0 B9R0.5 C#CCC(=O)C=C/C=C/C 1458a_100000185730_100000184674 [0,0,0,0,0,0|1,0,2]=3 1 B9R0.5 C/C=C/C=CC(=O)CC#N 1458a_100000185730_100011214920 [0,0,0,0,0,0|2,0,1]=3 2 B9R0.5 C/C=C/C=CC(=O)CCC 1458a_100000185730_100000210303 [0,0,0,0,0,0|1,0,0]=1 3 B9R0.5 C/C=C/C=CC(=O)CCF 1458a_100000185730_100011217306 [0,0,0,0,0,0|2,0,0]=2 4 B9R0.5 C/C=C/C=CC(=O)CCO 1458a_100000185730_100000211926 [0,0,0,0,0,0|2,0,0]=2 5 B9R0.5 C/C=C/C=CC(=O)NCC 11a_100015525214_100000185730 [0,0,0,0,0,0|1,0,0]=1 6 B9R0.5 C/C=C/C=CC(=O)NCC 240690a_100015525214_100000185730 [0,0,0,0,0,0|1,0,0]=1 7 B9R0.5 C/C=C/C=CC(=O)NNC 22a_100016993582_100000185730 [0,0,0,0,0,0|2,0,0]=2 8 B9R0.5 C=CCC(=O)C=C/C=C/C 1458a_100000185730_100000210623 [0,0,0,0,0,0|1,0,2]=3 9 B9R0.5 C=CCNCC(=O)OCC 2230a_100020586998_100000188475 [0,0,0,0,0,0|1,0,3]=4 10 B9R0.5 C=CCOCC(=O)OCC 34a_200000210373_100000188475 [0,0,0,0,0,0|1,0,3]=4 11 B9R0.5 C=CCSCC(=O)OCC 62a_100000188475_100000210623 [0,0,0,0,0,0|1,0,3]=4 12 B9R0.5 C=CCSCC(=O)OCC 62a_100000210623_100000188475 [0,0,0,0,0,0|1,0,3]=4 13 B9R0.5 CC#CC(=O)C/C=C\CC 1458a_100000763181_100103147603 [0,0,0,0,0,0|1,0,3]=4 14 B9R0.5 CC/C=C/CC(=O)CCC 1458a_100016274230_100000210303 [0,0,0,0,0,0|1,0,2]=3 15 B9R0.5 CC/C=C/CC(=O)CCF 1458a_100016274230_100011217306 [0,0,0,0,0,0|2,0,2]=4 16 B9R0.5 CC/C=C/CC(=O)CCO 1458a_100016274230_100000211926 [0,0,0,0,0,0|2,0,2]=4 17 B9R0.5 CC/C=C/CC(=O)NCC 11a_100015525214_100016274230 [0,0,0,0,0,0|1,0,2]=3 18 B9R0.5 CC/C=C/CC(=O)NCC 240690a_100015525214_100016274230 [0,0,0,0,0,0|1,0,2]=3 19 B9R0.5 CC/C=C/CC(=O)NCC 527a_100015525214_100016274230 [0,0,0,0,0,0|1,0,2]=3 20 B9R0.5 CC/C=C/CC(=O)NNC 22a_100016993582_100016274230 [0,0,0,0,0,0|2,0,2]=4 21 B9R0.5 CC/C=C\CC(=O)CCC 1458a_100000211992_100103147603 [0,0,0,0,0,0|1,0,2]=3 22 B9R0.5 CC/C=C\CC(=O)CCO 1458a_100011216618_100103147603 [0,0,0,0,0,0|2,0,2]=4 23 B9R0.5 CC/C=C\CC(=O)COC 1458a_100000210968_100103147603 [0,0,0,0,0,0|2,0,2]=4 24 B9R0.5 CC/C=C\CC(=O)CSC 1458a_100000184570_100103147603 [0,0,0,0,0,0|2,0,2]=4 25 B9R0.5 CC=CC(=O)C/C=C\CC 1458a_100000210699_100103147603 [0,0,0,0,0,0|1,0,3]=4 26 B9R0.5 CCC=NNC(=O)CCC 4a_100000189770_100000210100 [0,0,0,0,0,0|3,0,1]=4 27 B9R0.5 CCCC(=O)C=CCOC 1458a_100016285016_100000210303 [0,0,0,0,0,0|2,0,1]=3 28 B9R0.5 CCCC(=O)C=COCC 1458a_100016266692_100000210303 [0,0,0,0,0,0|2,0,1]=3 29 B9R0.5 CCCC=CC(=O)CCC 1458a_100000212230_100000210303 [0,0,0,0,0,0|1,0,2]=3 30 B9R0.5 CCCC=CC(=O)CCF 1458a_100000212230_100011217306 [0,0,0,0,0,0|2,0,2]=4 31 B9R0.5 CCCC=CC(=O)CCO 1458a_100000212230_100000211926 [0,0,0,0,0,0|2,0,2]=4 32 B9R0.5 CCCC=CC(=O)NCC 11a_100015525214_100000212230 [0,0,0,0,0,0|1,0,2]=3 33 B9R0.5 CCCC=CC(=O)NCC 240690a_100015525214_100000212230 [0,0,0,0,0,0|1,0,2]=3 34 B9R0.5 CCCC=CC(=O)NNC 22a_100016993582_100000212230 [0,0,0,0,0,0|2,0,2]=4 35 B9R0.5 CCCOCC(=O)OCC 34a_100000210258_100000188475 [0,0,0,0,0,0|1,0,3]=4 36 B9R0.5 CCCSCC(=O)OCC 62a_100000188475_100000210303 [0,0,0,0,0,0|1,0,3]=4 37 B9R0.5 CCCSCC(=O)OCC 62a_100000210303_100000188475 [0,0,0,0,0,0|1,0,3]=4 38 B9R0.5 CCNC(=O)C=CCOC 11a_100015525214_100016285016 [0,0,0,0,0,0|2,0,1]=3 39 B9R0.5 CCNC(=O)C=CCOC 240690a_100015525214_100016285016 [0,0,0,0,0,0|2,0,1]=3 40 B9R0.5 CCNC(=O)C=COCC 11a_100015525214_100016266692 [0,0,0,0,0,0|2,0,1]=3 41 B9R0.5 CCNC(=O)C=COCC 240690a_100015525214_100016266692 [0,0,0,0,0,0|2,0,1]=3 42 B9R0.5 CCNCCC(=O)OCC 2230a_100015525214_100011206558 [0,0,0,0,0,0|1,0,3]=4 43 B9R0.5 CCNN=CC(=O)OCC 4a_100000756455_100000742314 [0,0,0,0,0,0|2,0,1]=3 44 B9R0.5 CCOC(=O)/C=C/CNC 2230a_106832991635_100016267167 [0,0,0,0,0,0|1,0,1]=2 45 B9R0.5 CCOC(=O)/C=C/CNC 34a_100102657272_100016267167 [0,0,0,0,0,0|1,0,1]=2 46 B9R0.5 CCOC(=O)/C=C/CNC 7a_106832991635_100016267167 [0,0,0,0,0,0|1,0,1]=2 47 B9R0.5 CCOC(=O)/C=C/COC 34a_100138415774_100016267167 [0,0,0,0,0,0|1,0,1]=2 48 B9R0.5 CCOC(=O)/C=C/CSC 62a_100016267167_200000210301 [0,0,0,0,0,0|1,0,1]=2 49 B9R0.5 CCOC(=O)/C=C/CSC 62a_200000210301_100016267167 [0,0,0,0,0,0|1,0,1]=2 50 B9R0.5 CCOC(=O)/C=C/CS[13CH3] 62a_100016267167_200025704644 [0,0,0,0,0,0|1,0,1]=2 51 B9R0.5 CCOC(=O)/C=C/CS[13CH3] 62a_200025704644_100016267167 [0,0,0,0,0,0|1,0,1]=2 52 B9R0.5 CCOC(=O)CCCNC 2230a_106832991635_100009991533 [0,0,0,0,0,0|1,0,3]=4 53 B9R0.5 CCOC(=O)CCCNC 34a_100102657272_100009991533 [0,0,0,0,0,0|1,0,3]=4 54 B9R0.5 CCOC(=O)CCCNC 7a_106832991635_100011215271 [0,0,0,0,0,0|1,0,3]=4 55 B9R0.5 CCOC(=O)CCCOC 34a_100138415774_100009991533 [0,0,0,0,0,0|1,0,3]=4 56 B9R0.5 CCOC(=O)CCCOC 7a_100012001163_200000210301 [0,0,0,0,0,0|1,0,3]=4 57 B9R0.5 CCOC(=O)CCCO[13CH3] 7a_100012001163_200025704644 [0,0,0,0,0,0|1,0,3]=4 58 B9R0.5 CCOC(=O)CCCSC 62a_100009991533_200000210301 [0,0,0,0,0,0|1,0,3]=4 59 B9R0.5 CCOC(=O)CCCSC 62a_200000210301_100009991533 [0,0,0,0,0,0|1,0,3]=4 60 B9R0.5 CCOC(=O)CCCS[13CH3] 62a_100009991533_200025704644 [0,0,0,0,0,0|1,0,3]=4 61 B9R0.5 CCOC(=O)CCCS[13CH3] 62a_200025704644_100009991533 [0,0,0,0,0,0|1,0,3]=4 62 B9R0.5 CCOC(=O)CCSCC 62a_100000210202_100000765890 [0,0,0,0,0,0|1,0,3]=4 63 B9R0.5 CCOC(=O)CCSCC 62a_100000765890_100000210202 [0,0,0,0,0,0|1,0,3]=4 64 B9R0.5 CCOC(=O)CSCC=O 62a_100000188475_200015260668 [0,0,0,0,0,0|2,0,2]=4 65 B9R0.5 CCOC(=O)CSCC=O 62a_200015260668_100000188475 [0,0,0,0,0,0|2,0,2]=4 66 B9R0.5 CCOC(=O)CSCOC 62a_100000188475_100000766300 [0,0,0,0,0,0|2,0,2]=4 67 B9R0.5 CCOC(=O)CSCOC 62a_100000766300_100000188475 [0,0,0,0,0,0|2,0,2]=4 68 B9R0.5 CCOC(=O)CSCSC 62a_100000188475_100011218213 [0,0,0,0,0,0|2,0,2]=4 69 B9R0.5 CCOC(=O)CSCSC 62a_100011218213_100000188475 [0,0,0,0,0,0|2,0,2]=4 70 B9R0.5 CCOC(=O)NCCNC 7a_106832991635_200011445536 [0,0,0,0,0,0|2,0,2]=4 71 B9R0.5 CCOC(=O)NCCOC 34a_100000158857_200000210301 [0,0,0,0,0,0|2,0,2]=4 72 B9R0.5 CCOC(=O)NCCO[13CH3] 34a_100000158857_200025704644 [0,0,0,0,0,0|2,0,2]=4 73 B9R0.5 CCOC(=O)NCCSC 62a_200000210301_200011445536 [0,0,0,0,0,0|2,0,2]=4 74 B9R0.5 CCOC(=O)NCCS[13CH3] 62a_200025704644_200011445536 [0,0,0,0,0,0|2,0,2]=4 75 B9R0.5 CCOC(=O)OCSCC 62a_100000210202_100000075025 [0,0,0,0,0,0|2,0,2]=4 76 B9R0.5 CCOC=CC(=O)CCF 1458a_100016266692_100011217306 [0,0,0,0,0,0|3,0,1]=4 77 B9R0.5 CCOC=CC(=O)CCO 1458a_100016266692_100000211926 [0,0,0,0,0,0|3,0,1]=4 78 B9R0.5 CCOC=CC(=O)NNC 22a_100016993582_100016266692 [0,0,0,0,0,0|3,0,1]=4 79 B9R0.5 CCOCCC(=O)OCC 34a_100121572206_100000765890 [0,0,0,0,0,0|1,0,3]=4 80 B9R0.5 CNNC(=O)C=CCOC 22a_100016993582_100016285016 [0,0,0,0,0,0|3,0,1]=4 81 B9R0.5 COCC=CC(=O)CCF 1458a_100016285016_100011217306 [0,0,0,0,0,0|3,0,1]=4 82 B9R0.5 COCC=CC(=O)CCO 1458a_100016285016_100000211926 [0,0,0,0,0,0|3,0,1]=4 83 B8R0.1 C#CCC(=O)C=CC=C 1458a_100016291481_100000184674 [1,0,0,0,0,0|1,0,2]=4 84 B8R0.1 C/C=C/CC(=O)CCC 1458a_100000211992_100102629194 [1,0,0,0,0,0|1,0,1]=3 85 B8R0.1 C/C=C/CC(=O)CCO 1458a_100011216618_100102629194 [1,0,0,0,0,0|2,0,1]=4 86 B8R0.1 C/C=C/CC(=O)COC 1458a_100000210968_100102629194 [1,0,0,0,0,0|2,0,1]=4 87 B8R0.1 C/C=C/CC(=O)CSC 1458a_100000184570_100102629194 [1,0,0,0,0,0|2,0,1]=4 88 B8R0.1 C=CC=CC(=O)CC#N 1458a_100016291481_100011214920 [1,0,0,0,0,0|2,0,1]=4 89 B8R0.1 C=CC=CC(=O)CC=C 1458a_100016291481_100000210623 [1,0,0,0,0,0|1,0,2]=4 90 B8R0.1 C=CC=CC(=O)CCC 1458a_100016291481_100000210303 [1,0,0,0,0,0|1,0,0]=2 91 B8R0.1 C=CC=CC(=O)CCF 1458a_100016291481_100011217306 [1,0,0,0,0,0|2,0,0]=3 92 B8R0.1 C=CC=CC(=O)CCO 1458a_100016291481_100000211926 [1,0,0,0,0,0|2,0,0]=3 93 B8R0.1 C=CC=CC(=O)NNC 22a_100016993582_100016291481 [1,0,0,0,0,0|2,0,0]=3 94 B8R0.1 C=CCCC(=O)CCC 1458a_100000211992_100000754431 [1,0,0,0,0,0|1,0,2]=4 95 B8R0.1 C=CCCC(=O)CCC 1458a_100000749702_100000210303 [1,0,0,0,0,0|1,0,2]=4 96 B8R0.1 C=CCCC(=O)NCC 11a_100015525214_100000749702 [1,0,0,0,0,0|1,0,2]=4 97 B8R0.1 C=CCCC(=O)NCC 240690a_100015525214_100000749702 [1,0,0,0,0,0|1,0,2]=4 98 B8R0.1 C=CCCC(=O)NCC 527a_100015525214_100000749702 [1,0,0,0,0,0|1,0,2]=4 99 B8R0.1 C=CCNC(=O)CCC 1626a_100020586998_100000211992 [1,0,0,0,0,0|2,0,1]=4 100 B8R0.1 C=CCNC(=O)CCC 240690a_100020586998_100000211992 [1,0,0,0,0,0|2,0,1]=4 101 B8R0.1 C=CCNC(=O)CCC 527a_100020586998_100000211992 [1,0,0,0,0,0|2,0,1]=4 102 B8R0.1 C=CCNC(=O)NCC 