0 B7R1.3 CN1CC=CCC1 2230a_100000698166_200000210301 [0,1,0,0,0,0|1,0,2]=4 1 B7R1.3 CN1CC=CCC1 269982a_100000698166_200000210301 [0,1,0,0,0,0|1,0,2]=4 2 B7R1.3 CN1CC=CCC1 34a_100000698166_200000210301 [0,1,0,0,0,0|1,0,2]=4 3 B7R1.3 CN1CCCOC1 2230a_100000131196_200000210301 [0,1,0,0,0,0|1,0,0]=2 4 B7R1.3 CN1CCCOC1 269982a_100000131196_200000210301 [0,1,0,0,0,0|1,0,0]=2 5 B7R1.3 CN1CCCOC1 34a_100000131196_200000210301 [0,1,0,0,0,0|1,0,0]=2 6 B7R1.3 CN1CCOCC1 2230a_100015191051_200000210301 [0,1,0,0,0,0|1,0,0]=2 7 B7R1.3 CN1CCOCC1 269982a_100015191051_200000210301 [0,1,0,0,0,0|1,0,0]=2 8 B7R1.3 CN1CCOCC1 34a_100015191051_200000210301 [0,1,0,0,0,0|1,0,0]=2 9 B7R1.3 CN1CCSCC1 2230a_100000737611_200000210301 [0,1,0,0,0,0|1,1,0]=3 10 B7R1.3 CN1CCSCC1 269982a_100000737611_200000210301 [0,1,0,0,0,0|1,1,0]=3 11 B7R1.3 [13CH3]N1CC=CCC1 2230a_100000698166_200025704644 [0,1,0,0,0,0|1,0,2]=4 12 B7R1.3 [13CH3]N1CC=CCC1 269982a_100000698166_200025704644 [0,1,0,0,0,0|1,0,2]=4 13 B7R1.3 [13CH3]N1CC=CCC1 34a_100000698166_200025704644 [0,1,0,0,0,0|1,0,2]=4 14 B7R1.3 [13CH3]N1CCCOC1 2230a_100000131196_200025704644 [0,1,0,0,0,0|1,0,0]=2 15 B7R1.3 [13CH3]N1CCCOC1 269982a_100000131196_200025704644 [0,1,0,0,0,0|1,0,0]=2 16 B7R1.3 [13CH3]N1CCCOC1 34a_100000131196_200025704644 [0,1,0,0,0,0|1,0,0]=2 17 B7R1.3 [13CH3]N1CCOCC1 2230a_100015191051_200025704644 [0,1,0,0,0,0|1,0,0]=2 18 B7R1.3 [13CH3]N1CCOCC1 269982a_100015191051_200025704644 [0,1,0,0,0,0|1,0,0]=2 19 B7R1.3 [13CH3]N1CCOCC1 34a_100015191051_200025704644 [0,1,0,0,0,0|1,0,0]=2 20 B7R1.3 [13CH3]N1CCSCC1 2230a_100000737611_200025704644 [0,1,0,0,0,0|1,1,0]=3 21 B7R1.3 [13CH3]N1CCSCC1 269982a_100000737611_200025704644 [0,1,0,0,0,0|1,1,0]=3 22 B5R0.2 C#CCCNC 2230a_106832991635_100000688953 [0,0,1,0,0,0|1,0,2]=4 23 B5R0.2 C#CCCNC 34a_100000755551_200000210301 [0,0,1,0,0,0|1,0,2]=4 24 B5R0.2 C#CCCNC 34a_100102657272_100000688953 [0,0,1,0,0,0|1,0,2]=4 25 B5R0.2 C#CCCNC 7a_106832991635_100000688953 [0,0,1,0,0,0|1,0,2]=4 26 B5R0.2 C#CCCN[13CH3] 34a_100000755551_200025704644 [0,0,1,0,0,0|1,0,2]=4 27 B5R0.2 C#CCCOC 34a_100011215631_200000210301 [0,0,1,0,0,0|0,0,2]=3 28 B5R0.2 C#CCCOC 34a_100138415774_100000688953 [0,0,1,0,0,0|0,0,2]=3 29 B5R0.2 C#CCCO[13CH3] 34a_100011215631_200025704644 [0,0,1,0,0,0|0,0,2]=3 30 B5R0.2 C#CCCSC 62a_100000688953_200000210301 [0,0,1,0,0,0|0,1,2]=4 31 B5R0.2 C#CCCSC 62a_200000210301_100000688953 [0,0,1,0,0,0|0,1,2]=4 32 B5R0.2 C#CCCS[13CH3] 62a_100000688953_200025704644 [0,0,1,0,0,0|0,1,2]=4 33 B5R0.2 C#CCCS[13CH3] 62a_200025704644_100000688953 [0,0,1,0,0,0|0,1,2]=4 34 B5R0.2 C#CCNCC 2230a_100015525214_100000038162 [0,0,1,0,0,0|1,0,2]=4 35 B5R0.2 C#CCNCC 34a_100000212058_100000210202 [0,0,1,0,0,0|1,0,2]=4 36 B5R0.2 C#CCOCC 34a_100000210247_100000210202 [0,0,1,0,0,0|0,0,2]=3 37 B5R0.2 C#CCOCC 34a_100121572206_100000184674 [0,0,1,0,0,0|0,0,2]=3 38 B5R0.2 C#CCOCF 34a_100000210247_100015361967 [0,0,1,0,0,0|1,0,2]=4 39 B5R0.2 C#CCSCC 62a_100000038162_100000210202 [0,0,1,0,0,0|0,1,2]=4 40 B5R0.2 C/C=C/CNC 34a_100102657272_100102629194 [0,0,1,0,0,0|1,0,2]=4 41 B5R0.2 C/C=C/CNC 7a_106832991635_100102629194 [0,0,1,0,0,0|1,0,2]=4 42 B5R0.2 C/C=C/COC 34a_100016270725_200000210301 [0,0,1,0,0,0|0,0,2]=3 43 B5R0.2 C/C=C/COC 34a_100138415774_100102629194 [0,0,1,0,0,0|0,0,2]=3 44 B5R0.2 C/C=C/CO[13CH3] 34a_100016270725_200025704644 [0,0,1,0,0,0|0,0,2]=3 45 B5R0.2 C/C=C/CSC 62a_100102629194_200000210301 [0,0,1,0,0,0|0,1,2]=4 46 B5R0.2 C/C=C/CSC 62a_200000210301_100102629194 [0,0,1,0,0,0|0,1,2]=4 47 B5R0.2 C/C=C/CS[13CH3] 62a_100102629194_200025704644 [0,0,1,0,0,0|0,1,2]=4 48 B5R0.2 C/C=C/CS[13CH3] 62a_200025704644_100102629194 [0,0,1,0,0,0|0,1,2]=4 49 B5R0.2 C=CCCNC 2230a_100015191253_200000210301 [0,0,1,0,0,0|1,0,2]=4 50 B5R0.2 C=CCCNC 2230a_106832991635_100000754431 [0,0,1,0,0,0|1,0,2]=4 51 B5R0.2 C=CCCNC 34a_100102657272_100000754431 [0,0,1,0,0,0|1,0,2]=4 52 B5R0.2 C=CCCNC 7a_106832991635_100000754431 [0,0,1,0,0,0|1,0,2]=4 53 B5R0.2 C=CCCN[13CH3] 2230a_100015191253_200025704644 [0,0,1,0,0,0|1,0,2]=4 54 B5R0.2 C=CCCOC 34a_100011205117_200000210301 [0,0,1,0,0,0|0,0,2]=3 55 B5R0.2 C=CCCOC 34a_100138415774_100000754431 [0,0,1,0,0,0|0,0,2]=3 56 B5R0.2 C=CCCO[13CH3] 34a_100011205117_200025704644 [0,0,1,0,0,0|0,0,2]=3 57 B5R0.2 C=CCCSC 62a_100000754431_200000210301 [0,0,1,0,0,0|0,1,2]=4 58 B5R0.2 C=CCCSC 62a_200000210301_100000754431 [0,0,1,0,0,0|0,1,2]=4 59 B5R0.2 C=CCCS[13CH3] 62a_100000754431_200025704644 [0,0,1,0,0,0|0,1,2]=4 60 B5R0.2 C=CCCS[13CH3] 62a_200025704644_100000754431 [0,0,1,0,0,0|0,1,2]=4 61 B5R0.2 C=CCNCC 2230a_100015525214_100000210623 [0,0,1,0,0,0|1,0,2]=4 62 B5R0.2 C=CCNCC 2230a_100020586998_100000210202 [0,0,1,0,0,0|1,0,2]=4 63 B5R0.2 C=CCOCC 34a_100121572206_100015514636 [0,0,1,0,0,0|0,0,2]=3 64 B5R0.2 C=CCOCC 34a_200000210373_100000210202 [0,0,1,0,0,0|0,0,2]=3 65 B5R0.2 C=CCOCF 34a_200000210373_100015361967 [0,0,1,0,0,0|1,0,2]=4 66 B5R0.2 C=CCSCC 62a_100000210202_100000210623 [0,0,1,0,0,0|0,1,2]=4 67 B5R0.2 C=CCSCC 62a_100000210623_100000210202 [0,0,1,0,0,0|0,1,2]=4 68 B5R0.2 CC#CCNC 2230a_100000685387_200000210301 [0,0,1,0,0,0|1,0,2]=4 69 B5R0.2 CC#CCNC 2230a_106832991635_100000748600 [0,0,1,0,0,0|1,0,2]=4 70 B5R0.2 CC#CCNC 34a_100000685387_200000210301 [0,0,1,0,0,0|1,0,2]=4 71 B5R0.2 CC#CCNC 34a_100102657272_100000748600 [0,0,1,0,0,0|1,0,2]=4 72 B5R0.2 CC#CCNC 7a_106832991635_100000748600 [0,0,1,0,0,0|1,0,2]=4 73 B5R0.2 CC#CCN[13CH3] 2230a_100000685387_200025704644 [0,0,1,0,0,0|1,0,2]=4 74 B5R0.2 CC#CCN[13CH3] 34a_100000685387_200025704644 [0,0,1,0,0,0|1,0,2]=4 75 B5R0.2 CC#CCOC 34a_100000761923_200000210301 [0,0,1,0,0,0|0,0,2]=3 76 B5R0.2 CC#CCOC 34a_100138415774_100000748600 [0,0,1,0,0,0|0,0,2]=3 77 B5R0.2 CC#CCO[13CH3] 34a_100000761923_200025704644 [0,0,1,0,0,0|0,0,2]=3 78 B5R0.2 CC#CCSC 62a_100000748600_200000210301 [0,0,1,0,0,0|0,1,2]=4 79 B5R0.2 CC#CCSC 62a_200000210301_100000748600 [0,0,1,0,0,0|0,1,2]=4 80 B5R0.2 CC#CCS[13CH3] 62a_100000748600_200025704644 [0,0,1,0,0,0|0,1,2]=4 81 B5R0.2 CC#CCS[13CH3] 62a_200025704644_100000748600 [0,0,1,0,0,0|0,1,2]=4 82 B5R0.2 CC=CCNC 2230a_106832991635_100000070051 [0,0,1,0,0,0|1,0,2]=4 83 B5R0.2 CC=CCNC 34a_100102657272_100000070051 [0,0,1,0,0,0|1,0,2]=4 84 B5R0.2 CC=CCNC 7a_106832991635_100000070051 [0,0,1,0,0,0|1,0,2]=4 85 B5R0.2 CC=CCOC 34a_100138415774_100000070051 [0,0,1,0,0,0|0,0,2]=3 86 B5R0.2 CC=CCSC 62a_100000070051_200000210301 [0,0,1,0,0,0|0,1,2]=4 87 B5R0.2 CC=CCSC 62a_200000210301_100000070051 [0,0,1,0,0,0|0,1,2]=4 88 B5R0.2 CC=CCS[13CH3] 62a_100000070051_200025704644 [0,0,1,0,0,0|0,1,2]=4 89 B5R0.2 CC=CCS[13CH3] 62a_200025704644_100000070051 [0,0,1,0,0,0|0,1,2]=4 90 B5R0.2 CC=NNCC 4a_100000756455_200000210099 [0,0,1,0,0,0|2,0,1]=4 91 B5R0.2 CCCCNC 2230a_100000102301_200000210301 [0,0,1,0,0,0|1,0,0]=2 92 B5R0.2 CCCCNC 2230a_106832991635_100000210211 [0,0,1,0,0,0|1,0,0]=2 93 B5R0.2 CCCCNC 34a_100102657272_100000210210 [0,0,1,0,0,0|1,0,0]=2 94 B5R0.2 CCCCNC 7a_106832991635_100000210211 [0,0,1,0,0,0|1,0,0]=2 95 B5R0.2 CCCCNC 7a_106832991798_200000210301 [0,0,1,0,0,0|1,0,0]=2 96 B5R0.2 CCCCN[13CH3] 2230a_100000102301_200025704644 [0,0,1,0,0,0|1,0,0]=2 97 B5R0.2 CCCCN[13CH3] 7a_106832991798_200025704644 [0,0,1,0,0,0|1,0,0]=2 98 B5R0.2 CCCCOC 34a_100000210227_200000210301 [0,0,1,0,0,0|0,0,0]=1 99 B5R0.2 CCCCOC 34a_100138415774_100000210210 [0,0,1,0,0,0|0,0,0]=1 100 B5R0.2 CCCCOC 7a_100000210227_200000210301 [0,0,1,0,0,0|0,0,0]=1 101 B5R0.2 CCCCO[13CH3] 34a_100000210227_200025704644 [0,0,1,0,0,0|0,0,0]=1 102 B5R0.2 CCCCO[13CH3] 7a_100000210227_200025704644 [0,0,1,0,0,0|0,0,0]=1 103 B5R0.2 CCCCSC 62a_100000210211_200000210301 [0,0,1,0,0,0|0,1,0]=2 104 B5R0.2 CCCCSC 62a_200000210301_100000210210 [0,0,1,0,0,0|0,1,0]=2 105 B5R0.2 CCCCS[13CH3] 62a_100000210211_200025704644 [0,0,1,0,0,0|0,1,0]=2 106 B5R0.2 CCCCS[13CH3] 62a_200025704644_100000210210 [0,0,1,0,0,0|0,1,0]=2 107 B5R0.2 CCCNCC 2230a_100015525214_100000210303 [0,0,1,0,0,0|1,0,0]=2 108 B5R0.2 CCCOCC 34a_100000210258_100000210202 [0,0,1,0,0,0|0,0,0]=1 109 B5R0.2 CCCOCC 34a_100121572206_100000210303 [0,0,1,0,0,0|0,0,0]=1 110 B5R0.2 CCCOCF 34a_100000210258_100015361967 [0,0,1,0,0,0|1,0,0]=2 111 B5R0.2 CCCSCC 62a_100000210202_100000210303 [0,0,1,0,0,0|0,1,0]=2 112 B5R0.2 CCCSCC 62a_100000210303_100000210202 [0,0,1,0,0,0|0,1,0]=2 113 B5R0.2 CCCSCF 62a_100000210303_100015361967 [0,0,1,0,0,0|1,1,0]=3 114 B5R0.2 CCCSCF 62a_100015361967_100000210303 [0,0,1,0,0,0|1,1,0]=3 115 B5R0.2 CCNCC#N 2230a_100015525214_100011215382 [0,0,1,0,0,0|2,0,1]=4 116 B5R0.2 CCNCC=O 2230a_100015525214_200015260668 [0,0,1,0,0,0|1,0,2]=4 117 B5R0.2 CCNCCF 2230a_100015525214_100011217306 [0,0,1,0,0,0|2,0,0]=3 118 B5R0.2 CCNCCF 34a_100000724931_100000210202 [0,0,1,0,0,0|2,0,0]=3 119 B5R0.2 CCNCCO 2230a_100015525214_100000211926 [0,0,1,0,0,0|1,0,0]=2 120 B5R0.2 CCNCCO 2230a_100016997473_100000210202 [0,0,1,0,0,0|1,0,0]=2 121 B5R0.2 CCNCCO 34a_100016990907_100000210202 [0,0,1,0,0,0|1,0,0]=2 122 B5R0.2 CCNCOC 2230a_100015525214_100000766300 [0,0,1,0,0,0|1,0,0]=2 123 B5R0.2 CCNCSC 2230a_100015525214_100011218213 [0,0,1,0,0,0|1,1,0]=3 124 B5R0.2 CCOCC=O 34a_100121572206_200009817547 [0,0,1,0,0,0|1,0,1]=3 125 B5R0.2 CCOCCBr 34a_100000211926_100000210202 [0,0,1,0,0,0|1,0,0]=2 126 B5R0.2 CCOCCF 34a_100121572206_100011217306 [0,0,1,0,0,0|1,0,0]=2 127 B5R0.2 CCOCCN 34a_100000210304_100000210202 [0,0,1,0,0,0|1,0,0]=2 128 B5R0.2 CCOCCO 34a_100121572206_100000211926 [0,0,1,0,0,0|1,0,0]=2 129 B5R0.2 CCOCSC 34a_100121572206_100011218213 [0,0,1,0,0,0|1,0,0]=2 130 B5R0.2 CCOCSC 62a_100000739092_200000210301 [0,0,1,0,0,0|1,0,0]=2 131 B5R0.2 CCOCSC 62a_200000210301_100000739092 [0,0,1,0,0,0|1,0,0]=2 132 B5R0.2 CCOCS[13CH3] 62a_100000739092_200025704644 [0,0,1,0,0,0|1,0,0]=2 133 B5R0.2 CCOCS[13CH3] 62a_200025704644_100000739092 [0,0,1,0,0,0|1,0,0]=2 134 B5R0.2 CCSCC#N 62a_100000210202_100011215382 [0,0,1,0,0,0|1,1,1]=4 135 B5R0.2 CCSCC#N 62a_100011215382_100000210202 [0,0,1,0,0,0|1,1,1]=4 136 B5R0.2 CCSCC=O 62a_100000210202_200015260668 [0,0,1,0,0,0|1,0,2]=4 137 B5R0.2 CCSCC=O 62a_200015260668_100000210202 [0,0,1,0,0,0|1,0,2]=4 138 B5R0.2 CCSCCF 62a_100000210202_100011217306 [0,0,1,0,0,0|1,1,0]=3 139 B5R0.2 CCSCCF 62a_100011217306_100000210202 [0,0,1,0,0,0|1,1,0]=3 140 B5R0.2 CCSCCO 62a_100000210202_100000211926 [0,0,1,0,0,0|1,0,0]=2 141 B5R0.2 CCSCCO 62a_100000211926_100000210202 [0,0,1,0,0,0|1,0,0]=2 142 B5R0.2 CCSCOC 62a_100000210202_100000766300 [0,0,1,0,0,0|1,0,0]=2 143 B5R0.2 CCSCOC 62a_100000766300_100000210202 [0,0,1,0,0,0|1,0,0]=2 144 B5R0.2 CCSCSC 62a_100000210202_100011218213 [0,0,1,0,0,0|1,1,0]=3 145 B5R0.2 CCSCSC 62a_100011218213_100000210202 [0,0,1,0,0,0|1,1,0]=3 146 B5R0.2 CNCCC#N 2230a_106832991635_100011215226 [0,0,1,0,0,0|2,0,1]=4 147 B5R0.2 CNCCC#N 7a_106832991635_100000184422 [0,0,1,0,0,0|2,0,1]=4 148 B5R0.2 CNCCCF 2230a_100015189416_200000210301 [0,0,1,0,0,0|2,0,0]=3 149 B5R0.2 CNCCCF 2230a_106832991635_100011934791 [0,0,1,0,0,0|2,0,0]=3 150 B5R0.2 CNCCCF 34a_100015189416_200000210301 [0,0,1,0,0,0|2,0,0]=3 151 B5R0.2 CNCCCF 34a_100102657272_100011934791 [0,0,1,0,0,0|2,0,0]=3 152 B5R0.2 CNCCCF 7a_106832991635_100011934791 [0,0,1,0,0,0|2,0,0]=3 153 B5R0.2 CNCCCO 2230a_106832991635_100000230001 [0,0,1,0,0,0|1,0,0]=2 154 B5R0.2 CNCCCO 34a_100102657272_100000230001 [0,0,1,0,0,0|1,0,0]=2 155 B5R0.2 CNCCCO 7a_106832991635_100011215043 [0,0,1,0,0,0|1,0,0]=2 156 B5R0.2 CNCCOC 2230a_100000209980_200000210301 [0,0,1,0,0,0|1,0,0]=2 157 B5R0.2 CNCCOC 2230a_106832991635_100011201679 [0,0,1,0,0,0|1,0,0]=2 158 B5R0.2 CNCCOC 34a_100102657272_100011201679 [0,0,1,0,0,0|1,0,0]=2 159 B5R0.2 CNCCOC 7a_106832991635_100000233755 [0,0,1,0,0,0|1,0,0]=2 160 B5R0.2 CNCCSC 2230a_100020590264_200000210301 [0,0,1,0,0,0|1,1,0]=3 161 B5R0.2 CNCCSC 2230a_106832991635_100000751147 [0,0,1,0,0,0|1,1,0]=3 162 B5R0.2 CNCCSC 34a_100102657272_100000212216 [0,0,1,0,0,0|1,1,0]=3 163 B5R0.2 CNCCSC 7a_106832991635_100000212216 [0,0,1,0,0,0|1,1,0]=3 164 B5R0.2 COCCCBr 34a_100011217188_200000210301 [0,0,1,0,0,0|1,0,0]=2 165 B5R0.2 COCCCCl 34a_100000230001_200000210301 [0,0,1,0,0,0|1,0,0]=2 166 B5R0.2 COCCCF 34a_100000759539_200000210301 [0,0,1,0,0,0|1,0,0]=2 167 B5R0.2 COCCCF 34a_100138415774_100011934791 [0,0,1,0,0,0|1,0,0]=2 168 B5R0.2 COCCCN 34a_100000182051_200000210301 [0,0,1,0,0,0|1,0,0]=2 169 B5R0.2 COCCCO 34a_100138415774_100000230001 [0,0,1,0,0,0|1,0,0]=2 170 B5R0.2 COCCN[13CH3] 2230a_100000209980_200025704644 [0,0,1,0,0,0|1,0,0]=2 171 B5R0.2 COCCOC 34a_100000210237_200000210301 [0,0,1,0,0,0|1,0,0]=2 172 B5R0.2 COCCOC 34a_100138415774_100011201679 [0,0,1,0,0,0|1,0,0]=2 173 B5R0.2 COCCON 34a_100000700252_200000210301 [0,0,1,0,0,0|2,0,0]=3 174 B5R0.2 COCCO[13CH3] 34a_100000210237_200025704644 [0,0,1,0,0,0|1,0,0]=2 175 B5R0.2 COCCSC 34a_100000230434_200000210301 [0,0,1,0,0,0|1,0,0]=2 176 B5R0.2 COCCSC 34a_100138415774_100000212216 [0,0,1,0,0,0|1,0,0]=2 177 B5R0.2 COCCSC 62a_100000233755_200000210301 [0,0,1,0,0,0|1,0,0]=2 178 B5R0.2 COCCSC 62a_200000210301_100000233755 [0,0,1,0,0,0|1,0,0]=2 179 B5R0.2 COCCSC 7a_100000230434_200000210301 [0,0,1,0,0,0|1,0,0]=2 180 B5R0.2 COCCS[13CH3] 62a_100000233755_200025704644 [0,0,1,0,0,0|1,0,0]=2 181 B5R0.2 COCCS[13CH3] 62a_200025704644_100000233755 [0,0,1,0,0,0|1,0,0]=2 182 B5R0.2 COCSCF 62a_100000766300_100015361967 [0,0,1,0,0,0|2,0,0]=3 183 B5R0.2 COCSCF 62a_100015361967_100000766300 [0,0,1,0,0,0|2,0,0]=3 184 B5R0.2 CSCCC#N 62a_100011215226_200000210301 [0,0,1,0,0,0|1,1,1]=4 185 B5R0.2 CSCCC#N 62a_200000210301_100011215226 [0,0,1,0,0,0|1,1,1]=4 186 B5R0.2 CSCCCF 62a_100011934791_200000210301 [0,0,1,0,0,0|1,1,0]=3 187 B5R0.2 CSCCCF 62a_200000210301_100011934791 [0,0,1,0,0,0|1,1,0]=3 188 B5R0.2 CSCCCO 62a_100011215043_200000210301 [0,0,1,0,0,0|1,0,0]=2 189 B5R0.2 CSCCCO 62a_200000210301_100011215043 [0,0,1,0,0,0|1,0,0]=2 190 B5R0.2 CSCCN[13CH3] 2230a_100020590264_200025704644 [0,0,1,0,0,0|1,1,0]=3 191 B5R0.2 CSCCO[13CH3] 34a_100000230434_200025704644 [0,0,1,0,0,0|1,0,0]=2 192 B5R0.2 CSCCO[13CH3] 7a_100000230434_200025704644 [0,0,1,0,0,0|1,0,0]=2 193 B5R0.2 CSCCSC 62a_100000212216_200000210301 [0,0,1,0,0,0|1,1,0]=3 194 B5R0.2 CSCCSC 62a_200000210301_100000751147 [0,0,1,0,0,0|1,1,0]=3 195 B5R0.2 CSCCS[13CH3] 62a_100000212216_200025704644 [0,0,1,0,0,0|1,1,0]=3 196 B5R0.2 CSCCS[13CH3] 62a_200025704644_100000751147 [0,0,1,0,0,0|1,1,0]=3 197 B5R0.2 CSCSCF 62a_100011218213_100015361967 [0,0,1,0,0,0|2,1,0]=4 198 B5R0.2 CSCSCF 62a_100015361967_100011218213 [0,0,1,0,0,0|2,1,0]=4 199 B5R0.2 FCCNCF 34a_100000724931_100015361967 [0,0,1,0,0,0|3,0,0]=4 200 B5R0.2 FCCSCF 62a_100011217306_100015361967 [0,0,1,0,0,0|2,1,0]=4 201 B5R0.2 FCCSCF 62a_100015361967_100011217306 [0,0,1,0,0,0|2,1,0]=4 202 B5R0.2 FCOCCBr 34a_100000211926_100015361967 [0,0,1,0,0,0|2,0,0]=3 203 B5R0.2 NCCOCF 34a_100000210304_100015361967 [0,0,1,0,0,0|2,0,0]=3 204 B5R0.2 OCCNCF 34a_100016990907_100015361967 [0,0,1,0,0,0|2,0,0]=3 205 B5R0.2 OCCSCF 62a_100000211926_100015361967 [0,0,1,0,0,0|2,0,0]=3 206 B5R0.2 OCCSCF 62a_100015361967_100000211926 [0,0,1,0,0,0|2,0,0]=3 207 B5R0.2 [13CH3]NCCCF 2230a_100015189416_200025704644 [0,0,1,0,0,0|2,0,0]=3 208 B5R0.2 [13CH3]NCCCF 34a_100015189416_200025704644 [0,0,1,0,0,0|2,0,0]=3 209 B5R0.2 [13CH3]OCCCBr 34a_100011217188_200025704644 [0,0,1,0,0,0|1,0,0]=2 210 B5R0.2 [13CH3]OCCCCl 34a_100000230001_200025704644 [0,0,1,0,0,0|1,0,0]=2 211 B5R0.2 [13CH3]OCCCF 34a_100000759539_200025704644 [0,0,1,0,0,0|1,0,0]=2 212 B5R0.2 [13CH3]OCCCN 34a_100000182051_200025704644 [0,0,1,0,0,0|1,0,0]=2 213 B5R0.2 [13CH3]OCCON 34a_100000700252_200025704644 [0,0,1,0,0,0|2,0,0]=3 214 B5R0.2 [13CH3]SCCC#N 62a_100011215226_200025704644 [0,0,1,0,0,0|1,1,1]=4 215 B5R0.2 [13CH3]SCCC#N 62a_200025704644_100011215226 [0,0,1,0,0,0|1,1,1]=4 216 B5R0.2 [13CH3]SCCCF 62a_100011934791_200025704644 [0,0,1,0,0,0|1,1,0]=3 217 B5R0.2 [13CH3]SCCCF 62a_200025704644_100011934791 [0,0,1,0,0,0|1,1,0]=3 218 B5R0.2 [13CH3]SCCCO 62a_100011215043_200025704644 [0,0,1,0,0,0|1,0,0]=2 219 B5R0.2 [13CH3]SCCCO 62a_200025704644_100011215043 [0,0,1,0,0,0|1,0,0]=2 220 B4R0.2 C#CCOC 34a_100000210247_200000210301 [1,0,1,0,0,0|0,0,2]=4 221 B4R0.2 C#CCOC 34a_100138415774_100000184674 [1,0,1,0,0,0|0,0,2]=4 222 B4R0.2 C#CCO[13CH3] 34a_100000210247_200025704644 [1,0,1,0,0,0|0,0,2]=4 223 B4R0.2 C=CCOC 34a_100138415774_100015514636 [1,0,1,0,0,0|0,0,2]=4 224 B4R0.2 C=CCOC 34a_200000210373_200000210301 [1,0,1,0,0,0|0,0,2]=4 225 B4R0.2 C=CCO[13CH3] 34a_200000210373_200025704644 [1,0,1,0,0,0|0,0,2]=4 226 B4R0.2 CCCNC 2230a_106832991635_100000210303 [1,0,1,0,0,0|1,0,0]=3 227 B4R0.2 CCCNC 34a_100102657272_100000210303 [1,0,1,0,0,0|1,0,0]=3 228 B4R0.2 CCCNC 7a_106832991635_100000210303 [1,0,1,0,0,0|1,0,0]=3 229 B4R0.2 CCCOC 34a_100000210258_200000210301 [1,0,1,0,0,0|0,0,0]=2 230 B4R0.2 CCCOC 34a_100138415774_100000210303 [1,0,1,0,0,0|0,0,0]=2 231 B4R0.2 CCCO[13CH3] 34a_100000210258_200025704644 [1,0,1,0,0,0|0,0,0]=2 232 B4R0.2 CCCSC 62a_100000210303_200000210301 [1,0,1,0,0,0|0,1,0]=3 233 B4R0.2 CCCSC 62a_200000210301_100000210303 [1,0,1,0,0,0|0,1,0]=3 234 B4R0.2 CCCS[13CH3] 62a_100000210303_200025704644 [1,0,1,0,0,0|0,1,0]=3 235 B4R0.2 CCCS[13CH3] 62a_200025704644_100000210303 [1,0,1,0,0,0|0,1,0]=3 236 B4R0.2 CCNCC 2230a_100015525214_100000210202 [1,0,1,0,0,0|1,0,0]=3 237 B4R0.2 CCOCC 34a_100121572206_100000210202 [1,0,1,0,0,0|0,0,0]=2 238 B4R0.2 CCOCF 34a_100121572206_100015361967 [1,0,1,0,0,0|1,0,0]=3 239 B4R0.2 CCSCC 62a_100000210202_100000210202 [1,0,1,0,0,0|0,1,0]=3 240 B4R0.2 CCSCF 62a_100000210202_100015361967 [1,0,1,0,0,0|1,1,0]=4 241 B4R0.2 CCSCF 62a_100015361967_100000210202 [1,0,1,0,0,0|1,1,0]=4 242 B4R0.2 CNCCF 2230a_106832991635_100011217306 [1,0,1,0,0,0|2,0,0]=4 243 B4R0.2 CNCCF 34a_100000724931_200000210301 [1,0,1,0,0,0|2,0,0]=4 244 B4R0.2 CNCCF 34a_100102657272_100011217306 [1,0,1,0,0,0|2,0,0]=4 245 B4R0.2 CNCCF 7a_106832991635_100011217306 [1,0,1,0,0,0|2,0,0]=4 246 B4R0.2 CNCCO 2230a_100016997473_200000210301 [1,0,1,0,0,0|1,0,0]=3 247 B4R0.2 CNCCO 2230a_106832991635_100000211926 [1,0,1,0,0,0|1,0,0]=3 248 B4R0.2 CNCCO 34a_100016990907_200000210301 [1,0,1,0,0,0|1,0,0]=3 249 B4R0.2 CNCCO 34a_100102657272_100000211926 [1,0,1,0,0,0|1,0,0]=3 250 B4R0.2 CNCCO 7a_106832991635_100000211926 [1,0,1,0,0,0|1,0,0]=3 251 B4R0.2 CNCOC 2230a_106832991635_100000766300 [1,0,1,0,0,0|1,0,0]=3 252 B4R0.2 CNCSC 2230a_106832991635_100011218213 [1,0,1,0,0,0|1,1,0]=4 253 B4R0.2 CNCSC 34a_100102657272_100011218213 [1,0,1,0,0,0|1,1,0]=4 254 B4R0.2 COCC=O 34a_100138415774_200009817547 [1,0,1,0,0,0|1,0,1]=4 255 B4R0.2 COCCBr 34a_100000211926_200000210301 [1,0,1,0,0,0|1,0,0]=3 256 B4R0.2 COCCF 34a_100138415774_100011217306 [1,0,1,0,0,0|1,0,0]=3 257 B4R0.2 COCCN 34a_100000210304_200000210301 [1,0,1,0,0,0|1,0,0]=3 258 B4R0.2 COCCO 34a_100138415774_100000211926 [1,0,1,0,0,0|1,0,0]=3 259 B4R0.2 COCSC 34a_100138415774_100011218213 [1,0,1,0,0,0|1,0,0]=3 260 B4R0.2 COCSC 62a_100000766300_200000210301 [1,0,1,0,0,0|1,0,0]=3 261 B4R0.2 COCSC 62a_200000210301_100000766300 [1,0,1,0,0,0|1,0,0]=3 262 B4R0.2 COCS[13CH3] 62a_100000766300_200025704644 [1,0,1,0,0,0|1,0,0]=3 263 B4R0.2 COCS[13CH3] 62a_200025704644_100000766300 [1,0,1,0,0,0|1,0,0]=3 264 B4R0.2 CSCCF 62a_100011217306_200000210301 [1,0,1,0,0,0|1,1,0]=4 265 B4R0.2 CSCCF 62a_200000210301_100011217306 [1,0,1,0,0,0|1,1,0]=4 266 B4R0.2 CSCCO 62a_100000211926_200000210301 [1,0,1,0,0,0|1,0,0]=3 267 B4R0.2 CSCCO 62a_200000210301_100000211926 [1,0,1,0,0,0|1,0,0]=3 268 B4R0.2 CSCSC 62a_100011218213_200000210301 [1,0,1,0,0,0|1,1,0]=4 269 B4R0.2 CSCSC 62a_200000210301_100011218213 [1,0,1,0,0,0|1,1,0]=4 270 B4R0.2 CSCS[13CH3] 62a_100011218213_200025704644 [1,0,1,0,0,0|1,1,0]=4 271 B4R0.2 CSCS[13CH3] 62a_200025704644_100011218213 [1,0,1,0,0,0|1,1,0]=4 272 B4R0.2 [13CH3]NCCF 34a_100000724931_200025704644 [1,0,1,0,0,0|2,0,0]=4 273 B4R0.2 [13CH3]NCCO 2230a_100016997473_200025704644 [1,0,1,0,0,0|1,0,0]=3 274 B4R0.2 [13CH3]NCCO 34a_100016990907_200025704644 [1,0,1,0,0,0|1,0,0]=3 275 B4R0.2 [13CH3]OCCBr 34a_100000211926_200025704644 [1,0,1,0,0,0|1,0,0]=3 276 B4R0.2 [13CH3]OCCN 34a_100000210304_200025704644 [1,0,1,0,0,0|1,0,0]=3 277 B4R0.2 [13CH3]SCCF 62a_100011217306_200025704644 [1,0,1,0,0,0|1,1,0]=4 278 B4R0.2 [13CH3]SCCF 62a_200025704644_100011217306 [1,0,1,0,0,0|1,1,0]=4 279 B4R0.2 [13CH3]SCCO 62a_100000211926_200025704644 [1,0,1,0,0,0|1,0,0]=3 280 B4R0.2 [13CH3]SCCO 62a_200025704644_100000211926 [1,0,1,0,0,0|1,0,0]=3 281 B6R0.1 C#CC(C)OCC 34a_100121572206_200000035995 [0,1,1,0,0,0|0,0,2]=4 282 B6R0.1 C#CCC(C)OC 34a_100000685586_200000210301 [0,1,1,0,0,0|0,0,2]=4 283 B6R0.1 C#CCC(C)OC 7a_100000685586_200000210301 [0,1,1,0,0,0|0,0,2]=4 284 B6R0.1 C#CCC(C)O[13CH3] 34a_100000685586_200025704644 [0,1,1,0,0,0|0,0,2]=4 285 B6R0.1 C#CCC(C)O[13CH3] 7a_100000685586_200025704644 [0,1,1,0,0,0|0,0,2]=4 286 B6R0.1 C#C[C@@H](C)OCC 34a_100009815206_100000210202 [0,1,1,0,0,0|0,0,2]=4 287 B6R0.1 C#C[C@@H](C)OCC 7a_100009815206_100000210202 [0,1,1,0,0,0|0,0,2]=4 288 B6R0.1 C/C=C/C(C)OC 34a_200102604097_200000210301 [0,1,1,0,0,0|0,0,2]=4 289 B6R0.1 C/C=C/C(C)O[13CH3] 34a_200102604097_200025704644 [0,1,1,0,0,0|0,0,2]=4 290 B6R0.1 C=CC(C)COC 34a_100011215527_200000210301 [0,1,1,0,0,0|0,0,2]=4 291 B6R0.1 C=CC(C)COC 7a_100011215527_200000210301 [0,1,1,0,0,0|0,0,2]=4 292 B6R0.1 C=CC(C)CO[13CH3] 34a_100011215527_200025704644 [0,1,1,0,0,0|0,0,2]=4 293 B6R0.1 C=CC(C)CO[13CH3] 7a_100011215527_200025704644 [0,1,1,0,0,0|0,0,2]=4 294 B6R0.1 C=CC(C)OCC 34a_100000695699_100000210202 [0,1,1,0,0,0|0,0,2]=4 295 B6R0.1 C=CC(O)COC 34a_100138415774_100000730141 [0,1,1,0,0,0|0,0,2]=4 296 B6R0.1 C=CC[C@@H](C)OC 34a_100000731007_200000210301 [0,1,1,0,0,0|0,0,2]=4 297 B6R0.1 C=CC[C@@H](C)OC 7a_100000731007_200000210301 [0,1,1,0,0,0|0,0,2]=4 298 B6R0.1 C=CC[C@@H](C)O[13CH3] 34a_100000731007_200025704644 [0,1,1,0,0,0|0,0,2]=4 299 B6R0.1 C=CC[C@@H](C)O[13CH3] 7a_100000731007_200025704644 [0,1,1,0,0,0|0,0,2]=4 300 B6R0.1 C=C[C@H](N)COC 34a_100016989147_200000210301 [0,1,1,0,0,0|0,0,2]=4 301 B6R0.1 C=C[C@H](N)CO[13CH3] 34a_100016989147_200025704644 [0,1,1,0,0,0|0,0,2]=4 302 B6R0.1 CC#CC(C)OC 34a_100011216543_200000210301 [0,1,1,0,0,0|0,0,2]=4 303 B6R0.1 CC#CC(C)O[13CH3] 34a_100011216543_200025704644 [0,1,1,0,0,0|0,0,2]=4 304 B6R0.1 CC(CCBr)O[13CH3] 34a_100012276601_200025704644 [0,1,1,0,0,0|1,0,0]=3 305 B6R0.1 CC(CCO)S[13CH3] 62a_100009893172_200025704644 [0,1,1,0,0,0|1,0,0]=3 306 B6R0.1 CC(CCO)S[13CH3] 62a_200025704644_100009893172 [0,1,1,0,0,0|1,0,0]=3 307 B6R0.1 CC(CF)OCF 34a_100016041109_100015361967 [0,1,1,0,0,0|2,0,0]=4 308 B6R0.1 CC(CF)OCF 7a_100016041109_100015361967 [0,1,1,0,0,0|2,0,0]=4 309 B6R0.1 CC(CN)CO[13CH3] 34a_100000744482_200025704644 [0,1,1,0,0,0|1,0,0]=3 310 B6R0.1 CC(CN)OCF 34a_100000210904_100015361967 [0,1,1,0,0,0|2,0,0]=4 311 B6R0.1 CC(CO)CN[13CH3] 34a_100000744482_200025704644 [0,1,1,0,0,0|1,0,0]=3 312 B6R0.1 CC(CO)SCF 62a_100012180447_100015361967 [0,1,1,0,0,0|2,0,0]=4 313 B6R0.1 CCC(=O)CCF 1458a_100000210414_100011217306 [0,1,1,0,0,0|1,0,1]=4 314 B6R0.1 CCC(=O)CCO 1458a_100000210414_100000211926 [0,1,1,0,0,0|0,0,1]=3 315 B6R0.1 CCC(=O)CCO 1458a_100011216618_100000210202 [0,1,1,0,0,0|0,0,1]=3 316 B6R0.1 CCC(=O)CNC 7a_106832991635_100000747405 [0,1,1,0,0,0|1,0,1]=4 317 B6R0.1 CCC(=O)COC 1458a_100000210968_100000210202 [0,1,1,0,0,0|0,0,1]=3 318 B6R0.1 CCC(=O)COC 34a_100000725409_200000210301 [0,1,1,0,0,0|0,0,1]=3 319 B6R0.1 CCC(=O)CO[13CH3] 34a_100000725409_200025704644 [0,1,1,0,0,0|0,0,1]=3 320 B6R0.1 CCC(=O)CSC 1458a_100000184570_100000210202 [0,1,1,0,0,0|0,1,1]=4 321 B6R0.1 CCC(=O)CSC 62a_100000747405_200000210301 [0,1,1,0,0,0|0,1,1]=4 322 B6R0.1 CCC(=O)CSC 62a_200000210301_100000747405 [0,1,1,0,0,0|0,1,1]=4 323 B6R0.1 CCC(=O)CS[13CH3] 62a_100000747405_200025704644 [0,1,1,0,0,0|0,1,1]=4 324 B6R0.1 CCC(=O)CS[13CH3] 62a_200025704644_100000747405 [0,1,1,0,0,0|0,1,1]=4 325 B6R0.1 CCC(C)CNC 2230a_100020588543_200000210301 [0,1,1,0,0,0|1,0,0]=3 326 B6R0.1 CCC(C)CNC 2230a_106832991635_100000748023 [0,1,1,0,0,0|1,0,0]=3 327 B6R0.1 CCC(C)CNC 270004a_106832991635_100000243153 [0,1,1,0,0,0|1,0,0]=3 328 B6R0.1 CCC(C)CNC 34a_100102657272_100000748023 [0,1,1,0,0,0|1,0,0]=3 329 B6R0.1 CCC(C)CNC 7a_106832991635_100000748023 [0,1,1,0,0,0|1,0,0]=3 330 B6R0.1 CCC(C)CN[13CH3] 2230a_100020588543_200025704644 [0,1,1,0,0,0|1,0,0]=3 331 B6R0.1 CCC(C)COC 34a_100138415774_100000748023 [0,1,1,0,0,0|0,0,0]=2 332 B6R0.1 CCC(C)CSC 62a_100000748023_200000210301 [0,1,1,0,0,0|0,1,0]=3 333 B6R0.1 CCC(C)CSC 62a_200000210301_100000748023 [0,1,1,0,0,0|0,1,0]=3 334 B6R0.1 CCC(C)CS[13CH3] 62a_100000748023_200025704644 [0,1,1,0,0,0|0,1,0]=3 335 B6R0.1 CCC(C)CS[13CH3] 62a_200025704644_100000748023 [0,1,1,0,0,0|0,1,0]=3 336 B6R0.1 CCC(C)OCF 7a_100000210228_100015361967 [0,1,1,0,0,0|1,0,0]=3 337 B6R0.1 CCC(C)SCF 62a_100000758301_100015361967 [0,1,1,0,0,0|1,1,0]=4 338 B6R0.1 CCC(C)SCF 62a_100015361967_100000758301 [0,1,1,0,0,0|1,1,0]=4 339 B6R0.1 CCC(O)CNC 2230a_100011218483_200000210301 [0,1,1,0,0,0|1,0,0]=3 340 B6R0.1 CCC(O)CNC 2230a_106832991635_100011218378 [0,1,1,0,0,0|1,0,0]=3 341 B6R0.1 CCC(O)CNC 34a_100102657272_100011218378 [0,1,1,0,0,0|1,0,0]=3 342 B6R0.1 CCC(O)CNC 7a_106832991635_100011218378 [0,1,1,0,0,0|1,0,0]=3 343 B6R0.1 CCC(O)CN[13CH3] 2230a_100011218483_200025704644 [0,1,1,0,0,0|1,0,0]=3 344 B6R0.1 CCC(O)COC 34a_100138415774_100011218378 [0,1,1,0,0,0|0,0,0]=2 345 B6R0.1 CCC(O)CSC 62a_100011218378_200000210301 [0,1,1,0,0,0|0,1,0]=3 346 B6R0.1 CCC(O)CSC 62a_200000210301_100011218378 [0,1,1,0,0,0|0,1,0]=3 347 B6R0.1 CCC(O)CS[13CH3] 62a_100011218378_200025704644 [0,1,1,0,0,0|0,1,0]=3 348 B6R0.1 CCC(O)CS[13CH3] 62a_200025704644_100011218378 [0,1,1,0,0,0|0,1,0]=3 349 B6R0.1 CCCC(=O)CC 1458a_100000210414_100000210303 [0,1,1,0,0,0|1,0,0]=3 350 B6R0.1 CCCC(=O)CC 1458a_100000211992_100000210202 [0,1,1,0,0,0|1,0,0]=3 351 B6R0.1 CCCC(=O)CF 1458a_100000211992_100015361967 [0,1,1,0,0,0|1,0,1]=4 352 B6R0.1 CCCC(=O)CO 1458a_100000210174_100000210303 [0,1,1,0,0,0|0,0,1]=3 353 B6R0.1 CCCC(=O)NC 11a_106832991635_100000211992 [0,1,1,0,0,0|1,0,1]=4 354 B6R0.1 CCCC(=O)NC 1626a_100102657272_100000211992 [0,1,1,0,0,0|1,0,1]=4 355 B6R0.1 CCCC(=O)NC 240690a_100102657272_100000211992 [0,1,1,0,0,0|1,0,1]=4 356 B6R0.1 CCCC(=O)NC 527a_100102657272_100000211992 [0,1,1,0,0,0|1,0,1]=4 357 B6R0.1 CCCC(C)NC 2230a_100000741246_200000210301 [0,1,1,0,0,0|1,0,0]=3 358 B6R0.1 CCCC(C)NC 2230a_106832991635_100000766640 [0,1,1,0,0,0|1,0,0]=3 359 B6R0.1 CCCC(C)NC 270004a_106832991635_100000211909 [0,1,1,0,0,0|1,0,0]=3 360 B6R0.1 CCCC(C)NC 34a_100102657272_100000766640 [0,1,1,0,0,0|1,0,0]=3 361 B6R0.1 CCCC(C)NC 7a_106832991635_100000766640 [0,1,1,0,0,0|1,0,0]=3 362 B6R0.1 CCCC(C)N[13CH3] 2230a_100000741246_200025704644 [0,1,1,0,0,0|1,0,0]=3 363 B6R0.1 CCCC(C)OC 34a_100000764384_200000210301 [0,1,1,0,0,0|0,0,0]=2 364 B6R0.1 CCCC(C)OC 34a_100138415774_100000766640 [0,1,1,0,0,0|0,0,0]=2 365 B6R0.1 CCCC(C)OC 7a_100000764384_200000210301 [0,1,1,0,0,0|0,0,0]=2 366 B6R0.1 CCCC(C)O[13CH3] 34a_100000764384_200025704644 [0,1,1,0,0,0|0,0,0]=2 367 B6R0.1 CCCC(C)O[13CH3] 7a_100000764384_200025704644 [0,1,1,0,0,0|0,0,0]=2 368 B6R0.1 CCCC(C)SC 62a_100000766640_200000210301 [0,1,1,0,0,0|0,1,0]=3 369 B6R0.1 CCCC(C)SC 62a_200000210301_100000766640 [0,1,1,0,0,0|0,1,0]=3 370 B6R0.1 CCCC(C)S[13CH3] 62a_100000766640_200025704644 [0,1,1,0,0,0|0,1,0]=3 371 B6R0.1 CCCC(C)S[13CH3] 62a_200025704644_100000766640 [0,1,1,0,0,0|0,1,0]=3 372 B6R0.1 CCCN(C)CC 2230a_100000225621_100000210303 [0,1,1,0,0,0|1,0,0]=3 373 B6R0.1 CCCN(C)CC 2230a_100000226822_200000210301 [0,1,1,0,0,0|1,0,0]=3 374 B6R0.1 CCCN(C)CC 2230a_100000747261_100000210202 [0,1,1,0,0,0|1,0,0]=3 375 B6R0.1 CCCN(C)CC 269982a_100000225621_100000210303 [0,1,1,0,0,0|1,0,0]=3 376 B6R0.1 CCCN(C)CC 269982a_100000226822_200000210301 [0,1,1,0,0,0|1,0,0]=3 377 B6R0.1 CCCN(C)CC 269982a_100000747261_100000204670 [0,1,1,0,0,0|1,0,0]=3 378 B6R0.1 CCCN(C)CF 269982a_100000747261_100015361967 [0,1,1,0,0,0|2,0,0]=4 379 B6R0.1 CCCN([13CH3])CC 2230a_100000226822_200025704644 [0,1,1,0,0,0|1,0,0]=3 380 B6R0.1 CCCN([13CH3])CC 269982a_100000226822_200025704644 [0,1,1,0,0,0|1,0,0]=3 381 B6R0.1 CCN(C)CCF 2230a_100000225621_100011217306 [0,1,1,0,0,0|2,0,0]=4 382 B6R0.1 CCN(C)CCF 269982a_100000225621_100011217306 [0,1,1,0,0,0|2,0,0]=4 383 B6R0.1 CCN(C)CCO 2230a_100000210263_100000210202 [0,1,1,0,0,0|1,0,0]=3 384 B6R0.1 CCN(C)CCO 2230a_100000210973_200000210301 [0,1,1,0,0,0|1,0,0]=3 385 B6R0.1 CCN(C)CCO 2230a_100000225621_100000211926 [0,1,1,0,0,0|1,0,0]=3 386 B6R0.1 CCN(C)CCO 269982a_100000210263_100000204670 [0,1,1,0,0,0|1,0,0]=3 387 B6R0.1 CCN(C)CCO 269982a_100000210973_200000210301 [0,1,1,0,0,0|1,0,0]=3 388 B6R0.1 CCN(C)CCO 269982a_100000225621_100000211926 [0,1,1,0,0,0|1,0,0]=3 389 B6R0.1 CCN(C)COC 2230a_100000225621_100000766300 [0,1,1,0,0,0|1,0,0]=3 390 B6R0.1 CCN(C)COC 269982a_100000225621_100000766300 [0,1,1,0,0,0|1,0,0]=3 391 B6R0.1 CCN(C)CSC 2230a_100000225621_100011218213 [0,1,1,0,0,0|1,1,0]=4 392 B6R0.1 CCN(C)CSC 269982a_100000225621_100011218213 [0,1,1,0,0,0|1,1,0]=4 393 B6R0.1 CCN([13CH3])CCO 2230a_100000210973_200025704644 [0,1,1,0,0,0|1,0,0]=3 394 B6R0.1 CCN([13CH3])CCO 269982a_100000210973_200025704644 [0,1,1,0,0,0|1,0,0]=3 395 B6R0.1 CCNC(=O)CC 11a_100015525214_100000210414 [0,1,1,0,0,0|1,0,1]=4 396 B6R0.1 CCNC(=O)CC 240690a_100015525214_100000210414 [0,1,1,0,0,0|1,0,1]=4 397 B6R0.1 CCNC(=O)CC 527a_100015525214_100000210414 [0,1,1,0,0,0|1,0,1]=4 398 B6R0.1 CCNC(=O)CO 240690a_100015525214_100000210174 [0,1,1,0,0,0|1,0,1]=4 399 B6R0.1 CCNC(=O)CO 527a_100015525214_100000210174 [0,1,1,0,0,0|1,0,1]=4 400 B6R0.1 CCNC(C)CC 2230a_100000209981_100000210202 [0,1,1,0,0,0|1,0,0]=3 401 B6R0.1 CCNC(C)CC 2230a_100015525214_100000758301 [0,1,1,0,0,0|1,0,0]=3 402 B6R0.1 CCNC(C)CO 2230a_100015525214_100012180447 [0,1,1,0,0,0|1,0,0]=3 403 B6R0.1 CCN[C@H](C)CO 2230a_100000737577_100000210202 [0,1,1,0,0,0|1,0,0]=3 404 B6R0.1 CCOC(C)C#N 34a_100011218135_100000210202 [0,1,1,0,0,0|1,0,1]=4 405 B6R0.1 CCOC(C)CC 34a_100121572206_100011215416 [0,1,1,0,0,0|0,0,0]=2 406 B6R0.1 CCOC(C)CC 7a_100000210228_100000210202 [0,1,1,0,0,0|0,0,0]=2 407 B6R0.1 CCOC(C)CF 34a_100016041109_100000210202 [0,1,1,0,0,0|1,0,0]=3 408 B6R0.1 CCOC(C)CF 7a_100016041109_100000210202 [0,1,1,0,0,0|1,0,0]=3 409 B6R0.1 CCOC(C)CN 34a_100000210904_100000210202 [0,1,1,0,0,0|1,0,0]=3 410 B6R0.1 CCOC(C)CO 34a_100121572206_100012180447 [0,1,1,0,0,0|1,0,0]=3 411 B6R0.1 CCSC(C)CC 62a_100000210202_100000758301 [0,1,1,0,0,0|0,1,0]=3 412 B6R0.1 CCSC(C)CC 62a_100000758301_100000210202 [0,1,1,0,0,0|0,1,0]=3 413 B6R0.1 CCSC(C)CO 62a_100012180447_100000210202 [0,1,1,0,0,0|1,0,0]=3 414 B6R0.1 CCSC(C)OC 62a_100000210202_100009879195 [0,1,1,0,0,0|1,0,0]=3 415 B6R0.1 CCSC(C)OC 62a_100009879195_100000210202 [0,1,1,0,0,0|1,0,0]=3 416 B6R0.1 CCS[C@H](C)CO 62a_100000210202_100016084084 [0,1,1,0,0,0|1,0,0]=3 417 B6R0.1 CCS[C@H](C)CO 62a_100016084084_100000210202 [0,1,1,0,0,0|1,0,0]=3 418 B6R0.1 CC[C@H](C)CNC 2230a_106832991635_100009816398 [0,1,1,0,0,0|1,0,0]=3 419 B6R0.1 CC[C@H](C)CNC 34a_100102657272_100009816398 [0,1,1,0,0,0|1,0,0]=3 420 B6R0.1 CC[C@H](C)CNC 7a_106832991635_100009816398 [0,1,1,0,0,0|1,0,0]=3 421 B6R0.1 CC[C@H](C)COC 34a_100138415774_100009816398 [0,1,1,0,0,0|0,0,0]=2 422 B6R0.1 CC[C@H](C)COC 7a_100009816381_200000210301 [0,1,1,0,0,0|0,0,0]=2 423 B6R0.1 CC[C@H](C)CO[13CH3] 7a_100009816381_200025704644 [0,1,1,0,0,0|0,0,0]=2 424 B6R0.1 CC[C@H](C)CSC 62a_100009816398_200000210301 [0,1,1,0,0,0|0,1,0]=3 425 B6R0.1 CC[C@H](C)CSC 62a_200000210301_100009816398 [0,1,1,0,0,0|0,1,0]=3 426 B6R0.1 CC[C@H](C)CS[13CH3] 62a_100009816398_200025704644 [0,1,1,0,0,0|0,1,0]=3 427 B6R0.1 CC[C@H](C)CS[13CH3] 62a_200025704644_100009816398 [0,1,1,0,0,0|0,1,0]=3 428 B6R0.1 CN(CF)CCO 269982a_100000210263_100015361967 [0,1,1,0,0,0|2,0,0]=4 429 B6R0.1 CNC(=O)CCO 240690a_100102657272_100011216618 [0,1,1,0,0,0|1,0,1]=4 430 B6R0.1 CNC(=O)COC 11a_106832991635_100000210968 [0,1,1,0,0,0|1,0,1]=4 431 B6R0.1 CNC(=O)COC 1626a_100102657272_100000210968 [0,1,1,0,0,0|1,0,1]=4 432 B6R0.1 CNC(=O)COC 240690a_100102657272_100000210968 [0,1,1,0,0,0|1,0,1]=4 433 B6R0.1 CNC(=O)COC 34a_100000750040_200000210301 [0,1,1,0,0,0|1,0,1]=4 434 B6R0.1 CNC(=O)COC 34a_100138415774_100000183359 [0,1,1,0,0,0|1,0,1]=4 435 B6R0.1 CNC(=O)COC 527a_100102657272_100000210968 [0,1,1,0,0,0|1,0,1]=4 436 B6R0.1 CNC(=O)CO[13CH3] 34a_100000750040_200025704644 [0,1,1,0,0,0|1,0,1]=4 437 B6R0.1 CNC(C)CCO 2230a_106832991635_100009893172 [0,1,1,0,0,0|1,0,0]=3 438 B6R0.1 CNC(C)CCO 34a_100102657272_100009893172 [0,1,1,0,0,0|1,0,0]=3 439 B6R0.1 CNC(C)CCO 7a_106832991635_100009893172 [0,1,1,0,0,0|1,0,0]=3 440 B6R0.1 CNC(C)COC 2230a_106832991635_100000765312 [0,1,1,0,0,0|1,0,0]=3 441 B6R0.1 CNC(C)COC 270004a_106832991635_100000749346 [0,1,1,0,0,0|1,0,0]=3 442 B6R0.1 CNC(C)COC 34a_100102657272_100000765312 [0,1,1,0,0,0|1,0,0]=3 443 B6R0.1 CNC(C)COC 7a_106832991635_100000765312 [0,1,1,0,0,0|1,0,0]=3 444 B6R0.1 CNC(C)CSC 270004a_106832991635_100011216314 [0,1,1,0,0,0|1,1,0]=4 445 B6R0.1 CNCC(=O)OC 2230a_106832991635_100000747449 [0,1,1,0,0,0|1,0,1]=4 446 B6R0.1 CNCC(=O)OC 34a_100102657272_100000747449 [0,1,1,0,0,0|1,0,1]=4 447 B6R0.1 CNCC(=O)OC 7a_106832991635_100000747449 [0,1,1,0,0,0|1,0,1]=4 448 B6R0.1 CNCC(C)CO 34a_100000744482_200000210301 [0,1,1,0,0,0|1,0,0]=3 449 B6R0.1 CNCC(O)CO 2230a_106832991635_100011219619 [0,1,1,0,0,0|1,0,0]=3 450 B6R0.1 CNCC(O)CO 34a_100102657272_100011219619 [0,1,1,0,0,0|1,0,0]=3 451 B6R0.1 CNCC(O)CO 7a_106832991635_100011219619 [0,1,1,0,0,0|1,0,0]=3 452 B6R0.1 CNC[C@@H](C)CO 2230a_106832991635_100000059175 [0,1,1,0,0,0|1,0,0]=3 453 B6R0.1 CNC[C@@H](C)CO 34a_100102657272_100000059175 [0,1,1,0,0,0|1,0,0]=3 454 B6R0.1 CNC[C@@H](C)CO 7a_106832991635_100000059175 [0,1,1,0,0,0|1,0,0]=3 455 B6R0.1 CNC[C@@H](C)OC 2230a_100020591295_200000210301 [0,1,1,0,0,0|1,0,0]=3 456 B6R0.1 CNC[C@@H](F)CO 34a_100015665980_200000210301 [0,1,1,0,0,0|1,0,0]=3 457 B6R0.1 CNC[C@@H](O)CF 2230a_106832991635_100015614560 [0,1,1,0,0,0|2,0,0]=4 458 B6R0.1 CNC[C@@H](O)CF 34a_100102657272_100015614560 [0,1,1,0,0,0|2,0,0]=4 459 B6R0.1 CNC[C@@H](O)CF 7a_106832991635_100015614560 [0,1,1,0,0,0|2,0,0]=4 460 B6R0.1 CNC[C@@H](O)CO 2230a_106832991635_100009815848 [0,1,1,0,0,0|1,0,0]=3 461 B6R0.1 CNC[C@@H](O)CO 34a_100102657272_100009815848 [0,1,1,0,0,0|1,0,0]=3 462 B6R0.1 CNC[C@@H](O)CO 7a_106832991635_100009815848 [0,1,1,0,0,0|1,0,0]=3 463 B6R0.1 CNC[C@H](O)CO 2230a_100020644852_200000210301 [0,1,1,0,0,0|1,0,0]=3 464 B6R0.1 CN[C@H](C)CCO 2230a_100000706166_200000210301 [0,1,1,0,0,0|1,0,0]=3 465 B6R0.1 CN[C@H](C)CCO 34a_100000706166_200000210301 [0,1,1,0,0,0|1,0,0]=3 466 B6R0.1 CN[C@H](C)COC 2230a_100000764878_200000210301 [0,1,1,0,0,0|1,0,0]=3 467 B6R0.1 COC(=O)CSC 62a_100000747449_200000210301 [0,1,1,0,0,0|1,0,1]=4 468 B6R0.1 COC(=O)CSC 62a_200000210301_100000747449 [0,1,1,0,0,0|1,0,1]=4 469 B6R0.1 COC(=O)CS[13CH3] 62a_100000747449_200025704644 [0,1,1,0,0,0|1,0,1]=4 470 B6R0.1 COC(=O)CS[13CH3] 62a_200025704644_100000747449 [0,1,1,0,0,0|1,0,1]=4 471 B6R0.1 COC(C)CCBr 34a_100012276601_200000210301 [0,1,1,0,0,0|1,0,0]=3 472 B6R0.1 COC(C)CCO 34a_100138415774_100009893172 [0,1,1,0,0,0|1,0,0]=3 473 B6R0.1 COC(C)CO[13CH3] 34a_100000690652_200025704644 [0,1,1,0,0,0|1,0,0]=3 474 B6R0.1 COC(C)SCF 62a_100009879195_100015361967 [0,1,1,0,0,0|2,0,0]=4 475 B6R0.1 COC(C)SCF 62a_100015361967_100009879195 [0,1,1,0,0,0|2,0,0]=4 476 B6R0.1 COCC(=O)CF 1458a_100000210968_100015361967 [0,1,1,0,0,0|1,0,1]=4 477 B6R0.1 COCC(=O)OC 34a_100138415774_100000747449 [0,1,1,0,0,0|1,0,1]=4 478 B6R0.1 COCC(C)CN 34a_100000744482_200000210301 [0,1,1,0,0,0|1,0,0]=3 479 B6R0.1 COCC(C)OC 34a_100000690652_200000210301 [0,1,1,0,0,0|1,0,0]=3 480 B6R0.1 COCC(C)OC 34a_100138415774_100000765312 [0,1,1,0,0,0|1,0,0]=3 481 B6R0.1 COCC(C)SC 62a_100000765312_200000210301 [0,1,1,0,0,0|1,0,0]=3 482 B6R0.1 COCC(C)SC 62a_200000210301_100000765312 [0,1,1,0,0,0|1,0,0]=3 483 B6R0.1 COCC(C)S[13CH3] 62a_100000765312_200025704644 [0,1,1,0,0,0|1,0,0]=3 484 B6R0.1 COCC(C)S[13CH3] 62a_200025704644_100000765312 [0,1,1,0,0,0|1,0,0]=3 485 B6R0.1 COCC(Cl)CCl 34a_100000033668_200000210301 [0,1,1,0,0,0|1,0,0]=3 486 B6R0.1 COCC(O)CO 34a_100138415774_100011219619 [0,1,1,0,0,0|1,0,0]=3 487 B6R0.1 COC[C@@H](C)CO 34a_100138415774_100000059175 [0,1,1,0,0,0|1,0,0]=3 488 B6R0.1 COC[C@@H](C)N[13CH3] 2230a_100000764878_200025704644 [0,1,1,0,0,0|1,0,0]=3 489 B6R0.1 COC[C@@H](C)OC 34a_100011934205_200000210301 [0,1,1,0,0,0|1,0,0]=3 490 B6R0.1 COC[C@@H](C)O[13CH3] 34a_100011934205_200025704644 [0,1,1,0,0,0|1,0,0]=3 491 B6R0.1 COC[C@@H](O)CF 34a_100138415774_100015614560 [0,1,1,0,0,0|1,0,0]=3 492 B6R0.1 COC[C@@H](O)CO 34a_100138415774_100009815848 [0,1,1,0,0,0|1,0,0]=3 493 B6R0.1 COC[C@H](F)CN 34a_100015665980_200000210301 [0,1,1,0,0,0|1,0,0]=3 494 B6R0.1 CO[C@H](C)CN[13CH3] 2230a_100020591295_200025704644 [0,1,1,0,0,0|1,0,0]=3 495 B6R0.1 CSC(C)CCO 62a_100009893172_200000210301 [0,1,1,0,0,0|1,0,0]=3 496 B6R0.1 CSC(C)CCO 62a_200000210301_100009893172 [0,1,1,0,0,0|1,0,0]=3 497 B6R0.1 CSCC(O)CO 62a_100011219619_200000210301 [0,1,1,0,0,0|1,0,0]=3 498 B6R0.1 CSCC(O)CO 62a_200000210301_100011219619 [0,1,1,0,0,0|1,0,0]=3 499 B6R0.1 CSC[C@@H](C)CO 62a_100000059175_200000210301 [0,1,1,0,0,0|1,0,0]=3 500 B6R0.1 CSC[C@@H](C)CO 62a_200000210301_100000059175 [0,1,1,0,0,0|1,0,0]=3 501 B6R0.1 CSC[C@@H](O)CF 62a_100015614560_200000210301 [0,1,1,0,0,0|1,1,0]=4 502 B6R0.1 CSC[C@@H](O)CF 62a_200000210301_100015614560 [0,1,1,0,0,0|1,1,0]=4 503 B6R0.1 CSC[C@@H](O)CO 62a_100009815848_200000210301 [0,1,1,0,0,0|1,0,0]=3 504 B6R0.1 CSC[C@@H](O)CO 62a_200000210301_100009815848 [0,1,1,0,0,0|1,0,0]=3 505 B6R0.1 C[C@@H](CO)CS[13CH3] 62a_100000059175_200025704644 [0,1,1,0,0,0|1,0,0]=3 506 B6R0.1 C[C@@H](CO)CS[13CH3] 62a_200025704644_100000059175 [0,1,1,0,0,0|1,0,0]=3 507 B6R0.1 C[C@H](CCO)N[13CH3] 2230a_100000706166_200025704644 [0,1,1,0,0,0|1,0,0]=3 508 B6R0.1 C[C@H](CCO)N[13CH3] 34a_100000706166_200025704644 [0,1,1,0,0,0|1,0,0]=3 509 B6R0.1 C[C@H](CO)SCF 62a_100015361967_100016084084 [0,1,1,0,0,0|2,0,0]=4 510 B6R0.1 C[C@H](CO)SCF 62a_100016084084_100015361967 [0,1,1,0,0,0|2,0,0]=4 511 B6R0.1 O=C(CF)CCO 1458a_100011216618_100015361967 [0,1,1,0,0,0|1,0,1]=4 512 B6R0.1 O=C(CO)CCF 1458a_100000210174_100011217306 [0,1,1,0,0,0|1,0,1]=4 513 B6R0.1 O=C(CO)CCO 1458a_100000210174_100000211926 [0,1,1,0,0,0|1,0,1]=4 514 B6R0.1 [13CH3]NC[C@@H](F)CO 34a_100015665980_200025704644 [0,1,1,0,0,0|1,0,0]=3 515 B6R0.1 [13CH3]NC[C@H](O)CO 2230a_100020644852_200025704644 [0,1,1,0,0,0|1,0,0]=3 516 B6R0.1 [13CH3]OCC(Cl)CCl 34a_100000033668_200025704644 [0,1,1,0,0,0|1,0,0]=3 517 B6R0.1 [13CH3]OC[C@H](F)CN 34a_100015665980_200025704644 [0,1,1,0,0,0|1,0,0]=3 518 B6R0.1 [13CH3]SCC(O)CO 62a_100011219619_200025704644 [0,1,1,0,0,0|1,0,0]=3 519 B6R0.1 [13CH3]SCC(O)CO 62a_200025704644_100011219619 [0,1,1,0,0,0|1,0,0]=3 520 B6R0.1 [13CH3]SC[C@@H](O)CF 62a_100015614560_200025704644 [0,1,1,0,0,0|1,1,0]=4 521 B6R0.1 [13CH3]SC[C@@H](O)CF 62a_200025704644_100015614560 [0,1,1,0,0,0|1,1,0]=4 522 B6R0.1 [13CH3]SC[C@@H](O)CO 62a_100009815848_200025704644 [0,1,1,0,0,0|1,0,0]=3 523 B6R0.1 [13CH3]SC[C@@H](O)CO 62a_200025704644_100009815848 [0,1,1,0,0,0|1,0,0]=3 524 B6R0.4 C#CCOC(C)C 34a_100000210247_100000210206 [0,1,1,0,0,0|0,0,2]=4 525 B6R0.4 C#CCOC(C)C 34a_100000212225_100000184674 [0,1,1,0,0,0|0,0,2]=4 526 B6R0.4 C=C(Br)CCOC 34a_100009813270_200000210301 [0,1,1,0,0,0|0,0,2]=4 527 B6R0.4 C=C(Br)CCO[13CH3] 34a_100009813270_200025704644 [0,1,1,0,0,0|0,0,2]=4 528 B6R0.4 C=C(C)CCNC 2230a_106832991635_100000730704 [0,1,1,0,0,0|1,0,1]=4 529 B6R0.4 C=C(C)CCNC 34a_100102657272_100000730704 [0,1,1,0,0,0|1,0,1]=4 530 B6R0.4 C=C(C)CCNC 7a_106832991635_100000730704 [0,1,1,0,0,0|1,0,1]=4 531 B6R0.4 C=C(C)CCOC 34a_100000764851_200000210301 [0,1,1,0,0,0|0,0,1]=3 532 B6R0.4 C=C(C)CCOC 34a_100138415774_100000730704 [0,1,1,0,0,0|0,0,1]=3 533 B6R0.4 C=C(C)CCO[13CH3] 34a_100000764851_200025704644 [0,1,1,0,0,0|0,0,1]=3 534 B6R0.4 C=C(C)CCSC 62a_100000730704_200000210301 [0,1,1,0,0,0|0,1,1]=4 535 B6R0.4 C=C(C)CCSC 62a_200000210301_100000730704 [0,1,1,0,0,0|0,1,1]=4 536 B6R0.4 C=C(C)CCS[13CH3] 62a_100000730704_200025704644 [0,1,1,0,0,0|0,1,1]=4 537 B6R0.4 C=C(C)CCS[13CH3] 62a_200025704644_100000730704 [0,1,1,0,0,0|0,1,1]=4 538 B6R0.4 C=C(C)CNCC 2230a_100015525214_100000748629 [0,1,1,0,0,0|1,0,1]=4 539 B6R0.4 C=C(C)COCC 34a_100000210245_100000210202 [0,1,1,0,0,0|0,0,1]=3 540 B6R0.4 C=C(C)COCC 34a_100121572206_100000748629 [0,1,1,0,0,0|0,0,1]=3 541 B6R0.4 C=C(C)COCF 34a_100000210245_100015361967 [0,1,1,0,0,0|1,0,1]=4 542 B6R0.4 C=C(C)CSCC 62a_100000210202_100000211660 [0,1,1,0,0,0|0,1,1]=4 543 B6R0.4 C=C(C)CSCC 62a_100000748629_100000210202 [0,1,1,0,0,0|0,1,1]=4 544 B6R0.4 C=C(F)COCC 34a_100121572206_100009893438 [0,1,1,0,0,0|0,0,2]=4 545 B6R0.4 C=C(F)COCC 34a_200010262243_100000210202 [0,1,1,0,0,0|0,0,2]=4 546 B6R0.4 C=CCOC(C)C 34a_100000212225_100015514636 [0,1,1,0,0,0|0,0,2]=4 547 B6R0.4 C=CCOC(C)C 34a_200000210373_100000210206 [0,1,1,0,0,0|0,0,2]=4 548 B6R0.4 CC(=CCO[13CH3])C 34a_100000753907_200025704644 [0,1,1,0,0,0|0,0,2]=4 549 B6R0.4 CC(=O)CCCF 1458a_100000070787_100011934791 [0,1,1,0,0,0|1,0,1]=4 550 B6R0.4 CC(=O)CCCO 1458a_100000070787_100011215043 [0,1,1,0,0,0|0,0,1]=3 551 B6R0.4 CC(=O)CCO[13CH3] 34a_100000759926_200025704644 [0,1,1,0,0,0|0,0,1]=3 552 B6R0.4 CC(=O)CCO[13CH3] 7a_100000759926_200025704644 [0,1,1,0,0,0|0,0,1]=3 553 B6R0.4 CC(=O)CCS[13CH3] 62a_100000053229_200025704644 [0,1,1,0,0,0|0,1,1]=4 554 B6R0.4 CC(=O)CCS[13CH3] 62a_200025704644_100000053229 [0,1,1,0,0,0|0,1,1]=4 555 B6R0.4 CC(=O)COCF 34a_100000211253_100015361967 [0,1,1,0,0,0|1,0,1]=4 556 B6R0.4 CC(=O)NCCO 240690a_100000210304_100015343762 [0,1,1,0,0,0|1,0,1]=4 557 B6R0.4 CC(=O)NCCO 527a_100000210304_100103153847 [0,1,1,0,0,0|1,0,1]=4 558 B6R0.4 CC(=O)OCS[13CH3] 62a_100000076356_200025704644 [0,1,1,0,0,0|1,0,1]=4 559 B6R0.4 CC(=O)OCS[13CH3] 62a_200025704644_100000076356 [0,1,1,0,0,0|1,0,1]=4 560 B6R0.4 CC(Br)CCO[13CH3] 34a_100009893172_200025704644 [0,1,1,0,0,0|0,0,0]=2 561 B6R0.4 CC(Br)COCF 34a_100012180447_100015361967 [0,1,1,0,0,0|1,0,0]=3 562 B6R0.4 CC(C)CCO[13CH3] 34a_100000210254_200025704644 [0,1,1,0,0,0|0,0,0]=2 563 B6R0.4 CC(C)CCO[13CH3] 7a_100000210254_200025704644 [0,1,1,0,0,0|0,0,0]=2 564 B6R0.4 CC(C)CCS[13CH3] 62a_100000210312_200025704644 [0,1,1,0,0,0|0,1,0]=3 565 B6R0.4 CC(C)CCS[13CH3] 62a_200025704644_100000210312 [0,1,1,0,0,0|0,1,0]=3 566 B6R0.4 CC(C)CNCF 34a_100000210953_100015361967 [0,1,1,0,0,0|2,0,0]=4 567 B6R0.4 CC(C)COCF 34a_100000210257_100015361967 [0,1,1,0,0,0|1,0,0]=3 568 B6R0.4 CC(C)CSCF 62a_100000210624_100015361967 [0,1,1,0,0,0|1,1,0]=4 569 B6R0.4 CC(C)CSCF 62a_100015361967_100000210760 [0,1,1,0,0,0|1,1,0]=4 570 B6R0.4 CC(C)NCCF 2230a_100138425928_100011217306 [0,1,1,0,0,0|2,0,0]=4 571 B6R0.4 CC(C)NCCF 34a_100000724931_100000210206 [0,1,1,0,0,0|2,0,0]=4 572 B6R0.4 CC(C)NCCF 34a_100138425928_100011217306 [0,1,1,0,0,0|2,0,0]=4 573 B6R0.4 CC(C)NCCO 2230a_100016997473_100000210206 [0,1,1,0,0,0|1,0,0]=3 574 B6R0.4 CC(C)NCCO 2230a_100138425928_100000211926 [0,1,1,0,0,0|1,0,0]=3 575 B6R0.4 CC(C)NCCO 34a_100016990907_100000210206 [0,1,1,0,0,0|1,0,0]=3 576 B6R0.4 CC(C)NCCO 34a_100138425928_100000211926 [0,1,1,0,0,0|1,0,0]=3 577 B6R0.4 CC(C)OCC=O 34a_100000212225_200009817547 [0,1,1,0,0,0|1,0,1]=4 578 B6R0.4 CC(C)OCCBr 34a_100000211926_100000210206 [0,1,1,0,0,0|1,0,0]=3 579 B6R0.4 CC(C)OCCF 34a_100000212225_100011217306 [0,1,1,0,0,0|1,0,0]=3 580 B6R0.4 CC(C)OCCN 34a_100000210304_100000210206 [0,1,1,0,0,0|1,0,0]=3 581 B6R0.4 CC(C)OCCO 34a_100000212225_100000211926 [0,1,1,0,0,0|1,0,0]=3 582 B6R0.4 CC(C)OCS[13CH3] 62a_100000709892_200025704644 [0,1,1,0,0,0|1,0,0]=3 583 B6R0.4 CC(C)OCS[13CH3] 62a_200025704644_100000709892 [0,1,1,0,0,0|1,0,0]=3 584 B6R0.4 CC(C)SCCF 62a_100000210206_100011217306 [0,1,1,0,0,0|1,1,0]=4 585 B6R0.4 CC(C)SCCF 62a_100011217306_100000210206 [0,1,1,0,0,0|1,1,0]=4 586 B6R0.4 CC(C)SCCO 62a_100000210206_100000211926 [0,1,1,0,0,0|1,0,0]=3 587 B6R0.4 CC(C)SCCO 62a_100000211926_100000210206 [0,1,1,0,0,0|1,0,0]=3 588 B6R0.4 CC(F)COCF 34a_100015925927_100015361967 [0,1,1,0,0,0|1,0,0]=3 589 B6R0.4 CC(O)CCN[13CH3] 2230a_200000755665_200025704644 [0,1,1,0,0,0|1,0,0]=3 590 B6R0.4 CC(O)CCS[13CH3] 62a_100012276601_200025704644 [0,1,1,0,0,0|0,1,0]=3 591 B6R0.4 CC(O)CCS[13CH3] 62a_200025704644_100012276601 [0,1,1,0,0,0|0,1,0]=3 592 B6R0.4 CC(O)CNCF 34a_100000210904_100015361967 [0,1,1,0,0,0|2,0,0]=4 593 B6R0.4 CC(O)CSCF 62a_100011218427_100015361967 [0,1,1,0,0,0|1,1,0]=4 594 B6R0.4 CC(O)CSCF 62a_100015361967_100011218427 [0,1,1,0,0,0|1,1,0]=4 595 B6R0.4 CCCCC(=O)C 1458a_100000070787_100000210211 [0,1,1,0,0,0|1,0,0]=3 596 B6R0.4 CCCCC(=O)C 1458a_100000210183_200000210301 [0,1,1,0,0,0|1,0,0]=3 597 B6R0.4 CCCCC(=O)[13CH3] 1458a_100000210183_200025704644 [0,1,1,0,0,0|1,0,0]=3 598 B6R0.4 CCCCN(C)C 2230a_100000207549_200000210301 [0,1,1,0,0,0|1,0,0]=3 599 B6R0.4 CCCCN(C)C 2230a_100102631434_100000210211 [0,1,1,0,0,0|1,0,0]=3 600 B6R0.4 CCCCN(C)C 269982a_100000207549_200000210301 [0,1,1,0,0,0|1,0,0]=3 601 B6R0.4 CCCCN(C)C 269982a_100102631434_100000210211 [0,1,1,0,0,0|1,0,0]=3 602 B6R0.4 CCCCN(C)[13CH3] 2230a_100000207549_200025704644 [0,1,1,0,0,0|1,0,0]=3 603 B6R0.4 CCCCN(C)[13CH3] 269982a_100000207549_200025704644 [0,1,1,0,0,0|1,0,0]=3 604 B6R0.4 CCCNC(=O)C 11a_100020643023_100015343762 [0,1,1,0,0,0|1,0,1]=4 605 B6R0.4 CCCNC(=O)C 1626a_100020643023_100015343762 [0,1,1,0,0,0|1,0,1]=4 606 B6R0.4 CCCNC(=O)C 240690a_100020643023_100015343762 [0,1,1,0,0,0|1,0,1]=4 607 B6R0.4 CCCNC(=O)C 527a_100020643023_100103153847 [0,1,1,0,0,0|1,0,1]=4 608 B6R0.4 CCCNC(C)C 2230a_100138425928_100000210303 [0,1,1,0,0,0|1,0,0]=3 609 B6R0.4 CCCNC(C)C 34a_100138425928_100000210303 [0,1,1,0,0,0|1,0,0]=3 610 B6R0.4 CCCOC(C)C 34a_100000210258_100000210206 [0,1,1,0,0,0|0,0,0]=2 611 B6R0.4 CCCOC(C)C 34a_100000212225_100000210303 [0,1,1,0,0,0|0,0,0]=2 612 B6R0.4 CCCSC(C)C 62a_100000210206_100000210303 [0,1,1,0,0,0|0,1,0]=3 613 B6R0.4 CCCSC(C)C 62a_100000210303_100000210206 [0,1,1,0,0,0|0,1,0]=3 614 B6R0.4 CCNCC(=O)O 269956a_100016091260_100000210202 [0,1,1,0,0,0|1,0,1]=4 615 B6R0.4 CCNCC(C)C 2230a_100000210953_100000210202 [0,1,1,0,0,0|1,0,0]=3 616 B6R0.4 CCNCC(C)C 2230a_100015525214_100000210760 [0,1,1,0,0,0|1,0,0]=3 617 B6R0.4 CCNCC(C)C 270004a_100015525214_100000210432 [0,1,1,0,0,0|1,0,0]=3 618 B6R0.4 CCNCC(C)C 34a_100000210953_100000210202 [0,1,1,0,0,0|1,0,0]=3 619 B6R0.4 CCNCC(C)O 2230a_100000210904_100000210202 [0,1,1,0,0,0|1,0,0]=3 620 B6R0.4 CCNCC(C)O 2230a_100015525214_100011218427 [0,1,1,0,0,0|1,0,0]=3 621 B6R0.4 CCNCC(C)O 34a_100000210904_100000210202 [0,1,1,0,0,0|1,0,0]=3 622 B6R0.4 CCNCC(F)F 2230a_100015525214_100011934356 [0,1,1,0,0,0|2,0,0]=4 623 B6R0.4 CCNCC(F)F 34a_100000765723_100000210202 [0,1,1,0,0,0|2,0,0]=4 624 B6R0.4 CCNC[C@@H](C)O 2230a_100015525214_100009817552 [0,1,1,0,0,0|1,0,0]=3 625 B6R0.4 CCOCC(=O)C 1458a_100000211967_200000210301 [0,1,1,0,0,0|0,0,1]=3 626 B6R0.4 CCOCC(=O)C 34a_100000211253_100000210202 [0,1,1,0,0,0|0,0,1]=3 627 B6R0.4 CCOCC(=O)N 34a_100121572206_100000187820 [0,1,1,0,0,0|1,0,1]=4 628 B6R0.4 CCOCC(=O)[13CH3] 1458a_100000211967_200025704644 [0,1,1,0,0,0|0,0,1]=3 629 B6R0.4 CCOCC(=O)[O-] 34a_100121572206_100020667443 [0,1,1,0,0,0|1,0,1]=4 630 B6R0.4 CCOCC(C)Br 34a_100012180447_100000210202 [0,1,1,0,0,0|0,0,0]=2 631 B6R0.4 CCOCC(C)C 34a_100000210257_100000210202 [0,1,1,0,0,0|0,0,0]=2 632 B6R0.4 CCOCC(C)C 34a_100121572206_100000210624 [0,1,1,0,0,0|0,0,0]=2 633 B6R0.4 CCOCC(C)F 34a_100015925927_100000210202 [0,1,1,0,0,0|0,0,0]=2 634 B6R0.4 CCOCC(C)O 34a_100121572206_100011218427 [0,1,1,0,0,0|0,0,0]=2 635 B6R0.4 CCOCC(F)F 34a_100000743014_100000210202 [0,1,1,0,0,0|1,0,0]=3 636 B6R0.4 CCOCC(F)F 34a_100121572206_100011934356 [0,1,1,0,0,0|1,0,0]=3 637 B6R0.4 CCOCN(C)C 269982a_100102631434_100000739092 [0,1,1,0,0,0|1,0,0]=3 638 B6R0.4 CCOC[C@@H](C)Cl 34a_100016084084_100000210202 [0,1,1,0,0,0|0,0,0]=2 639 B6R0.4 CCOC[C@@H](C)N 34a_100000737577_100000210202 [0,1,1,0,0,0|0,0,0]=2 640 B6R0.4 CCOC[C@@H](C)O 34a_100121572206_100009817552 [0,1,1,0,0,0|0,0,0]=2 641 B6R0.4 CCOC[N+](=O)[O-] 34a_100121572206_100000761209 [0,1,1,0,0,0|2,0,0]=4 642 B6R0.4 CCSCC(=O)C 1458a_100000230394_200000210301 [0,1,1,0,0,0|0,1,1]=4 643 B6R0.4 CCSCC(=O)[13CH3] 1458a_100000230394_200025704644 [0,1,1,0,0,0|0,1,1]=4 644 B6R0.4 CCSCC(C)C 62a_100000210202_100000210760 [0,1,1,0,0,0|0,1,0]=3 645 B6R0.4 CCSCC(C)C 62a_100000210624_100000210202 [0,1,1,0,0,0|0,1,0]=3 646 B6R0.4 CCSCC(C)O 62a_100000210202_100011218427 [0,1,1,0,0,0|0,1,0]=3 647 B6R0.4 CCSCC(C)O 62a_100011218427_100000210202 [0,1,1,0,0,0|0,1,0]=3 648 B6R0.4 CCSCC(F)F 62a_100000210202_100011934356 [0,1,1,0,0,0|1,1,0]=4 649 B6R0.4 CCSCC(F)F 62a_100011934356_100000210202 [0,1,1,0,0,0|1,1,0]=4 650 B6R0.4 CCSC[C@@H](C)O 62a_100000210202_100009817552 [0,1,1,0,0,0|0,1,0]=3 651 B6R0.4 CCSC[C@@H](C)O 62a_100009817552_100000210202 [0,1,1,0,0,0|0,1,0]=3 652 B6R0.4 CN(C)CCCF 2230a_100102631434_100011934791 [0,1,1,0,0,0|2,0,0]=4 653 B6R0.4 CN(C)CCCF 269982a_100102631434_100011934791 [0,1,1,0,0,0|2,0,0]=4 654 B6R0.4 CN(C)CCCO 2230a_100000213112_200000210301 [0,1,1,0,0,0|1,0,0]=3 655 B6R0.4 CN(C)CCCO 2230a_100102631434_100000230001 [0,1,1,0,0,0|1,0,0]=3 656 B6R0.4 CN(C)CCCO 269982a_100000213112_200000210301 [0,1,1,0,0,0|1,0,0]=3 657 B6R0.4 CN(C)CCCO 269982a_100102631434_100011215043 [0,1,1,0,0,0|1,0,0]=3 658 B6R0.4 CN(C)CCS[13CH3] 62a_200025704644_100000755713 [0,1,1,0,0,0|1,1,0]=4 659 B6R0.4 CN([13CH3])CCCO 2230a_100000213112_200025704644 [0,1,1,0,0,0|1,0,0]=3 660 B6R0.4 CN([13CH3])CCCO 269982a_100000213112_200025704644 [0,1,1,0,0,0|1,0,0]=3 661 B6R0.4 CNCCC(=O)C 7a_106832991635_100000053229 [0,1,1,0,0,0|1,0,1]=4 662 B6R0.4 CNCCC(C)C 2230a_106832991635_100000210312 [0,1,1,0,0,0|1,0,0]=3 663 B6R0.4 CNCCC(C)C 269862a_106832991636_100000185833 [0,1,1,0,0,0|1,0,0]=3 664 B6R0.4 CNCCC(C)C 34a_100102657272_100000210312 [0,1,1,0,0,0|1,0,0]=3 665 B6R0.4 CNCCC(C)C 7a_106832991635_100000210626 [0,1,1,0,0,0|1,0,0]=3 666 B6R0.4 CNCCC(C)O 2230a_106832991635_100012276601 [0,1,1,0,0,0|1,0,0]=3 667 B6R0.4 CNCCC(C)O 2230a_200000755665_200000210301 [0,1,1,0,0,0|1,0,0]=3 668 B6R0.4 CNCCC(C)O 34a_100102657272_100012276601 [0,1,1,0,0,0|1,0,0]=3 669 B6R0.4 CNCCC(C)O 7a_106832991635_100012276601 [0,1,1,0,0,0|1,0,0]=3 670 B6R0.4 CNCCN(C)C 7a_106832991635_100000755713 [0,1,1,0,0,0|2,0,0]=4 671 B6R0.4 CNCOC(=O)C 34a_100102657272_100009813279 [0,1,1,0,0,0|1,0,1]=4 672 B6R0.4 CNCOC(C)C 2230a_106832991635_100000709892 [0,1,1,0,0,0|1,0,0]=3 673 B6R0.4 CNCOC(C)C 34a_100102657272_100000709892 [0,1,1,0,0,0|1,0,0]=3 674 B6R0.4 COCC=C(C)C 34a_100000753907_200000210301 [0,1,1,0,0,0|0,0,2]=4 675 B6R0.4 COCC=C(C)C 34a_100138415774_100000761012 [0,1,1,0,0,0|0,0,2]=4 676 B6R0.4 COCCC(=O)C 1458a_100000070787_100000233755 [0,1,1,0,0,0|0,0,1]=3 677 B6R0.4 COCCC(=O)C 1458a_100000749529_200000210301 [0,1,1,0,0,0|0,0,1]=3 678 B6R0.4 COCCC(=O)C 34a_100000759926_200000210301 [0,1,1,0,0,0|0,0,1]=3 679 B6R0.4 COCCC(=O)C 7a_100000759926_200000210301 [0,1,1,0,0,0|0,0,1]=3 680 B6R0.4 COCCC(=O)N 34a_100000757172_200000210301 [0,1,1,0,0,0|1,0,1]=4 681 B6R0.4 COCCC(=O)N 34a_100138415774_100000731001 [0,1,1,0,0,0|1,0,1]=4 682 B6R0.4 COCCC(=O)N 7a_100000757172_200000210301 [0,1,1,0,0,0|1,0,1]=4 683 B6R0.4 COCCC(=O)[13CH3] 1458a_100000749529_200025704644 [0,1,1,0,0,0|0,0,1]=3 684 B6R0.4 COCCC(C)Br 34a_100009893172_200000210301 [0,1,1,0,0,0|0,0,0]=2 685 B6R0.4 COCCC(C)C 34a_100000210254_200000210301 [0,1,1,0,0,0|0,0,0]=2 686 B6R0.4 COCCC(C)C 34a_100138415774_100000210312 [0,1,1,0,0,0|0,0,0]=2 687 B6R0.4 COCCC(C)C 7a_100000210254_200000210301 [0,1,1,0,0,0|0,0,0]=2 688 B6R0.4 COCCC(C)O 34a_100138415774_100012276601 [0,1,1,0,0,0|0,0,0]=2 689 B6R0.4 COCCC(F)F 34a_100103093639_200000210301 [0,1,1,0,0,0|1,0,0]=3 690 B6R0.4 COCCN(C)C 2230a_100000743101_200000210301 [0,1,1,0,0,0|1,0,0]=3 691 B6R0.4 COCCN(C)C 2230a_100102631434_100011201679 [0,1,1,0,0,0|1,0,0]=3 692 B6R0.4 COCCN(C)C 269982a_100000743101_200000210301 [0,1,1,0,0,0|1,0,0]=3 693 B6R0.4 COCCN(C)C 269982a_100102631434_100000233755 [0,1,1,0,0,0|1,0,0]=3 694 B6R0.4 COCCN(C)[13CH3] 2230a_100000743101_200025704644 [0,1,1,0,0,0|1,0,0]=3 695 B6R0.4 COCCN(C)[13CH3] 269982a_100000743101_200025704644 [0,1,1,0,0,0|1,0,0]=3 696 B6R0.4 COCC[C@@H](C)N 34a_100000706166_200000210301 [0,1,1,0,0,0|0,0,0]=2 697 B6R0.4 COCNC(C)C 2230a_100138425928_100000766300 [0,1,1,0,0,0|1,0,0]=3 698 B6R0.4 COCOC(=O)C 34a_100138415774_100009813279 [0,1,1,0,0,0|1,0,1]=4 699 B6R0.4 COCOC(C)C 34a_100138415774_100000709892 [0,1,1,0,0,0|1,0,0]=3 700 B6R0.4 COCSC(C)C 62a_100000210206_100000766300 [0,1,1,0,0,0|1,0,0]=3 701 B6R0.4 COCSC(C)C 62a_100000766300_100000210206 [0,1,1,0,0,0|1,0,0]=3 702 B6R0.4 CSCCC(=O)C 1458a_100000070787_100000751147 [0,1,1,0,0,0|0,1,1]=4 703 B6R0.4 CSCCC(=O)C 1458a_100000174002_200000210301 [0,1,1,0,0,0|0,1,1]=4 704 B6R0.4 CSCCC(=O)C 62a_100000053229_200000210301 [0,1,1,0,0,0|0,1,1]=4 705 B6R0.4 CSCCC(=O)C 62a_200000210301_100000053229 [0,1,1,0,0,0|0,1,1]=4 706 B6R0.4 CSCCC(=O)[13CH3] 1458a_100000174002_200025704644 [0,1,1,0,0,0|0,1,1]=4 707 B6R0.4 CSCCC(C)C 62a_100000210312_200000210301 [0,1,1,0,0,0|0,1,0]=3 708 B6R0.4 CSCCC(C)C 62a_200000210301_100000210312 [0,1,1,0,0,0|0,1,0]=3 709 B6R0.4 CSCCC(C)O 62a_100012276601_200000210301 [0,1,1,0,0,0|0,1,0]=3 710 B6R0.4 CSCCC(C)O 62a_200000210301_100012276601 [0,1,1,0,0,0|0,1,0]=3 711 B6R0.4 CSCCN(C)C 2230a_100000686725_200000210301 [0,1,1,0,0,0|1,1,0]=4 712 B6R0.4 CSCCN(C)C 2230a_100102631434_100000751147 [0,1,1,0,0,0|1,1,0]=4 713 B6R0.4 CSCCN(C)C 269982a_100000686725_200000210301 [0,1,1,0,0,0|1,1,0]=4 714 B6R0.4 CSCCN(C)C 269982a_100102631434_100000212216 [0,1,1,0,0,0|1,1,0]=4 715 B6R0.4 CSCCN(C)C 62a_200000210301_100000755713 [0,1,1,0,0,0|1,1,0]=4 716 B6R0.4 CSCCN(C)[13CH3] 2230a_100000686725_200025704644 [0,1,1,0,0,0|1,1,0]=4 717 B6R0.4 CSCCN(C)[13CH3] 269982a_100000686725_200025704644 [0,1,1,0,0,0|1,1,0]=4 718 B6R0.4 CSCNC(C)C 2230a_100138425928_100011218213 [0,1,1,0,0,0|1,1,0]=4 719 B6R0.4 CSCNC(C)C 34a_100138425928_100011218213 [0,1,1,0,0,0|1,1,0]=4 720 B6R0.4 CSCOC(=O)C 62a_100000076356_200000210301 [0,1,1,0,0,0|1,0,1]=4 721 B6R0.4 CSCOC(=O)C 62a_200000210301_100000076356 [0,1,1,0,0,0|1,0,1]=4 722 B6R0.4 CSCOC(C)C 34a_100000212225_100011218213 [0,1,1,0,0,0|1,0,0]=3 723 B6R0.4 CSCOC(C)C 62a_100000709892_200000210301 [0,1,1,0,0,0|1,0,0]=3 724 B6R0.4 CSCOC(C)C 62a_200000210301_100000709892 [0,1,1,0,0,0|1,0,0]=3 725 B6R0.4 CSCSC(C)C 62a_100000210206_100011218213 [0,1,1,0,0,0|1,1,0]=4 726 B6R0.4 CSCSC(C)C 62a_100011218213_100000210206 [0,1,1,0,0,0|1,1,0]=4 727 B6R0.4 C[C@@H](Cl)COCF 34a_100016084084_100015361967 [0,1,1,0,0,0|1,0,0]=3 728 B6R0.4 C[C@@H](N)CCO[13CH3] 34a_100000706166_200025704644 [0,1,1,0,0,0|0,0,0]=2 729 B6R0.4 C[C@@H](N)COCF 34a_100000737577_100015361967 [0,1,1,0,0,0|1,0,0]=3 730 B6R0.4 C[C@@H](O)CSCF 62a_100009817552_100015361967 [0,1,1,0,0,0|1,1,0]=4 731 B6R0.4 C[C@@H](O)CSCF 62a_100015361967_100009817552 [0,1,1,0,0,0|1,1,0]=4 732 B6R0.4 FCOCC(F)F 34a_100000743014_100015361967 [0,1,1,0,0,0|2,0,0]=4 733 B6R0.4 [13CH3]OCCC(=O)N 34a_100000757172_200025704644 [0,1,1,0,0,0|1,0,1]=4 734 B6R0.4 [13CH3]OCCC(=O)N 7a_100000757172_200025704644 [0,1,1,0,0,0|1,0,1]=4 735 B6R0.4 [13CH3]OCCC(F)F 34a_100103093639_200025704644 [0,1,1,0,0,0|1,0,0]=3 736 B6R0.6 C#CCCCNC 2230a_106832991635_100000731252 [0,1,1,0,0,0|1,0,1]=4 737 B6R0.6 C#CCCCNC 34a_100000718082_200000210301 [0,1,1,0,0,0|1,0,1]=4 738 B6R0.6 C#CCCCNC 34a_100102657272_100000695029 [0,1,1,0,0,0|1,0,1]=4 739 B6R0.6 C#CCCCNC 7a_106832991635_100011215417 [0,1,1,0,0,0|1,0,1]=4 740 B6R0.6 C#CCCCN[13CH3] 34a_100000718082_200025704644 [0,1,1,0,0,0|1,0,1]=4 741 B6R0.6 C#CCCCOC 34a_100000215630_200000210301 [0,1,1,0,0,0|0,0,1]=3 742 B6R0.6 C#CCCCOC 34a_100138415774_100000695029 [0,1,1,0,0,0|0,0,1]=3 743 B6R0.6 C#CCCCOC 7a_100000215630_200000210301 [0,1,1,0,0,0|0,0,1]=3 744 B6R0.6 C#CCCCO[13CH3] 34a_100000215630_200025704644 [0,1,1,0,0,0|0,0,1]=3 745 B6R0.6 C#CCCCO[13CH3] 7a_100000215630_200025704644 [0,1,1,0,0,0|0,0,1]=3 746 B6R0.6 C#CCCCSC 62a_100011215417_200000210301 [0,1,1,0,0,0|0,1,1]=4 747 B6R0.6 C#CCCCSC 62a_200000210301_100011215417 [0,1,1,0,0,0|0,1,1]=4 748 B6R0.6 C#CCCCS[13CH3] 62a_100011215417_200025704644 [0,1,1,0,0,0|0,1,1]=4 749 B6R0.6 C#CCCCS[13CH3] 62a_200025704644_100011215417 [0,1,1,0,0,0|0,1,1]=4 750 B6R0.6 C#CCCNCC 2230a_100015525214_100000688953 [0,1,1,0,0,0|1,0,1]=4 751 B6R0.6 C#CCCNCC 34a_100000755551_100000210202 [0,1,1,0,0,0|1,0,1]=4 752 B6R0.6 C#CCCOCC 34a_100011215631_100000210202 [0,1,1,0,0,0|0,0,1]=3 753 B6R0.6 C#CCCOCC 34a_100121572206_100000688953 [0,1,1,0,0,0|0,0,1]=3 754 B6R0.6 C#CCCOCF 34a_100011215631_100015361967 [0,1,1,0,0,0|0,0,2]=4 755 B6R0.6 C#CCCSCC 62a_100000210202_100000688953 [0,1,1,0,0,0|0,1,1]=4 756 B6R0.6 C#CCCSCC 62a_100000688953_100000210202 [0,1,1,0,0,0|0,1,1]=4 757 B6R0.6 C#CCNCCC 34a_100000212058_100000210303 [0,1,1,0,0,0|1,0,1]=4 758 B6R0.6 C#CCNCCO 2230a_100016997473_100000038162 [0,1,1,0,0,0|0,0,2]=4 759 B6R0.6 C#CCNCCO 34a_100000212058_100000211926 [0,1,1,0,0,0|0,0,2]=4 760 B6R0.6 C#CCNCCO 34a_100016990907_100000184674 [0,1,1,0,0,0|0,0,2]=4 761 B6R0.6 C#CCOCCBr 34a_100000211926_100000184674 [0,1,1,0,0,0|0,0,2]=4 762 B6R0.6 C#CCOCCC 34a_100000210247_100000210303 [0,1,1,0,0,0|0,0,1]=3 763 B6R0.6 C#CCOCCC 34a_100000210258_100000184674 [0,1,1,0,0,0|0,0,1]=3 764 B6R0.6 C#CCOCCF 34a_100000210247_100011217306 [0,1,1,0,0,0|0,0,2]=4 765 B6R0.6 C#CCOCCN 34a_100000210304_100000184674 [0,1,1,0,0,0|0,0,2]=4 766 B6R0.6 C#CCOCCO 34a_100000210247_100000211926 [0,1,1,0,0,0|0,0,2]=4 767 B6R0.6 C#CCOCSC 34a_100000210247_100011218213 [0,1,1,0,0,0|0,0,2]=4 768 B6R0.6 C#CCSCCC 62a_100000038162_100000210303 [0,1,1,0,0,0|0,1,1]=4 769 B6R0.6 C#CCSCCO 62a_100000038162_100000211926 [0,1,1,0,0,0|0,0,2]=4 770 B6R0.6 C#CCSCOC 62a_100000038162_100000766300 [0,1,1,0,0,0|0,0,2]=4 771 B6R0.6 C/C=C/CCOC 34a_100016278192_200000210301 [0,1,1,0,0,0|0,0,1]=3 772 B6R0.6 C/C=C/CCO[13CH3] 34a_100016278192_200025704644 [0,1,1,0,0,0|0,0,1]=3 773 B6R0.6 C/C=C/COCC 34a_100016270725_100000210202 [0,1,1,0,0,0|0,0,1]=3 774 B6R0.6 C/C=C/COCC 34a_100121572206_100102629194 [0,1,1,0,0,0|0,0,1]=3 775 B6R0.6 C/C=C/COCF 34a_100016270725_100015361967 [0,1,1,0,0,0|0,0,2]=4 776 B6R0.6 C/C=C/CSCC 62a_100000210202_100102629194 [0,1,1,0,0,0|0,1,1]=4 777 B6R0.6 C/C=C/CSCC 62a_100102629194_100000210202 [0,1,1,0,0,0|0,1,1]=4 778 B6R0.6 C=CCCCNC 2230a_100000700776_200000210301 [0,1,1,0,0,0|1,0,1]=4 779 B6R0.6 C=CCCCNC 2230a_106832991635_100011713584 [0,1,1,0,0,0|1,0,1]=4 780 B6R0.6 C=CCCCNC 34a_100000700776_200000210301 [0,1,1,0,0,0|1,0,1]=4 781 B6R0.6 C=CCCCNC 34a_100102657272_100000757094 [0,1,1,0,0,0|1,0,1]=4 782 B6R0.6 C=CCCCNC 7a_106832991635_100000757094 [0,1,1,0,0,0|1,0,1]=4 783 B6R0.6 C=CCCCN[13CH3] 2230a_100000700776_200025704644 [0,1,1,0,0,0|1,0,1]=4 784 B6R0.6 C=CCCCN[13CH3] 34a_100000700776_200025704644 [0,1,1,0,0,0|1,0,1]=4 785 B6R0.6 C=CCCCOC 34a_100000758997_200000210301 [0,1,1,0,0,0|0,0,1]=3 786 B6R0.6 C=CCCCOC 34a_100138415774_100000757094 [0,1,1,0,0,0|0,0,1]=3 787 B6R0.6 C=CCCCOC 7a_100000758997_200000210301 [0,1,1,0,0,0|0,0,1]=3 788 B6R0.6 C=CCCCO[13CH3] 34a_100000758997_200025704644 [0,1,1,0,0,0|0,0,1]=3 789 B6R0.6 C=CCCCO[13CH3] 7a_100000758997_200025704644 [0,1,1,0,0,0|0,0,1]=3 790 B6R0.6 C=CCCCSC 62a_100011713584_200000210301 [0,1,1,0,0,0|0,1,1]=4 791 B6R0.6 C=CCCCSC 62a_200000210301_100000757094 [0,1,1,0,0,0|0,1,1]=4 792 B6R0.6 C=CCCCS[13CH3] 62a_100011713584_200025704644 [0,1,1,0,0,0|0,1,1]=4 793 B6R0.6 C=CCCCS[13CH3] 62a_200025704644_100000757094 [0,1,1,0,0,0|0,1,1]=4 794 B6R0.6 C=CCCNCC 2230a_100015191253_100000210202 [0,1,1,0,0,0|1,0,1]=4 795 B6R0.6 C=CCCNCC 2230a_100015525214_100000754431 [0,1,1,0,0,0|1,0,1]=4 796 B6R0.6 C=CCCOCC 34a_100011205117_100000210202 [0,1,1,0,0,0|0,0,1]=3 797 B6R0.6 C=CCCOCC 34a_100121572206_100000754431 [0,1,1,0,0,0|0,0,1]=3 798 B6R0.6 C=CCCOCF 34a_100011205117_100015361967 [0,1,1,0,0,0|0,0,2]=4 799 B6R0.6 C=CCCSCC 62a_100000210202_100000754431 [0,1,1,0,0,0|0,1,1]=4 800 B6R0.6 C=CCCSCC 62a_100000754431_100000210202 [0,1,1,0,0,0|0,1,1]=4 801 B6R0.6 C=CCNCCC 2230a_100020586998_100000210303 [0,1,1,0,0,0|1,0,1]=4 802 B6R0.6 C=CCNCCO 2230a_100016997473_100000210623 [0,1,1,0,0,0|0,0,2]=4 803 B6R0.6 C=CCNCCO 2230a_100020586998_100000211926 [0,1,1,0,0,0|0,0,2]=4 804 B6R0.6 C=CCNCCO 34a_100016990907_100015514636 [0,1,1,0,0,0|0,0,2]=4 805 B6R0.6 C=CCNCOC 2230a_100020586998_100000766300 [0,1,1,0,0,0|0,0,2]=4 806 B6R0.6 C=CCOCCBr 34a_100000211926_100015514636 [0,1,1,0,0,0|0,0,2]=4 807 B6R0.6 C=CCOCCC 34a_100000210258_100015514636 [0,1,1,0,0,0|0,0,1]=3 808 B6R0.6 C=CCOCCC 34a_200000210373_100000210303 [0,1,1,0,0,0|0,0,1]=3 809 B6R0.6 C=CCOCCF 34a_200000210373_100011217306 [0,1,1,0,0,0|0,0,2]=4 810 B6R0.6 C=CCOCCN 34a_100000210304_100015514636 [0,1,1,0,0,0|0,0,2]=4 811 B6R0.6 C=CCOCCO 34a_200000210373_100000211926 [0,1,1,0,0,0|0,0,2]=4 812 B6R0.6 C=CCOCSC 34a_200000210373_100011218213 [0,1,1,0,0,0|0,0,2]=4 813 B6R0.6 C=CCSCCC 62a_100000210303_100000210623 [0,1,1,0,0,0|0,1,1]=4 814 B6R0.6 C=CCSCCC 62a_100000210623_100000210303 [0,1,1,0,0,0|0,1,1]=4 815 B6R0.6 C=CCSCCO 62a_100000210623_100000211926 [0,1,1,0,0,0|0,0,2]=4 816 B6R0.6 C=CCSCCO 62a_100000211926_100000210623 [0,1,1,0,0,0|0,0,2]=4 817 B6R0.6 C=CCSCOC 62a_100000210623_100000766300 [0,1,1,0,0,0|0,0,2]=4 818 B6R0.6 C=CCSCOC 62a_100000766300_100000210623 [0,1,1,0,0,0|0,0,2]=4 819 B6R0.6 C=COCCNC 2230a_106832991635_100000039644 [0,1,1,0,0,0|0,0,2]=4 820 B6R0.6 C=COCCNC 34a_100102657272_100000039644 [0,1,1,0,0,0|0,0,2]=4 821 B6R0.6 C=COCCNC 7a_106832991635_100000039644 [0,1,1,0,0,0|0,0,2]=4 822 B6R0.6 C=COCCOC 34a_100000033082_200000210301 [0,1,1,0,0,0|0,0,2]=4 823 B6R0.6 C=COCCOC 34a_100138415774_100000039644 [0,1,1,0,0,0|0,0,2]=4 824 B6R0.6 C=COCCO[13CH3] 34a_100000033082_200025704644 [0,1,1,0,0,0|0,0,2]=4 825 B6R0.6 C=COCCSC 62a_100000039644_200000210301 [0,1,1,0,0,0|0,0,2]=4 826 B6R0.6 C=COCCSC 62a_200000210301_100000039644 [0,1,1,0,0,0|0,0,2]=4 827 B6R0.6 C=COCCS[13CH3] 62a_100000039644_200025704644 [0,1,1,0,0,0|0,0,2]=4 828 B6R0.6 C=COCCS[13CH3] 62a_200025704644_100000039644 [0,1,1,0,0,0|0,0,2]=4 829 B6R0.6 CC#CCCOC 34a_100000750427_200000210301 [0,1,1,0,0,0|0,0,1]=3 830 B6R0.6 CC#CCCO[13CH3] 34a_100000750427_200025704644 [0,1,1,0,0,0|0,0,1]=3 831 B6R0.6 CC#CCNCC 2230a_100000685387_100000210202 [0,1,1,0,0,0|1,0,1]=4 832 B6R0.6 CC#CCNCC 2230a_100015525214_100000748600 [0,1,1,0,0,0|1,0,1]=4 833 B6R0.6 CC#CCNCC 34a_100000685387_100000210202 [0,1,1,0,0,0|1,0,1]=4 834 B6R0.6 CC#CCOCC 34a_100000761923_100000210202 [0,1,1,0,0,0|0,0,1]=3 835 B6R0.6 CC#CCOCC 34a_100121572206_100000748600 [0,1,1,0,0,0|0,0,1]=3 836 B6R0.6 CC#CCOCF 34a_100000761923_100015361967 [0,1,1,0,0,0|0,0,2]=4 837 B6R0.6 CC#CCSCC 62a_100000210202_100000748600 [0,1,1,0,0,0|0,1,1]=4 838 B6R0.6 CC#CCSCC 62a_100000748600_100000210202 [0,1,1,0,0,0|0,1,1]=4 839 B6R0.6 CC/C=C\CNC 2230a_106832991635_100103147603 [0,1,1,0,0,0|1,0,1]=4 840 B6R0.6 CC/C=C\CNC 34a_100102657272_100103147603 [0,1,1,0,0,0|1,0,1]=4 841 B6R0.6 CC/C=C\CNC 7a_106832991635_100103147603 [0,1,1,0,0,0|1,0,1]=4 842 B6R0.6 CC/C=C\COC 34a_100016268518_200000210301 [0,1,1,0,0,0|0,0,1]=3 843 B6R0.6 CC/C=C\COC 34a_100138415774_100103147603 [0,1,1,0,0,0|0,0,1]=3 844 B6R0.6 CC/C=C\CO[13CH3] 34a_100016268518_200025704644 [0,1,1,0,0,0|0,0,1]=3 845 B6R0.6 CC/C=C\CSC 62a_100103147603_200000210301 [0,1,1,0,0,0|0,1,1]=4 846 B6R0.6 CC/C=C\CSC 62a_200000210301_100103147603 [0,1,1,0,0,0|0,1,1]=4 847 B6R0.6 CC/C=C\CS[13CH3] 62a_100103147603_200025704644 [0,1,1,0,0,0|0,1,1]=4 848 B6R0.6 CC/C=C\CS[13CH3] 62a_200025704644_100103147603 [0,1,1,0,0,0|0,1,1]=4 849 B6R0.6 CC=CCNCC 2230a_100015525214_100000070051 [0,1,1,0,0,0|1,0,1]=4 850 B6R0.6 CC=CCOCC 34a_100121572206_100000070051 [0,1,1,0,0,0|0,0,1]=3 851 B6R0.6 CC=CCSCC 62a_100000070051_100000210202 [0,1,1,0,0,0|0,1,1]=4 852 B6R0.6 CC=CCSCC 62a_100000210202_100000070051 [0,1,1,0,0,0|0,1,1]=4 853 B6R0.6 CC=NNCCC 4a_100000740057_200000210099 [0,1,1,0,0,0|1,0,1]=4 854 B6R0.6 CC=NNCCO 4a_100000210001_200000210099 [0,1,1,0,0,0|1,0,1]=4 855 B6R0.6 CCC#CCNC 2230a_106832991635_100009813939 [0,1,1,0,0,0|1,0,1]=4 856 B6R0.6 CCC#CCNC 34a_100102657272_100009813939 [0,1,1,0,0,0|1,0,1]=4 857 B6R0.6 CCC#CCNC 7a_106832991635_100009813939 [0,1,1,0,0,0|1,0,1]=4 858 B6R0.6 CCC#CCOC 34a_100000032950_200000210301 [0,1,1,0,0,0|0,0,1]=3 859 B6R0.6 CCC#CCOC 34a_100138415774_100009813939 [0,1,1,0,0,0|0,0,1]=3 860 B6R0.6 CCC#CCO[13CH3] 34a_100000032950_200025704644 [0,1,1,0,0,0|0,0,1]=3 861 B6R0.6 CCC#CCSC 62a_100009813939_200000210301 [0,1,1,0,0,0|0,1,1]=4 862 B6R0.6 CCC#CCSC 62a_200000210301_100009813939 [0,1,1,0,0,0|0,1,1]=4 863 B6R0.6 CCC#CCS[13CH3] 62a_100009813939_200025704644 [0,1,1,0,0,0|0,1,1]=4 864 B6R0.6 CCC#CCS[13CH3] 62a_200025704644_100009813939 [0,1,1,0,0,0|0,1,1]=4 865 B6R0.6 CCC=NNCC 4a_100000756455_100000210100 [0,1,1,0,0,0|1,0,1]=4 866 B6R0.6 CCCCCNC 2230a_100000209983_200000210301 [0,1,1,0,0,0|1,0,0]=3 867 B6R0.6 CCCCCNC 2230a_106832991635_100000210326 [0,1,1,0,0,0|1,0,0]=3 868 B6R0.6 CCCCCNC 34a_100102657272_100000718602 [0,1,1,0,0,0|1,0,0]=3 869 B6R0.6 CCCCCNC 7a_106832991635_100000210326 [0,1,1,0,0,0|1,0,0]=3 870 B6R0.6 CCCCCN[13CH3] 2230a_100000209983_200025704644 [0,1,1,0,0,0|1,0,0]=3 871 B6R0.6 CCCCCOC 34a_100000210253_200000210301 [0,1,1,0,0,0|0,0,0]=2 872 B6R0.6 CCCCCOC 34a_100138415774_100000718602 [0,1,1,0,0,0|0,0,0]=2 873 B6R0.6 CCCCCOC 7a_100000210253_200000210301 [0,1,1,0,0,0|0,0,0]=2 874 B6R0.6 CCCCCO[13CH3] 34a_100000210253_200025704644 [0,1,1,0,0,0|0,0,0]=2 875 B6R0.6 CCCCCO[13CH3] 7a_100000210253_200025704644 [0,1,1,0,0,0|0,0,0]=2 876 B6R0.6 CCCCCSC 62a_100000210326_200000210301 [0,1,1,0,0,0|0,1,0]=3 877 B6R0.6 CCCCCSC 62a_200000210301_100000210326 [0,1,1,0,0,0|0,1,0]=3 878 B6R0.6 CCCCCS[13CH3] 62a_100000210326_200025704644 [0,1,1,0,0,0|0,1,0]=3 879 B6R0.6 CCCCCS[13CH3] 62a_200025704644_100000210326 [0,1,1,0,0,0|0,1,0]=3 880 B6R0.6 CCCCNCC 2230a_100000102301_100000210202 [0,1,1,0,0,0|1,0,0]=3 881 B6R0.6 CCCCNCC 2230a_100015525214_100000210211 [0,1,1,0,0,0|1,0,0]=3 882 B6R0.6 CCCCNCC 7a_106832991798_100000210202 [0,1,1,0,0,0|1,0,0]=3 883 B6R0.6 CCCCNCF 7a_106832991798_100015361967 [0,1,1,0,0,0|1,0,0]=3 884 B6R0.6 CCCCOCC 34a_100000210227_100000210202 [0,1,1,0,0,0|0,0,0]=2 885 B6R0.6 CCCCOCC 34a_100121572206_100000210210 [0,1,1,0,0,0|0,0,0]=2 886 B6R0.6 CCCCOCC 7a_100000210227_100000210202 [0,1,1,0,0,0|0,0,0]=2 887 B6R0.6 CCCCOCF 34a_100000210227_100015361967 [0,1,1,0,0,0|0,0,0]=2 888 B6R0.6 CCCCOCF 7a_100000210227_100015361967 [0,1,1,0,0,0|0,0,0]=2 889 B6R0.6 CCCCSCC 62a_100000210202_100000210210 [0,1,1,0,0,0|0,1,0]=3 890 B6R0.6 CCCCSCC 62a_100000210211_100000210202 [0,1,1,0,0,0|0,1,0]=3 891 B6R0.6 CCCCSCF 62a_100000210211_100015361967 [0,1,1,0,0,0|0,1,0]=3 892 B6R0.6 CCCCSCF 62a_100015361967_100000210210 [0,1,1,0,0,0|0,1,0]=3 893 B6R0.6 CCCNCCF 34a_100000724931_100000210303 [0,1,1,0,0,0|1,0,0]=3 894 B6R0.6 CCCNCCO 2230a_100016997473_100000210303 [0,1,1,0,0,0|0,0,0]=2 895 B6R0.6 CCCNCCO 34a_100016990907_100000210303 [0,1,1,0,0,0|0,0,0]=2 896 B6R0.6 CCCOCC=O 34a_100000210258_200009817547 [0,1,1,0,0,0|0,0,1]=3 897 B6R0.6 CCCOCCBr 34a_100000211926_100000210303 [0,1,1,0,0,0|0,0,0]=2 898 B6R0.6 CCCOCCC 34a_100000210258_100000210303 [0,1,1,0,0,0|0,0,0]=2 899 B6R0.6 CCCOCCF 34a_100000210258_100011217306 [0,1,1,0,0,0|0,0,0]=2 900 B6R0.6 CCCOCCN 34a_100000210304_100000210303 [0,1,1,0,0,0|0,0,0]=2 901 B6R0.6 CCCOCCO 34a_100000210258_100000211926 [0,1,1,0,0,0|0,0,0]=2 902 B6R0.6 CCCOCSC 34a_100000210258_100011218213 [0,1,1,0,0,0|0,0,0]=2 903 B6R0.6 CCCSCC#N 62a_100000210303_100011215382 [0,1,1,0,0,0|0,1,1]=4 904 B6R0.6 CCCSCC#N 62a_100011215382_100000210303 [0,1,1,0,0,0|0,1,1]=4 905 B6R0.6 CCCSCC=O 62a_100000210303_200015260668 [0,1,1,0,0,0|0,0,2]=4 906 B6R0.6 CCCSCC=O 62a_200015260668_100000210303 [0,1,1,0,0,0|0,0,2]=4 907 B6R0.6 CCCSCCC 62a_100000210303_100000210303 [0,1,1,0,0,0|0,1,0]=3 908 B6R0.6 CCCSCCF 62a_100000210303_100011217306 [0,1,1,0,0,0|0,1,0]=3 909 B6R0.6 CCCSCCF 62a_100011217306_100000210303 [0,1,1,0,0,0|0,1,0]=3 910 B6R0.6 CCCSCCO 62a_100000210303_100000211926 [0,1,1,0,0,0|0,0,0]=2 911 B6R0.6 CCCSCCO 62a_100000211926_100000210303 [0,1,1,0,0,0|0,0,0]=2 912 B6R0.6 CCCSCOC 62a_100000210303_100000766300 [0,1,1,0,0,0|0,0,0]=2 913 B6R0.6 CCCSCOC 62a_100000766300_100000210303 [0,1,1,0,0,0|0,0,0]=2 914 B6R0.6 CCCSCSC 62a_100000210303_100011218213 [0,1,1,0,0,0|0,1,0]=3 915 B6R0.6 CCCSCSC 62a_100011218213_100000210303 [0,1,1,0,0,0|0,1,0]=3 916 B6R0.6 CCNCCC#N 2230a_100015525214_100011215226 [0,1,1,0,0,0|1,0,1]=4 917 B6R0.6 CCNCCCF 2230a_100015189416_100000210202 [0,1,1,0,0,0|1,0,0]=3 918 B6R0.6 CCNCCCF 2230a_100015525214_100011934791 [0,1,1,0,0,0|1,0,0]=3 919 B6R0.6 CCNCCCF 34a_100015189416_100000210202 [0,1,1,0,0,0|1,0,0]=3 920 B6R0.6 CCNCCCO 2230a_100015525214_100000230001 [0,1,1,0,0,0|0,0,0]=2 921 B6R0.6 CCNCCOC 2230a_100000209980_100000210202 [0,1,1,0,0,0|0,0,0]=2 922 B6R0.6 CCNCCOC 2230a_100015525214_100011201679 [0,1,1,0,0,0|0,0,0]=2 923 B6R0.6 CCNCCSC 2230a_100015525214_100000751147 [0,1,1,0,0,0|0,1,0]=3 924 B6R0.6 CCNCCSC 2230a_100020590264_100000210202 [0,1,1,0,0,0|0,1,0]=3 925 B6R0.6 CCOCCCBr 34a_100011217188_100000210202 [0,1,1,0,0,0|0,0,0]=2 926 B6R0.6 CCOCCCCl 34a_100000230001_100000210202 [0,1,1,0,0,0|0,0,0]=2 927 B6R0.6 CCOCCCF 34a_100000759539_100000210202 [0,1,1,0,0,0|0,0,0]=2 928 B6R0.6 CCOCCCF 34a_100121572206_100011934791 [0,1,1,0,0,0|0,0,0]=2 929 B6R0.6 CCOCCCN 34a_100000182051_100000210202 [0,1,1,0,0,0|0,0,0]=2 930 B6R0.6 CCOCCCO 34a_100121572206_100000230001 [0,1,1,0,0,0|0,0,0]=2 931 B6R0.6 CCOCCNC 2230a_102516460346_200000210301 [0,1,1,0,0,0|0,0,0]=2 932 B6R0.6 CCOCCNC 2230a_106832991635_100011215890 [0,1,1,0,0,0|0,0,0]=2 933 B6R0.6 CCOCCNC 34a_100102657272_100000210147 [0,1,1,0,0,0|0,0,0]=2 934 B6R0.6 CCOCCNC 34a_102516460346_200000210301 [0,1,1,0,0,0|0,0,0]=2 935 B6R0.6 CCOCCNC 7a_106832991635_100011215890 [0,1,1,0,0,0|0,0,0]=2 936 B6R0.6 CCOCCN[13CH3] 2230a_102516460346_200025704644 [0,1,1,0,0,0|0,0,0]=2 937 B6R0.6 CCOCCN[13CH3] 34a_102516460346_200025704644 [0,1,1,0,0,0|0,0,0]=2 938 B6R0.6 CCOCCOC 34a_100000210136_200000210301 [0,1,1,0,0,0|0,0,0]=2 939 B6R0.6 CCOCCOC 34a_100000210237_100000210202 [0,1,1,0,0,0|0,0,0]=2 940 B6R0.6 CCOCCOC 34a_100121572206_100011201679 [0,1,1,0,0,0|0,0,0]=2 941 B6R0.6 CCOCCOC 34a_100138415774_100000210147 [0,1,1,0,0,0|0,0,0]=2 942 B6R0.6 CCOCCOC 7a_100000210136_200000210301 [0,1,1,0,0,0|0,0,0]=2 943 B6R0.6 CCOCCON 34a_100000700252_100000210202 [0,1,1,0,0,0|1,0,0]=3 944 B6R0.6 CCOCCO[13CH3] 34a_100000210136_200025704644 [0,1,1,0,0,0|0,0,0]=2 945 B6R0.6 CCOCCO[13CH3] 7a_100000210136_200025704644 [0,1,1,0,0,0|0,0,0]=2 946 B6R0.6 CCOCCSC 34a_100000230434_100000210202 [0,1,1,0,0,0|0,0,0]=2 947 B6R0.6 CCOCCSC 34a_100121572206_100000212216 [0,1,1,0,0,0|0,0,0]=2 948 B6R0.6 CCOCCSC 62a_100000210147_200000210301 [0,1,1,0,0,0|0,0,0]=2 949 B6R0.6 CCOCCSC 62a_200000210301_100011215890 [0,1,1,0,0,0|0,0,0]=2 950 B6R0.6 CCOCCSC 7a_100000230434_100000210202 [0,1,1,0,0,0|0,0,0]=2 951 B6R0.6 CCOCCS[13CH3] 62a_100000210147_200025704644 [0,1,1,0,0,0|0,0,0]=2 952 B6R0.6 CCOCCS[13CH3] 62a_200025704644_100011215890 [0,1,1,0,0,0|0,0,0]=2 953 B6R0.6 CCOCSCC 62a_100000210202_100000739092 [0,1,1,0,0,0|0,0,0]=2 954 B6R0.6 CCOCSCC 62a_100000739092_100000210202 [0,1,1,0,0,0|0,0,0]=2 955 B6R0.6 CCOCSCF 62a_100000739092_100015361967 [0,1,1,0,0,0|1,0,0]=3 956 B6R0.6 CCOCSCF 62a_100015361967_100000739092 [0,1,1,0,0,0|1,0,0]=3 957 B6R0.6 CCSCCC#N 62a_100000210202_100011215226 [0,1,1,0,0,0|0,1,1]=4 958 B6R0.6 CCSCCC#N 62a_100011215226_100000210202 [0,1,1,0,0,0|0,1,1]=4 959 B6R0.6 CCSCCCF 62a_100000210202_100011934791 [0,1,1,0,0,0|0,1,0]=3 960 B6R0.6 CCSCCCF 62a_100011934791_100000210202 [0,1,1,0,0,0|0,1,0]=3 961 B6R0.6 CCSCCCO 62a_100000210202_100011215043 [0,1,1,0,0,0|0,0,0]=2 962 B6R0.6 CCSCCCO 62a_100011215043_100000210202 [0,1,1,0,0,0|0,0,0]=2 963 B6R0.6 CCSCCNC 2230a_100000106463_200000210301 [0,1,1,0,0,0|0,1,0]=3 964 B6R0.6 CCSCCNC 2230a_106832991635_100000757381 [0,1,1,0,0,0|0,1,0]=3 965 B6R0.6 CCSCCNC 34a_100102657272_100000757381 [0,1,1,0,0,0|0,1,0]=3 966 B6R0.6 CCSCCNC 7a_106832991635_100000757381 [0,1,1,0,0,0|0,1,0]=3 967 B6R0.6 CCSCCN[13CH3] 2230a_100000106463_200025704644 [0,1,1,0,0,0|0,1,0]=3 968 B6R0.6 CCSCCOC 34a_100000212035_200000210301 [0,1,1,0,0,0|0,0,0]=2 969 B6R0.6 CCSCCOC 34a_100138415774_100000757381 [0,1,1,0,0,0|0,0,0]=2 970 B6R0.6 CCSCCOC 62a_100000210202_100000233755 [0,1,1,0,0,0|0,0,0]=2 971 B6R0.6 CCSCCOC 62a_100000233755_100000210202 [0,1,1,0,0,0|0,0,0]=2 972 B6R0.6 CCSCCOC 7a_100000212035_200000210301 [0,1,1,0,0,0|0,0,0]=2 973 B6R0.6 CCSCCO[13CH3] 34a_100000212035_200025704644 [0,1,1,0,0,0|0,0,0]=2 974 B6R0.6 CCSCCO[13CH3] 7a_100000212035_200025704644 [0,1,1,0,0,0|0,0,0]=2 975 B6R0.6 CCSCCSC 62a_100000210202_100000751147 [0,1,1,0,0,0|0,1,0]=3 976 B6R0.6 CCSCCSC 62a_100000212216_100000210202 [0,1,1,0,0,0|0,1,0]=3 977 B6R0.6 CCSCCSC 62a_100000757381_200000210301 [0,1,1,0,0,0|0,1,0]=3 978 B6R0.6 CCSCCSC 62a_200000210301_100000757381 [0,1,1,0,0,0|0,1,0]=3 979 B6R0.6 CCSCCS[13CH3] 62a_100000757381_200025704644 [0,1,1,0,0,0|0,1,0]=3 980 B6R0.6 CCSCCS[13CH3] 62a_200025704644_100000757381 [0,1,1,0,0,0|0,1,0]=3 981 B6R0.6 CNCC#CCO 2230a_106832991635_200000047223 [0,1,1,0,0,0|0,0,2]=4 982 B6R0.6 CNCC#CCO 34a_100102657272_200000047223 [0,1,1,0,0,0|0,0,2]=4 983 B6R0.6 CNCC#CCO 7a_106832991635_200000047223 [0,1,1,0,0,0|0,0,2]=4 984 B6R0.6 CNCCCC#N 2230a_106832991635_100000687738 [0,1,1,0,0,0|1,0,1]=4 985 B6R0.6 CNCCCC#N 7a_106832991635_100000687738 [0,1,1,0,0,0|1,0,1]=4 986 B6R0.6 CNCCCC=O 2230a_106832991635_200011292268 [0,1,1,0,0,0|0,0,2]=4 987 B6R0.6 CNCCCC=O 7a_106832991635_200011292268 [0,1,1,0,0,0|0,0,2]=4 988 B6R0.6 CNCCCCF 2230a_106832991635_100000729493 [0,1,1,0,0,0|1,0,0]=3 989 B6R0.6 CNCCCCF 34a_100102657272_100000729493 [0,1,1,0,0,0|1,0,0]=3 990 B6R0.6 CNCCCCF 7a_106832991635_100000729493 [0,1,1,0,0,0|1,0,0]=3 991 B6R0.6 CNCCCCO 2230a_100000750430_200000210301 [0,1,1,0,0,0|0,0,0]=2 992 B6R0.6 CNCCCCO 2230a_106832991635_100000210776 [0,1,1,0,0,0|0,0,0]=2 993 B6R0.6 CNCCCCO 34a_100000750430_200000210301 [0,1,1,0,0,0|0,0,0]=2 994 B6R0.6 CNCCCCO 34a_100102657272_100011216708 [0,1,1,0,0,0|0,0,0]=2 995 B6R0.6 CNCCCCO 7a_106832991635_100000210776 [0,1,1,0,0,0|0,0,0]=2 996 B6R0.6 CNCCCOC 2230a_106832991635_100000740836 [0,1,1,0,0,0|0,0,0]=2 997 B6R0.6 CNCCCOC 34a_100000213112_200000210301 [0,1,1,0,0,0|0,0,0]=2 998 B6R0.6 CNCCCOC 34a_100102657272_100000740836 [0,1,1,0,0,0|0,0,0]=2 999 B6R0.6 CNCCCOC 34a_100150723488_200000210301 [0,1,1,0,0,0|0,0,0]=2 1000 B6R0.6 CNCCCOC 7a_106832991635_100000740836 [0,1,1,0,0,0|0,0,0]=2 1001 B6R0.6 CNCCCO[13CH3] 34a_100000213112_200025704644 [0,1,1,0,0,0|0,0,0]=2 1002 B6R0.6 CNCCCSC 2230a_100000749238_200000210301 [0,1,1,0,0,0|0,1,0]=3 1003 B6R0.6 COCC#CCCl 34a_200000047223_200000210301 [0,1,1,0,0,0|0,0,2]=4 1004 B6R0.6 COCC#CCO 34a_100138415774_200000047223 [0,1,1,0,0,0|0,0,2]=4 1005 B6R0.6 COCCCCBr 34a_100011216708_200000210301 [0,1,1,0,0,0|0,0,0]=2 1006 B6R0.6 COCCCCCl 34a_100000210776_200000210301 [0,1,1,0,0,0|0,0,0]=2 1007 B6R0.6 COCCCCCl 7a_100000210776_200000210301 [0,1,1,0,0,0|0,0,0]=2 1008 B6R0.6 COCCCCF 34a_100011995726_200000210301 [0,1,1,0,0,0|0,0,0]=2 1009 B6R0.6 COCCCCF 34a_100138415774_100000729493 [0,1,1,0,0,0|0,0,0]=2 1010 B6R0.6 COCCCCF 7a_100011995726_200000210301 [0,1,1,0,0,0|0,0,0]=2 1011 B6R0.6 COCCCCI 34a_200012148704_200000210301 [0,1,1,0,0,0|0,0,0]=2 1012 B6R0.6 COCCCCN 34a_100000750430_200000210301 [0,1,1,0,0,0|0,0,0]=2 1013 B6R0.6 COCCCCO 34a_100138415774_100011216708 [0,1,1,0,0,0|0,0,0]=2 1014 B6R0.6 COCCCN[13CH3] 34a_100150723488_200025704644 [0,1,1,0,0,0|0,0,0]=2 1015 B6R0.6 COCCCOC 34a_100000740835_200000210301 [0,1,1,0,0,0|0,0,0]=2 1016 B6R0.6 COCCCOC 34a_100138415774_100000740836 [0,1,1,0,0,0|0,0,0]=2 1017 B6R0.6 COCCCO[13CH3] 34a_100000740835_200025704644 [0,1,1,0,0,0|0,0,0]=2 1018 B6R0.6 COCCCSC 34a_100000690336_200000210301 [0,1,1,0,0,0|0,0,0]=2 1019 B6R0.6 COCCCSC 62a_100000709357_200000210301 [0,1,1,0,0,0|0,0,0]=2 1020 B6R0.6 COCCCSC 62a_200000210301_100000709357 [0,1,1,0,0,0|0,0,0]=2 1021 B6R0.6 COCCCSC 7a_100000690336_200000210301 [0,1,1,0,0,0|0,0,0]=2 1022 B6R0.6 COCCCS[13CH3] 62a_100000709357_200025704644 [0,1,1,0,0,0|0,0,0]=2 1023 B6R0.6 COCCCS[13CH3] 62a_200025704644_100000709357 [0,1,1,0,0,0|0,0,0]=2 1024 B6R0.6 COCCOCF 34a_100000210237_100015361967 [0,1,1,0,0,0|1,0,0]=3 1025 B6R0.6 COCCSCF 62a_100000233755_100015361967 [0,1,1,0,0,0|1,0,0]=3 1026 B6R0.6 COCCSCF 62a_100015361967_100000233755 [0,1,1,0,0,0|1,0,0]=3 1027 B6R0.6 COCNCCO 2230a_100016997473_100000766300 [0,1,1,0,0,0|1,0,0]=3 1028 B6R0.6 COCSCC#N 62a_100000766300_100011215382 [0,1,1,0,0,0|1,0,1]=4 1029 B6R0.6 COCSCC#N 62a_100011215382_100000766300 [0,1,1,0,0,0|1,0,1]=4 1030 B6R0.6 COCSCC=O 62a_100000766300_200015260668 [0,1,1,0,0,0|1,0,1]=4 1031 B6R0.6 COCSCC=O 62a_200015260668_100000766300 [0,1,1,0,0,0|1,0,1]=4 1032 B6R0.6 COCSCCF 62a_100000766300_100011217306 [0,1,1,0,0,0|1,0,0]=3 1033 B6R0.6 COCSCCF 62a_100011217306_100000766300 [0,1,1,0,0,0|1,0,0]=3 1034 B6R0.6 COCSCCO 62a_100000211926_100000766300 [0,1,1,0,0,0|1,0,0]=3 1035 B6R0.6 COCSCCO 62a_100000766300_100000211926 [0,1,1,0,0,0|1,0,0]=3 1036 B6R0.6 COCSCOC 62a_100000766300_100000766300 [0,1,1,0,0,0|1,0,0]=3 1037 B6R0.6 COCSCSC 62a_100000766300_100011218213 [0,1,1,0,0,0|1,0,0]=3 1038 B6R0.6 COCSCSC 62a_100011218213_100000766300 [0,1,1,0,0,0|1,0,0]=3 