C 34a_100015890283_100000210206 [0,1,0,0,0,0|3,0,0]=4 262 B7R0.9 CC(C)OC(C)(C)C 7a_100015890283_100000210206 [0,1,0,0,0,0|3,0,0]=4 263 B7R0.9 CC(C)SC(C)(C)C 62a_100000210206_100000211941 [0,1,0,0,0,0|3,0,0]=4 264 B7R0.9 CC(C)SC(C)(C)C 62a_100000211941_100000210206 [0,1,0,0,0,0|3,0,0]=4 265 B7R0.9 CN(C)CC(C)(C)C 2230a_100000742839_200000210301 [0,1,0,0,0,0|3,0,0]=4 266 B7R0.9 CN(C)CC(C)(C)C 269982a_100000742839_200000210301 [0,1,0,0,0,0|3,0,0]=4 267 B7R0.9 CN(C)CC(C)(C)C 270004a_100102631434_100011204126 [0,1,0,0,0,0|3,0,0]=4 268 B7R0.9 CN(C)C[N+](C)(C)C 269982a_100102631434_200000036245 [0,1,0,0,0,0|2,0,0]=3 269 B7R0.9 CN(C)C[Si](C)(C)C 2230a_100102631434_100000037933 [0,1,0,0,0,0|3,0,0]=4 270 B7R0.9 CN(C)C[Si](C)(C)C 269982a_200020589227_200000210301 [0,1,0,0,0,0|3,0,0]=4 271 B7R0.9 CN([13CH3])CC(C)(C)C 2230a_100000742839_200025704644 [0,1,0,0,0,0|3,0,0]=4 272 B7R0.9 CN([13CH3])CC(C)(C)C 269982a_100000742839_200025704644 [0,1,0,0,0,0|3,0,0]=4 273 B7R0.9 CN([13CH3])C[Si](C)(C)C 269982a_200020589227_200025704644 [0,1,0,0,0,0|3,0,0]=4 274 B7R0.9 C[N+](C)(C)CC(=O)[13CH3] 1458a_100000033712_200025704644 [0,1,0,0,0,0|0,0,2]=3 275 B7R0.9 C[Si](C)(C)CC(=O)[13CH3] 1458a_100011218504_200025704644 [0,1,0,0,0,0|1,0,2]=4 276 B7R0.11 C=CCC(C)(C)OC 7a_100011995686_200000210301 [0,1,0,0,0,0|2,0,1]=4 277 B7R0.11 C=CCC(C)(C)O[13CH3] 7a_100011995686_200025704644 [0,1,0,0,0,0|2,0,1]=4 278 B7R0.11 CC(C)(CCBr)O[13CH3] 7a_100000702414_200025704644 [0,1,0,0,0,0|2,0,0]=3 279 B7R0.11 CC(C)(CCl)CO[13CH3] 7a_100011217199_200025704644 [0,1,0,0,0,0|3,0,0]=4 280 B7R0.11 CC(C)(CCl)OCF 7a_100000764493_100015361967 [0,1,0,0,0,0|3,0,0]=4 281 B7R0.11 CC(C)(CO)CN[13CH3] 2230a_100020635058_200025704644 [0,1,0,0,0,0|3,0,0]=4 282 B7R0.11 CC(C)(CO)CS[13CH3] 62a_100009813988_200025704644 [0,1,0,0,0,0|3,0,0]=4 283 B7R0.11 CC(C)(CO)CS[13CH3] 62a_200025704644_100009813988 [0,1,0,0,0,0|3,0,0]=4 284 B7R0.11 CCC(C)(C)COC 7a_100000765029_200000210301 [0,1,0,0,0,0|3,0,0]=4 285 B7R0.11 CCC(C)(C)CO[13CH3] 7a_100000765029_200025704644 [0,1,0,0,0,0|3,0,0]=4 286 B7R0.11 CCC(C)(C)OCF 7a_100000210230_100015361967 [0,1,0,0,0,0|3,0,0]=4 287 B7R0.11 CCC(C)(C)SCF 62a_100000032637_100015361967 [0,1,0,0,0,0|3,0,0]=4 288 B7R0.11 CCC(C)(C)SCF 62a_100015361967_100000032637 [0,1,0,0,0,0|3,0,0]=4 289 B7R0.11 CCCC(C)(C)OC 7a_100000748436_200000210301 [0,1,0,0,0,0|2,0,0]=3 290 B7R0.11 CCCC(C)(C)O[13CH3] 7a_100000748436_200025704644 [0,1,0,0,0,0|2,0,0]=3 291 B7R0.11 CCNC(C)(C)CC 2230a_100000211385_100000210202 [0,1,0,0,0,0|3,0,0]=4 292 B7R0.11 CCNC(C)(C)CO 2230a_100000210608_100000210202 [0,1,0,0,0,0|3,0,0]=4 293 B7R0.11 CCOC(C)(C)CC 7a_100000210230_100000210202 [0,1,0,0,0,0|3,0,0]=4 294 B7R0.11 CCOC(C)(C)CCl 7a_100000764493_100000210202 [0,1,0,0,0,0|3,0,0]=4 295 B7R0.11 CCSC(C)(C)CC 62a_100000032637_100000210202 [0,1,0,0,0,0|3,0,0]=4 296 B7R0.11 CCSC(C)(C)CC 62a_100000210202_100000032637 [0,1,0,0,0,0|3,0,0]=4 297 B7R0.11 CNC(C)(C)COC 2230a_100000752728_200000210301 [0,1,0,0,0,0|3,0,0]=4 298 B7R0.11 CNC(C)(C)CSC 2230a_100000759623_200000210301 [0,1,0,0,0,0|3,0,0]=4 299 B7R0.11 CNC(C)(C)CSC 7a_100000759623_200000210301 [0,1,0,0,0,0|3,0,0]=4 300 B7R0.11 CNCC(C)(C)CO 2230a_100020635058_200000210301 [0,1,0,0,0,0|3,0,0]=4 301 B7R0.11 CNCC(C)(C)CO 34a_100102657272_100009813988 [0,1,0,0,0,0|3,0,0]=4 302 B7R0.11 CNCC(C)(C)CO 7a_106832991635_100009813988 [0,1,0,0,0,0|3,0,0]=4 303 B7R0.11 CNCC(C)(C)OC 2230a_100000763424_200000210301 [0,1,0,0,0,0|3,0,0]=4 304 B7R0.11 CNCC(C)(C)OC 34a_100102657272_100000701081 [0,1,0,0,0,0|3,0,0]=4 305 B7R0.11 CNCC(C)(C)SC 270004a_106832991635_100009845794 [0,1,0,0,0,0|3,0,0]=4 306 B7R0.11 COC(C)(C)CCBr 7a_100000702414_200000210301 [0,1,0,0,0,0|2,0,0]=3 307 B7R0.11 COC(C)(C)CN[13CH3] 2230a_100000763424_200025704644 [0,1,0,0,0,0|3,0,0]=4 308 B7R0.11 COC(C)(C)CSC 62a_100000701081_200000210301 [0,1,0,0,0,0|3,0,0]=4 309 B7R0.11 COC(C)(C)CSC 62a_200000210301_100000701081 [0,1,0,0,0,0|3,0,0]=4 310 B7R0.11 COC(C)(C)CS[13CH3] 62a_100000701081_200025704644 [0,1,0,0,0,0|3,0,0]=4 311 B7R0.11 COC(C)(C)CS[13CH3] 62a_200025704644_100000701081 [0,1,0,0,0,0|3,0,0]=4 312 B7R0.11 COCC(C)(C)CCl 7a_100011217199_200000210301 [0,1,0,0,0,0|3,0,0]=4 313 B7R0.11 COCC(C)(C)CO 34a_100138415774_100009813988 [0,1,0,0,0,0|3,0,0]=4 314 B7R0.11 COCC(C)(C)N[13CH3] 2230a_100000752728_200025704644 [0,1,0,0,0,0|3,0,0]=4 315 B7R0.11 COCC(C)(C)OC 34a_100138415774_100000701081 [0,1,0,0,0,0|3,0,0]=4 316 B7R0.11 CSCC(C)(C)CO 62a_100009813988_200000210301 [0,1,0,0,0,0|3,0,0]=4 317 B7R0.11 CSCC(C)(C)CO 62a_200000210301_100009813988 [0,1,0,0,0,0|3,0,0]=4 318 B7R0.11 CSCC(C)(C)N[13CH3] 2230a_100000759623_200025704644 [0,1,0,0,0,0|3,0,0]=4 319 B7R0.11 CSCC(C)(C)N[13CH3] 7a_100000759623_200025704644 [0,1,0,0,0,0|3,0,0]=4 320 B7R0.14 CC(C)(C)C(=O)CF 1458a_106744555173_100015361967 [0,1,0,0,0,0|2,0,1]=4 321 B7R0.14 CCC(=O)C(C)(C)C 1458a_106744555173_100000210202 [0,1,0,0,0,0|2,0,1]=4 322 B7R0.14 CCN(C)C(C)(C)C 2230a_100011200764_200000210301 [0,1,0,0,0,0|3,0,0]=4 323 B7R0.14 CCN(C)C(C)(C)C 269982a_100000225621_100000210625 [0,1,0,0,0,0|3,0,0]=4 324 B7R0.14 CCN(C)C(C)(C)C 269982a_100011200764_200000210301 [0,1,0,0,0,0|3,0,0]=4 325 B7R0.14 CCN(C)C(C)(C)C 269982a_100011215553_100000204670 [0,1,0,0,0,0|3,0,0]=4 326 B7R0.14 CCN([13CH3])C(C)(C)C 2230a_100011200764_200025704644 [0,1,0,0,0,0|3,0,0]=4 327 B7R0.14 CCN([13CH3])C(C)(C)C 269982a_100011200764_200025704644 [0,1,0,0,0,0|3,0,0]=4 328 B7R0.14 CN(CF)C(C)(C)C 269982a_100011215553_100015361967 [0,1,0,0,0,0|3,0,0]=4 329 B7R0.14 CN[C@H](C)C(C)(C)C 2230a_100025703359_200000210301 [0,1,0,0,0,0|3,0,0]=4 330 B7R0.14 C[C@@H](N[13CH3])C(C)(C)C 2230a_100025703359_200025704644 [0,1,0,0,0,0|3,0,0]=4 331 B7R1.16 CC1(CN(C1)[13CH3])C 2230a_100000753659_200025704644 [0,0,0,1,0,0|3,0,0]=4 332 B7R1.16 CC1(CN(C1)[13CH3])C 269982a_100000753659_200025704644 [0,0,0,1,0,0|3,0,0]=4 333 B7R1.16 CN1CC(C1)(C)C 2230a_100000753659_200000210301 [0,0,0,1,0,0|3,0,0]=4 334 B7R1.16 CN1CC(C1)(C)C 269982a_100000753659_200000210301 [0,0,0,1,0,0|3,0,0]=4 335 B7R1.21 CC1(CC1)CN[13CH3] 2230a_100000766693_200025704644 [0,0,0,1,0,0|3,0,0]=4 336 B7R1.21 CC1(CC1)CO[13CH3] 7a_100000698024_200025704644 [0,0,0,1,0,0|3,0,0]=4 337 B7R1.21 CC1(CC1)OCF 7a_100011725673_100015361967 [0,0,0,1,0,0|3,0,0]=4 338 B7R1.21 CCNC1(CC1)C 2230a_100000757604_100000210202 [0,0,0,1,0,0|3,0,0]=4 339 B7R1.21 CCOC1(CC1)C 7a_100011725673_100000210202 [0,0,0,1,0,0|3,0,0]=4 340 B7R1.21 CNCC1(CC1)C 2230a_100000766693_200000210301 [0,0,0,1,0,0|3,0,0]=4 341 B7R1.21 COCC1(CC1)C 7a_100000698024_200000210301 [0,0,0,1,0,0|3,0,0]=4 342 B4R0.1 CC(=O)CO 1458a_100000210174_200000210301 [2,0,0,0,0,0|2,0,0]=4 343 B4R0.1 CC(C)N[13CH3] 2230a_100138425928_200025704644 [2,0,0,0,0,0|2,0,0]=4 344 B4R0.1 CC(C)N[13CH3] 34a_100138425928_200025704644 [2,0,0,0,0,0|2,0,0]=4 345 B4R0.1 CC(C)O[13CH3] 34a_100000212225_200025704644 [2,0,0,0,0,0|2,0,0]=4 346 B4R0.1 CC(C)S[13CH3] 62a_100000210206_200025704644 [2,0,0,0,0,0|2,0,0]=4 347 B4R0.1 CC(C)S[13CH3] 62a_200025704644_100000210206 [2,0,0,0,0,0|2,0,0]=4 348 B4R0.1 CCC(=O)C 1458a_100000070787_100000210202 [2,0,0,0,0,0|2,0,0]=4 349 B4R0.1 CCC(=O)C 1458a_100000210414_200000210301 [2,0,0,0,0,0|2,0,0]=4 350 B4R0.1 CCC(=O)[13CH3] 1458a_100000210414_200025704644 [2,0,0,0,0,0|2,0,0]=4 351 B4R0.1 CCN(C)C 2230a_100000225621_200000210301 [2,0,0,0,0,0|0,0,1]=3 352 B4R0.1 CCN(C)C 2230a_100102631434_100000210202 [2,0,0,0,0,0|0,0,1]=3 353 B4R0.1 CCN(C)C 269982a_100000225621_200000210301 [2,0,0,0,0,0|0,0,1]=3 354 B4R0.1 CCN(C)C 269982a_100102631434_100000204670 [2,0,0,0,0,0|0,0,1]=3 355 B4R0.1 CCN(C)[13CH3] 2230a_100000225621_200025704644 [2,0,0,0,0,0|0,0,1]=3 356 B4R0.1 CCN(C)[13CH3] 269982a_100000225621_200025704644 [2,0,0,0,0,0|0,0,1]=3 357 B4R0.1 CN(C)CF 269982a_100102631434_100015361967 [2,0,0,0,0,0|1,0,1]=4 358 B4R0.1 CNC(C)C 2230a_100138425928_200000210301 [2,0,0,0,0,0|2,0,0]=4 359 B4R0.1 CNC(C)C 2230a_106832991635_100000210206 [2,0,0,0,0,0|2,0,0]=4 360 B4R0.1 CNC(C)C 34a_100102657272_100000210206 [2,0,0,0,0,0|2,0,0]=4 361 B4R0.1 CNC(C)C 34a_100138425928_200000210301 [2,0,0,0,0,0|2,0,0]=4 362 B4R0.1 CNC(C)C 7a_106832991635_100000210206 [2,0,0,0,0,0|2,0,0]=4 363 B4R0.1 COC(C)C 34a_100000212225_200000210301 [2,0,0,0,0,0|2,0,0]=4 364 B4R0.1 COC(C)C 34a_100138415774_100000210206 [2,0,0,0,0,0|2,0,0]=4 365 B4R0.1 CSC(C)C 62a_100000210206_200000210301 [2,0,0,0,0,0|2,0,0]=4 366 B4R0.1 CSC(C)C 62a_200000210301_100000210206 [2,0,0,0,0,0|2,0,0]=4 367 B4R0.1 [13CH3]C(=O)CO 1458a_100000210174_200025704644 [2,0,0,0,0,0|2,0,0]=4 368 B4R0.2 CCCNC 2230a_106832991635_100000210303 [2,0,0,0,0,0|1,0,1]=4 369 B4R0.2 