2708a_100015525214_100020586998 [1,0,0,0,0,0|2,0,1]=4 103 B8R0.1 C=CCNC(=O)NCC 273464a_100015525214_100020586998 [1,0,0,0,0,0|2,0,1]=4 104 B8R0.1 C=CCNC(=O)NCC 273464a_100020586998_100015525214 [1,0,0,0,0,0|2,0,1]=4 105 B8R0.1 C=CCNC(=O)NCC 512a_100015525214_100020586998 [1,0,0,0,0,0|2,0,1]=4 106 B8R0.1 C=CCNC(=O)NCC 512a_100020586998_100015525214 [1,0,0,0,0,0|2,0,1]=4 107 B8R0.1 CC#CC(=O)C/C=C/C 1458a_100000763181_100102629194 [1,0,0,0,0,0|1,0,2]=4 108 B8R0.1 CC#CC(=O)CC=CC 1458a_100000763181_100000070051 [1,0,0,0,0,0|1,0,2]=4 109 B8R0.1 CC=CC(=O)C/C=C/C 1458a_100000210699_100102629194 [1,0,0,0,0,0|1,0,2]=4 110 B8R0.1 CC=CCC(=O)C=CC 1458a_100000210699_100000070051 [1,0,0,0,0,0|1,0,2]=4 111 B8R0.1 CC=CCC(=O)CCC 1458a_100000211992_100000070051 [1,0,0,0,0,0|1,0,1]=3 112 B8R0.1 CC=CCC(=O)CCC 1458a_100121576822_100000210303 [1,0,0,0,0,0|1,0,1]=3 113 B8R0.1 CC=CCC(=O)CCF 1458a_100121576822_100011217306 [1,0,0,0,0,0|2,0,1]=4 114 B8R0.1 CC=CCC(=O)CCO 1458a_100011216618_100000070051 [1,0,0,0,0,0|2,0,1]=4 115 B8R0.1 CC=CCC(=O)CCO 1458a_100121576822_100000211926 [1,0,0,0,0,0|2,0,1]=4 116 B8R0.1 CC=CCC(=O)COC 1458a_100000210968_100000070051 [1,0,0,0,0,0|2,0,1]=4 117 B8R0.1 CC=CCC(=O)CSC 1458a_100000184570_100000070051 [1,0,0,0,0,0|2,0,1]=4 118 B8R0.1 CC=CCC(=O)NCC 11a_100015525214_100121576822 [1,0,0,0,0,0|1,0,1]=3 119 B8R0.1 CC=CCC(=O)NCC 240690a_100015525214_100121576822 [1,0,0,0,0,0|1,0,1]=3 120 B8R0.1 CC=CCC(=O)NCC 527a_100015525214_100121576822 [1,0,0,0,0,0|1,0,1]=3 121 B8R0.1 CC=CCC(=O)NNC 22a_100016993582_100121576822 [1,0,0,0,0,0|2,0,1]=4 122 B8R0.1 CC=NNC(=O)CCC 4a_100000189770_200000210099 [1,0,0,0,0,0|3,0,0]=4 123 B8R0.1 CCC=CC(=O)CCC 1458a_100000212282_100000210303 [1,0,0,0,0,0|1,0,1]=3 124 B8R0.1 CCC=CC(=O)CCF 1458a_100000212282_100011217306 [1,0,0,0,0,0|2,0,1]=4 125 B8R0.1 CCC=CC(=O)CCO 1458a_100000212282_100000211926 [1,0,0,0,0,0|2,0,1]=4 126 B8R0.1 CCC=CC(=O)NCC 11a_100015525214_100000212282 [1,0,0,0,0,0|1,0,1]=3 127 B8R0.1 CCC=CC(=O)NCC 240690a_100015525214_100000212282 [1,0,0,0,0,0|1,0,1]=3 128 B8R0.1 CCC=CC(=O)NNC 22a_100016993582_100000212282 [1,0,0,0,0,0|2,0,1]=4 129 B8R0.1 CCCC(=O)C=COC 1458a_100016268678_100000210303 [1,0,0,0,0,0|2,0,0]=3 130 B8R0.1 CCNC(=O)C=COC 240690a_100015525214_100016268678 [1,0,0,0,0,0|2,0,0]=3 131 B8R0.1 CCNCC(=O)OCC 2230a_100015525214_100000188475 [1,0,0,0,0,0|1,0,2]=4 132 B8R0.1 CCOC(=O)CCNC 2230a_106832991635_100011206558 [1,0,0,0,0,0|1,0,2]=4 133 B8R0.1 CCOC(=O)CCNC 34a_100102657272_100000765890 [1,0,0,0,0,0|1,0,2]=4 134 B8R0.1 CCOC(=O)CCNC 7a_106832991635_100011206558 [1,0,0,0,0,0|1,0,2]=4 135 B8R0.1 CCOC(=O)CCOC 34a_100138415774_100000765890 [1,0,0,0,0,0|1,0,2]=4 136 B8R0.1 CCOC(=O)CCSC 62a_100000765890_200000210301 [1,0,0,0,0,0|1,0,2]=4 137 B8R0.1 CCOC(=O)CCSC 62a_200000210301_100000765890 [1,0,0,0,0,0|1,0,2]=4 138 B8R0.1 CCOC(=O)CCS[13CH3] 62a_100000765890_200025704644 [1,0,0,0,0,0|1,0,2]=4 139 B8R0.1 CCOC(=O)CCS[13CH3] 62a_200025704644_100000765890 [1,0,0,0,0,0|1,0,2]=4 140 B8R0.1 CCOC(=O)CSCC 62a_100000188475_100000210202 [1,0,0,0,0,0|1,0,2]=4 141 B8R0.1 CCOC(=O)CSCC 62a_100000210202_100000188475 [1,0,0,0,0,0|1,0,2]=4 142 B8R0.1 CCOC(=O)OCSC 62a_200000210301_100000075025 [1,0,0,0,0,0|2,0,1]=4 143 B8R0.1 CCOC(=O)OCS[13CH3] 62a_200025704644_100000075025 [1,0,0,0,0,0|2,0,1]=4 144 B8R0.1 CCOCC(=O)OCC 34a_100121572206_100000188475 [1,0,0,0,0,0|1,0,2]=4 145 B8R0.1 CNNC(=O)C=COC 22a_100016993582_100016268678 [1,0,0,0,0,0|3,0,0]=4 146 B8R0.1 COC=CC(=O)CCF 1458a_100016268678_100011217306 [1,0,0,0,0,0|3,0,0]=4 147 B8R0.1 COC=CC(=O)CCO 1458a_100016268678_100000211926 [1,0,0,0,0,0|3,0,0]=4 148 B8R0.4 C/C=C/C=C/COCC 34a_100016283227_100000210202 [1,0,0,0,0,0|0,0,1]=2 149 B8R0.4 C/C=C/C=C/COCF 34a_100016283227_100015361967 [1,0,0,0,0,0|1,0,1]=3 150 B8R0.4 C/C=C/CSCOCC 62a_100000739092_100102629194 [1,0,0,0,0,0|1,0,2]=4 151 B8R0.4 C/C=C/CSCOCC 62a_100102629194_100000739092 [1,0,0,0,0,0|1,0,2]=4 152 B8R0.4 CC/C=C\CCOCC 34a_100016288707_100000210202 [1,0,0,0,0,0|0,0,3]=4 153 B8R0.4 CC/C=C\CCOCC 34a_100121572206_100015370543 [1,0,0,0,0,0|0,0,3]=4 154 B8R0.4 CC/C=C\CCOCC 7a_100016288707_100000210202 [1,0,0,0,0,0|0,0,3]=4 155 B8R0.4 CC=C=CCCOCC 34a_100011020354_100000210202 [1,0,0,0,0,0|0,0,3]=4 156 B8R0.4 CC=CCCCOCC 34a_100020645299_100000210202 [1,0,0,0,0,0|0,0,3]=4 157 B8R0.4 CC=CCSCOCC 62a_100000070051_100000739092 [1,0,0,0,0,0|1,0,2]=4 158 B8R0.4 CC=CCSCOCC 62a_100000739092_100000070051 [1,0,0,0,0,0|1,0,2]=4 159 B8R0.4 CCC/C=C/COCC 34a_100016278788_100000210202 [1,0,0,0,0,0|0,0,3]=4 160 B8R0.4 CCC/C=C/COCC 7a_100016278788_100000210202 [1,0,0,0,0,0|0,0,3]=4 161 B8R0.4 CCC=CC=NNCC 4a_100000756455_100011216943 [1,0,0,0,0,0|2,0,1]=4 162 B8R0.6 C/C=C/C=CC(=O)CC 1458a_100000185730_100000210202 [1,0,0,0,0,0|0,0,0]=1 163 B8R0.6 C/C=C/C=CC(=O)CF 1458a_100000185730_100015361967 [1,0,0,0,0,0|1,0,0]=2 164 B8R0.6 C/C=C/C=CC(=O)NC 11a_106832991635_100000185730 [1,0,0,0,0,0|1,0,0]=2 165 B8R0.6 C/C=C/C=CC(=O)NC 1626a_100102657272_100000185730 [1,0,0,0,0,0|1,0,0]=2 166 B8R0.6 C/C=C/C=CC(=O)NC 240690a_100102657272_100000185730 [1,0,0,0,0,0|1,0,0]=2 167 B8R0.6 CC/C=C/CC(=O)CC 1458a_100016274230_100000210202 [1,0,0,0,0,0|0,0,2]=3 168 B8R0.6 CC/C=C/CC(=O)CF 1458a_100016274230_100015361967 [1,0,0,0,0,0|1,0,2]=4 169 B8R0.6 CC/C=C/CC(=O)NC 11a_106832991635_100016274230 [1,0,0,0,0,0|1,0,2]=4 170 B8R0.6 CC/C=C/CC(=O)NC 1626a_100102657272_100016274230 [1,0,0,0,0,0|1,0,2]=4 171 B8R0.6 CC/C=C/CC(=O)NC 240690a_100102657272_100016274230 [1,0,0,0,0,0|1,0,2]=4 172 B8R0.6 CC/C=C/CC(=O)NC 527a_100102657272_100016274230 [1,0,0,0,0,0|1,0,2]=4 173 B8R0.6 CC/C=C\CC(=O)CC 1458a_100000210414_100103147603 [1,0,0,0,0,0|0,0,2]=3 174 B8R0.6 CC/C=C\CC(=O)CO 1458a_100000210174_100103147603 [1,0,0,0,0,0|1,0,2]=4 175 B8R0.6 CCC(=O)C=CCOC 1458a_100016285016_100000210202 [1,0,0,0,0,0|1,0,1]=3 176 B8R0.6 CCC=NNC(=O)CC 4a_100000183195_100000210100 [1,0,0,0,0,0|2,0,1]=4 177 B8R0.6 CCCC=CC(=O)CC 1458a_100000212230_100000210202 [1,0,0,0,0,0|0,0,2]=3 178 B8R0.6 CCCC=CC(=O)CF 1458a_100000212230_100015361967 [1,0,0,0,0,0|1,0,2]=4 179 B8R0.6 CCCC=CC(=O)NC 11a_106832991635_100000212230 [1,0,0,0,0,0|1,0,2]=4 180 B8R0.6 CCCC=CC(=O)NC 1626a_100102657272_100000212230 [1,0,0,0,0,0|1,0,2]=4 181 B8R0.6 CCCC=CC(=O)NC 240690a_100102657272_100000212230 [1,0,0,0,0,0|1,0,2]=4 182 B8R0.6 CCNN=CC(=O)OC 4a_100000756455_200011823558 [1,0,0,0,0,0|2,0,1]=4 183 B8R0.6 CCOC=CC(=O)CC 1458a_100016266692_100000210202 [1,0,0,0,0,0|1,0,1]=3 184 B8R0.6 CCOC=CC(=O)CF 1458a_100016266692_100015361967 [1,0,0,0,0,0|2,0,1]=4 185 B8R0.6 CCOC=CC(=O)NC 11a_106832991635_100016266692 [1,0,0,0,0,0|2,0,1]=4 186 B8R0.6 CCOC=CC(=O)NC 1626a_100102657272_100016266692 [1,0,0,0,0,0|2,0,1]=4 187 B8R0.6 CCOC=CC(=O)NC 240690a_100102657272_100016266692 [1,0,0,0,0,0|2,0,1]=4 188 B8R0.6 CNC(=O)C=CCOC 11a_106832991635_100016285016 [1,0,0,0,0,0|2,0,1]=4 189 B8R0.6 CNC(=O)C=CCOC 1626a_100102657272_100016285016 [1,0,0,0,0,0|2,0,1]=4 190 B8R0.6 CNC(=O)C=CCOC 240690a_100102657272_100016285016 [1,0,0,0,0,0|2,0,1]=4 191 B8R0.6 CNC/C=C/C(=O)OC 2230a_106832991635_100000742655 [1,0,0,0,0,0|1,0,1]=3 192 B8R0.6 CNC/C=C/C(=O)OC 34a_100102657272_100000742655 [1,0,0,0,0,0|1,0,1]=3 193 B8R0.6 CNC/C=C/C(=O)OC 7a_106832991635_100000742655 [1,0,0,0,0,0|1,0,1]=3 194 B8R0.6 COC(=O)/C=C/CSC 62a_100000742655_200000210301 [1,0,0,0,0,0|1,0,1]=3 195 B8R0.6 COC(=O)/C=C/CSC 62a_200000210301_100000742655 [1,0,0,0,0,0|1,0,1]=3 196 B8R0.6 COC(=O)/C=C/CS[13CH3] 62a_100000742655_200025704644 [1,0,0,0,0,0|1,0,1]=3 197 B8R0.6 COC(=O)/C=C/CS[13CH3] 62a_200025704644_100000742655 [1,0,0,0,0,0|1,0,1]=3 198 B8R0.6 COC/C=C/C(=O)OC 34a_100138415774_100000742655 [1,0,0,0,0,0|1,0,1]=3 199 B8R0.6 COCC=CC(=O)CF 1458a_100016285016_100015361967 [1,0,0,0,0,0|2,0,1]=4 200 B10R0.1 C/C=C/COCC(=O)NCC 34a_100016270725_100000183381 [0,1,0,0,0,0|1,0,2]=4 201 B10R0.1 C/C=C/COCC(=O)OCC 34a_100016270725_100000188475 [0,1,0,0,0,0|0,0,2]=3 202 B10R0.1 C/C=C/CSCC(=O)CCC 62a_100000747444_100102629194 [0,1,0,0,0,0|1,0,2]=4 203 B10R0.1 C/C=C/CSCC(=O)CCC 62a_100102629194_100000747444 [0,1,0,0,0,0|1,0,2]=4 204 B10R0.1 C/C=C/CSCC(=O)NCC 62a_100000183381_100102629194 [0,1,0,0,0,0|1,0,2]=4 205 B10R0.1 C/C=C/CSCC(=O)NCC 62a_100102629194_100000183381 [0,1,0,0,0,0|1,0,2]=4 206 B10R0.1 C/C=C/CSCC(=O)OCC 62a_100000188475_100102629194 [0,1,0,0,0,0|0,0,2]=3 207 B10R0.1 C/C=C/CSCC(=O)OCC 62a_100102629194_100000188475 [0,1,0,0,0,0|0,0,2]=3 208 B10R0.1 CC/C=C\CCC(=O)CCC 1458a_100000211992_100015370543 [0,1,0,0,0,0|1,0,2]=4 209 B10R0.1 CC=CCNCC(=O)NCC 2230a_100016988866_100000070051 [0,1,0,0,0,0|1,0,2]=4 210 B10R0.1 CC=CCSCC(=O)CCC 62a_100000070051_100000747444 [0,1,0,0,0,0|1,0,2]=4 211 B10R0.1 CC=CCSCC(=O)CCC 62a_100000747444_100000070051 [0,1,0,0,0,0|1,0,2]=4 212 B10R0.1 CC=CCSCC(=O)NCC 62a_100000070051_100000183381 [0,1,0,0,0,0|1,0,2]=4 213 B10R0.1 CC=CCSCC(=O)NCC 62a_100000183381_100000070051 [0,1,0,0,0,0|1,0,2]=4 214 B10R0.1 CC=CCSCC(=O)OCC 62a_100000070051_100000188475 [0,1,0,0,0,0|0,0,2]=3 215 B10R0.1 CC=CCSCC(=O)OCC 62a_100000188475_100000070051 [0,1,0,0,0,0|0,0,2]=3 216 B10R0.1 CCC/C=C/CC(=O)CCC 1458a_200016266809_100000210303 [0,1,0,0,0,0|1,0,2]=4 217 B10R0.1 CCC/C=C/CC(=O)NCC 11a_100015525214_200016266809 [0,1,0,0,0,0|1,0,2]=4 218 B10R0.1 CCC/C=C/CC(=O)NCC 240690a_100015525214_200016266809 [0,1,0,0,0,0|1,0,2]=4 219 B10R0.1 CCC/C=C/CC(=O)NCC 527a_100015525214_200016266809 [0,1,0,0,0,0|1,0,2]=4 220 B10R0.1 CCCCC=CC(=O)CCC 1458a_100016266645_100000210303 [0,1,0,0,0,0|1,0,2]=4 221 B10R0.1 CCCCC=CC(=O)NCC 11a_100015525214_100016266645 [0,1,0,0,0,0|1,0,2]=4 222 B10R0.1 CCCCC=CC(=O)NCC 240690a_100015525214_100016266645 [0,1,0,0,0,0|1,0,2]=4 223 B10R0.1 CCCNN=CC(=O)OCC 4a_100000740057_100000742314 [0,1,0,0,0,0|1,0,2]=4 224 B10R0.1 CCNC/C=C/C(=O)OCC 2230a_100015525214_100016267167 [0,1,0,0,0,0|0,0,2]=3 225 B10R0.1 CCNN=C[CH-]C(=O)OCC 4a_100000756455_100010622808 [0,1,0,0,0,0|1,0,2]=4 226 B10R0.1 CCOC(=O)/C=C/CSCC 62a_100000210202_100016267167 [0,1,0,0,0,0|0,0,2]=3 227 B10R0.1 CCOC(=O)/C=C/CSCC 62a_100016267167_100000210202 [0,1,0,0,0,0|0,0,2]=3 228 B10R0.1 CCOC(=O)/C=C/CSCF 62a_100015361967_100016267167 [0,1,0,0,0,0|1,0,1]=3 229 B10R0.1 CCOC(=O)/C=C/CSCF 62a_100016267167_100015361967 [0,1,0,0,0,0|1,0,1]=3 230 B10R0.1 CCOC(=O)C=NNCCO 4a_100000210001_100000742314 [0,1,0,0,0,0|2,0,1]=4 231 B10R0.1 CCOC(=O)NN=CCSC 62a_200000210301_100015372823 [0,1,0,0,0,0|2,0,1]=4 232 B10R0.1 CCOC(=O)NN=CCS[13CH3] 62a_200025704644_100015372823 [0,1,0,0,0,0|2,0,1]=4 233 B10R0.1 CCOC/C=C/C(=O)OCC 34a_100121572206_100016267167 [0,1,0,0,0,0|0,0,2]=3 234 B10R0.2 C=CCC(=O)CC(=O)OCC 1458a_100000210193_100000188475 [0,1,0,0,0,0|0,0,3]=4 235 B10R0.2 C=CCC(=O)CC(=O)OCC 1458a_100000243816_100000210623 [0,1,0,0,0,0|0,0,3]=4 236 B10R0.2 C=COC(=O)CC(=O)C=CC 1458a_100000210699_100000036128 [0,1,0,0,0,0|0,0,3]=4 237 B10R0.2 CC#CC(=O)CC(=O)OCC 1458a_100000763181_100000188475 [0,1,0,0,0,0|0,0,3]=4 238 B10R0.2 CC=CC(=O)CC(=O)CCC 1458a_100000210699_100000747444 [0,1,0,0,0,0|1,0,1]=3 239 B10R0.2 CC=CC(=O)CC(=O)NCC 1458a_100000210699_100000183381 [0,1,0,0,0,0|1,0,1]=3 240 B10R0.2 CC=CC(=O)CC(=O)NCO 1458a_100000210699_100000185155 [0,1,0,0,0,0|2,0,1]=4 241 B10R0.2 CC=CC(=O)CC(=O)OCC 1458a_100000210699_100000188475 [0,1,0,0,0,0|0,0,1]=2 242 B10R0.2 CCCC(=CC(=O)NCC)C 11a_100015525214_100020676950 [0,1,0,0,0,0|1,0,2]=4 243 B10R0.2 CCCC(=CC(=O)NCC)C 240690a_100015525214_100020676950 [0,1,0,0,0,0|1,0,2]=4 244 B10R0.2 CCCC(=O)C=C(C)CCC 1458a_100020676950_100000210303 [0,1,0,0,0,0|1,0,2]=4 245 B10R0.2 CCCC(=O)CC(=O)C=CBr 1458a_100016273825_100000747444 [0,1,0,0,0,0|2,0,1]=4 246 B10R0.2 CCCC(=O)CC(=O)C=CCl 1458a_200016279998_100000747444 [0,1,0,0,0,0|2,0,1]=4 247 B10R0.2 CCCC(=O)CC(=O)C=CI 1458a_100016256311_100000747444 [0,1,0,0,0,0|2,0,1]=4 248 B10R0.2 CCCC(=O)CC(=O)OCC 1458a_100000211992_100000188475 [0,1,0,0,0,0|0,0,3]=4 249 B10R0.2 CCCC(=O)CC(=O)OCC 1458a_100000243816_100000210303 [0,1,0,0,0,0|0,0,3]=4 250 B10R0.2 CCNC(=O)CC(=O)C=CBr 1458a_100016273825_100000183381 [0,1,0,0,0,0|2,0,1]=4 251 B10R0.2 CCNC(=O)CC(=O)C=CCl 1458a_200016279998_100000183381 [0,1,0,0,0,0|2,0,1]=4 252 B10R0.2 CCNC(=O)CC(=O)C=CI 1458a_100016256311_100000183381 [0,1,0,0,0,0|2,0,1]=4 253 B10R0.2 