1039 B6R0.6 CSCC#CCO 62a_200000047223_200000210301 [0,1,1,0,0,0|0,0,2]=4 1040 B6R0.6 CSCC#CCO 62a_200000210301_200000047223 [0,1,1,0,0,0|0,0,2]=4 1041 B6R0.6 CSCCCC#N 62a_100000687738_200000210301 [0,1,1,0,0,0|0,1,1]=4 1042 B6R0.6 CSCCCC#N 62a_200000210301_100000687738 [0,1,1,0,0,0|0,1,1]=4 1043 B6R0.6 CSCCCC=O 62a_200000210301_200011292268 [0,1,1,0,0,0|0,0,2]=4 1044 B6R0.6 CSCCCC=O 62a_200011292268_200000210301 [0,1,1,0,0,0|0,0,2]=4 1045 B6R0.6 CSCCCCF 62a_100000729493_200000210301 [0,1,1,0,0,0|0,1,0]=3 1046 B6R0.6 CSCCCCF 62a_200000210301_100000729493 [0,1,1,0,0,0|0,1,0]=3 1047 B6R0.6 CSCCCCO 62a_100000210776_200000210301 [0,1,1,0,0,0|0,0,0]=2 1048 B6R0.6 CSCCCCO 62a_200000210301_100000210776 [0,1,1,0,0,0|0,0,0]=2 1049 B6R0.6 CSCCCN[13CH3] 2230a_100000749238_200025704644 [0,1,1,0,0,0|0,1,0]=3 1050 B6R0.6 CSCCCO[13CH3] 34a_100000690336_200025704644 [0,1,1,0,0,0|0,0,0]=2 1051 B6R0.6 CSCCCO[13CH3] 7a_100000690336_200025704644 [0,1,1,0,0,0|0,0,0]=2 1052 B6R0.6 CSCCOCF 34a_100000230434_100015361967 [0,1,1,0,0,0|1,0,0]=3 1053 B6R0.6 CSCCOCF 7a_100000230434_100015361967 [0,1,1,0,0,0|1,0,0]=3 1054 B6R0.6 CSCCSCF 62a_100000212216_100015361967 [0,1,1,0,0,0|1,1,0]=4 1055 B6R0.6 CSCCSCF 62a_100015361967_100000751147 [0,1,1,0,0,0|1,1,0]=4 1056 B6R0.6 CSCNCCF 34a_100000724931_100011218213 [0,1,1,0,0,0|1,1,0]=4 1057 B6R0.6 CSCNCCO 2230a_100016997473_100011218213 [0,1,1,0,0,0|1,0,0]=3 1058 B6R0.6 CSCNCCO 34a_100016990907_100011218213 [0,1,1,0,0,0|1,0,0]=3 1059 B6R0.6 CSCOCCBr 34a_100000211926_100011218213 [0,1,1,0,0,0|1,0,0]=3 1060 B6R0.6 CSCOCCN 34a_100000210304_100011218213 [0,1,1,0,0,0|1,0,0]=3 1061 B6R0.6 CSCSCCF 62a_100011217306_100011218213 [0,1,1,0,0,0|1,1,0]=4 1062 B6R0.6 CSCSCCF 62a_100011218213_100011217306 [0,1,1,0,0,0|1,1,0]=4 1063 B6R0.6 CSCSCCO 62a_100000211926_100011218213 [0,1,1,0,0,0|1,0,0]=3 1064 B6R0.6 CSCSCCO 62a_100011218213_100000211926 [0,1,1,0,0,0|1,0,0]=3 1065 B6R0.6 CSCSCSC 62a_100011218213_100011218213 [0,1,1,0,0,0|1,1,0]=4 1066 B6R0.6 FCCCNCF 34a_100015189416_100015361967 [0,1,1,0,0,0|2,0,0]=4 1067 B6R0.6 FCCCOCF 34a_100000759539_100015361967 [0,1,1,0,0,0|1,0,0]=3 1068 B6R0.6 FCCCSCF 62a_100011934791_100015361967 [0,1,1,0,0,0|1,1,0]=4 1069 B6R0.6 FCCCSCF 62a_100015361967_100011934791 [0,1,1,0,0,0|1,1,0]=4 1070 B6R0.6 FCCNCCF 34a_100000724931_100011217306 [0,1,1,0,0,0|2,0,0]=4 1071 B6R0.6 FCCOCCBr 34a_100000211926_100011217306 [0,1,1,0,0,0|1,0,0]=3 1072 B6R0.6 FCCSCCF 62a_100011217306_100011217306 [0,1,1,0,0,0|1,1,0]=4 1073 B6R0.6 FCOCCCBr 34a_100011217188_100015361967 [0,1,1,0,0,0|1,0,0]=3 1074 B6R0.6 FCOCCCCl 34a_100000230001_100015361967 [0,1,1,0,0,0|1,0,0]=3 1075 B6R0.6 N#CCNCCO 2230a_100016997473_100011215382 [0,1,1,0,0,0|1,0,1]=4 1076 B6R0.6 N#CCSCCO 62a_100000211926_100011215382 [0,1,1,0,0,0|1,0,1]=4 1077 B6R0.6 N#CCSCCO 62a_100011215382_100000211926 [0,1,1,0,0,0|1,0,1]=4 1078 B6R0.6 NCCCOCF 34a_100000182051_100015361967 [0,1,1,0,0,0|1,0,0]=3 1079 B6R0.6 NCCOCC=O 34a_100000210304_200009817547 [0,1,1,0,0,0|1,0,1]=4 1080 B6R0.6 NCCOCCF 34a_100000210304_100011217306 [0,1,1,0,0,0|1,0,0]=3 1081 B6R0.6 NCCOCCO 34a_100000210304_100000211926 [0,1,1,0,0,0|1,0,0]=3 1082 B6R0.6 NOCCOCF 34a_100000700252_100015361967 [0,1,1,0,0,0|2,0,0]=4 1083 B6R0.6 O=CCNCCO 2230a_100016997473_200015260668 [0,1,1,0,0,0|1,0,1]=4 1084 B6R0.6 O=CCNCCO 34a_100016990907_200009817547 [0,1,1,0,0,0|1,0,1]=4 1085 B6R0.6 O=CCOCCBr 34a_100000211926_200009817547 [0,1,1,0,0,0|1,0,1]=4 1086 B6R0.6 O=CCSCCO 62a_100000211926_200015260668 [0,1,1,0,0,0|1,0,1]=4 1087 B6R0.6 O=CCSCCO 62a_200015260668_100000211926 [0,1,1,0,0,0|1,0,1]=4 1088 B6R0.6 OCCCSCF 62a_100011215043_100015361967 [0,1,1,0,0,0|1,0,0]=3 1089 B6R0.6 OCCCSCF 62a_100015361967_100011215043 [0,1,1,0,0,0|1,0,0]=3 1090 B6R0.6 OCCNCCF 2230a_100016997473_100011217306 [0,1,1,0,0,0|1,0,0]=3 1091 B6R0.6 OCCNCCF 34a_100000724931_100000211926 [0,1,1,0,0,0|1,0,0]=3 1092 B6R0.6 OCCNCCF 34a_100016990907_100011217306 [0,1,1,0,0,0|1,0,0]=3 1093 B6R0.6 OCCNCCO 2230a_100016997473_100000211926 [0,1,1,0,0,0|1,0,0]=3 1094 B6R0.6 OCCNCCO 34a_100016990907_100000211926 [0,1,1,0,0,0|1,0,0]=3 1095 B6R0.6 OCCOCCBr 34a_100000211926_100000211926 [0,1,1,0,0,0|1,0,0]=3 1096 B6R0.6 OCCSCCF 62a_100000211926_100011217306 [0,1,1,0,0,0|1,0,0]=3 1097 B6R0.6 OCCSCCF 62a_100011217306_100000211926 [0,1,1,0,0,0|1,0,0]=3 1098 B6R0.6 OCCSCCO 62a_100000211926_100000211926 [0,1,1,0,0,0|1,0,0]=3 1099 B6R0.6 [13CH3]NCCCCO 2230a_100000750430_200025704644 [0,1,1,0,0,0|0,0,0]=2 1100 B6R0.6 [13CH3]NCCCCO 34a_100000750430_200025704644 [0,1,1,0,0,0|0,0,0]=2 1101 B6R0.6 [13CH3]OCC#CCCl 34a_200000047223_200025704644 [0,1,1,0,0,0|0,0,2]=4 1102 B6R0.6 [13CH3]OCCCCBr 34a_100011216708_200025704644 [0,1,1,0,0,0|0,0,0]=2 1103 B6R0.6 [13CH3]OCCCCCl 34a_100000210776_200025704644 [0,1,1,0,0,0|0,0,0]=2 1104 B6R0.6 [13CH3]OCCCCCl 7a_100000210776_200025704644 [0,1,1,0,0,0|0,0,0]=2 1105 B6R0.6 [13CH3]OCCCCF 34a_100011995726_200025704644 [0,1,1,0,0,0|0,0,0]=2 1106 B6R0.6 [13CH3]OCCCCF 7a_100011995726_200025704644 [0,1,1,0,0,0|0,0,0]=2 1107 B6R0.6 [13CH3]OCCCCI 34a_200012148704_200025704644 [0,1,1,0,0,0|0,0,0]=2 1108 B6R0.6 [13CH3]OCCCCN 34a_100000750430_200025704644 [0,1,1,0,0,0|0,0,0]=2 1109 B6R0.6 [13CH3]SCC#CCO 62a_200000047223_200025704644 [0,1,1,0,0,0|0,0,2]=4 1110 B6R0.6 [13CH3]SCC#CCO 62a_200025704644_200000047223 [0,1,1,0,0,0|0,0,2]=4 1111 B6R0.6 [13CH3]SCCCC#N 62a_100000687738_200025704644 [0,1,1,0,0,0|0,1,1]=4 1112 B6R0.6 [13CH3]SCCCC#N 62a_200025704644_100000687738 [0,1,1,0,0,0|0,1,1]=4 1113 B6R0.6 [13CH3]SCCCC=O 62a_200011292268_200025704644 [0,1,1,0,0,0|0,0,2]=4 1114 B6R0.6 [13CH3]SCCCC=O 62a_200025704644_200011292268 [0,1,1,0,0,0|0,0,2]=4 1115 B6R0.6 [13CH3]SCCCCF 62a_100000729493_200025704644 [0,1,1,0,0,0|0,1,0]=3 1116 B6R0.6 [13CH3]SCCCCF 62a_200025704644_100000729493 [0,1,1,0,0,0|0,1,0]=3 1117 B6R0.6 [13CH3]SCCCCO 62a_100000210776_200025704644 [0,1,1,0,0,0|0,0,0]=2 1118 B6R0.6 [13CH3]SCCCCO 62a_200025704644_100000210776 [0,1,1,0,0,0|0,0,0]=2 1119 B6R1.2 CN1CCCC1 2230a_100000188435_200000210301 [0,1,0,0,1,0|1,0,0]=3 1120 B6R1.2 CN1CCCC1 269982a_100000188435_200000210301 [0,1,0,0,1,0|1,0,0]=3 1121 B6R1.2 CN1CCSC1 2230a_100011215254_200000210301 [0,1,0,0,1,0|1,1,0]=4 1122 B6R1.2 CN1CCSC1 269982a_100011215254_200000210301 [0,1,0,0,1,0|1,1,0]=4 1123 B6R1.2 [13CH3]N1CCCC1 2230a_100000188435_200025704644 [0,1,0,0,1,0|1,0,0]=3 1124 B6R1.2 [13CH3]N1CCCC1 269982a_100000188435_200025704644 [0,1,0,0,1,0|1,0,0]=3 1125 B6R1.2 [13CH3]N1CCSC1 2230a_100011215254_200025704644 [0,1,0,0,1,0|1,1,0]=4 1126 B6R1.2 [13CH3]N1CCSC1 269982a_100011215254_200025704644 [0,1,0,0,1,0|1,1,0]=4 1127 B8R1.22 CN1CCCCCC1 2230a_100000185865_200000210301 [0,1,0,0,0,1|1,0,0]=3 1128 B8R1.22 CN1CCCCCC1 269982a_100000185865_200000210301 [0,1,0,0,0,1|1,0,0]=3 1129 B8R1.22 CN1CCCCCC1 34a_100000185865_200000210301 [0,1,0,0,0,1|1,0,0]=3 1130 B8R1.22 CN1CCCOCC1 2230a_100000685342_200000210301 [0,1,0,0,0,1|0,0,0]=2 1131 B8R1.22 CN1CCCOCC1 269982a_100000685342_200000210301 [0,1,0,0,0,1|0,0,0]=2 1132 B8R1.22 CN1CCCOCC1 34a_100000685342_200000210301 [0,1,0,0,0,1|0,0,0]=2 1133 B8R1.22 [13CH3]N1CCCCCC1 2230a_100000185865_200025704644 [0,1,0,0,0,1|1,0,0]=3 1134 B8R1.22 [13CH3]N1CCCCCC1 269982a_100000185865_200025704644 [0,1,0,0,0,1|1,0,0]=3 1135 B8R1.22 [13CH3]N1CCCCCC1 34a_100000185865_200025704644 [0,1,0,0,0,1|1,0,0]=3 1136 B8R1.22 [13CH3]N1CCCOCC1 2230a_100000685342_200025704644 [0,1,0,0,0,1|0,0,0]=2 1137 B8R1.22 [13CH3]N1CCCOCC1 269982a_100000685342_200025704644 [0,1,0,0,0,1|0,0,0]=2 1138 B8R1.22 [13CH3]N1CCCOCC1 34a_100000685342_200025704644 [0,1,0,0,0,1|0,0,0]=2 1139 B8R1.2 CCN1CCCOC1 2230a_100000131196_100000210202 [0,2,0,0,0,0|1,0,0]=3 1140 B8R1.2 CCN1CCCOC1 269982a_100000131196_100000204670 [0,2,0,0,0,0|1,0,0]=3 1141 B8R1.2 CCN1CCCOC1 34a_100000131196_100000210202 [0,2,0,0,0,0|1,0,0]=3 1142 B8R1.2 CCN1CCOCC1 2230a_100015191051_100000210202 [0,2,0,0,0,0|1,0,0]=3 1143 B8R1.2 CCN1CCOCC1 269982a_100015191051_100000204670 [0,2,0,0,0,0|1,0,0]=3 1144 B8R1.2 CCN1CCOCC1 34a_100015191051_100000210202 [0,2,0,0,0,0|1,0,0]=3 1145 B8R1.2 CCN1CCSCC1 2230a_100000737611_100000210202 [0,2,0,0,0,0|1,1,0]=4 1146 B8R1.2 CCN1CCSCC1 269982a_100000737611_100000204670 [0,2,0,0,0,0|1,1,0]=4 1147 B8R1.2 CNC1C=CCCC1 2230a_106832991635_100000751183 [0,2,0,0,0,0|1,0,1]=4 1148 B8R1.2 CNC1C=CCCC1 7a_106832991635_100000751183 [0,2,0,0,0,0|1,0,1]=4 1149 B8R1.2 CNC1CCCCC1 2230a_100000182618_200000210301 [0,2,0,0,0,0|1,0,0]=3 1150 B8R1.2 CNC1CCCCC1 270004a_106832991635_100000210434 [0,2,0,0,0,0|1,0,0]=3 1151 B8R1.2 CNC1CCCCC1 34a_100000182618_200000210301 [0,2,0,0,0,0|1,0,0]=3 1152 B8R1.2 CNC1CCCCC1 34a_100102657272_100000210327 [0,2,0,0,0,0|1,0,0]=3 1153 B8R1.2 CNC1CCCCC1 7a_106832991635_100000210327 [0,2,0,0,0,0|1,0,0]=3 1154 B8R1.2 CNC1CCCOC1 2230a_100000719290_200000210301 [0,2,0,0,0,0|0,0,0]=2 1155 B8R1.2 CNC1CCCOC1 270004a_106832991635_100000753404 [0,2,0,0,0,0|0,0,0]=2 1156 B8R1.2 CNC1CCCOC1 34a_100000719290_200000210301 [0,2,0,0,0,0|0,0,0]=2 1157 B8R1.2 CNC1CCCOC1 34a_100102657272_100000693364 [0,2,0,0,0,0|0,0,0]=2 1158 B8R1.2 CNC1CCCOC1 7a_106832991635_100000693364 [0,2,0,0,0,0|0,0,0]=2 1159 B8R1.2 CNC1CCCSC1 270004a_106832991635_100000057913 [0,2,0,0,0,0|0,1,0]=3 1160 B8R1.2 CNC1CCNCC1 270004a_106832991635_100015192401 [0,2,0,0,0,0|1,0,0]=3 1161 B8R1.2 CNC1CCOCC1 2230a_100000741149_200000210301 [0,2,0,0,0,0|0,0,0]=2 1162 B8R1.2 CNC1CCOCC1 270004a_106832991635_100011217826 [0,2,0,0,0,0|0,0,0]=2 1163 B8R1.2 CNC1CCOCC1 34a_100000741149_200000210301 [0,2,0,0,0,0|0,0,0]=2 1164 B8R1.2 CNC1CCOCC1 7a_106832991635_100000686592 [0,2,0,0,0,0|0,0,0]=2 1165 B8R1.2 CNC1CCSCC1 2230a_100000748639_200000210301 [0,2,0,0,0,0|0,1,0]=3 1166 B8R1.2 CNC1CCSCC1 270004a_106832991635_100000203788 [0,2,0,0,0,0|0,1,0]=3 1167 B8R1.2 CNC1CCSCC1 34a_100000748639_200000210301 [0,2,0,0,0,0|0,1,0]=3 1168 B8R1.2 CNC1CCSCC1 34a_100102657272_100000069128 [0,2,0,0,0,0|0,1,0]=3 1169 B8R1.2 CNC1CCSCC1 7a_106832991635_100011500858 [0,2,0,0,0,0|0,1,0]=3 1170 B8R1.2 COC1C=CCCC1 34a_100011215024_200000210301 [0,2,0,0,0,0|1,0,1]=4 1171 B8R1.2 COC1CC=CCC1 34a_100000073881_200000210301 [0,2,0,0,0,0|1,0,1]=4 1172 B8R1.2 COC1CCCCC1 34a_100000210231_200000210301 [0,2,0,0,0,0|1,0,0]=3 1173 B8R1.2 COC1CCCCC1 34a_100138415774_100000210327 [0,2,0,0,0,0|1,0,0]=3 1174 B8R1.2 COC1CCCCC1 7a_100000210231_200000210301 [0,2,0,0,0,0|1,0,0]=3 1175 B8R1.2 COC1CCCCO1 34a_100000033831_200000210301 [0,2,0,0,0,0|0,0,0]=2 1176 B8R1.2 COC1CCCOC1 34a_100000754041_200000210301 [0,2,0,0,0,0|0,0,0]=2 1177 B8R1.2 COC1CCCOC1 34a_100138415774_100000693364 [0,2,0,0,0,0|0,0,0]=2 1178 B8R1.2 COC1CCCSC1 7a_100015962668_200000210301 [0,2,0,0,0,0|0,1,0]=3 1179 B8R1.2 COC1CCOCC1 34a_100000744328_200000210301 [0,2,0,0,0,0|0,0,0]=2 1180 B8R1.2 COC1CCSCC1 34a_100000731022_200000210301 [0,2,0,0,0,0|0,1,0]=3 1181 B8R1.2 COC1CCSCC1 34a_100138415774_100000069128 [0,2,0,0,0,0|0,1,0]=3 1182 B8R1.2 COC1CCSCC1 7a_100000731022_200000210301 [0,2,0,0,0,0|0,1,0]=3 1183 B8R1.2 CSC1C=CCCC1 62a_100000751183_200000210301 [0,2,0,0,0,0|1,0,1]=4 1184 B8R1.2 CSC1C=CCCC1 62a_200000210301_100000751183 [0,2,0,0,0,0|1,0,1]=4 1185 B8R1.2 CSC1CCCCC1 62a_100000210327_200000210301 [0,2,0,0,0,0|1,0,0]=3 1186 B8R1.2 CSC1CCCCC1 62a_200000210301_100000210327 [0,2,0,0,0,0|1,0,0]=3 1187 B8R1.2 CSC1CCCOC1 62a_200000210301_100000693364 [0,2,0,0,0,0|0,0,0]=2 1188 B8R1.2 CSC1CCOCC1 62a_200000210301_100011324220 [0,2,0,0,0,0|0,0,0]=2 1189 B8R1.2 CSC1CCSCC1 62a_200000210301_100000069128 [0,2,0,0,0,0|0,1,0]=3 1190 B8R1.2 FCN1CCCOC1 269982a_100000131196_100015361967 [0,2,0,0,0,0|1,0,0]=3 1191 B8R1.2 FCN1CCCOC1 34a_100000131196_100015361967 [0,2,0,0,0,0|1,0,0]=3 1192 B8R1.2 FCN1CCOCC1 269982a_100015191051_100015361967 [0,2,0,0,0,0|1,0,0]=3 1193 B8R1.2 FCN1CCOCC1 34a_100015191051_100015361967 [0,2,0,0,0,0|1,0,0]=3 1194 B8R1.2 FCN1CCSCC1 269982a_100000737611_100015361967 [0,2,0,0,0,0|1,1,0]=4 1195 B8R1.2 [13CH3]NC1CCCCC1 2230a_100000182618_200025704644 [0,2,0,0,0,0|1,0,0]=3 1196 B8R1.2 [13CH3]NC1CCCCC1 34a_100000182618_200025704644 [0,2,0,0,0,0|1,0,0]=3 1197 B8R1.2 [13CH3]NC1CCCOC1 2230a_100000719290_200025704644 [0,2,0,0,0,0|0,0,0]=2 1198 B8R1.2 [13CH3]NC1CCCOC1 34a_100000719290_200025704644 [0,2,0,0,0,0|0,0,0]=2 1199 B8R1.2 [13CH3]NC1CCOCC1 2230a_100000741149_200025704644 [0,2,0,0,0,0|0,0,0]=2 1200 B8R1.2 [13CH3]NC1CCOCC1 34a_100000741149_200025704644 [0,2,0,0,0,0|0,0,0]=2 1201 B8R1.2 [13CH3]NC1CCSCC1 2230a_100000748639_200025704644 [0,2,0,0,0,0|0,1,0]=3 1202 B8R1.2 [13CH3]NC1CCSCC1 34a_100000748639_200025704644 [0,2,0,0,0,0|0,1,0]=3 1203 B8R1.2 [13CH3]OC1C=CCCC1 34a_100011215024_200025704644 [0,2,0,0,0,0|1,0,1]=4 1204 B8R1.2 [13CH3]OC1CC=CCC1 34a_100000073881_200025704644 [0,2,0,0,0,0|1,0,1]=4 1205 B8R1.2 [13CH3]OC1CCCCC1 34a_100000210231_200025704644 [0,2,0,0,0,0|1,0,0]=3 1206 B8R1.2 [13CH3]OC1CCCCC1 7a_100000210231_200025704644 [0,2,0,0,0,0|1,0,0]=3 1207 B8R1.2 [13CH3]OC1CCCCO1 