CCCNC 34a_100102657272_100000210303 [2,0,0,0,0,0|1,0,1]=4 370 B4R0.2 CCCNC 7a_106832991635_100000210303 [2,0,0,0,0,0|1,0,1]=4 371 B4R0.2 CCCOC 34a_100000210258_200000210301 [2,0,0,0,0,0|2,0,0]=4 372 B4R0.2 CCCOC 34a_100138415774_100000210303 [2,0,0,0,0,0|2,0,0]=4 373 B4R0.2 CCCO[13CH3] 34a_100000210258_200025704644 [2,0,0,0,0,0|2,0,0]=4 374 B4R0.2 CCCSC 62a_100000210303_200000210301 [2,0,0,0,0,0|2,0,0]=4 375 B4R0.2 CCCSC 62a_200000210301_100000210303 [2,0,0,0,0,0|2,0,0]=4 376 B4R0.2 CCCS[13CH3] 62a_100000210303_200025704644 [2,0,0,0,0,0|2,0,0]=4 377 B4R0.2 CCCS[13CH3] 62a_200025704644_100000210303 [2,0,0,0,0,0|2,0,0]=4 378 B4R0.2 CNCCF 2230a_106832991635_100011217306 [2,0,0,0,0,0|1,0,1]=4 379 B4R0.2 CNCCF 34a_100000724931_200000210301 [2,0,0,0,0,0|1,0,1]=4 380 B4R0.2 CNCCF 34a_100102657272_100011217306 [2,0,0,0,0,0|1,0,1]=4 381 B4R0.2 CNCCF 7a_106832991635_100011217306 [2,0,0,0,0,0|1,0,1]=4 382 B4R0.2 CNCCO 2230a_100016997473_200000210301 [2,0,0,0,0,0|0,0,1]=3 383 B4R0.2 CNCCO 2230a_106832991635_100000211926 [2,0,0,0,0,0|0,0,1]=3 384 B4R0.2 CNCCO 34a_100016990907_200000210301 [2,0,0,0,0,0|0,0,1]=3 385 B4R0.2 CNCCO 34a_100102657272_100000211926 [2,0,0,0,0,0|0,0,1]=3 386 B4R0.2 CNCCO 7a_106832991635_100000211926 [2,0,0,0,0,0|0,0,1]=3 387 B4R0.2 COCCBr 34a_100000211926_200000210301 [2,0,0,0,0,0|2,0,0]=4 388 B4R0.2 COCCF 34a_100138415774_100011217306 [2,0,0,0,0,0|2,0,0]=4 389 B4R0.2 COCCN 34a_100000210304_200000210301 [2,0,0,0,0,0|2,0,0]=4 390 B4R0.2 COCCO 34a_100138415774_100000211926 [2,0,0,0,0,0|1,0,0]=3 391 B4R0.2 CSCCF 62a_100011217306_200000210301 [2,0,0,0,0,0|2,0,0]=4 392 B4R0.2 CSCCF 62a_200000210301_100011217306 [2,0,0,0,0,0|2,0,0]=4 393 B4R0.2 CSCCO 62a_100000211926_200000210301 [2,0,0,0,0,0|1,0,0]=3 394 B4R0.2 CSCCO 62a_200000210301_100000211926 [2,0,0,0,0,0|1,0,0]=3 395 B4R0.2 [13CH3]NCCF 34a_100000724931_200025704644 [2,0,0,0,0,0|1,0,1]=4 396 B4R0.2 [13CH3]NCCO 2230a_100016997473_200025704644 [2,0,0,0,0,0|0,0,1]=3 397 B4R0.2 [13CH3]NCCO 34a_100016990907_200025704644 [2,0,0,0,0,0|0,0,1]=3 398 B4R0.2 [13CH3]OCCBr 34a_100000211926_200025704644 [2,0,0,0,0,0|2,0,0]=4 399 B4R0.2 [13CH3]OCCN 34a_100000210304_200025704644 [2,0,0,0,0,0|2,0,0]=4 400 B4R0.2 [13CH3]SCCF 62a_100011217306_200025704644 [2,0,0,0,0,0|2,0,0]=4 401 B4R0.2 [13CH3]SCCF 62a_200025704644_100011217306 [2,0,0,0,0,0|2,0,0]=4 402 B4R0.2 [13CH3]SCCO 62a_100000211926_200025704644 [2,0,0,0,0,0|1,0,0]=3 403 B4R0.2 [13CH3]SCCO 62a_200025704644_100000211926 [2,0,0,0,0,0|1,0,0]=3 404 B6R0.1 CC(CCBr)O[13CH3] 34a_100012276601_200025704644 [1,1,0,0,0,0|2,0,0]=4 405 B6R0.1 CC(CCO)S[13CH3] 62a_100009893172_200025704644 [1,1,0,0,0,0|1,0,0]=3 406 B6R0.1 CC(CCO)S[13CH3] 62a_200025704644_100009893172 [1,1,0,0,0,0|1,0,0]=3 407 B6R0.1 CCC(=O)CCO 1458a_100000210414_100000211926 [1,1,0,0,0,0|2,0,0]=4 408 B6R0.1 CCC(=O)CCO 1458a_100011216618_100000210202 [1,1,0,0,0,0|2,0,0]=4 409 B6R0.1 CCCC(C)NC 2230a_100000741246_200000210301 [1,1,0,0,0,0|2,0,0]=4 410 B6R0.1 CCCC(C)NC 2230a_106832991635_100000766640 [1,1,0,0,0,0|2,0,0]=4 411 B6R0.1 CCCC(C)NC 270004a_106832991635_100000211909 [1,1,0,0,0,0|2,0,0]=4 412 B6R0.1 CCCC(C)NC 34a_100102657272_100000766640 [1,1,0,0,0,0|2,0,0]=4 413 B6R0.1 CCCC(C)NC 7a_106832991635_100000766640 [1,1,0,0,0,0|2,0,0]=4 414 B6R0.1 CCCC(C)N[13CH3] 2230a_100000741246_200025704644 [1,1,0,0,0,0|2,0,0]=4 415 B6R0.1 CCCC(C)OC 34a_100000764384_200000210301 [1,1,0,0,0,0|2,0,0]=4 416 B6R0.1 CCCC(C)OC 34a_100138415774_100000766640 [1,1,0,0,0,0|2,0,0]=4 417 B6R0.1 CCCC(C)OC 7a_100000764384_200000210301 [1,1,0,0,0,0|2,0,0]=4 418 B6R0.1 CCCC(C)O[13CH3] 34a_100000764384_200025704644 [1,1,0,0,0,0|2,0,0]=4 419 B6R0.1 CCCC(C)O[13CH3] 7a_100000764384_200025704644 [1,1,0,0,0,0|2,0,0]=4 420 B6R0.1 CCCC(C)SC 62a_100000766640_200000210301 [1,1,0,0,0,0|2,0,0]=4 421 B6R0.1 CCCC(C)SC 62a_200000210301_100000766640 [1,1,0,0,0,0|2,0,0]=4 422 B6R0.1 CCCC(C)S[13CH3] 62a_100000766640_200025704644 [1,1,0,0,0,0|2,0,0]=4 423 B6R0.1 CCCC(C)S[13CH3] 62a_200025704644_100000766640 [1,1,0,0,0,0|2,0,0]=4 424 B6R0.1 CCCN(C)CC 2230a_100000225621_100000210303 [1,1,0,0,0,0|1,0,1]=4 425 B6R0.1 CCCN(C)CC 2230a_100000226822_200000210301 [1,1,0,0,0,0|1,0,1]=4 426 B6R0.1 CCCN(C)CC 2230a_100000747261_100000210202 [1,1,0,0,0,0|1,0,1]=4 427 B6R0.1 CCCN(C)CC 269982a_100000225621_100000210303 [1,1,0,0,0,0|1,0,1]=4 428 B6R0.1 CCCN(C)CC 269982a_100000226822_200000210301 [1,1,0,0,0,0|1,0,1]=4 429 B6R0.1 CCCN(C)CC 269982a_100000747261_100000204670 [1,1,0,0,0,0|1,0,1]=4 430 B6R0.1 CCCN(C)CF 269982a_100000747261_100015361967 [1,1,0,0,0,0|1,0,1]=4 431 B6R0.1 CCCN([13CH3])CC 2230a_100000226822_200025704644 [1,1,0,0,0,0|1,0,1]=4 432 B6R0.1 CCCN([13CH3])CC 269982a_100000226822_200025704644 [1,1,0,0,0,0|1,0,1]=4 433 B6R0.1 CCN(C)CCF 2230a_100000225621_100011217306 [1,1,0,0,0,0|1,0,1]=4 434 B6R0.1 CCN(C)CCF 269982a_100000225621_100011217306 [1,1,0,0,0,0|1,0,1]=4 435 B6R0.1 CCN(C)CCO 2230a_100000210263_100000210202 [1,1,0,0,0,0|0,0,1]=3 436 B6R0.1 CCN(C)CCO 2230a_100000210973_200000210301 [1,1,0,0,0,0|0,0,1]=3 437 B6R0.1 CCN(C)CCO 2230a_100000225621_100000211926 [1,1,0,0,0,0|0,0,1]=3 438 B6R0.1 CCN(C)CCO 269982a_100000210263_100000204670 [1,1,0,0,0,0|0,0,1]=3 439 B6R0.1 CCN(C)CCO 269982a_100000210973_200000210301 [1,1,0,0,0,0|0,0,1]=3 440 B6R0.1 CCN(C)CCO 269982a_100000225621_100000211926 [1,1,0,0,0,0|0,0,1]=3 441 B6R0.1 CCN([13CH3])CCO 2230a_100000210973_200025704644 [1,1,0,0,0,0|0,0,1]=3 442 B6R0.1 CCN([13CH3])CCO 269982a_100000210973_200025704644 [1,1,0,0,0,0|0,0,1]=3 443 B6R0.1 CN(CF)CCO 269982a_100000210263_100015361967 [1,1,0,0,0,0|0,0,1]=3 444 B6R0.1 CNC(=O)CCO 240690a_100102657272_100011216618 [1,1,0,0,0,0|2,0,0]=4 445 B6R0.1 CNC(C)CCO 2230a_106832991635_100009893172 [1,1,0,0,0,0|1,0,0]=3 446 B6R0.1 CNC(C)CCO 34a_100102657272_100009893172 [1,1,0,0,0,0|1,0,0]=3 447 B6R0.1 CNC(C)CCO 7a_106832991635_100009893172 [1,1,0,0,0,0|1,0,0]=3 448 B6R0.1 CN[C@H](C)CCO 2230a_100000706166_200000210301 [1,1,0,0,0,0|1,0,0]=3 449 B6R0.1 CN[C@H](C)CCO 34a_100000706166_200000210301 [1,1,0,0,0,0|1,0,0]=3 450 B6R0.1 COC(C)CCBr 34a_100012276601_200000210301 [1,1,0,0,0,0|2,0,0]=4 451 B6R0.1 COC(C)CCO 34a_100138415774_100009893172 [1,1,0,0,0,0|1,0,0]=3 452 B6R0.1 CSC(C)CCO 62a_100009893172_200000210301 [1,1,0,0,0,0|1,0,0]=3 453 B6R0.1 CSC(C)CCO 62a_200000210301_100009893172 [1,1,0,0,0,0|1,0,0]=3 454 B6R0.1 C[C@H](CCO)N[13CH3] 2230a_100000706166_200025704644 [1,1,0,0,0,0|1,0,0]=3 455 B6R0.1 C[C@H](CCO)N[13CH3] 34a_100000706166_200025704644 [1,1,0,0,0,0|1,0,0]=3 456 B6R0.1 O=C(CF)CCO 1458a_100011216618_100015361967 [1,1,0,0,0,0|2,0,0]=4 457 B6R0.1 O=C(CO)CCO 1458a_100000210174_100000211926 [1,1,0,0,0,0|2,0,0]=4 458 B6R0.2 CC(=O)CC(C)O 1458a_100000070787_100011218427 [1,1,0,0,0,0|2,0,0]=4 459 B6R0.2 CC(=O)C[C@@H](C)O 1458a_100011933948_200000210301 [1,1,0,0,0,0|2,0,0]=4 460 B6R0.2 CC(C)CN(C)C 2230a_100000747067_200000210301 [1,1,0,0,0,0|1,0,1]=4 461 B6R0.2 CC(C)CN(C)C 2230a_100102631434_100000210760 [1,1,0,0,0,0|1,0,1]=4 462 B6R0.2 CC(C)CN(C)C 269982a_100000747067_200000210301 [1,1,0,0,0,0|1,0,1]=4 463 B6R0.2 CC(C)CN(C)C 269982a_100102631434_100000210624 [1,1,0,0,0,0|1,0,1]=4 464 B6R0.2 CC(C)CN(C)C 270004a_100102631434_100000210432 [1,1,0,0,0,0|1,0,1]=4 465 B6R0.2 CC(C)CN(C)[13CH3] 2230a_100000747067_200025704644 [1,1,0,0,0,0|1,0,1]=4 466 B6R0.2 CC(C)CN(C)[13CH3] 269982a_100000747067_200025704644 [1,1,0,0,0,0|1,0,1]=4 467 B6R0.2 CC(O)CN(C)C 2230a_100000227577_200000210301 [1,1,0,0,0,0|0,0,1]=3 468 B6R0.2 CC(O)CN(C)C 2230a_100102631434_100011218427 [1,1,0,0,0,0|0,0,1]=3 469 B6R0.2 CC(O)CN(C)C 269982a_100000227577_200000210301 [1,1,0,0,0,0|0,0,1]=3 470 B6R0.2 CC(O)CN(C)C 269982a_100102631434_100011218427 [1,1,0,0,0,0|0,0,1]=3 471 B6R0.2 CC(O)CN(C)[13CH3] 2230a_100000227577_200025704644 [1,1,0,0,0,0|0,0,1]=3 472 B6R0.2 CC(O)CN(C)[13CH3] 269982a_100000227577_200025704644 [1,1,0,0,0,0|0,0,1]=3 473 B6R0.2 CN(C)CC(=O)O 269956a_100000746989_200000210301 [1,1,0,0,0,0|0,0,2]=4 474 B6R0.2 CN(C)CC(F)F 2230a_100102631434_100011934356 [1,1,0,0,0,0|1,0,1]=4 475 B6R0.2 CN(C)CC(F)F 269982a_100102631434_100011934356 [1,1,0,0,0,0|1,0,1]=4 476 B6R0.2 CN([13CH3])CC(=O)O 269956a_100000746989_200025704644 [1,1,0,0,0,0|0,0,2]=4 477 B6R0.2 C[C@@H](O)CC(=O)[13CH3] 1458a_100011933948_200025704644 [1,1,0,0,0,0|2,0,0]=4 478 B6R0.2 C[C@@H](O)CN(C)C 2230a_100102631434_100009817552 [1,1,0,0,0,0|0,0,1]=3 479 B6R0.2 C[C@@H](O)CN(C)C 269982a_100102631434_100009817552 [1,1,0,0,0,0|0,0,1]=3 480 B6R0.3 CC(=O)C(O)CO 1458a_100011215603_200000210301 [1,1,0,0,0,0|2,0,0]=4 481 B6R0.3 CC(C)C(=O)CO 1458a_100000210174_100000210206 [1,1,0,0,0,0|1,0,1]=4 