CCNC(=O)CC(=O)OCC 240690a_100015525214_100000243816 [0,1,0,0,0,0|1,0,2]=4 254 B10R0.2 CCOC(=O)C=C(C)CNC 2230a_106832991635_100135422193 [0,1,0,0,0,0|1,0,1]=3 255 B10R0.2 CCOC(=O)C=C(C)CNC 34a_100102657272_100135422193 [0,1,0,0,0,0|1,0,1]=3 256 B10R0.2 CCOC(=O)C=C(C)CNC 7a_106832991635_100135422193 [0,1,0,0,0,0|1,0,1]=3 257 B10R0.2 CCOC(=O)C=C(C)COC 34a_100138415774_100135422193 [0,1,0,0,0,0|1,0,1]=3 258 B10R0.2 CCOC(=O)C=C(C)CSC 62a_100135422193_200000210301 [0,1,0,0,0,0|1,0,1]=3 259 B10R0.2 CCOC(=O)C=C(C)CSC 62a_200000210301_100135422193 [0,1,0,0,0,0|1,0,1]=3 260 B10R0.2 CCOC(=O)C=C(C)CS[13CH3] 62a_100135422193_200025704644 [0,1,0,0,0,0|1,0,1]=3 261 B10R0.2 CCOC(=O)C=C(C)CS[13CH3] 62a_200025704644_100135422193 [0,1,0,0,0,0|1,0,1]=3 262 B10R0.2 CCOC(=O)CC(=O)C=CBr 1458a_100016273825_100000188475 [0,1,0,0,0,0|1,0,1]=3 263 B10R0.2 CCOC(=O)CC(=O)C=CCl 1458a_200016279998_100000188475 [0,1,0,0,0,0|1,0,1]=3 264 B10R0.2 CCOC(=O)CC(=O)C=CI 1458a_100016256311_100000188475 [0,1,0,0,0,0|1,0,1]=3 265 B10R0.2 CCOC(=O)CC(=O)COC 1458a_100000210968_100000188475 [0,1,0,0,0,0|1,0,2]=4 266 B10R0.2 CCOC(=O)CC(=O)CSC 1458a_100000184570_100000188475 [0,1,0,0,0,0|1,0,2]=4 267 B10R0.2 CCOC(=O)CC(=O)CSC 62a_100000210311_200000210301 [0,1,0,0,0,0|1,0,2]=4 268 B10R0.2 CCOC(=O)CC(=O)CSC 62a_200000210301_100000210311 [0,1,0,0,0,0|1,0,2]=4 269 B10R0.2 CCOC(=O)CC(=O)CS[13CH3] 62a_100000210311_200025704644 [0,1,0,0,0,0|1,0,2]=4 270 B10R0.2 CCOC(=O)CC(=O)CS[13CH3] 62a_200025704644_100000210311 [0,1,0,0,0,0|1,0,2]=4 271 B10R0.2 CCOC(=O)CC(=O)NNC 22a_100016993582_100000243816 [0,1,0,0,0,0|2,0,1]=4 272 B10R0.2 CCOC(=O)NC(=O)CNC 7a_106832991635_100000010344 [0,1,0,0,0,0|2,0,1]=4 273 B10R0.2 CCOC(=O)NC(=O)CSC 62a_200000210301_100000010344 [0,1,0,0,0,0|2,0,1]=4 274 B10R0.2 CCOC(=O)NC(=O)CS[13CH3] 62a_200025704644_100000010344 [0,1,0,0,0,0|2,0,1]=4 275 B10R0.3 C=C(C)C=NNC(=O)CCC 4a_100000189770_100000210575 [0,1,0,0,0,0|3,0,0]=4 276 B10R0.3 C=C(C)COCC(=O)OCC 34a_100000210245_100000188475 [0,1,0,0,0,0|1,0,2]=4 277 B10R0.3 C=C(C)CSCC(=O)OCC 62a_100000188475_100000211660 [0,1,0,0,0,0|1,0,2]=4 278 B10R0.3 C=C(C)CSCC(=O)OCC 62a_100000748629_100000188475 [0,1,0,0,0,0|1,0,2]=4 279 B10R0.3 CCCC(=O)C/C=C/C(C)C 1458a_100016292215_100000210303 [0,1,0,0,0,0|1,0,2]=4 280 B10R0.3 CCCC(=O)C=CCN(C)C 1458a_100000754359_100000210303 [0,1,0,0,0,0|2,0,1]=4 281 B10R0.3 CCCC(=O)CCC=C(C)C 1458a_100000211992_100011217483 [0,1,0,0,0,0|1,0,2]=4 282 B10R0.3 CCCC(=O)NCC=C(C)C 11a_100000718196_100000211992 [0,1,0,0,0,0|2,0,1]=4 283 B10R0.3 CCCC(=O)NCC=C(C)C 1626a_100000718196_100000211992 [0,1,0,0,0,0|2,0,1]=4 284 B10R0.3 CCCC(=O)NCC=C(C)C 527a_100000718196_100000211992 [0,1,0,0,0,0|2,0,1]=4 285 B10R0.3 CCNC(=O)C/C=C/C(C)C 11a_100015525214_100016292215 [0,1,0,0,0,0|1,0,2]=4 286 B10R0.3 CCNC(=O)C/C=C/C(C)C 240690a_100015525214_100016292215 [0,1,0,0,0,0|1,0,2]=4 287 B10R0.3 CCNC(=O)C=CCN(C)C 240690a_100015525214_100000754359 [0,1,0,0,0,0|2,0,1]=4 288 B10R0.3 CCNC(=O)NCC=C(C)C 2708a_100000718196_100015525214 [0,1,0,0,0,0|2,0,1]=4 289 B10R0.3 CCNC(=O)NCC=C(C)C 2708a_100015525214_100000718196 [0,1,0,0,0,0|2,0,1]=4 290 B10R0.3 CCNC(=O)NCC=C(C)C 273464a_100000718196_100015525214 [0,1,0,0,0,0|2,0,1]=4 291 B10R0.3 CCNC(=O)NCC=C(C)C 273464a_100015525214_100000718196 [0,1,0,0,0,0|2,0,1]=4 292 B10R0.3 CCNC(=O)NCC=C(C)C 512a_100000718196_100015525214 [0,1,0,0,0,0|2,0,1]=4 293 B10R0.3 CCNC(=O)NCC=C(C)C 512a_100015525214_100000718196 [0,1,0,0,0,0|2,0,1]=4 294 B10R0.3 CCOC(=O)/C=C/CN(C)C 2230a_100102631434_100016267167 [0,1,0,0,0,0|1,0,1]=3 295 B10R0.3 CCOC(=O)/C=C/CN(C)C 269982a_100102631434_100016267167 [0,1,0,0,0,0|1,0,1]=3 296 B10R0.3 CCOC(=O)C=NNC(=O)C 4a_100000189765_100000742314 [0,1,0,0,0,0|2,0,0]=3 297 B10R0.3 CCOC(=O)C=NNC(C)C 4a_100000741168_100000742314 [0,1,0,0,0,0|2,0,1]=4 298 B10R0.3 CCOC(=O)CCCC(=O)C 1458a_100000070787_100011215271 [0,1,0,0,0,0|0,0,3]=4 299 B10R0.3 CCOC(=O)CCCC(=O)C 1458a_100000210991_200000210301 [0,1,0,0,0,0|0,0,3]=4 300 B10R0.3 CCOC(=O)CCCC(=O)[13CH3] 1458a_100000210991_200025704644 [0,1,0,0,0,0|0,0,3]=4 