34a_100000033831_200025704644 [0,2,0,0,0,0|0,0,0]=2 1208 B8R1.2 [13CH3]OC1CCCOC1 34a_100000754041_200025704644 [0,2,0,0,0,0|0,0,0]=2 1209 B8R1.2 [13CH3]OC1CCCSC1 7a_100015962668_200025704644 [0,2,0,0,0,0|0,1,0]=3 1210 B8R1.2 [13CH3]OC1CCOCC1 34a_100000744328_200025704644 [0,2,0,0,0,0|0,0,0]=2 1211 B8R1.2 [13CH3]OC1CCSCC1 34a_100000731022_200025704644 [0,2,0,0,0,0|0,1,0]=3 1212 B8R1.2 [13CH3]OC1CCSCC1 7a_100000731022_200025704644 [0,2,0,0,0,0|0,1,0]=3 1213 B8R1.2 [13CH3]SC1C=CCCC1 62a_100000751183_200025704644 [0,2,0,0,0,0|1,0,1]=4 1214 B8R1.2 [13CH3]SC1C=CCCC1 62a_200025704644_100000751183 [0,2,0,0,0,0|1,0,1]=4 1215 B8R1.2 [13CH3]SC1CCCCC1 62a_100000210327_200025704644 [0,2,0,0,0,0|1,0,0]=3 1216 B8R1.2 [13CH3]SC1CCCCC1 62a_200025704644_100000210327 [0,2,0,0,0,0|1,0,0]=3 1217 B8R1.2 [13CH3]SC1CCCOC1 62a_200025704644_100000693364 [0,2,0,0,0,0|0,0,0]=2 1218 B8R1.2 [13CH3]SC1CCOCC1 62a_200025704644_100011324220 [0,2,0,0,0,0|0,0,0]=2 1219 B8R1.2 [13CH3]SC1CCSCC1 62a_200025704644_100000069128 [0,2,0,0,0,0|0,1,0]=3 1220 B8R1.3 C=C1CCN(CC1)C 2230a_100000752442_200000210301 [0,2,0,0,0,0|1,0,1]=4 1221 B8R1.3 C=C1CCN(CC1)C 269982a_100000752442_200000210301 [0,2,0,0,0,0|1,0,1]=4 1222 B8R1.3 C=C1CCN(CC1)C 34a_100000752442_200000210301 [0,2,0,0,0,0|1,0,1]=4 1223 B8R1.3 C=C1CCN(CC1)[13CH3] 2230a_100000752442_200025704644 [0,2,0,0,0,0|1,0,1]=4 1224 B8R1.3 C=C1CCN(CC1)[13CH3] 269982a_100000752442_200025704644 [0,2,0,0,0,0|1,0,1]=4 1225 B8R1.3 C=C1CCN(CC1)[13CH3] 34a_100000752442_200025704644 [0,2,0,0,0,0|1,0,1]=4 1226 B8R1.3 CC1CCN(CC1)C 2230a_100000188429_200000210301 [0,2,0,0,0,0|1,0,0]=3 1227 B8R1.3 CC1CCN(CC1)C 269982a_100000188429_200000210301 [0,2,0,0,0,0|1,0,0]=3 1228 B8R1.3 CC1CCN(CC1)C 34a_100000188429_200000210301 [0,2,0,0,0,0|1,0,0]=3 1229 B8R1.3 CC1CCN(CC1)[13CH3] 2230a_100000188429_200025704644 [0,2,0,0,0,0|1,0,0]=3 1230 B8R1.3 CC1CCN(CC1)[13CH3] 269982a_100000188429_200025704644 [0,2,0,0,0,0|1,0,0]=3 1231 B8R1.3 CC1CCN(CC1)[13CH3] 34a_100000188429_200025704644 [0,2,0,0,0,0|1,0,0]=3 1232 B8R1.3 CN1CCC(CC1)F 2230a_100015193889_200000210301 [0,2,0,0,0,0|1,0,0]=3 1233 B8R1.3 CN1CCC(CC1)F 269982a_100015193889_200000210301 [0,2,0,0,0,0|1,0,0]=3 1234 B8R1.3 CN1CCC(CC1)F 34a_100015193889_200000210301 [0,2,0,0,0,0|1,0,0]=3 1235 B8R1.3 CN1CCC(CC1)O 2230a_100025773856_200000210301 [0,2,0,0,0,0|1,0,0]=3 1236 B8R1.3 CN1CCC(CC1)O 269982a_100025773856_200000210301 [0,2,0,0,0,0|1,0,0]=3 1237 B8R1.3 CN1CCN(CC1)C 2230a_100000188432_200000210301 [0,2,0,0,0,0|2,0,0]=4 1238 B8R1.3 CN1CCN(CC1)C 269982a_100000188432_200000210301 [0,2,0,0,0,0|2,0,0]=4 1239 B8R1.3 CN1CCN(CC1)[13CH3] 2230a_100000188432_200025704644 [0,2,0,0,0,0|2,0,0]=4 1240 B8R1.3 CN1CCN(CC1)[13CH3] 269982a_100000188432_200025704644 [0,2,0,0,0,0|2,0,0]=4 1241 B8R1.3 CN1CCS(=O)CC1 2230a_100000752083_200000210301 [0,2,0,0,0,0|1,1,0]=4 1242 B8R1.3 CN1CCS(=O)CC1 269982a_100000752083_200000210301 [0,2,0,0,0,0|1,1,0]=4 1243 B8R1.3 [13CH3]N1CCC(CC1)F 2230a_100015193889_200025704644 [0,2,0,0,0,0|1,0,0]=3 1244 B8R1.3 [13CH3]N1CCC(CC1)F 269982a_100015193889_200025704644 [0,2,0,0,0,0|1,0,0]=3 1245 B8R1.3 [13CH3]N1CCC(CC1)F 34a_100015193889_200025704644 [0,2,0,0,0,0|1,0,0]=3 1246 B8R1.3 [13CH3]N1CCC(CC1)O 2230a_100025773856_200025704644 [0,2,0,0,0,0|1,0,0]=3 1247 B8R1.3 [13CH3]N1CCC(CC1)O 269982a_100025773856_200025704644 [0,2,0,0,0,0|1,0,0]=3 1248 B8R1.3 [13CH3]N1CCS(=O)CC1 2230a_100000752083_200025704644 [0,2,0,0,0,0|1,1,0]=4 1249 B8R1.3 [13CH3]N1CCS(=O)CC1 269982a_100000752083_200025704644 [0,2,0,0,0,0|1,1,0]=4 1250 B8R1.4 CC1CN(CCO1)C 2230a_100000729577_200000210301 [0,2,0,0,0,0|1,0,0]=3 1251 B8R1.4 CC1CN(CCO1)C 269982a_100000729577_200000210301 [0,2,0,0,0,0|1,0,0]=3 1252 B8R1.4 CC1CN(CCO1)C 34a_100000729577_200000210301 [0,2,0,0,0,0|1,0,0]=3 1253 B8R1.4 CC1CN(CCO1)[13CH3] 2230a_100000729577_200025704644 [0,2,0,0,0,0|1,0,0]=3 1254 B8R1.4 CC1CN(CCO1)[13CH3] 269982a_100000729577_200025704644 [0,2,0,0,0,0|1,0,0]=3 1255 B8R1.4 CC1CN(CCO1)[13CH3] 34a_100000729577_200025704644 [0,2,0,0,0,0|1,0,0]=3 1256 B8R1.4 CN1CCCC(C1)F 2230a_100000697950_200000210301 [0,2,0,0,0,0|1,0,0]=3 1257 B8R1.4 CN1CCCC(C1)F 269982a_100000697950_200000210301 [0,2,0,0,0,0|1,0,0]=3 1258 B8R1.4 CN1CCCC(C1)F 34a_100000697950_200000210301 [0,2,0,0,0,0|1,0,0]=3 1259 B8R1.4 CN1CCCC(C1)O 2230a_100000211013_200000210301 [0,2,0,0,0,0|1,0,0]=3 1260 B8R1.4 CN1CCCC(C1)O 269982a_100000211013_200000210301 [0,2,0,0,0,0|1,0,0]=3 1261 B8R1.4 CN1CCOC(=O)C1 2230a_100000131268_200000210301 [0,2,0,0,0,0|1,0,1]=4 1262 B8R1.4 CN1CCOC(C1)O 2230a_100000688207_200000210301 [0,2,0,0,0,0|1,0,0]=3 1263 B8R1.4 CN1CCOC(C1)O 269982a_100000688207_200000210301 [0,2,0,0,0,0|1,0,0]=3 1264 B8R1.4 C[C@H]1CCCN(C1)C 2230a_100000717927_200000210301 [0,2,0,0,0,0|1,0,0]=3 1265 B8R1.4 C[C@H]1CCCN(C1)C 269982a_100000717927_200000210301 [0,2,0,0,0,0|1,0,0]=3 1266 B8R1.4 C[C@H]1CCCN(C1)C 34a_100000717927_200000210301 [0,2,0,0,0,0|1,0,0]=3 1267 B8R1.4 C[C@H]1CCCN(C1)[13CH3] 2230a_100000717927_200025704644 [0,2,0,0,0,0|1,0,0]=3 1268 B8R1.4 C[C@H]1CCCN(C1)[13CH3] 269982a_100000717927_200025704644 [0,2,0,0,0,0|1,0,0]=3 1269 B8R1.4 C[C@H]1CCCN(C1)[13CH3] 34a_100000717927_200025704644 [0,2,0,0,0,0|1,0,0]=3 1270 B8R1.4 [13CH3]N1CCCC(C1)F 2230a_100000697950_200025704644 [0,2,0,0,0,0|1,0,0]=3 1271 B8R1.4 [13CH3]N1CCCC(C1)F 269982a_100000697950_200025704644 [0,2,0,0,0,0|1,0,0]=3 1272 B8R1.4 [13CH3]N1CCCC(C1)F 34a_100000697950_200025704644 [0,2,0,0,0,0|1,0,0]=3 1273 B8R1.4 [13CH3]N1CCCC(C1)O 2230a_100000211013_200025704644 [0,2,0,0,0,0|1,0,0]=3 1274 B8R1.4 [13CH3]N1CCCC(C1)O 269982a_100000211013_200025704644 [0,2,0,0,0,0|1,0,0]=3 1275 B8R1.4 [13CH3]N1CCOC(=O)C1 2230a_100000131268_200025704644 [0,2,0,0,0,0|1,0,1]=4 1276 B8R1.4 [13CH3]N1CCOC(C1)O 2230a_100000688207_200025704644 [0,2,0,0,0,0|1,0,0]=3 1277 B8R1.4 [13CH3]N1CCOC(C1)O 269982a_100000688207_200025704644 [0,2,0,0,0,0|1,0,0]=3 1278 B8R1.5 CC1CCCCN1C 2230a_100000211376_200000210301 [0,2,0,0,0,0|1,0,0]=3 1279 B8R1.5 CC1CCCCN1C 269982a_100000211376_200000210301 [0,2,0,0,0,0|1,0,0]=3 1280 B8R1.5 CC1CCCCN1C 34a_100000211376_200000210301 [0,2,0,0,0,0|1,0,0]=3 1281 B8R1.5 CC1CCCCN1[13CH3] 2230a_100000211376_200025704644 [0,2,0,0,0,0|1,0,0]=3 1282 B8R1.5 CC1CCCCN1[13CH3] 269982a_100000211376_200025704644 [0,2,0,0,0,0|1,0,0]=3 1283 B8R1.5 CC1CCCCN1[13CH3] 34a_100000211376_200025704644 [0,2,0,0,0,0|1,0,0]=3 1284 B8R1.5 C[C@H]1COCCN1C 2230a_100009815349_200000210301 [0,2,0,0,0,0|1,0,0]=3 1285 B8R1.5 C[C@H]1COCCN1C 269982a_100009815349_200000210301 [0,2,0,0,0,0|1,0,0]=3 1286 B8R1.5 C[C@H]1COCCN1C 34a_100009815349_200000210301 [0,2,0,0,0,0|1,0,0]=3 1287 B8R1.5 C[C@H]1COCCN1[13CH3] 2230a_100009815349_200025704644 [0,2,0,0,0,0|1,0,0]=3 1288 B8R1.5 C[C@H]1COCCN1[13CH3] 269982a_100009815349_200025704644 [0,2,0,0,0,0|1,0,0]=3 1289 B8R1.5 C[C@H]1COCCN1[13CH3] 34a_100009815349_200025704644 [0,2,0,0,0,0|1,0,0]=3 1290 B6R1.3 CCNC1CC1 34a_100000212008_100000210202 [0,0,1,1,0,0|1,0,0]=3 1291 B6R1.3 CCOC1CC1 34a_100121572206_100000211595 [0,0,1,1,0,0|0,0,0]=2 1292 B6R1.3 CCSC1CC1 62a_100000210202_100000211595 [0,0,1,1,0,0|0,1,0]=3 1293 B6R1.3 CNCC1CC1 2230a_100000735609_200000210301 [0,0,1,1,0,0|1,0,0]=3 1294 B6R1.3 CNCC1CC1 2230a_106832991635_100000742324 [0,0,1,1,0,0|1,0,0]=3 1295 B6R1.3 CNCC1CC1 269862a_106832991636_100000741477 [0,0,1,1,0,0|1,0,0]=3 1296 B6R1.3 CNCC1CC1 34a_100000735609_200000210301 [0,0,1,1,0,0|1,0,0]=3 1297 B6R1.3 CNCC1CC1 34a_100102657272_100000742324 [0,0,1,1,0,0|1,0,0]=3 1298 B6R1.3 CNCC1CC1 7a_106832991635_100000742324 [0,0,1,1,0,0|1,0,0]=3 1299 B6R1.3 CNCC1CO1 2230a_106832991635_100011216344 [0,0,1,1,0,0|1,0,0]=3 1300 B6R1.3 CNCC1CO1 34a_100102657272_102125554688 [0,0,1,1,0,0|1,0,0]=3 1301 B6R1.3 CNCC1CO1 7a_106832991635_102125554688 [0,0,1,1,0,0|1,0,0]=3 1302 B6R1.3 CNCC1CS1 7a_106832991635_100000031435 [0,0,1,1,0,0|1,1,0]=4 1303 B6R1.3 CNC[C@@H]1CO1 7a_106832991635_100000745022 [0,0,1,1,0,0|1,0,0]=3 1304 B6R1.3 COCC1CC1 34a_100000211283_200000210301 [0,0,1,1,0,0|0,0,0]=2 1305 B6R1.3 COCC1CC1 34a_100138415774_100000742324 [0,0,1,1,0,0|0,0,0]=2 1306 B6R1.3 COCC1CO1 34a_100138415774_102125554688 [0,0,1,1,0,0|1,0,0]=3 1307 B6R1.3 COC[C@@H]1CO1 34a_100000757423_200000210301 [0,0,1,1,0,0|1,0,0]=3 1308 B6R1.3 CSCC1CC1 62a_100000756562_200000210301 [0,0,1,1,0,0|0,1,0]=3 1309 B6R1.3 CSCC1CC1 62a_200000210301_100000742324 [0,0,1,1,0,0|0,1,0]=3 1310 B6R1.3 CSCC1CO1 62a_102125554688_200000210301 [0,0,1,1,0,0|1,0,0]=3 1311 B6R1.3 CSCC1CO1 62a_200000210301_102125554688 [0,0,1,1,0,0|1,0,0]=3 1312 B6R1.3 CSCC1CS1 62a_100000031435_200000210301 [0,0,1,1,0,0|1,1,0]=4 1313 B6R1.3 CSCC1CS1 62a_200000210301_100000031435 [0,0,1,1,0,0|1,1,0]=4 1314 B6R1.3 CSC[C@@H]1CO1 62a_100000745022_200000210301 [0,0,1,1,0,0|1,0,0]=3 1315 B6R1.3 CSC[C@@H]1CO1 62a_200000210301_100000745022 [0,0,1,1,0,0|1,0,0]=3 1316 B6R1.3 FCNC1CC1 34a_100000212008_100015361967 [0,0,1,1,0,0|2,0,0]=4 1317 B6R1.3 FCSC1CC1 62a_100015361967_100000211595 [0,0,1,1,0,0|1,1,0]=4 1318 B6R1.3 [13CH3]NCC1CC1 2230a_100000735609_200025704644 [0,0,1,1,0,0|1,0,0]=3 1319 B6R1.3 [13CH3]NCC1CC1 34a_100000735609_200025704644 [0,0,1,1,0,0|1,0,0]=3 1320 B6R1.3 [13CH3]OCC1CC1 34a_100000211283_200025704644 [0,0,1,1,0,0|0,0,0]=2 1321 B6R1.3 [13CH3]OC[C@@H]1CO1 34a_100000757423_200025704644 [0,0,1,1,0,0|1,0,0]=3 1322 B6R1.3 [13CH3]SCC1CC1 62a_100000756562_200025704644 [0,0,1,1,0,0|0,1,0]=3 1323 B6R1.3 [13CH3]SCC1CC1 62a_200025704644_100000742324 [0,0,1,1,0,0|0,1,0]=3 1324 B6R1.3 [13CH3]SCC1CO1 62a_102125554688_200025704644 [0,0,1,1,0,0|1,0,0]=3 1325 B6R1.3 [13CH3]SCC1CO1 62a_200025704644_102125554688 [0,0,1,1,0,0|1,0,0]=3 1326 B6R1.3 [13CH3]SCC1CS1 62a_100000031435_200025704644 [0,0,1,1,0,0|1,1,0]=4 1327 B6R1.3 [13CH3]SCC1CS1 62a_200025704644_100000031435 [0,0,1,1,0,0|1,1,0]=4 1328 B6R1.3 [13CH3]SC[C@@H]1CO1 62a_100000745022_200025704644 [0,0,1,1,0,0|1,0,0]=3 1329 B6R1.3 [13CH3]SC[C@@H]1CO1 62a_200025704644_100000745022 [0,0,1,1,0,0|1,0,0]=3 1330 B6R1.4 CC1CCN1C 269982a_100000755817_200000210301 [0,0,1,1,0,0|1,0,0]=3 1331 B6R1.4 CC1CCN1C 34a_100000755817_200000210301 [0,0,1,1,0,0|1,0,0]=3 1332 B6R1.4 CC1CCN1[13CH3] 269982a_100000755817_200025704644 [0,0,1,1,0,0|1,0,0]=3 1333 B6R1.4 CC1CCN1[13CH3] 34a_100000755817_200025704644 [0,0,1,1,0,0|1,0,0]=3 1334 B6R1.6 CCN1CCC1 269982a_100000754969_100000204670 [0,0,1,1,0,0|1,0,0]=3 1335 B6R1.6 CNC1CCC1 2230a_100000749019_200000210301 [0,0,1,1,0,0|1,0,0]=3 1336 B6R1.6 CNC1CCC1 270004a_106832991635_100000241760 [0,0,1,1,0,0|1,0,0]=3 1337 B6R1.6 CNC1CCC1 34a_100000749019_200000210301 [0,0,1,1,0,0|1,0,0]=3 1338 B6R1.6 CNC1CCC1 34a_100102657272_100000749161 [0,0,1,1,0,0|1,0,0]=3 1339 B6R1.6 CNC1COC1 2230a_100016991112_200000210301 [0,0,1,1,0,0|1,0,0]=3 1340 B6R1.6 CNC1COC1 34a_100102657272_100009818527 [0,0,1,1,0,0|1,0,0]=3 1341 B6R1.6 CNC1COC1 7a_106832991635_100009818527 [0,0,1,1,0,0|1,0,0]=3 1342 B6R1.6 COC1CCC1 34a_100000748187_200000210301 [0,0,1,1,0,0|0,0,0]=2 1343 B6R1.6 COC1CCC1 34a_100138415774_100000749161 [0,0,1,1,0,0|0,0,0]=2 1344 B6R1.6 COC1COC1 34a_100138415774_100009818527 [0,0,1,1,0,0|1,0,0]=3 1345 B6R1.6 COC1CSC1 7a_100000072292_200000210301 [0,0,1,1,0,0|1,0,0]=3 1346 B6R1.6 CSC1CCC1 62a_200000210301_100000749161 [0,0,1,1,0,0|0,1,0]=3 1347 B6R1.6 CSC1COC1 62a_200000210301_100009818527 [0,0,1,1,0,0|1,0,0]=3 1348 B6R1.6 FCN1CCC1 269982a_100000754969_100015361967 [0,0,1,1,0,0|2,0,0]=4 1349 B6R1.6 [13CH3]NC1CCC1 2230a_100000749019_200025704644 [0,0,1,1,0,0|1,0,0]=3 1350 B6R1.6 [13CH3]NC1CCC1 34a_100000749019_200025704644 [0,0,1,1,0,0|1,0,0]=3 1351 B6R1.6 [13CH3]NC1COC1 2230a_100016991112_200025704644 [0,0,1,1,0,0|1,0,0]=3 1352 B6R1.6 [13CH3]OC1CCC1 34a_100000748187_200025704644 [0,0,1,1,0,0|0,0,0]=2 1353 B6R1.6 [13CH3]OC1CSC1 7a_100000072292_200025704644 [0,0,1,1,0,0|1,0,0]=3 1354 B6R1.6 [13CH3]SC1CCC1 62a_200025704644_100000749161 [0,0,1,1,0,0|0,1,0]=3 1355 B6R1.6 [13CH3]SC1COC1 62a_200025704644_100009818527 [0,0,1,1,0,0|1,0,0]=3 1356 B6R1.8 CN[C@@H]1C[C@@H]1F 2230a_100015190264_200000210301 [0,0,1,1,0,0|2,0,0]=4 1357 B6R1.8 CN[C@@H]1C[C@H]1F 2230a_100025746932_200000210301 [0,0,1,1,0,0|2,0,0]=4 1358 B6R1.8 CN[C@@H]1C[C@H]1F 34a_100025746932_200000210301 [0,0,1,1,0,0|2,0,0]=4 1359 B6R1.8 [13CH3]N[C@@H]1C[C@@H]1F 2230a_100015190264_200025704644 [0,0,1,1,0,0|2,0,0]=4 1360 B6R1.8 [13CH3]N[C@@H]1C[C@H]1F 2230a_100025746932_200025704644 [0,0,1,1,0,0|2,0,0]=4 1361 B6R1.8 [13CH3]N[C@@H]1C[C@H]1F 34a_100025746932_200025704644 [0,0,1,1,0,0|2,0,0]=4 1362 B8R2.18 CN1CC2CC2C1 2230a_100000741873_200000210301 [0,1,0,1,0,0|1,0,0]=3 1363 B8R2.18 CN1CC2CC2C1 269982a_100000741873_200000210301 [0,1,0,1,0,0|1,0,0]=3 1364 B8R2.18 CN1CC2CC2C1 34a_100000741873_200000210301 [0,1,0,1,0,0|1,0,0]=3 1365 B8R2.18 [13CH3]N1CC2CC2C1 2230a_100000741873_200025704644 [0,1,0,1,0,0|1,0,0]=3 1366 B8R2.18 [13CH3]N1CC2CC2C1 269982a_100000741873_200025704644 [0,1,0,1,0,0|1,0,0]=3 1367 B8R2.18 [13CH3]N1CC2CC2C1 34a_100000741873_200025704644 [0,1,0,1,0,0|1,0,0]=3