482 B6R0.3 CC(CO)N(C)C 2230a_100000693034_200000210301 [1,1,0,0,0,0|0,0,1]=3 483 B6R0.3 CC(CO)N(C)C 2230a_100102631434_100012180447 [1,1,0,0,0,0|0,0,1]=3 484 B6R0.3 CC(CO)N(C)C 269982a_100000693034_200000210301 [1,1,0,0,0,0|0,0,1]=3 485 B6R0.3 CC(CO)N(C)[13CH3] 2230a_100000693034_200025704644 [1,1,0,0,0,0|0,0,1]=3 486 B6R0.3 CC(CO)N(C)[13CH3] 269982a_100000693034_200025704644 [1,1,0,0,0,0|0,0,1]=3 487 B6R0.3 CCC(C)N(C)C 2230a_100000741768_200000210301 [1,1,0,0,0,0|1,0,1]=4 488 B6R0.3 CCC(C)N(C)C 2230a_100102631434_100000758301 [1,1,0,0,0,0|1,0,1]=4 489 B6R0.3 CCC(C)N(C)C 269982a_100000741768_200000210301 [1,1,0,0,0,0|1,0,1]=4 490 B6R0.3 CCC(C)N(C)C 269982a_100102631434_100000758301 [1,1,0,0,0,0|1,0,1]=4 491 B6R0.3 CCC(C)N(C)[13CH3] 2230a_100000741768_200025704644 [1,1,0,0,0,0|1,0,1]=4 492 B6R0.3 CCC(C)N(C)[13CH3] 269982a_100000741768_200025704644 [1,1,0,0,0,0|1,0,1]=4 493 B6R0.3 CN(C)C(=O)CO 240690a_100102631434_100000210174 [1,1,0,0,0,0|0,0,2]=4 494 B6R0.3 CN(C)C(=O)CO 527a_100102631434_100000210174 [1,1,0,0,0,0|0,0,2]=4 495 B6R0.3 C[C@H](CO)N(C)C 269982a_100102631434_100016084084 [1,1,0,0,0,0|0,0,1]=3 496 B6R0.3 [13CH3]C(=O)C(O)CO 1458a_100011215603_200025704644 [1,1,0,0,0,0|2,0,0]=4 497 B6R0.4 C#CCCN(C)C 2230a_100102631434_100000688953 [1,1,0,0,0,0|1,0,1]=4 498 B6R0.4 C#CCCN(C)C 269982a_100102631434_100000730999 [1,1,0,0,0,0|1,0,1]=4 499 B6R0.4 C=C(C)CCOC 34a_100000764851_200000210301 [1,1,0,0,0,0|1,0,1]=4 500 B6R0.4 C=C(C)CCOC 34a_100138415774_100000730704 [1,1,0,0,0,0|1,0,1]=4 501 B6R0.4 C=C(C)CCO[13CH3] 34a_100000764851_200025704644 [1,1,0,0,0,0|1,0,1]=4 502 B6R0.4 C=CCCN(C)C 2230a_100020639649_200000210301 [1,1,0,0,0,0|1,0,1]=4 503 B6R0.4 C=CCCN(C)C 2230a_100102631434_100000754431 [1,1,0,0,0,0|1,0,1]=4 504 B6R0.4 C=CCCN(C)C 269982a_100020639649_200000210301 [1,1,0,0,0,0|1,0,1]=4 505 B6R0.4 C=CCCN(C)C 269982a_100102631434_100000754431 [1,1,0,0,0,0|1,0,1]=4 506 B6R0.4 C=CCCN(C)[13CH3] 2230a_100020639649_200025704644 [1,1,0,0,0,0|1,0,1]=4 507 B6R0.4 C=CCCN(C)[13CH3] 269982a_100020639649_200025704644 [1,1,0,0,0,0|1,0,1]=4 508 B6R0.4 CC(=CCO[13CH3])C 34a_100000753907_200025704644 [1,1,0,0,0,0|1,0,1]=4 509 B6R0.4 CC(=O)CCCO 1458a_100000070787_100011215043 [1,1,0,0,0,0|2,0,0]=4 510 B6R0.4 CC(=O)CCO[13CH3] 34a_100000759926_200025704644 [1,1,0,0,0,0|2,0,0]=4 511 B6R0.4 CC(=O)CCO[13CH3] 7a_100000759926_200025704644 [1,1,0,0,0,0|2,0,0]=4 512 B6R0.4 CC(=O)NCCO 240690a_100000210304_100015343762 [1,1,0,0,0,0|2,0,0]=4 513 B6R0.4 CC(=O)NCCO 527a_100000210304_100103153847 [1,1,0,0,0,0|2,0,0]=4 514 B6R0.4 CC(Br)CCO[13CH3] 34a_100009893172_200025704644 [1,1,0,0,0,0|2,0,0]=4 515 B6R0.4 CC(C)CCO[13CH3] 34a_100000210254_200025704644 [1,1,0,0,0,0|1,0,0]=3 516 B6R0.4 CC(C)CCO[13CH3] 7a_100000210254_200025704644 [1,1,0,0,0,0|1,0,0]=3 517 B6R0.4 CC(C)CCS[13CH3] 62a_100000210312_200025704644 [1,1,0,0,0,0|1,1,0]=4 518 B6R0.4 CC(C)CCS[13CH3] 62a_200025704644_100000210312 [1,1,0,0,0,0|1,1,0]=4 519 B6R0.4 CC(C)CNCF 34a_100000210953_100015361967 [1,1,0,0,0,0|2,0,0]=4 520 B6R0.4 CC(C)COCF 34a_100000210257_100015361967 [1,1,0,0,0,0|2,0,0]=4 521 B6R0.4 CC(C)CSCF 62a_100000210624_100015361967 [1,1,0,0,0,0|2,0,0]=4 522 B6R0.4 CC(C)CSCF 62a_100015361967_100000210760 [1,1,0,0,0,0|2,0,0]=4 523 B6R0.4 CC(C)NCCF 2230a_100138425928_100011217306 [1,1,0,0,0,0|2,0,0]=4 524 B6R0.4 CC(C)NCCF 34a_100000724931_100000210206 [1,1,0,0,0,0|2,0,0]=4 525 B6R0.4 CC(C)NCCF 34a_100138425928_100011217306 [1,1,0,0,0,0|2,0,0]=4 526 B6R0.4 CC(C)NCCO 2230a_100016997473_100000210206 [1,1,0,0,0,0|1,0,0]=3 527 B6R0.4 CC(C)NCCO 2230a_100138425928_100000211926 [1,1,0,0,0,0|1,0,0]=3 528 B6R0.4 CC(C)NCCO 34a_100016990907_100000210206 [1,1,0,0,0,0|1,0,0]=3 529 B6R0.4 CC(C)NCCO 34a_100138425928_100000211926 [1,1,0,0,0,0|1,0,0]=3 530 B6R0.4 CC(C)OCCBr 34a_100000211926_100000210206 [1,1,0,0,0,0|2,0,0]=4 531 B6R0.4 CC(C)OCCF 34a_100000212225_100011217306 [1,1,0,0,0,0|2,0,0]=4 532 B6R0.4 CC(C)OCCN 34a_100000210304_100000210206 [1,1,0,0,0,0|2,0,0]=4 533 B6R0.4 CC(C)OCCO 34a_100000212225_100000211926 [1,1,0,0,0,0|1,0,0]=3 534 B6R0.4 CC(C)SCCF 62a_100000210206_100011217306 [1,1,0,0,0,0|2,0,0]=4 535 B6R0.4 CC(C)SCCF 62a_100011217306_100000210206 [1,1,0,0,0,0|2,0,0]=4 536 B6R0.4 CC(C)SCCO 62a_100000210206_100000211926 [1,1,0,0,0,0|1,0,0]=3 537 B6R0.4 CC(C)SCCO 62a_100000211926_100000210206 [1,1,0,0,0,0|1,0,0]=3 538 B6R0.4 CCCCN(C)C 2230a_100000207549_200000210301 [1,1,0,0,0,0|1,0,1]=4 539 B6R0.4 CCCCN(C)C 2230a_100102631434_100000210211 [1,1,0,0,0,0|1,0,1]=4 540 B6R0.4 CCCCN(C)C 269982a_100000207549_200000210301 [1,1,0,0,0,0|1,0,1]=4 541 B6R0.4 CCCCN(C)C 269982a_100102631434_100000210211 [1,1,0,0,0,0|1,0,1]=4 542 B6R0.4 CCCCN(C)[13CH3] 2230a_100000207549_200025704644 [1,1,0,0,0,0|1,0,1]=4 543 B6R0.4 CCCCN(C)[13CH3] 269982a_100000207549_200025704644 [1,1,0,0,0,0|1,0,1]=4 544 B6R0.4 CCCNC(C)C 2230a_100138425928_100000210303 [1,1,0,0,0,0|2,0,0]=4 545 B6R0.4 CCCNC(C)C 34a_100138425928_100000210303 [1,1,0,0,0,0|2,0,0]=4 546 B6R0.4 CCCOC(C)C 34a_100000210258_100000210206 [1,1,0,0,0,0|2,0,0]=4 547 B6R0.4 CCCOC(C)C 34a_100000212225_100000210303 [1,1,0,0,0,0|2,0,0]=4 548 B6R0.4 CCCSC(C)C 62a_100000210206_100000210303 [1,1,0,0,0,0|2,0,0]=4 549 B6R0.4 CCCSC(C)C 62a_100000210303_100000210206 [1,1,0,0,0,0|2,0,0]=4 550 B6R0.4 CCNCC(C)C 2230a_100000210953_100000210202 [1,1,0,0,0,0|2,0,0]=4 551 B6R0.4 CCNCC(C)C 2230a_100015525214_100000210760 [1,1,0,0,0,0|2,0,0]=4 552 B6R0.4 CCNCC(C)C 270004a_100015525214_100000210432 [1,1,0,0,0,0|2,0,0]=4 553 B6R0.4 CCNCC(C)C 34a_100000210953_100000210202 [1,1,0,0,0,0|2,0,0]=4 554 B6R0.4 CCOCC(C)C 34a_100000210257_100000210202 [1,1,0,0,0,0|2,0,0]=4 555 B6R0.4 CCOCC(C)C 34a_100121572206_100000210624 [1,1,0,0,0,0|2,0,0]=4 556 B6R0.4 CCOCN(C)C 269982a_100102631434_100000739092 [1,1,0,0,0,0|1,0,1]=4 557 B6R0.4 CCSCC(C)C 62a_100000210202_100000210760 [1,1,0,0,0,0|2,0,0]=4 558 B6R0.4 CCSCC(C)C 62a_100000210624_100000210202 [1,1,0,0,0,0|2,0,0]=4 559 B6R0.4 CN(C)CCC#N 2230a_100000184479_200000210301 [1,1,0,0,0,0|1,0,1]=4 560 B6R0.4 CN(C)CCC#N 2230a_100102631434_100011215226 [1,1,0,0,0,0|1,0,1]=4 561 B6R0.4 CN(C)CCC#N 269982a_100102631434_100011215226 [1,1,0,0,0,0|1,0,1]=4 562 B6R0.4 CN(C)CCCF 2230a_100102631434_100011934791 [1,1,0,0,0,0|1,0,1]=4 563 B6R0.4 CN(C)CCCF 269982a_100102631434_100011934791 [1,1,0,0,0,0|1,0,1]=4 564 B6R0.4 CN(C)CCCO 2230a_100000213112_200000210301 [1,1,0,0,0,0|0,0,1]=3 565 B6R0.4 CN(C)CCCO 2230a_100102631434_100000230001 [1,1,0,0,0,0|0,0,1]=3 566 B6R0.4 CN(C)CCCO 269982a_100000213112_200000210301 [1,1,0,0,0,0|0,0,1]=3 567 B6R0.4 CN(C)CCCO 269982a_100102631434_100011215043 [1,1,0,0,0,0|0,0,1]=3 568 B6R0.4 CN(C)CCS[13CH3] 62a_200025704644_100000755713 [1,1,0,0,0,0|0,1,1]=4 569 B6R0.4 CN([13CH3])CCC#N 2230a_100000184479_200025704644 [1,1,0,0,0,0|1,0,1]=4 570 B6R0.4 CN([13CH3])CCCO 2230a_100000213112_200025704644 [1,1,0,0,0,0|0,0,1]=3 571 B6R0.4 CN([13CH3])CCCO 269982a_100000213112_200025704644 [1,1,0,0,0,0|0,0,1]=3 572 B6R0.4 CNCCC(C)C 2230a_106832991635_100000210312 [1,1,0,0,0,0|2,0,0]=4 573 B6R0.4 CNCCC(C)C 269862a_106832991636_100000185833 [1,1,0,0,0,0|2,0,0]=4 574 B6R0.4 CNCCC(C)C 34a_100102657272_100000210312 [1,1,0,0,0,0|2,0,0]=4 575 B6R0.4 CNCCC(C)C 7a_106832991635_100000210626 [1,1,0,0,0,0|2,0,0]=4 576 B6R0.4 CNCCN(C)C 7a_106832991635_100000755713 [1,1,0,0,0,0|1,0,1]=4 577 B6R0.4 COCC=C(C)C 34a_100000753907_200000210301 [1,1,0,0,0,0|1,0,1]=4 578 B6R0.4 COCC=C(C)C 34a_100138415774_100000761012 [1,1,0,0,0,0|1,0,1]=4 579 B6R0.4 COCCC(=O)C 1458a_100000070787_100000233755 [1,1,0,0,0,0|2,0,0]=4 580 B6R0.4 COCCC(=O)C 1458a_100000749529_200000210301 [1,1,0,0,0,0|2,0,0]=4 581 B6R0.4 COCCC(=O)C 34a_100000759926_200000210301 [1,1,0,0,0,0|2,0,0]=4 582 B6R0.4 COCCC(=O)C 7a_100000759926_200000210301 [1,1,0,0,0,0|2,0,0]=4 583 B6R0.4 COCCC(=O)[13CH3] 1458a_100000749529_200025704644 [1,1,0,0,0,0|2,0,0]=4 584 B6R0.4 COCCC(C)Br 34a_100009893172_200000210301 [1,1,0,0,0,0|2,0,0]=4 585 B6R0.4 COCCC(C)C 34a_100000210254_200000210301 [1,1,0,0,0,0|1,0,0]=3 586 B6R0.4 COCCC(C)C 34a_100138415774_100000210312 [1,1,0,0,0,0|1,0,0]=3 587 B6R0.4 COCCC(C)C 7a_100000210254_200000210301 [1,1,0,0,0,0|1,0,0]=3 588 B6R0.4 COCCC(C)O 34a_100138415774_100012276601 [1,1,0,0,0,0|2,0,0]=4 589 B6R0.4 COCCN(C)C 2230a_100000743101_200000210301 [1,1,0,0,0,0|0,0,1]=3 590 B6R0.4 COCCN(C)C 2230a_100102631434_100011201679 [1,1,0,0,0,0|0,0,1]=3 591 B6R0.4 COCCN(C)C 269982a_100000743101_200000210301 [1,1,0,0,0,0|0,0,1]=3 592 B6R0.4 COCCN(C)C 269982a_100102631434_100000233755 [1,1,0,0,0,0|0,0,1]=3 593 B6R0.4 COCCN(C)[13CH3] 2230a_100000743101_200025704644 [1,1,0,0,0,0|0,0,1]=3 