301 B10R0.3 CCOC(=O)CCNC(=O)C 188690a_100000746078_100015343762 [0,1,0,0,0,0|1,0,2]=4 302 B10R0.3 CCOC(=O)COCC(=O)C 34a_100000211253_100000188475 [0,1,0,0,0,0|1,0,2]=4 303 B10R0.3 CCOC(=O)NCCC(=O)C 1458a_100000070787_200011445536 [0,1,0,0,0,0|1,0,2]=4 304 B10R0.6 C/C=C/C=CC(=O)CC(=O)N 1458a_100000185730_100000187820 [0,1,0,0,0,0|2,0,1]=4 305 B10R0.6 C/C=C/C=CC(=O)CC(=O)[O-] 1458a_100000185730_100020667443 [0,1,0,0,0,0|2,0,1]=4 306 B10R0.6 C/C=C/C=CC(=O)CC(C)C 1458a_100000185730_100000210624 [0,1,0,0,0,0|1,0,0]=2 307 B10R0.6 C/C=C/C=CC(=O)CC(C)O 1458a_100000185730_100011218427 [0,1,0,0,0,0|1,0,0]=2 308 B10R0.6 C/C=C/C=CC(=O)CC(F)F 1458a_100000185730_100011934356 [0,1,0,0,0,0|2,0,0]=3 309 B10R0.6 C/C=C/C=CC(=O)C[N+](=O)[O-] 1458a_100000185730_100000761209 [0,1,0,0,0,0|3,0,0]=4 310 B10R0.6 C/C=C/C=CC(=O)NC(C)C 11a_100138425928_100000185730 [0,1,0,0,0,0|1,0,0]=2 311 B10R0.6 C/C=C/C=CC(=O)NC(C)C 1626a_100138425928_100000185730 [0,1,0,0,0,0|1,0,0]=2 312 B10R0.6 C/C=C/C=CC(=O)NC(C)C 240690a_100138425928_100000185730 [0,1,0,0,0,0|1,0,0]=2 313 B10R0.6 C=C(C)CC(=O)C=C/C=C/C 1458a_100000185730_100000748629 [0,1,0,0,0,0|1,0,1]=3 314 B10R0.6 C=C(F)CC(=O)C=C/C=C/C 1458a_100000185730_100009893438 [0,1,0,0,0,0|1,0,2]=4 315 B10R0.6 CC/C=C/CC(=O)CC(C)C 1458a_100016274230_100000210624 [0,1,0,0,0,0|1,0,2]=4 316 B10R0.6 CC/C=C/CC(=O)CC(C)O 1458a_100016274230_100011218427 [0,1,0,0,0,0|1,0,2]=4 317 B10R0.6 CC/C=C/CC(=O)NC(C)C 11a_100138425928_100016274230 [0,1,0,0,0,0|1,0,2]=4 318 B10R0.6 CC/C=C/CC(=O)NC(C)C 1626a_100138425928_100016274230 [0,1,0,0,0,0|1,0,2]=4 319 B10R0.6 CC/C=C/CC(=O)NC(C)C 240690a_100138425928_100016274230 [0,1,0,0,0,0|1,0,2]=4 320 B10R0.6 CC/C=C/CC(=O)NC(C)C 527a_100138425928_100016274230 [0,1,0,0,0,0|1,0,2]=4 321 B10R0.6 CC/C=C\CC(=O)CC(C)C 1458a_100000210554_100103147603 [0,1,0,0,0,0|1,0,2]=4 322 B10R0.6 CC/C=C\CC(=O)C[C@@H](C)O 1458a_100011933948_100103147603 [0,1,0,0,0,0|1,0,2]=4 323 B10R0.6 CCCC=CC(=O)CC(C)C 1458a_100000212230_100000210624 [0,1,0,0,0,0|1,0,2]=4 324 B10R0.6 CCCC=CC(=O)CC(C)O 1458a_100000212230_100011218427 [0,1,0,0,0,0|1,0,2]=4 325 B10R0.6 CCCC=CC(=O)NC(C)C 11a_100138425928_100000212230 [0,1,0,0,0,0|1,0,2]=4 326 B10R0.6 CCCC=CC(=O)NC(C)C 1626a_100138425928_100000212230 [0,1,0,0,0,0|1,0,2]=4 327 B10R0.6 CCCC=CC(=O)NC(C)C 240690a_100138425928_100000212230 [0,1,0,0,0,0|1,0,2]=4 328 B10R0.6 CCOC=CC(=O)CC(C)C 1458a_100016266692_100000210624 [0,1,0,0,0,0|2,0,1]=4 329 B10R0.6 CCOC=CC(=O)CC(C)O 1458a_100016266692_100011218427 [0,1,0,0,0,0|2,0,1]=4 330 B10R0.6 CCOC=CC(=O)NC(C)C 11a_100138425928_100016266692 [0,1,0,0,0,0|2,0,1]=4 331 B10R0.6 CCOC=CC(=O)NC(C)C 1626a_100138425928_100016266692 [0,1,0,0,0,0|2,0,1]=4 332 B10R0.6 CCOC=CC(=O)NC(C)C 240690a_100138425928_100016266692 [0,1,0,0,0,0|2,0,1]=4 333 B10R0.6 COCC=CC(=O)CC(C)C 1458a_100016285016_100000210624 [0,1,0,0,0,0|2,0,1]=4 334 B10R0.6 COCC=CC(=O)CC(C)O 1458a_100016285016_100011218427 [0,1,0,0,0,0|2,0,1]=4 335 B10R0.6 COCC=CC(=O)NC(C)C 11a_100138425928_100016285016 [0,1,0,0,0,0|2,0,1]=4 336 B10R0.6 COCC=CC(=O)NC(C)C 1626a_100138425928_100016285016 [0,1,0,0,0,0|2,0,1]=4 337 B10R0.6 COCC=CC(=O)NC(C)C 240690a_100138425928_100016285016 [0,1,0,0,0,0|2,0,1]=4 338 B10R0.19 C/C=C/CC(=O)/C(=C/CC)/C 1458a_100016988807_100102629194 [0,1,0,0,0,0|2,0,1]=4 339 B10R0.19 C/C=C/CC(=O)C(=O)NCC 1458a_200011297158_100102629194 [0,1,0,0,0,0|1,0,1]=3 340 B10R0.19 C/C=C/CC(=O)C(C)OCC 1458a_100000739345_100102629194 [0,1,0,0,0,0|1,0,2]=4 341 B10R0.19 C=C(COCC)C(=O)OCC 34a_100121572206_100000755967 [0,1,0,0,0,0|1,0,2]=4 342 B10R0.19 C=C(CSCC)C(=O)OCC 62a_100000210202_100000755967 [0,1,0,0,0,0|1,0,2]=4 343 B10R0.19 C=C(CSCC)C(=O)OCC 62a_100000755967_100000210202 [0,1,0,0,0,0|1,0,2]=4 344 B10R0.19 C=CCNC(=O)C(=O)OCC 1626a_100020586998_100014798877 [0,1,0,0,0,0|1,0,2]=4 345 B10R0.19 C=CCNC(=O)C(=O)OCC 240690a_100020586998_100014798877 [0,1,0,0,0,0|1,0,2]=4 346 B10R0.19 CC=CCC(=O)/C(=C/CC)/C 1458a_100016988807_100000070051 [0,1,0,0,0,0|2,0,1]=4 347 B10R0.19 CC=CCC(=O)C(=O)NCC 1458a_200011297158_100000070051 [0,1,0,0,0,0|1,0,1]=3 