594 B6R0.4 COCCN(C)[13CH3] 269982a_100000743101_200025704644 [1,1,0,0,0,0|0,0,1]=3 595 B6R0.4 COCC[C@@H](C)N 34a_100000706166_200000210301 [1,1,0,0,0,0|2,0,0]=4 596 B6R0.4 COCNC(C)C 2230a_100138425928_100000766300 [1,1,0,0,0,0|2,0,0]=4 597 B6R0.4 COCOC(C)C 34a_100138415774_100000709892 [1,1,0,0,0,0|2,0,0]=4 598 B6R0.4 COCSC(C)C 62a_100000210206_100000766300 [1,1,0,0,0,0|2,0,0]=4 599 B6R0.4 COCSC(C)C 62a_100000766300_100000210206 [1,1,0,0,0,0|2,0,0]=4 600 B6R0.4 CSCCC(C)C 62a_100000210312_200000210301 [1,1,0,0,0,0|1,1,0]=4 601 B6R0.4 CSCCC(C)C 62a_200000210301_100000210312 [1,1,0,0,0,0|1,1,0]=4 602 B6R0.4 CSCCN(C)C 2230a_100000686725_200000210301 [1,1,0,0,0,0|0,1,1]=4 603 B6R0.4 CSCCN(C)C 2230a_100102631434_100000751147 [1,1,0,0,0,0|0,1,1]=4 604 B6R0.4 CSCCN(C)C 269982a_100000686725_200000210301 [1,1,0,0,0,0|0,1,1]=4 605 B6R0.4 CSCCN(C)C 269982a_100102631434_100000212216 [1,1,0,0,0,0|0,1,1]=4 606 B6R0.4 CSCCN(C)C 62a_200000210301_100000755713 [1,1,0,0,0,0|0,1,1]=4 607 B6R0.4 CSCCN(C)[13CH3] 2230a_100000686725_200025704644 [1,1,0,0,0,0|0,1,1]=4 608 B6R0.4 CSCCN(C)[13CH3] 269982a_100000686725_200025704644 [1,1,0,0,0,0|0,1,1]=4 609 B6R0.4 C[C@@H](N)CCO[13CH3] 34a_100000706166_200025704644 [1,1,0,0,0,0|2,0,0]=4 610 B6R0.7 CC(=O)C(C)(C)C 1458a_106744555173_200000210301 [1,1,0,0,0,0|1,0,1]=4 611 B6R0.7 CC(C)(C)C(=O)[13CH3] 1458a_106744555173_200025704644 [1,1,0,0,0,0|1,0,1]=4 612 B6R0.7 CN(C)C(C)(C)C 269982a_100011215553_200000210301 [1,1,0,0,0,0|2,0,0]=4 613 B6R0.7 CN(C)C(C)(C)C 269982a_100102631434_100000210625 [1,1,0,0,0,0|2,0,0]=4 614 B6R0.7 CN([13CH3])C(C)(C)C 269982a_100011215553_200025704644 [1,1,0,0,0,0|2,0,0]=4 615 B6R0.8 CC(C)(CCl)O[13CH3] 7a_100000764493_200025704644 [1,1,0,0,0,0|2,0,0]=4 616 B6R0.8 CC(C)(CO)N[13CH3] 2230a_100000210608_200025704644 [1,1,0,0,0,0|1,0,0]=3 617 B6R0.8 CCC(C)(C)NC 2230a_100000211385_200000210301 [1,1,0,0,0,0|1,0,0]=3 618 B6R0.8 CCC(C)(C)NC 7a_106832991635_100000210677 [1,1,0,0,0,0|1,0,0]=3 619 B6R0.8 CCC(C)(C)N[13CH3] 2230a_100000211385_200025704644 [1,1,0,0,0,0|1,0,0]=3 620 B6R0.8 CCC(C)(C)OC 7a_100000210230_200000210301 [1,1,0,0,0,0|1,0,0]=3 621 B6R0.8 CCC(C)(C)O[13CH3] 7a_100000210230_200025704644 [1,1,0,0,0,0|1,0,0]=3 622 B6R0.8 CCC(C)(C)SC 62a_100000032637_200000210301 [1,1,0,0,0,0|1,0,0]=3 623 B6R0.8 CCC(C)(C)SC 62a_200000210301_100000032637 [1,1,0,0,0,0|1,0,0]=3 624 B6R0.8 CCC(C)(C)S[13CH3] 62a_100000032637_200025704644 [1,1,0,0,0,0|1,0,0]=3 625 B6R0.8 CCC(C)(C)S[13CH3] 62a_200025704644_100000032637 [1,1,0,0,0,0|1,0,0]=3 626 B6R0.8 CNC(C)(C)CO 2230a_100000210608_200000210301 [1,1,0,0,0,0|1,0,0]=3 627 B6R0.8 COC(C)(C)CCl 7a_100000764493_200000210301 [1,1,0,0,0,0|2,0,0]=4 628 B8R0.14 CC(C)(C)C(=O)CCF 1458a_106744555173_100011217306 [0,2,0,0,0,0|2,0,0]=4 629 B8R0.14 CC(C)(C)C(=O)CCO 1458a_106744555173_100000211926 [0,2,0,0,0,0|1,0,0]=3 630 B8R0.14 CC(C)(C)C(=O)CO[13CH3] 34a_200011592769_200025704644 [0,2,0,0,0,0|1,0,1]=4 631 B8R0.14 CC(C)(C)C(=O)CO[13CH3] 7a_200011592769_200025704644 [0,2,0,0,0,0|1,0,1]=4 632 B8R0.14 CC(C)(C)N([13CH3])CCO 2230a_100011215626_200025704644 [0,2,0,0,0,0|1,0,0]=3 633 B8R0.14 CC(C)(C)N([13CH3])CCO 269982a_100011215626_200025704644 [0,2,0,0,0,0|1,0,0]=3 634 B8R0.14 CC(C)(F)C(=O)CCO 1458a_100000765255_100000211926 [0,2,0,0,0,0|2,0,0]=4 635 B8R0.14 CC(C)(O)C(=O)CCO 1458a_100000242741_100000211926 [0,2,0,0,0,0|2,0,0]=4 636 B8R0.14 CCCC(=O)C(C)(C)C 1458a_106744555173_100000210303 [0,2,0,0,0,0|2,0,0]=4 637 B8R0.14 CCCN(C)C(C)(C)C 2230a_100000743177_200000210301 [0,2,0,0,0,0|2,0,0]=4 638 B8R0.14 CCCN(C)C(C)(C)C 269982a_100000743177_200000210301 [0,2,0,0,0,0|2,0,0]=4 639 B8R0.14 CCCN(C)C(C)(C)C 269982a_100000747261_100000210625 [0,2,0,0,0,0|2,0,0]=4 640 B8R0.14 CCCN(C)C(C)(C)C 269982a_100011215553_100000210303 [0,2,0,0,0,0|2,0,0]=4 641 B8R0.14 CCCN([13CH3])C(C)(C)C 2230a_100000743177_200025704644 [0,2,0,0,0,0|2,0,0]=4 642 B8R0.14 CCCN([13CH3])C(C)(C)C 269982a_100000743177_200025704644 [0,2,0,0,0,0|2,0,0]=4 643 B8R0.14 CCN[C@H](C)C(C)(C)C 2230a_100025703359_100000210202 [0,2,0,0,0,0|2,0,0]=4 644 B8R0.14 CN(CCF)C(C)(C)C 269982a_100011215553_100011217306 [0,2,0,0,0,0|2,0,0]=4 645 B8R0.14 CN(CCO)C(C)(C)C 2230a_100011215626_200000210301 [0,2,0,0,0,0|1,0,0]=3 646 B8R0.14 CN(CCO)C(C)(C)C 269982a_100000210263_100000210625 [0,2,0,0,0,0|1,0,0]=3 647 B8R0.14 CN(CCO)C(C)(C)C 269982a_100011215553_100000211926 [0,2,0,0,0,0|1,0,0]=3 648 B8R0.14 CN(CCO)C(C)(C)C 269982a_100011215626_200000210301 [0,2,0,0,0,0|1,0,0]=3 649 B8R0.14 COCC(=O)C(C)(C)C 34a_100138415774_100000229897 [0,2,0,0,0,0|1,0,1]=4 650 B8R0.14 COCC(=O)C(C)(C)C 34a_200011592769_200000210301 [0,2,0,0,0,0|1,0,1]=4 651 B8R0.14 COCC(=O)C(C)(C)C 7a_200011592769_200000210301 [0,2,0,0,0,0|1,0,1]=4 652 B8R0.14 COCN(C)C(C)(C)C 269982a_100011215553_100000766300 [0,2,0,0,0,0|2,0,0]=4 653 B8R0.21 C#CCCNC(C)(C)C 2230a_100000715429_100000688953 [0,2,0,0,0,0|2,0,0]=4 654 B8R0.21 C#CCCNC(C)(C)C 34a_100000755551_100000210625 [0,2,0,0,0,0|2,0,0]=4 655 B8R0.21 C#CCCOC(C)(C)C 34a_100011215631_100000210625 [0,2,0,0,0,0|2,0,0]=4 656 B8R0.21 C#CCCOC(C)(C)C 34a_100015890283_100000688953 [0,2,0,0,0,0|2,0,0]=4 657 B8R0.21 C#CCCOC(C)(C)C 7a_100015890283_100000688953 [0,2,0,0,0,0|2,0,0]=4 658 B8R0.21 C#CCCSC(C)(C)C 62a_100000211941_100000688953 [0,2,0,0,0,0|2,0,0]=4 659 B8R0.21 C#CCCSC(C)(C)C 62a_100000688953_100000211941 [0,2,0,0,0,0|2,0,0]=4 660 B8R0.21 C#CCNCC(C)(C)C 2230a_100000743828_100000038162 [0,2,0,0,0,0|2,0,0]=4 661 B8R0.21 C#CCNCC(C)(C)C 34a_100000212058_100011219605 [0,2,0,0,0,0|2,0,0]=4 662 B8R0.21 C#CCOCC(C)(C)C 34a_100000210247_100011219605 [0,2,0,0,0,0|2,0,0]=4 663 B8R0.21 C#CCSCC(C)(C)C 62a_100000038162_100011219605 [0,2,0,0,0,0|2,0,0]=4 664 B8R0.21 C#CCSC[N+](C)(C)C 62a_100000038162_200000036245 [0,2,0,0,0,0|1,0,0]=3 665 B8R0.21 C#CCSC[Si](C)(C)C 62a_100000038162_100000037933 [0,2,0,0,0,0|2,0,0]=4 666 B8R0.21 C=CCCNC(C)(C)C 2230a_100000715429_100000754431 [0,2,0,0,0,0|2,0,0]=4 667 B8R0.21 C=CCCOC(C)(C)C 34a_100011205117_100000210625 [0,2,0,0,0,0|2,0,0]=4 668 B8R0.21 C=CCCOC(C)(C)C 34a_100015890283_100000754431 [0,2,0,0,0,0|2,0,0]=4 669 B8R0.21 C=CCCOC(C)(C)C 7a_100015890283_100000754431 [0,2,0,0,0,0|2,0,0]=4 670 B8R0.21 C=CCCSC(C)(C)C 62a_100000211941_100000754431 [0,2,0,0,0,0|2,0,0]=4 671 B8R0.21 C=CCCSC(C)(C)C 62a_100000754431_100000211941 [0,2,0,0,0,0|2,0,0]=4 672 B8R0.21 C=CCNCC(C)(C)C 2230a_100000743828_100000210623 [0,2,0,0,0,0|2,0,0]=4 673 B8R0.21 C=CCNCC(C)(C)C 270004a_100020586998_100011204126 [0,2,0,0,0,0|2,0,0]=4 674 B8R0.21 C=CCNC[Si](C)(C)C 2230a_100020586998_100000037933 [0,2,0,0,0,0|2,0,0]=4 675 B8R0.21 C=CCOCC(C)(C)C 34a_200000210373_100011219605 [0,2,0,0,0,0|2,0,0]=4 676 B8R0.21 C=CCSCC(C)(C)C 62a_100000210623_100011219605 [0,2,0,0,0,0|2,0,0]=4 677 B8R0.21 C=CCSCC(C)(C)C 62a_100011219605_100000210623 [0,2,0,0,0,0|2,0,0]=4 678 B8R0.21 C=CCSC[N+](C)(C)C 62a_100000210623_200000036245 [0,2,0,0,0,0|1,0,0]=3 679 B8R0.21 C=CCSC[N+](C)(C)C 62a_200000036245_100000210623 [0,2,0,0,0,0|1,0,0]=3 680 B8R0.21 C=CCSC[Si](C)(C)C 62a_100000037933_100000210623 [0,2,0,0,0,0|2,0,0]=4 681 B8R0.21 C=CCSC[Si](C)(C)C 62a_100000210623_100000037933 [0,2,0,0,0,0|2,0,0]=4 682 B8R0.21 CC(C)(C)CCOCF 7a_100000765024_100015361967 [0,2,0,0,0,0|1,0,0]=3 683 B8R0.21 CC(C)(C)CCSCF 62a_100000755188_100015361967 [0,2,0,0,0,0|1,1,0]=4 684 B8R0.21 CC(C)(C)CCSCF 62a_100015361967_100000755188 [0,2,0,0,0,0|1,1,0]=4 685 B8R0.21 CC(C)(C)CNCC#N 2230a_100000743828_100011215382 [0,2,0,0,0,0|2,0,0]=4 686 B8R0.21 CC(C)(C)CNCC=O 2230a_100000743828_200015260668 [0,2,0,0,0,0|1,0,1]=4 687 B8R0.21 CC(C)(C)CNCCF 2230a_100000743828_100011217306 [0,2,0,0,0,0|2,0,0]=4 688 B8R0.21 CC(C)(C)CNCCF 34a_100000724931_100011219605 [0,2,0,0,0,0|2,0,0]=4 689 B8R0.21 CC(C)(C)CNCCO 2230a_100000743828_100000211926 [0,2,0,0,0,0|1,0,0]=3 690 B8R0.21 CC(C)(C)CNCCO 270004a_100000210304_100011204126 [0,2,0,0,0,0|1,0,0]=3 691 B8R0.21 CC(C)(C)CNCCO 34a_100016990907_100011219605 [0,2,0,0,0,0|1,0,0]=3 692 B8R0.21 CC(C)(C)COCCBr 34a_100000211926_100011219605 [0,2,0,0,0,0|2,0,0]=4 693 B8R0.21 CC(C)(C)COCCN 34a_100000210304_100011219605 [0,2,0,0,0,0|2,0,0]=4 694 B8R0.21 CC(C)(C)CSCC#N 62a_100011215382_100011219605 [0,2,0,0,0,0|2,0,0]=4 695 B8R0.21 CC(C)(C)CSCC#N 62a_100011219605_100011215382 [0,2,0,0,0,0|2,0,0]=4 696 B8R0.21 CC(C)(C)CSCC=O 62a_100011219605_200015260668 [0,2,0,0,0,0|1,0,1]=4 697 B8R0.21 CC(C)(C)CSCC=O 62a_200015260668_100011219605 [0,2,0,0,0,0|1,0,1]=4 698 B8R0.21 CC(C)(C)CSCCF 62a_100011217306_100011219605 [0,2,0,0,0,0|2,0,0]=4 699 B8R0.21 CC(C)(C)CSCCF 62a_100011219605_100011217306 [0,2,0,0,0,0|2,0,0]=4 700 B8R0.21 CC(C)(C)CSCCO 62a_100000211926_100011219605 [0,2,0,0,0,0|1,0,0]=3 701 B8R0.21 CC(C)(C)CSCCO 62a_100011219605_100000211926 [0,2,0,0,0,0|1,0,0]=3 702 B8R0.21 CC(C)(C)NCCC#N 2230a_100000715429_100011215226 [0,2,0,0,0,0|2,0,0]=4 703 B8R0.21 CC(C)(C)NCCCF 2230a_100000715429_100011934791 [0,2,0,0,0,0|2,0,0]=4 704 B8R0.21 CC(C)(C)NCCCF 34a_100015189416_100000210625 [0,2,0,0,0,0|2,0,0]=4 705 B8R0.21 CC(C)(C)NCCCO 2230a_100000715429_100000230001 [0,2,0,0,0,0|1,0,0]=3 706 B8R0.21 CC(C)(C)OCCC#N 7a_100015890283_100000184422 [0,2,0,0,0,0|2,0,0]=4 707 B8R0.21 CC(C)(C)OCCCBr 34a_100011217188_100000210625 [0,2,0,0,0,0|2,0,0]=4 708 B8R0.21 CC(C)(C)OCCCCl 34a_100000230001_100000210625 [0,2,0,0,0,0|2,0,0]=4 709 B8R0.21 CC(C)(C)OCCCF 34a_100000759539_100000210625 [0,2,0,0,0,0|2,0,0]=4 710 B8R0.21 CC(C)(C)OCCCF 34a_100015890283_100011934791 [0,2,0,0,0,0|2,0,0]=4 711 B8R0.21 CC(C)(C)OCCCF 7a_100015890283_100011934791 [0,2,0,0,0,0|2,0,0]=4 712 B8R0.21 CC(C)(C)OCCCN 34a_100000182051_100000210625 [0,2,0,0,0,0|2,0,0]=4 713 B8R0.21 CC(C)(C)OCCCO 34a_100015890283_100000230001 [0,2,0,0,0,0|1,0,0]=3 714 B8R0.21 CC(C)(C)OCCCO 7a_100015890283_100011215043 [0,2,0,0,0,0|1,0,0]=3 715 B8R0.21 CC(C)(C)OCCN[13CH3] 2230a_100000747557_200025704644 [0,2,0,0,0,0|2,0,0]=4 716 B8R0.21 CC(C)(C)OCCON 34a_100000700252_100000210625 [0,2,0,0,0,0|1,0,0]=3 717 B8R0.21 CC(C)(C)OCCO[13CH3] 34a_100000693234_200025704644 [0,2,0,0,0,0|1,0,0]=3 718 B8R0.21 CC(C)(C)OCCO[13CH3] 7a_100000693234_200025704644 [0,2,0,0,0,0|1,0,0]=3 719 B8R0.21 CC(C)(C)SCCC#N 62a_100000211941_100011215226 [0,2,0,0,0,0|2,0,0]=4 720 B8R0.21 CC(C)(C)SCCC#N 62a_100011215226_100000211941 [0,2,0,0,0,0|2,0,0]=4 721 B8R0.21 CC(C)(C)SCCCF 62a_100000211941_100011934791 [0,2,0,0,0,0|2,0,0]=4 722 B8R0.21 CC(C)(C)SCCCF 62a_100011934791_100000211941 [0,2,0,0,0,0|2,0,0]=4 723 B8R0.21 CC(C)(C)SCCCO 62a_100000211941_100011215043 [0,2,0,0,0,0|1,0,0]=3 724 B8R0.21 CC(C)(C)SCCCO 62a_100011215043_100000211941 [0,2,0,0,0,0|1,0,0]=3 725 B8R0.21 CC(C)(C)SCCN[13CH3] 2230a_100000689375_200025704644 [0,2,0,0,0,0|2,0,0]=4 726 B8R0.21 CC(C)(F)CNCCO 2230a_100020643315_100000211926 [0,2,0,0,0,0|2,0,0]=4 727 B8R0.21 CC(C)(F)CNCCO 34a_100016990907_100011997219 [0,2,0,0,0,0|2,0,0]=4 728 B8R0.21 CC(C)(F)COCCO 34a_100000716592_100000211926 [0,2,0,0,0,0|2,0,0]=4 729 B8R0.21 CC(C)(F)CSCCO 62a_100000211926_100011997219 [0,2,0,0,0,0|2,0,0]=4 730 B8R0.21 CC(C)(F)CSCCO 62a_100011997219_100000211926 [0,2,0,0,0,0|2,0,0]=4 731 B8R0.21 CC(C)(O)CNCCO 2230a_100000751335_100000211926 [0,2,0,0,0,0|2,0,0]=4 732 B8R0.21 CC(C)(O)CNCCO 34a_100016990907_100000764493 [0,2,0,0,0,0|2,0,0]=4 733 B8R0.21 CC(C)(O)CSCCO 62a_100000211926_100000764493 [0,2,0,0,0,0|2,0,0]=4 734 B8R0.21 CC(C)(O)CSCCO 62a_100000764493_100000211926 [0,2,0,0,0,0|2,0,0]=4 735 B8R0.21 CCCCNC(C)(C)C 2230a_100000715429_100000210211 [0,2,0,0,0,0|2,0,0]=4 736 B8R0.21 CCCCOC(C)(C)C 34a_100000210227_100000210625 [0,2,0,0,0,0|2,0,0]=4 737 B8R0.21 CCCCOC(C)(C)C 34a_100015890283_100000210210 [0,2,0,0,0,0|2,0,0]=4 738 B8R0.21 CCCCOC(C)(C)C 7a_100015890283_100000210211 [0,2,0,0,0,0|2,0,0]=4 739 B8R0.21 CCCCSC(C)(C)C 62a_100000210211_100000211941 [0,2,0,0,0,0|2,0,0]=4 740 B8R0.21 CCCCSC(C)(C)C 62a_100000211941_100000210210 [0,2,0,0,0,0|2,0,0]=4 741 B8R0.21 CCCNCC(C)(C)C 2230a_100000743828_100000210303 [0,2,0,0,0,0|2,0,0]=4 742 B8R0.21 CCCNCC(C)(C)C 270004a_100020643023_100011204126 [0,2,0,0,0,0|2,0,0]=4 743 B8R0.21 CCCOCC(C)(C)C 34a_100000210258_100011219605 [0,2,0,0,0,0|2,0,0]=4 744 B8R0.21 CCCSCC(C)(C)C 62a_100000210303_100011219605 [0,2,0,0,0,0|2,0,0]=4 745 B8R0.21 CCCSCC(C)(C)C 62a_100011219605_100000210303 [0,2,0,0,0,0|2,0,0]=4 746 B8R0.21 CCCSC[N+](C)(C)C 62a_100000210303_200000036245 [0,2,0,0,0,0|1,0,0]=3 747 B8R0.21 CCCSC[N+](C)(C)C 62a_200000036245_100000210303 [0,2,0,0,0,0|1,0,0]=3 748 B8R0.21 CCCSC[Si](C)(C)C 62a_100000037933_100000210303 [0,2,0,0,0,0|2,0,0]=4 749 B8R0.21 CCCSC[Si](C)(C)C 62a_100000210303_100000037933 [0,2,0,0,0,0|2,0,0]=4 750 B8R0.21 CCNCCC(C)(C)C 2230a_100000738805_100000210202 [0,2,0,0,0,0|2,0,0]=4 751 B8R0.21 CCNCCC(C)(C)C 2230a_100015525214_100000755188 [0,2,0,0,0,0|2,0,0]=4 752 B8R0.21 CCNCC[Si](C)(C)C 2230a_100015525214_200000733723 [0,2,0,0,0,0|2,0,0]=4 753 B8R0.21 CCOCCC(C)(C)C 34a_100121572206_100000755188 [0,2,0,0,0,0|1,0,0]=3 754 B8R0.21 CCOCCC(C)(C)C 7a_100000765024_100000210202 [0,2,0,0,0,0|1,0,0]=3 755 B8R0.21 CCOCCC(C)(C)O 34a_100121572206_100000702414 [0,2,0,0,0,0|2,0,0]=4 756 B8R0.21 CCOCC[N+](C)(C)C 34a_100121572206_100000085578 [0,2,0,0,0,0|0,0,0]=2 757 B8R0.21 CCOCC[N+](C)(C)C 7a_200020618287_100000210202 [0,2,0,0,0,0|0,0,0]=2 758 B8R0.21 CCOCC[Si](C)(C)C 34a_100121572206_200000733723 [0,2,0,0,0,0|1,0,0]=3 759 B8R0.21 CCOCC[Si](C)(C)C 7a_100000039746_100000210202 [0,2,0,0,0,0|1,0,0]=3 760 B8R0.21 CCOCSC(C)(C)C 62a_100000211941_100000739092 [0,2,0,0,0,0|2,0,0]=4 761 B8R0.21 CCOCSC(C)(C)C 62a_100000739092_100000211941 [0,2,0,0,0,0|2,0,0]=4 762 B8R0.21 CCSCCC(C)(C)C 62a_100000210202_100000755188 [0,2,0,0,0,0|1,1,0]=4 763 B8R0.21 CCSCCC(C)(C)C 62a_100000755188_100000210202 [0,2,0,0,0,0|1,1,0]=4 764 B8R0.21 CCSCC[N+](C)(C)C 62a_100000085578_100000210202 [0,2,0,0,0,0|0,1,0]=3 765 B8R0.21 CCSCC[N+](C)(C)C 62a_100000210202_100000085578 [0,2,0,0,0,0|0,1,0]=3 766 B8R0.21 CCSCC[Si](C)(C)C 62a_100000210202_200000733723 [0,2,0,0,0,0|1,1,0]=4 767 B8R0.21 CCSCC[Si](C)(C)C 62a_200000733723_100000210202 [0,2,0,0,0,0|1,1,0]=4 768 B8R0.21 CNCCC[N+](C)(C)C 2230a_106832991635_100016990835 [0,2,0,0,0,0|1,0,0]=3 769 B8R0.21 CNCCC[N+](C)(C)C 34a_100102657272_100016990835 [0,2,0,0,0,0|1,0,0]=3 770 B8R0.21 CNCCC[N+](C)(C)C 7a_106832991635_100016990835 [0,2,0,0,0,0|1,0,0]=3 771 B8R0.21 CNCCC[Si](C)(C)C 2230a_106832991635_100011219597 [0,2,0,0,0,0|2,0,0]=4 772 B8R0.21 CNCCC[Si](C)(C)C 34a_100102657272_100011219597 [0,2,0,0,0,0|2,0,0]=4 773 B8R0.21 CNCCC[Si](C)(C)C 7a_106832991635_100011219597 [0,2,0,0,0,0|2,0,0]=4 774 B8R0.21 CNCCOC(C)(C)C 2230a_100000747557_200000210301 [0,2,0,0,0,0|2,0,0]=4 775 B8R0.21 CNCCO[Si](C)(C)C 2230a_106832991635_200000032530 [0,2,0,0,0,0|2,0,0]=4 776 B8R0.21 CNCCO[Si](C)(C)C 34a_100102657272_200000032530 [0,2,0,0,0,0|2,0,0]=4 777 B8R0.21 CNCCO[Si](C)(C)C 7a_106832991635_200000032530 [0,2,0,0,0,0|2,0,0]=4 778 B8R0.21 CNCCSC(C)(C)C 2230a_100000689375_200000210301 [0,2,0,0,0,0|2,0,0]=4 779 B8R0.21 COC/C=C/[Si](C)(C)C 7a_200016270829_200000210301 [0,2,0,0,0,0|1,0,1]=4 780 B8R0.21 COCC#C[Si](C)(C)C 34a_100138415774_100000764098 [0,2,0,0,0,0|1,0,1]=4 781 B8R0.21 COCC#C[Si](C)(C)C 7a_100000036595_200000210301 [0,2,0,0,0,0|1,0,1]=4 782 B8R0.21 COCCCC(C)(C)O 34a_100138415774_100009888830 [0,2,0,0,0,0|2,0,0]=4 783 B8R0.21 COCCC[N+](C)(C)C 34a_100138415774_100016990835 [0,2,0,0,0,0|0,0,0]=2 784 B8R0.21 COCCC[Si](C)(C)C 34a_100138415774_100011219597 [0,2,0,0,0,0|1,0,0]=3 785 B8R0.21 COCCC[Si](C)(C)C 7a_200011215415_200000210301 [0,2,0,0,0,0|1,0,0]=3 786 B8R0.21 COCCNC(C)(C)C 2230a_100000715429_100011201679 [0,2,0,0,0,0|1,0,0]=3 787 B8R0.21 COCCOC(C)(C)C 34a_100000210237_100000210625 [0,2,0,0,0,0|1,0,0]=3 788 B8R0.21 COCCOC(C)(C)C 34a_100000693234_200000210301 [0,2,0,0,0,0|1,0,0]=3 789 B8R0.21 COCCOC(C)(C)C 34a_100015890283_100011201679 [0,2,0,0,0,0|1,0,0]=3 790 B8R0.21 COCCOC(C)(C)C 7a_100000693234_200000210301 [0,2,0,0,0,0|1,0,0]=3 791 B8R0.21 COCCOC(C)(C)C 7a_100015890283_100000233755 [0,2,0,0,0,0|1,0,0]=3 792 B8R0.21 COCCO[Si](C)(C)C 34a_100138415774_200000032530 [0,2,0,0,0,0|1,0,0]=3 793 B8R0.21 COCCSC(C)(C)C 62a_100000211941_100000233755 [0,2,0,0,0,0|1,0,0]=3 794 B8R0.21 COCCSC(C)(C)C 62a_100000233755_100000211941 [0,2,0,0,0,0|1,0,0]=3 795 B8R0.21 COCNCC(C)(C)C 2230a_100000743828_100000766300 [0,2,0,0,0,0|1,0,0]=3 796 B8R0.21 COCNCC(C)(C)F 2230a_100020643315_100000766300 [0,2,0,0,0,0|2,0,0]=4 797 B8R0.21 COCNCC(C)(C)O 2230a_100000751335_100000766300 [0,2,0,0,0,0|2,0,0]=4 798 B8R0.21 COCSCC(C)(C)C 62a_100000766300_100011219605 [0,2,0,0,0,0|1,0,0]=3 799 B8R0.21 COCSCC(C)(C)C 62a_100011219605_100000766300 [0,2,0,0,0,0|1,0,0]=3 800 B8R0.21 COCSCC(C)(C)F 62a_100000766300_100011997219 [0,2,0,0,0,0|2,0,0]=4 801 B8R0.21 COCSCC(C)(C)F 62a_100011997219_100000766300 [0,2,0,0,0,0|2,0,0]=4 802 B8R0.21 COCSCC(C)(C)O 62a_100000764493_100000766300 [0,2,0,0,0,0|2,0,0]=4 803 B8R0.21 COCSCC(C)(C)O 62a_100000766300_100000764493 [0,2,0,0,0,0|2,0,0]=4 804 B8R0.21 COCSC[N+](C)(C)C 62a_100000766300_200000036245 [0,2,0,0,0,0|0,0,0]=2 805 B8R0.21 COCSC[N+](C)(C)C 62a_200000036245_100000766300 [0,2,0,0,0,0|0,0,0]=2 806 B8R0.21 COCSC[Si](C)(C)C 62a_100000037933_100000766300 [0,2,0,0,0,0|1,0,0]=3 807 B8R0.21 COCSC[Si](C)(C)C 62a_100000766300_100000037933 [0,2,0,0,0,0|1,0,0]=3 808 B8R0.21 CSCCC[N+](C)(C)C 62a_100016990835_200000210301 [0,2,0,0,0,0|0,1,0]=3 809 B8R0.21 CSCCC[N+](C)(C)C 62a_200000210301_100016990835 [0,2,0,0,0,0|0,1,0]=3 810 B8R0.21 CSCCC[Si](C)(C)C 62a_100011219597_200000210301 [0,2,0,0,0,0|1,1,0]=4 811 B8R0.21 CSCCC[Si](C)(C)C 62a_200000210301_100011219597 [0,2,0,0,0,0|1,1,0]=4 812 B8R0.21 CSCCNC(C)(C)C 2230a_100000715429_100000751147 [0,2,0,0,0,0|1,1,0]=4 813 B8R0.21 CSCCOC(C)(C)C 34a_100000230434_100000210625 [0,2,0,0,0,0|1,1,0]=4 814 B8R0.21 CSCCOC(C)(C)C 34a_100015890283_100000212216 [0,2,0,0,0,0|1,1,0]=4 815 B8R0.21 CSCCOC(C)(C)C 7a_100015890283_100000212216 [0,2,0,0,0,0|1,1,0]=4 816 B8R0.21 CSCCO[Si](C)(C)C 62a_200000032530_200000210301 [0,2,0,0,0,0|1,1,0]=4 817 B8R0.21 CSCCO[Si](C)(C)C 62a_200000210301_200000032530 [0,2,0,0,0,0|1,1,0]=4 818 B8R0.21 CSCCSC(C)(C)C 62a_100000211941_100000751147 [0,2,0,0,0,0|1,1,0]=4 819 B8R0.21 CSCCSC(C)(C)C 62a_100000212216_100000211941 [0,2,0,0,0,0|1,1,0]=4 820 B8R0.21 CSCNCC(C)(C)C 2230a_100000743828_100011218213 [0,2,0,0,0,0|1,1,0]=4 821 B8R0.21 CSCSCC(C)(C)C 62a_100011218213_100011219605 [0,2,0,0,0,0|1,1,0]=4 822 B8R0.21 CSCSCC(C)(C)C 62a_100011219605_100011218213 [0,2,0,0,0,0|1,1,0]=4 823 B8R0.21 CSCSC[N+](C)(C)C 62a_100011218213_200000036245 [0,2,0,0,0,0|0,1,0]=3 824 B8R0.21 CSCSC[N+](C)(C)C 62a_200000036245_100011218213 [0,2,0,0,0,0|0,1,0]=3 825 B8R0.21 CSCSC[Si](C)(C)C 62a_100000037933_100011218213 [0,2,0,0,0,0|1,1,0]=4 826 B8R0.21 CSCSC[Si](C)(C)C 62a_100011218213_100000037933 [0,2,0,0,0,0|1,1,0]=4 827 B8R0.21 C[N+](C)(C)CCCS[13CH3] 62a_100016990835_200025704644 [0,2,0,0,0,0|0,1,0]=3 828 B8R0.21 C[N+](C)(C)CCCS[13CH3] 62a_200025704644_100016990835 [0,2,0,0,0,0|0,1,0]=3 829 B8R0.21 C[N+](C)(C)CCOCF 7a_200020618287_100015361967 [0,2,0,0,0,0|0,0,0]=2 830 B8R0.21 C[N+](C)(C)CCSCF 62a_100000085578_100015361967 [0,2,0,0,0,0|0,1,0]=3 831 B8R0.21 C[N+](C)(C)CCSCF 62a_100015361967_100000085578 [0,2,0,0,0,0|0,1,0]=3 832 B8R0.21 C[N+](C)(C)CSCC#N 62a_100011215382_200000036245 [0,2,0,0,0,0|1,0,0]=3 833 B8R0.21 C[N+](C)(C)CSCC#N 62a_200000036245_100011215382 [0,2,0,0,0,0|1,0,0]=3 834 B8R0.21 C[N+](C)(C)CSCC=O 62a_200000036245_200015260668 [0,2,0,0,0,0|0,0,1]=3 835 B8R0.21 C[N+](C)(C)CSCC=O 62a_200015260668_200000036245 [0,2,0,0,0,0|0,0,1]=3 836 B8R0.21 C[N+](C)(C)CSCCF 62a_100011217306_200000036245 [0,2,0,0,0,0|1,0,0]=3 837 B8R0.21 C[N+](C)(C)CSCCF 62a_200000036245_100011217306 [0,2,0,0,0,0|1,0,0]=3 838 B8R0.21 C[N+](C)(C)CSCCO 62a_100000211926_200000036245 [0,2,0,0,0,0|0,0,0]=2 839 B8R0.21 C[N+](C)(C)CSCCO 62a_200000036245_100000211926 [0,2,0,0,0,0|0,0,0]=2 840 B8R0.21 C[Si](C)(C)/C=C/CO[13CH3] 7a_200016270829_200025704644 [0,2,0,0,0,0|1,0,1]=4 841 B8R0.21 C[Si](C)(C)C#CCO[13CH3] 7a_100000036595_200025704644 [0,2,0,0,0,0|1,0,1]=4 842 B8R0.21 C[Si](C)(C)CCCO[13CH3] 7a_200011215415_200025704644 [0,2,0,0,0,0|1,0,0]=3 843 B8R0.21 C[Si](C)(C)CCCS[13CH3] 62a_100011219597_200025704644 [0,2,0,0,0,0|1,1,0]=4 844 B8R0.21 C[Si](C)(C)CCCS[13CH3] 62a_200025704644_100011219597 [0,2,0,0,0,0|1,1,0]=4 845 B8R0.21 C[Si](C)(C)CCOCF 7a_100000039746_100015361967 [0,2,0,0,0,0|1,0,0]=3 846 B8R0.21 C[Si](C)(C)CCSCF 62a_100015361967_200000733723 [0,2,0,0,0,0|1,1,0]=4 847 B8R0.21 C[Si](C)(C)CCSCF 62a_200000733723_100015361967 [0,2,0,0,0,0|1,1,0]=4 848 B8R0.21 C[Si](C)(C)CNCCO 2230a_100016997473_100000037933 [0,2,0,0,0,0|1,0,0]=3 849 B8R0.21 C[Si](C)(C)CSCC#N 62a_100000037933_100011215382 [0,2,0,0,0,0|2,0,0]=4 850 B8R0.21 C[Si](C)(C)CSCC#N 62a_100011215382_100000037933 [0,2,0,0,0,0|2,0,0]=4 851 B8R0.21 C[Si](C)(C)CSCC=O 62a_100000037933_200015260668 [0,2,0,0,0,0|1,0,1]=4 852 B8R0.21 C[Si](C)(C)CSCC=O 62a_200015260668_100000037933 [0,2,0,0,0,0|1,0,1]=4 853 B8R0.21 C[Si](C)(C)CSCCF 62a_100000037933_100011217306 [0,2,0,0,0,0|2,0,0]=4 854 B8R0.21 C[Si](C)(C)CSCCF 62a_100011217306_100000037933 [0,2,0,0,0,0|2,0,0]=4 855 B8R0.21 C[Si](C)(C)CSCCO 62a_100000037933_100000211926 [0,2,0,0,0,0|1,0,0]=3 856 B8R0.21 C[Si](C)(C)CSCCO 62a_100000211926_100000037933 [0,2,0,0,0,0|1,0,0]=3 857 B8R0.21 C[Si](C)(C)OCCS[13CH3] 62a_200000032530_200025704644 [0,2,0,0,0,0|1,1,0]=4 858 B8R0.21 C[Si](C)(C)OCCS[13CH3] 62a_200025704644_200000032530 [0,2,0,0,0,0|1,1,0]=4 859 B8R0.24 CC(C)(C)CC(=O)CF 1458a_100000211214_100015361967 [0,2,0,0,0,0|2,0,0]=4 860 B8R0.24 CC(C)(C)NC(=O)CO 240690a_100000715429_100000210174 [0,2,0,0,0,0|1,0,1]=4 861 B8R0.24 CC(C)(C)NC(=O)CO 527a_100000715429_100000210174 [0,2,0,0,0,0|1,0,1]=4 862 B8R0.24 CC(CC(C)(C)C)O[13CH3] 7a_200011218616_200025704644 [0,2,0,0,0,0|1,0,0]=3 863 B8R0.24 CC(CF)OC(C)(C)C 34a_100016041109_100000210625 [0,2,0,0,0,0|2,0,0]=4 864 B8R0.24 CC(CN)OC(C)(C)C 34a_100000210904_100000210625 [0,2,0,0,0,0|2,0,0]=4 865 B8R0.24 CC(CO)NC(C)(C)C 2230a_100000715429_100012180447 [0,2,0,0,0,0|1,0,0]=3 866 B8R0.24 CC(CO)OC(C)(C)C 34a_100015890283_100012180447 [0,2,0,0,0,0|1,0,0]=3 867 B8R0.24 CC(CO)OC(C)(C)C 7a_100015890283_100012180447 [0,2,0,0,0,0|1,0,0]=3 868 B8R0.24 CC(CO)SC(C)(C)C 62a_100012180447_100000211941 [0,2,0,0,0,0|1,0,0]=3 869 B8R0.24 CCC(=O)CC(C)(C)C 1458a_100000211214_100000210202 [0,2,0,0,0,0|2,0,0]=4 870 B8R0.24 CCC(=O)C[N+](C)(C)C 1458a_100000033712_100000210202 [0,2,0,0,0,0|1,0,0]=3 871 B8R0.24 CCC(=O)C[Si](C)(C)C 1458a_100000210414_100000233785 [0,2,0,0,0,0|2,0,0]=4 872 B8R0.24 CCC(=O)C[Si](C)(C)C 1458a_100011218504_100000210202 [0,2,0,0,0,0|2,0,0]=4 873 B8R0.24 CCC(C)NC(C)(C)C 2230a_100000715429_100000758301 [0,2,0,0,0,0|2,0,0]=4 874 B8R0.24 CCC(C)OC(C)(C)C 34a_100015890283_100011215416 [0,2,0,0,0,0|2,0,0]=4 875 B8R0.24 CCC(C)OC(C)(C)C 7a_100015890283_100000758301 [0,2,0,0,0,0|2,0,0]=4 876 B8R0.24 CCC(C)SC(C)(C)C 62a_100000211941_100000758301 [0,2,0,0,0,0|2,0,0]=4 877 B8R0.24 CCC(C)SC(C)(C)C 62a_100000758301_100000211941 [0,2,0,0,0,0|2,0,0]=4 878 B8R0.24 CCN(C)CC(C)(C)C 2230a_100000732750_200000210301 [0,2,0,0,0,0|2,0,0]=4 879 B8R0.24 CCN(C)CC(C)(C)C 2230a_100000742839_100000210202 [0,2,0,0,0,0|2,0,0]=4 880 B8R0.24 CCN(C)CC(C)(C)C 269982a_100000732750_200000210301 [0,2,0,0,0,0|2,0,0]=4 881 B8R0.24 CCN(C)CC(C)(C)C 269982a_100000742839_100000204670 [0,2,0,0,0,0|2,0,0]=4 882 B8R0.24 CCN(C)C[N+](C)(C)C 269982a_100000225621_200000036245 [0,2,0,0,0,0|1,0,0]=3 883 B8R0.24 CCN(C)C[Si](C)(C)C 2230a_100000225621_100000037933 [0,2,0,0,0,0|2,0,0]=4 884 B8R0.24 CCN(C)C[Si](C)(C)C 269982a_200020589227_100000204670 [0,2,0,0,0,0|2,0,0]=4 885 B8R0.24 CCN([13CH3])CC(C)(C)C 2230a_100000732750_200025704644 [0,2,0,0,0,0|2,0,0]=4 886 B8R0.24 CCN([13CH3])CC(C)(C)C 269982a_100000732750_200025704644 [0,2,0,0,0,0|2,0,0]=4 887 B8R0.24 CN(CF)CC(C)(C)C 269982a_100000742839_100015361967 [0,2,0,0,0,0|2,0,0]=4 888 B8R0.24 CN(CF)C[Si](C)(C)C 269982a_200020589227_100015361967 [0,2,0,0,0,0|2,0,0]=4 889 B8R0.24 CNC(=O)C[N+](C)(C)C 11a_106832991635_100000033712 [0,2,0,0,0,0|0,0,2]=4 890 B8R0.24 CNC(=O)C[N+](C)(C)C 1626a_100102657272_100000033712 [0,2,0,0,0,0|0,0,2]=4 891 B8R0.24 CNC(=O)C[N+](C)(C)C 240690a_100102657272_100000033712 [0,2,0,0,0,0|0,0,2]=4 892 B8R0.24 CNC(=O)C[N+](C)(C)C 527a_100102657272_100000033712 [0,2,0,0,0,0|0,0,2]=4 893 B8R0.24 CN[C@@H](C)CC(C)(C)C 2230a_106358413534_200000210301 [0,2,0,0,0,0|2,0,0]=4 894 B8R0.24 COC(C)CC(C)(C)C 7a_200011218616_200000210301 [0,2,0,0,0,0|1,0,0]=3 895 B8R0.24 COC(C)SC(C)(C)C 62a_100000211941_100009879195 [0,2,0,0,0,0|2,0,0]=4 896 B8R0.24 COC(C)SC(C)(C)C 62a_100009879195_100000211941 [0,2,0,0,0,0|2,0,0]=4 897 B8R0.24 C[C@@H](CC(C)(C)C)N[13CH3] 2230a_106358413534_200025704644 [0,2,0,0,0,0|2,0,0]=4 898 B8R0.24 C[C@H](CO)SC(C)(C)C 62a_100000211941_100016084084 [0,2,0,0,0,0|1,0,0]=3 899 B8R0.24 C[C@H](CO)SC(C)(C)C 62a_100016084084_100000211941 [0,2,0,0,0,0|1,0,0]=3 900 B8R0.24 C[N+](C)(C)CC(=O)CF 1458a_100000033712_100015361967 [0,2,0,0,0,0|1,0,0]=3 901 B8R0.24 C[Si](C)(C)CC(=O)CF 1458a_100011218504_100015361967 [0,2,0,0,0,0|2,0,0]=4 902 B8R0.24 C[Si](C)(C)CC(=O)CO 1458a_100000210174_100000233785 [0,2,0,0,0,0|1,0,0]=3 903 B8R0.25 C#CC(C)(C)NCCO 34a_100000054563_100000211926 [0,2,0,0,0,0|1,0,1]=4 904 B8R0.25 C#CC(C)(C)NCCO 34a_100016990907_100000038118 [0,2,0,0,0,0|1,0,1]=4 905 B8R0.25 C#CC(C)(C)OCCO 34a_100000189450_100000211926 [0,2,0,0,0,0|1,0,1]=4 906 B8R0.25 C#CC(C)(C)OCCO 7a_100000189450_100000211926 [0,2,0,0,0,0|1,0,1]=4 907 B8R0.25 C#CC(C)(C)SCCO 62a_100000038118_100000211926 [0,2,0,0,0,0|1,0,1]=4 908 B8R0.25 C#CC(C)(C)SCCO 62a_100000211926_100000038118 [0,2,0,0,0,0|1,0,1]=4 909 B8R0.25 C=CC(C)(C)OCCO 34a_100011215311_100000211926 [0,2,0,0,0,0|1,0,1]=4 910 B8R0.25 C=CC(C)(C)OCCO 7a_100011215311_100000211926 [0,2,0,0,0,0|1,0,1]=4 911 B8R0.25 CC(C)(C#N)NCCO 34a_100016990907_100011162410 [0,2,0,0,0,0|1,0,1]=4 912 B8R0.25 CC(C)(C#N)OCCO 34a_200015195151_100000211926 [0,2,0,0,0,0|1,0,1]=4 913 B8R0.25 CC(C)(C#N)SCCO 62a_100000211926_100011162410 [0,2,0,0,0,0|1,0,1]=4 914 B8R0.25 CC(C)(C#N)SCCO 62a_100011162410_100000211926 [0,2,0,0,0,0|1,0,1]=4 915 B8R0.25 CC(C)(CCCBr)O[13CH3] 7a_100009888830_200025704644 [0,2,0,0,0,0|2,0,0]=4 916 B8R0.25 CC(C)(CCl)COCF 7a_100011217199_100015361967 [0,2,0,0,0,0|2,0,0]=4 917 B8R0.25 CC(C)(CCl)OCCF 7a_100000764493_100011217306 [0,2,0,0,0,0|2,0,0]=4 918 B8R0.25 CC(C)(CCl)OCCO 7a_100000764493_100000211926 [0,2,0,0,0,0|1,0,0]=3 919 B8R0.25 CC(C)(CO)CSCF 62a_100009813988_100015361967 [0,2,0,0,0,0|2,0,0]=4 920 B8R0.25 CC(C)(CO)CSCF 62a_100015361967_100009813988 [0,2,0,0,0,0|2,0,0]=4 921 B8R0.25 CC(C)(CO)NCCF 2230a_100000210608_100011217306 [0,2,0,0,0,0|2,0,0]=4 922 B8R0.25 CC(C)(CO)NCCO 2230a_100000210608_100000211926 [0,2,0,0,0,0|1,0,0]=3 923 B8R0.25 CCC(C)(C)COCF 7a_100000765029_100015361967 [0,2,0,0,0,0|2,0,0]=4 924 B8R0.25 CCC(C)(C)NCCF 2230a_100000211385_100011217306 [0,2,0,0,0,0|2,0,0]=4 925 B8R0.25 CCC(C)(C)NCCO 2230a_100000211385_100000211926 [0,2,0,0,0,0|1,0,0]=3 926 B8R0.25 CCC(C)(C)NCOC 2230a_100000211385_100000766300 [0,2,0,0,0,0|2,0,0]=4 927 B8R0.25 CCC(C)(C)OCCF 7a_100000210230_100011217306 [0,2,0,0,0,0|2,0,0]=4 928 B8R0.25 CCC(C)(C)OCCO 7a_100000210230_100000211926 [0,2,0,0,0,0|1,0,0]=3 929 B8R0.25 CCC(C)(C)SCCF 62a_100000032637_100011217306 [0,2,0,0,0,0|2,0,0]=4 930 B8R0.25 CCC(C)(C)SCCF 62a_100011217306_100000032637 [0,2,0,0,0,0|2,0,0]=4 931 B8R0.25 CCC(C)(C)SCCO 62a_100000032637_100000211926 [0,2,0,0,0,0|1,0,0]=3 932 B8R0.25 CCC(C)(C)SCCO 62a_100000211926_100000032637 [0,2,0,0,0,0|1,0,0]=3 933 B8R0.25 CCC(C)(C)SCOC 62a_100000032637_100000766300 [0,2,0,0,0,0|2,0,0]=4 934 B8R0.25 CCC(C)(C)SCOC 62a_100000766300_100000032637 [0,2,0,0,0,0|2,0,0]=4 935 B8R0.25 CCCCC(C)(C)OC 7a_100011219641_200000210301 [0,2,0,0,0,0|2,0,0]=4 936 B8R0.25 CCCCC(C)(C)O[13CH3] 7a_100011219641_200025704644 [0,2,0,0,0,0|2,0,0]=4 937 B8R0.25 CCCNC(C)(C)CC 2230a_100000211385_100000210303 [0,2,0,0,0,0|2,0,0]=4 938 B8R0.25 CCCNC(C)(C)CO 2230a_100000210608_100000210303 [0,2,0,0,0,0|2,0,0]=4 939 B8R0.25 CCCOC(C)(C)CC 7a_100000210230_100000210303 [0,2,0,0,0,0|2,0,0]=4 940 B8R0.25 CCCOC(C)(C)CCl 7a_100000764493_100000210303 [0,2,0,0,0,0|2,0,0]=4 941 B8R0.25 CCCSC(C)(C)CC 62a_100000032637_100000210303 [0,2,0,0,0,0|2,0,0]=4 942 B8R0.25 CCCSC(C)(C)CC 62a_100000210303_100000032637 [0,2,0,0,0,0|2,0,0]=4 943 B8R0.25 CCNCC(C)(C)CO 2230a_100020635058_100000210202 [0,2,0,0,0,0|2,0,0]=4 944 B8R0.25 CCNCC(C)(C)OC 2230a_100000763424_100000210202 [0,2,0,0,0,0|2,0,0]=4 945 B8R0.25 CCNCC(C)(C)SC 270004a_100015525214_100009845794 [0,2,0,0,0,0|2,0,0]=4 946 B8R0.25 CCOCC(C)(C)CC 7a_100000765029_100000210202 [0,2,0,0,0,0|2,0,0]=4 947 B8R0.25 CCOCC(C)(C)CCl 7a_100011217199_100000210202 [0,2,0,0,0,0|2,0,0]=4 948 B8R0.25 CCOCC(C)(C)CO 34a_100121572206_100009813988 [0,2,0,0,0,0|2,0,0]=4 949 B8R0.25 CCOCC(C)(C)OC 34a_100121572206_100000701081 [0,2,0,0,0,0|2,0,0]=4 950 B8R0.25 CCSCC(C)(C)CO 62a_100000210202_100009813988 [0,2,0,0,0,0|2,0,0]=4 951 B8R0.25 CCSCC(C)(C)CO 62a_100009813988_100000210202 [0,2,0,0,0,0|2,0,0]=4 952 B8R0.25 CCSCC(C)(C)OC 62a_100000210202_100000701081 [0,2,0,0,0,0|2,0,0]=4 953 B8R0.25 CCSCC(C)(C)OC 62a_100000701081_100000210202 [0,2,0,0,0,0|2,0,0]=4 954 B8R0.25 COC(C)(C)CCCBr 7a_100009888830_200000210301 [0,2,0,0,0,0|2,0,0]=4 955 B8R0.25 COC(C)(C)CCO[13CH3] 7a_100000699976_200025704644 [0,2,0,0,0,0|1,0,0]=3 956 B8R0.25 COC(C)(C)CSCF 62a_100000701081_100015361967 [0,2,0,0,0,0|2,0,0]=4 957 B8R0.25 COC(C)(C)CSCF 62a_100015361967_100000701081 [0,2,0,0,0,0|2,0,0]=4 958 B8R0.25 COCCC(C)(C)OC 7a_100000699976_200000210301 [0,2,0,0,0,0|1,0,0]=3 959 B8R0.25 COCNC(C)(C)CO 2230a_100000210608_100000766300 [0,2,0,0,0,0|2,0,0]=4 960 B8R0.29 CC(=O)CCC(C)(C)C 1458a_100000070787_100000755188 [0,2,0,0,0,0|1,0,1]=4 961 B8R0.29 CC(=O)CCC(C)(C)C 1458a_100000757465_200000210301 [0,2,0,0,0,0|1,0,1]=4 962 B8R0.29 CC(=O)CC[N+](C)(C)C 1458a_100000070787_100000085578 [0,2,0,0,0,0|0,0,1]=3 963 B8R0.29 CC(=O)CC[Si](C)(C)C 1458a_100000070787_200000733723 [0,2,0,0,0,0|1,0,1]=4 964 B8R0.29 CC(=O)CC[Si](C)(C)C 1458a_100011215282_200000210301 [0,2,0,0,0,0|1,0,1]=4 965 B8R0.29 CC(Br)COC(C)(C)C 34a_100012180447_100000210625 [0,2,0,0,0,0|2,0,0]=4 966 B8R0.29 CC(C)(C)CCC(=O)[13CH3] 1458a_100000757465_200025704644 [0,2,0,0,0,0|1,0,1]=4 967 B8R0.29 CC(C)(C)NCC(=O)O 269956a_100016091260_100000211941 [0,2,0,0,0,0|1,0,1]=4 968 B8R0.29 CC(C)(C)NCC(F)F 2230a_100000715429_100011934356 [0,2,0,0,0,0|2,0,0]=4 969 B8R0.29 CC(C)(C)NCC(F)F 34a_100000765723_100000210625 [0,2,0,0,0,0|2,0,0]=4 970 B8R0.29 CC(C)(C)OCC(F)F 34a_100000743014_100000210625 [0,2,0,0,0,0|2,0,0]=4 971 B8R0.29 CC(C)(C)OCC(F)F 34a_100015890283_100011934356 [0,2,0,0,0,0|2,0,0]=4 972 B8R0.29 CC(C)(C)OCC(F)F 7a_100015890283_100011934356 [0,2,0,0,0,0|2,0,0]=4 973 B8R0.29 CC(C)(C)SCC(F)F 62a_100000211941_100011934356 [0,2,0,0,0,0|2,0,0]=4 974 B8R0.29 CC(C)(C)SCC(F)F 62a_100011934356_100000211941 [0,2,0,0,0,0|2,0,0]=4 975 B8R0.29 CC(C)CNC(C)(C)C 2230a_100000715429_100000210760 [0,2,0,0,0,0|2,0,0]=4 976 B8R0.29 CC(C)CNC(C)(C)C 34a_100000210953_100000210625 [0,2,0,0,0,0|2,0,0]=4 977 B8R0.29 CC(C)COC(C)(C)C 34a_100000210257_100000210625 [0,2,0,0,0,0|2,0,0]=4 978 B8R0.29 CC(C)COC(C)(C)C 34a_100015890283_100000210624 [0,2,0,0,0,0|2,0,0]=4 979 B8R0.29 CC(C)COC(C)(C)C 7a_100015890283_100000210760 [0,2,0,0,0,0|2,0,0]=4 980 B8R0.29 CC(C)CSC(C)(C)C 62a_100000210624_100000211941 [0,2,0,0,0,0|2,0,0]=4 981 B8R0.29 CC(C)CSC(C)(C)C 62a_100000211941_100000210760 [0,2,0,0,0,0|2,0,0]=4 982 B8R0.29 CC(C)NCC(C)(C)C 2230a_100000743828_100000210206 [0,2,0,0,0,0|2,0,0]=4 983 B8R0.29 CC(C)NCC(C)(C)C 34a_100138425928_100011219605 [0,2,0,0,0,0|2,0,0]=4 984 B8R0.29 CC(C)NC[Si](C)(C)C 2230a_100138425928_100000037933 [0,2,0,0,0,0|2,0,0]=4 985 B8R0.29 CC(C)OCC(C)(C)C 34a_100000212225_100011219605 [0,2,0,0,0,0|2,0,0]=4 986 B8R0.29 CC(C)SCC(C)(C)C 62a_100000210206_100011219605 [0,2,0,0,0,0|2,0,0]=4 987 B8R0.29 CC(C)SCC(C)(C)C 62a_100011219605_100000210206 [0,2,0,0,0,0|2,0,0]=4 988 B8R0.29 CC(C)SC[N+](C)(C)C 62a_100000210206_200000036245 [0,2,0,0,0,0|1,0,0]=3 989 B8R0.29 CC(C)SC[N+](C)(C)C 62a_200000036245_100000210206 [0,2,0,0,0,0|1,0,0]=3 990 B8R0.29 CC(C)SC[Si](C)(C)C 62a_100000037933_100000210206 [0,2,0,0,0,0|2,0,0]=4 991 B8R0.29 CC(C)SC[Si](C)(C)C 62a_100000210206_100000037933 [0,2,0,0,0,0|2,0,0]=4 992 B8R0.29 CC(F)COC(C)(C)C 34a_100015925927_100000210625 [0,2,0,0,0,0|2,0,0]=4 993 B8R0.29 CC(O)CNC(C)(C)C 2230a_100000715429_100011218427 [0,2,0,0,0,0|1,0,0]=3 994 B8R0.29 CC(O)CNC(C)(C)C 34a_100000210904_100000210625 [0,2,0,0,0,0|1,0,0]=3 995 B8R0.29 CC(O)COC(C)(C)C 34a_100015890283_100011218427 [0,2,0,0,0,0|1,0,0]=3 996 B8R0.29 CC(O)COC(C)(C)C 7a_100015890283_100011218427 [0,2,0,0,0,0|1,0,0]=3 997 B8R0.29 CC(O)CSC(C)(C)C 62a_100000211941_100011218427 [0,2,0,0,0,0|1,0,0]=3 998 B8R0.29 CC(O)CSC(C)(C)C 62a_100011218427_100000211941 [0,2,0,0,0,0|1,0,0]=3 999 B8R0.29 CN(C)CCC(C)(C)C 2230a_100102631434_100000755188 [0,2,0,0,0,0|2,0,0]=4 1000 B8R0.29 CN(C)CCC(C)(C)C 269982a_100102631434_100000755188 [0,2,0,0,0,0|2,0,0]=4 1001 B8R0.29 CN(C)CC[N+](C)(C)C 269982a_100102631434_100000085578 [0,2,0,0,0,0|1,0,0]=3 1002 B8R0.29 CN(C)CC[Si](C)(C)C 2230a_100102631434_200000733723 [0,2,0,0,0,0|2,0,0]=4 1003 B8R0.29 CN(C)CC[Si](C)(C)C 269982a_100102631434_200000733723 [0,2,0,0,0,0|2,0,0]=4 1004 B8R0.29 C[C@@H](Cl)COC(C)(C)C 34a_100016084084_100000210625 [0,2,0,0,0,0|2,0,0]=4 1005 B8R0.29 C[C@@H](N)COC(C)(C)C 34a_100000737577_100000210625 [0,2,0,0,0,0|2,0,0]=4 1006 B8R0.29 C[C@@H](O)CNC(C)(C)C 2230a_100000715429_100009817552 [0,2,0,0,0,0|1,0,0]=3 1007 B8R0.29 C[C@@H](O)COC(C)(C)C 34a_100015890283_100009817552 [0,2,0,0,0,0|1,0,0]=3 1008 B8R0.29 C[C@@H](O)COC(C)(C)C 7a_100015890283_100009817552 [0,2,0,0,0,0|1,0,0]=3 1009 B8R0.29 C[C@@H](O)CSC(C)(C)C 62a_100000211941_100009817552 [0,2,0,0,0,0|1,0,0]=3 1010 B8R0.29 C[C@@H](O)CSC(C)(C)C 62a_100009817552_100000211941 [0,2,0,0,0,0|1,0,0]=3 1011 B8R0.29 C[Si](C)(C)CCC(=O)[13CH3] 1458a_100011215282_200025704644 [0,2,0,0,0,0|1,0,1]=4 1012 B8R0.34 CC(C)(CC(=O)O)N[13CH3] 269956a_100000755897_200025704644 [0,2,0,0,0,0|1,0,1]=4 1013 B8R0.34 CC(C)CC(C)(C)N[13CH3] 2230a_100011346068_200025704644 [0,2,0,0,0,0|2,0,0]=4 1014 B8R0.34 CNC(C)(C)CC(=O)O 269956a_100000755897_200000210301 [0,2,0,0,0,0|1,0,1]=4 1015 B8R0.34 CNC(C)(C)CC(C)C 2230a_100011346068_200000210301 [0,2,0,0,0,0|2,0,0]=4 1016 B8R0.12 CCCC(C)(C)C(=O)C 1458a_100011215034_200000210301 [0,2,0,0,0,0|2,0,0]=4 1017 B8R0.12 CCCC(C)(C)C(=O)[13CH3] 1458a_100011215034_200025704644 [0,2,0,0,0,0|2,0,0]=4 1018 B8R0.30 CC(C)(CCBr)OCF 7a_100000702414_100015361967 [0,2,0,0,0,0|2,0,0]=4 1019 B8R0.30 CCCC(C)(C)COC 7a_100011995695_200000210301 [0,2,0,0,0,0|2,0,0]=4 1020 B8R0.30 CCCC(C)(C)CO[13CH3] 7a_100011995695_200025704644 [0,2,0,0,0,0|2,0,0]=4 1021 B8R0.30 CCCC(C)(C)OCC 7a_100000748436_100000210202 [0,2,0,0,0,0|2,0,0]=4 1022 B8R0.30 CCCC(C)(C)OCF 7a_100000748436_100015361967 [0,2,0,0,0,0|2,0,0]=4 1023 B8R0.30 CCOC(C)(C)CCBr 7a_100000702414_100000210202 [0,2,0,0,0,0|2,0,0]=4 1024 B8R0.30 CNC[N+](C)(C)CCO 7a_106832991635_200010270792 [0,2,0,0,0,0|0,0,0]=2 1025 B8R0.30 CSC[N+](C)(C)CCO 62a_200000210301_200010270792 [0,2,0,0,0,0|0,0,0]=2 1026 B8R0.30 CSC[N+](C)(C)CCO 62a_200010270792_200000210301 [0,2,0,0,0,0|0,0,0]=2 1027 B8R0.30 C[N+](C)(CCO)CS[13CH3] 62a_200010270792_200025704644 [0,2,0,0,0,0|0,0,0]=2 1028 B8R0.30 C[N+](C)(CCO)CS[13CH3] 62a_200025704644_200010270792 [0,2,0,0,0,0|0,0,0]=2 1029 B8R0.31 CCCC(C)(CC)NC 7a_106832991635_200000040151 [0,2,0,0,0,0|2,0,0]=4 1030 B8R0.31 CCCC(C)(CC)OC 7a_200011215934_200000210301 [0,2,0,0,0,0|2,0,0]=4 1031 B8R0.31 CCCC(C)(CC)O[13CH3] 7a_200011215934_200025704644 [0,2,0,0,0,0|2,0,0]=4 1032 B8R0.31 CCCC(C)(CC)SC 62a_200000040151_200000210301 [0,2,0,0,0,0|2,0,0]=4 1033 B8R0.31 CCCC(C)(CC)SC 62a_200000210301_200000040151 [0,2,0,0,0,0|2,0,0]=4 1034 B8R0.31 CCCC(C)(CC)S[13CH3] 62a_200000040151_200025704644 [0,2,0,0,0,0|2,0,0]=4 1035 B8R0.31 CCCC(C)(CC)S[13CH3] 62a_200025704644_200000040151 [0,2,0,0,0,0|2,0,0]=4 1036 B8R0.26 CC(C)(C)[C@@H](CO)N[13CH3] 2230a_100000763378_200025704644 [0,2,0,0,0,0|1,0,0]=3 1037 B8R0.26 CCC(OC)C(C)(C)C 7a_100011215073_200000210301 [0,2,0,0,0,0|2,0,0]=4 1038 B8R0.26 CCC(O[13CH3])C(C)(C)C 7a_100011215073_200025704644 [0,2,0,0,0,0|2,0,0]=4 1039 B8R0.26 CN[C@H](CO)C(C)(C)C 2230a_100000763378_200000210301 [0,2,0,0,0,0|1,0,0]=3 1040 B6R1.2 CN1CCCC1 2230a_100000188435_200000210301 [1,0,0,1,0,0|1,0,1]=4 1041 B6R1.2 CN1CCCC1 269982a_100000188435_200000210301 [1,0,0,1,0,0|1,0,1]=4 1042 B6R1.2 CN1CCSC1 2230a_100011215254_200000210301 [1,0,0,1,0,0|0,1,1]=4 1043 B6R1.2 CN1CCSC1 269982a_100011215254_200000210301 [1,0,0,1,0,0|0,1,1]=4 1044 B6R1.2 [13CH3]N1CCCC1 2230a_100000188435_200025704644 [1,0,0,1,0,0|1,0,1]=4 1045 B6R1.2 [13CH3]N1CCCC1 269982a_100000188435_200025704644 [1,0,0,1,0,0|1,0,1]=4 1046 B6R1.2 [13CH3]N1CCSC1 2230a_100011215254_200025704644 [1,0,0,1,0,0|0,1,1]=4 1047 B6R1.2 [13CH3]N1CCSC1 269982a_100011215254_200025704644 [1,0,0,1,0,0|0,1,1]=4 1048 B6R1.5 CC1CN(C1)C 2230a_100000702820_200000210301 [1,0,0,1,0,0|1,0,1]=4 1049 B6R1.5 CC1CN(C1)C 269982a_100000702820_200000210301 [1,0,0,1,0,0|1,0,1]=4 1050 B6R1.5 CC1CN(C1)C 34a_100000702820_200000210301 [1,0,0,1,0,0|1,0,1]=4 1051 B6R1.5 CC1CN(C1)[13CH3] 2230a_100000702820_200025704644 [1,0,0,1,0,0|1,0,1]=4 1052 B6R1.5 CC1CN(C1)[13CH3] 269982a_100000702820_200025704644 [1,0,0,1,0,0|1,0,1]=4 1053 B6R1.5 CC1CN(C1)[13CH3] 34a_100000702820_200025704644 [1,0,0,1,0,0|1,0,1]=4 1054 B6R1.5 CN1CC(C1)F 2230a_100000690557_200000210301 [1,0,0,1,0,0|1,0,1]=4 1055 B6R1.5 CN1CC(C1)F 269982a_100000690557_200000210301 [1,0,0,1,0,0|1,0,1]=4 1056 B6R1.5 CN1CC(C1)F 34a_100000690557_200000210301 [1,0,0,1,0,0|1,0,1]=4 1057 B6R1.5 CN1CC(C1)O 269982a_100000749847_200000210301 [1,0,0,1,0,0|0,0,1]=3 1058 B6R1.5 [13CH3]N1CC(C1)F 2230a_100000690557_200025704644 [1,0,0,1,0,0|1,0,1]=4 1059 B6R1.5 [13CH3]N1CC(C1)F 269982a_100000690557_200025704644 [1,0,0,1,0,0|1,0,1]=4 1060 B6R1.5 [13CH3]N1CC(C1)F 34a_100000690557_200025704644 [1,0,0,1,0,0|1,0,1]=4 1061 B6R1.5 [13CH3]N1CC(C1)O 269982a_100000749847_200025704644 [1,0,0,1,0,0|0,0,1]=3 1062 B6R1.11 CC(=O)C1CO1 1458a_100000701028_200000210301 [1,0,0,1,0,0|2,0,0]=4 1063 B6R1.11 CN(C)C1CC1 2230a_100000226674_200000210301 [1,0,0,1,0,0|1,0,1]=4 1064 B6R1.11 CN(C)C1CC1 269982a_100000226674_200000210301 [1,0,0,1,0,0|1,0,1]=4 1065 B6R1.11 CN(C)C1CC1 269982a_100102631434_100000211595 [1,0,0,1,0,0|1,0,1]=4 1066 B6R1.11 CN([13CH3])C1CC1 2230a_100000226674_200025704644 [1,0,0,1,0,0|1,0,1]=4 1067 B6R1.11 CN([13CH3])C1CC1 269982a_100000226674_200025704644 [1,0,0,1,0,0|1,0,1]=4 1068 B6R1.11 [13CH3]C(=O)C1CO1 1458a_100000701028_200025704644 [1,0,0,1,0,0|2,0,0]=4 1069 B6R1.7 CC1(CC1)N[13CH3] 2230a_100000757604_200025704644 [1,0,0,1,0,0|2,0,0]=4 1070 B6R1.7 CC1(CC1)O[13CH3] 7a_100011725673_200025704644 [1,0,0,1,0,0|2,0,0]=4 1071 B6R1.7 CNC1(CC1)C 2230a_100000757604_200000210301 [1,0,0,1,0,0|2,0,0]=4 1072 B6R1.7 COC1(CC1)C 7a_100011725673_200000210301 [1,0,0,1,0,0|2,0,0]=4 1073 B8R1.27 CC1(CC1CO[13CH3])C 34a_100000728257_200025704644 [0,1,0,1,0,0|1,0,0]=3 1074 B8R1.27 CC1(CC1CO[13CH3])C 7a_100000728257_200025704644 [0,1,0,1,0,0|1,0,0]=3 1075 B8R1.27 CC1(OC1CO[13CH3])C 34a_200010283642_200025704644 [0,1,0,1,0,0|2,0,0]=4 1076 B8R1.27 CC1(OC1CO[13CH3])C 7a_200010283642_200025704644 [0,1,0,1,0,0|2,0,0]=4 1077 B8R1.27 COCC1CC1(C)C 34a_100000728257_200000210301 [0,1,0,1,0,0|1,0,0]=3 1078 B8R1.27 COCC1CC1(C)C 7a_100000728257_200000210301 [0,1,0,1,0,0|1,0,0]=3 1079 B8R1.27 COCC1OC1(C)C 34a_200010283642_200000210301 [0,1,0,1,0,0|2,0,0]=4 1080 B8R1.27 COCC1OC1(C)C 7a_200010283642_200000210301 [0,1,0,1,0,0|2,0,0]=4 1081 B8R1.41 CC1(CC1)COCF 7a_100000698024_100015361967 [0,1,0,1,0,0|2,0,0]=4 1082 B8R1.41 CC1(CC1)NCCF 2230a_100000757604_100011217306 [0,1,0,1,0,0|2,0,0]=4 1083 B8R1.41 CC1(CC1)NCCO 2230a_100000757604_100000211926 [0,1,0,1,0,0|1,0,0]=3 1084 B8R1.41 CC1(CC1)OCCF 7a_100011725673_100011217306 [0,1,0,1,0,0|2,0,0]=4 1085 B8R1.41 CC1(CC1)OCCO 7a_100011725673_100000211926 [0,1,0,1,0,0|1,0,0]=3 1086 B8R1.41 CCCNC1(CC1)C 2230a_100000757604_100000210303 [0,1,0,1,0,0|2,0,0]=4 1087 B8R1.41 CCCOC1(CC1)C 7a_100011725673_100000210303 [0,1,0,1,0,0|2,0,0]=4 1088 B8R1.41 CCNCC1(CC1)C 2230a_100000766693_100000210202 [0,1,0,1,0,0|2,0,0]=4 1089 B8R1.41 CCOCC1(CC1)C 7a_100000698024_100000210202 [0,1,0,1,0,0|2,0,0]=4 1090 B8R1.41 COCNC1(CC1)C 2230a_100000757604_100000766300 [0,1,0,1,0,0|2,0,0]=4 1091 B8R1.51 CC1(CCN(C1)[13CH3])C 2230a_100000764714_200025704644 [0,1,0,1,0,0|2,0,0]=4 1092 B8R1.51 CC1(CCN(C1)[13CH3])C 269982a_100000764714_200025704644 [0,1,0,1,0,0|2,0,0]=4 1093 B8R1.51 CN1CCC(C1)(C)C 2230a_100000764714_200000210301 [0,1,0,1,0,0|2,0,0]=4 1094 B8R1.51 CN1CCC(C1)(C)C 269982a_100000764714_200000210301 [0,1,0,1,0,0|2,0,0]=4 1095 B8R1.53 CC1(CN(C1)CF)C 269982a_100000753659_100015361967 [0,1,0,1,0,0|2,0,0]=4 1096 B8R1.53 CCN1CC(C1)(C)C 2230a_100000753659_100000210202 [0,1,0,1,0,0|2,0,0]=4 1097 B8R1.53 CCN1CC(C1)(C)C 269982a_100000753659_100000204670 [0,1,0,1,0,0|2,0,0]=4 1098 B8R1.55 CC(C)(C)N1CCC1 269982a_100000754969_100000210625 [0,1,0,1,0,0|2,0,0]=4 1099 B8R1.56 CC(C)(C)NC1CC1 34a_100000212008_100000210625 [0,1,0,1,0,0|2,0,0]=4 1100 B8R1.56 CC(C)(C)OC1CC1 34a_100015890283_100000211595 [0,1,0,1,0,0|2,0,0]=4 1101 B8R1.56 CC(C)(C)SC1CC1 62a_100000211941_100000211595 [0,1,0,1,0,0|2,0,0]=4 1102 B8R1.19 CC1(CCCN1[13CH3])C 2230a_100000761399_200025704644 [0,1,0,1,0,0|2,0,0]=4 1103 B8R1.19 CC1(CCCN1[13CH3])C 269982a_100000761399_200025704644 [0,1,0,1,0,0|2,0,0]=4 1104 B8R1.19 CC1(CCCN1[13CH3])C 34a_100000761399_200025704644 [0,1,0,1,0,0|2,0,0]=4 1105 B8R1.19 CC1(COCN1[13CH3])C 2230a_100000043020_200025704644 [0,1,0,1,0,0|2,0,0]=4 1106 B8R1.19 CC1(COCN1[13CH3])C 269982a_100000043020_200025704644 [0,1,0,1,0,0|2,0,0]=4 1107 B8R1.19 CN1CCCC1(C)C 2230a_100000761399_200000210301 [0,1,0,1,0,0|2,0,0]=4 1108 B8R1.19 CN1CCCC1(C)C 269982a_100000761399_200000210301 [0,1,0,1,0,0|2,0,0]=4 1109 B8R1.19 CN1CCCC1(C)C 34a_100000761399_200000210301 [0,1,0,1,0,0|2,0,0]=4 1110 B8R1.19 CN1COCC1(C)C 2230a_100000043020_200000210301 [0,1,0,1,0,0|2,0,0]=4 1111 B8R1.19 CN1COCC1(C)C 269982a_100000043020_200000210301 [0,1,0,1,0,0|2,0,0]=4 1112 B8R1.28 CC(C)(N[13CH3])C1CC1 2230a_100000695267_200025704644 [0,1,0,1,0,0|2,0,0]=4 1113 B8R1.28 CNC(C)(C)C1CC1 2230a_100000695267_200000210301 [0,1,0,1,0,0|2,0,0]=4 1114 B8R1.52 CC1(CCCC1)O[13CH3] 34a_100000751722_200025704644 [0,1,0,1,0,0|2,0,0]=4 1115 B8R1.52 CC1(CCCC1)O[13CH3] 7a_100000751722_200025704644 [0,1,0,1,0,0|2,0,0]=4 1116 B8R1.52 CC1(CCOC1)N[13CH3] 2230a_100000693475_200025704644 [0,1,0,1,0,0|1,0,0]=3 1117 B8R1.52 CNC1(CCOC1)C 2230a_100000693475_200000210301 [0,1,0,1,0,0|1,0,0]=3 1118 B8R1.52 COC1(CCCC1)C 34a_100000751722_200000210301 [0,1,0,1,0,0|2,0,0]=4 1119 B8R1.52 COC1(CCCC1)C 7a_100000751722_200000210301 [0,1,0,1,0,0|2,0,0]=4 1120 B8R1.82 CCCC1(CC1)NC 2230a_100015185929_200000210301 [0,1,0,1,0,0|2,0,0]=4 1121 B8R1.82 CCCC1(CC1)N[13CH3] 2230a_100015185929_200025704644 [0,1,0,1,0,0|2,0,0]=4