348 B10R0.19 CC=CCC(=O)C(C)OCC 1458a_100000739345_100000070051 [0,1,0,0,0,0|1,0,2]=4 349 B10R0.19 CCC/C=C(\C)/C(=O)CCC 1458a_200020648666_100000210303 [0,1,0,0,0,0|1,0,2]=4 350 B10R0.19 CCC/C=C(\C)/C(=O)NCC 11a_100015525214_200020648666 [0,1,0,0,0,0|1,0,2]=4 351 B10R0.19 CCC/C=C(\C)/C(=O)NCC 240690a_100015525214_200020648666 [0,1,0,0,0,0|1,0,2]=4 352 B10R0.19 CCCNC(=O)C(=O)OCC 11a_100020643023_100014798877 [0,1,0,0,0,0|1,0,2]=4 353 B10R0.19 CCCNC(=O)C(=O)OCC 1626a_100020643023_100014798877 [0,1,0,0,0,0|1,0,2]=4 354 B10R0.19 CCCNC(=O)C(=O)OCC 240690a_100020643023_100014798877 [0,1,0,0,0,0|1,0,2]=4 355 B10R0.19 CCNN=C(C)C(=O)OCC 4a_100000756455_100000209952 [0,1,0,0,0,0|2,0,1]=4 356 B10R0.19 CCOC(=O)C(=O)CSCC 62a_100000210202_100000211299 [0,1,0,0,0,0|1,0,2]=4 357 B10R0.19 CCOC(=O)C(=O)CSCC 62a_100000211299_100000210202 [0,1,0,0,0,0|1,0,2]=4 358 B10R0.83 C#CC(C)C(=O)C=C/C=C/C 1458a_100000185730_200000035995 [0,1,0,0,0,0|1,0,2]=4 359 B10R0.83 C/C=C/C=CC(=O)C(C)C#N 1458a_100000185730_100000703298 [0,1,0,0,0,0|2,0,1]=4 360 B10R0.83 C/C=C/C=CC(=O)C(C)CC 1458a_100000185730_100000758301 [0,1,0,0,0,0|1,0,0]=2 361 B10R0.83 C/C=C/C=CC(=O)N(C)CC 11a_100000225621_100000185730 [0,1,0,0,0,0|1,0,0]=2 362 B10R0.83 C/C=C/C=CC(=O)N(C)CC 1626a_100000225621_100000185730 [0,1,0,0,0,0|1,0,0]=2 363 B10R0.83 C/C=C/C=CC(=O)N(C)CC 240690a_100000225621_100000185730 [0,1,0,0,0,0|1,0,0]=2 364 B10R0.83 CC/C=C/CC(=O)C(C)CC 1458a_100016274230_100000758301 [0,1,0,0,0,0|1,0,2]=4 365 B10R0.83 CC/C=C/CC(=O)N(C)CC 11a_100000225621_100016274230 [0,1,0,0,0,0|1,0,2]=4 366 B10R0.83 CC/C=C/CC(=O)N(C)CC 1626a_100000225621_100016274230 [0,1,0,0,0,0|1,0,2]=4 367 B10R0.83 CC/C=C/CC(=O)N(C)CC 240690a_100000225621_100016274230 [0,1,0,0,0,0|1,0,2]=4 368 B10R0.83 CC/C=C/CC(=O)N(C)CC 527a_100000225621_100016274230 [0,1,0,0,0,0|1,0,2]=4 369 B10R0.83 CC/C=C\CC(=O)C(C)CC 1458a_100011192722_100103147603 [0,1,0,0,0,0|1,0,2]=4 370 B10R0.83 CC/C=C\CC(=O)C(O)CC 1458a_100011196387_100103147603 [0,1,0,0,0,0|1,0,2]=4 371 B10R0.83 CCC(C)C(=O)C=CCOC 1458a_100016285016_100000758301 [0,1,0,0,0,0|2,0,1]=4 372 B10R0.83 CCCC=CC(=O)C(C)CC 1458a_100000212230_100000758301 [0,1,0,0,0,0|1,0,2]=4 373 B10R0.83 CCCC=CC(=O)N(C)CC 11a_100000225621_100000212230 [0,1,0,0,0,0|1,0,2]=4 374 B10R0.83 CCCC=CC(=O)N(C)CC 1626a_100000225621_100000212230 [0,1,0,0,0,0|1,0,2]=4 375 B10R0.83 CCCC=CC(=O)N(C)CC 240690a_100000225621_100000212230 [0,1,0,0,0,0|1,0,2]=4 376 B10R0.83 CCN(C)C(=O)C=CCOC 11a_100000225621_100016285016 [0,1,0,0,0,0|2,0,1]=4 377 B10R0.83 CCN(C)C(=O)C=CCOC 1626a_100000225621_100016285016 [0,1,0,0,0,0|2,0,1]=4 378 B10R0.83 CCN(C)C(=O)C=CCOC 240690a_100000225621_100016285016 [0,1,0,0,0,0|2,0,1]=4 379 B10R0.83 CCOC=CC(=O)C(C)CC 1458a_100016266692_100000758301 [0,1,0,0,0,0|2,0,1]=4 380 B10R0.83 CCOC=CC(=O)N(C)CC 11a_100000225621_100016266692 [0,1,0,0,0,0|2,0,1]=4 381 B10R0.83 CCOC=CC(=O)N(C)CC 1626a_100000225621_100016266692 [0,1,0,0,0,0|2,0,1]=4 382 B10R0.83 CCOC=CC(=O)N(C)CC 240690a_100000225621_100016266692 [0,1,0,0,0,0|2,0,1]=4 383 B10R0.91 C#CCCC(=O)C=C/C=C/C 1458a_100000185730_100000753159 [0,1,0,0,0,0|1,0,1]=3 384 B10R0.91 C#CCNC(=O)C=C/C=C/C 11a_100000212058_100000185730 [0,1,0,0,0,0|1,0,1]=3 385 B10R0.91 C#CCNC(=O)C=C/C=C/C 1626a_100000212058_100000185730 [0,1,0,0,0,0|1,0,1]=3 386 B10R0.91 C#CCNC(=O)C=C/C=C/C 240690a_100000212058_100000185730 [0,1,0,0,0,0|1,0,1]=3 387 B10R0.91 C/C=C/C=CC(=NNCC)C 4a_100000756455_100016268696 [0,1,0,0,0,0|2,0,0]=3 388 B10R0.91 C/C=C/C=CC(=O)C/C=C/C 1458a_100000185730_100102629194 [0,1,0,0,0,0|1,0,1]=3 389 B10R0.91 C/C=C/C=CC(=O)CCC#N 1458a_100000185730_100011215226 [0,1,0,0,0,0|1,0,1]=3 390 B10R0.91 C/C=C/C=CC(=O)CCCC 1458a_100000185730_100000210211 [0,1,0,0,0,0|1,0,0]=2 391 B10R0.91 C/C=C/C=CC(=O)CCCF 1458a_100000185730_100011934791 [0,1,0,0,0,0|1,0,0]=2 392 B10R0.91 C/C=C/C=CC(=O)CCCO 1458a_100000185730_100011215043 [0,1,0,0,0,0|1,0,0]=2 393 B10R0.91 C/C=C/C=CC(=O)CCOC 1458a_100000185730_100000233755 [0,1,0,0,0,0|1,0,0]=2 394 B10R0.91 C/C=C/C=CC(=O)CCSC 1458a_100000185730_100000751147 [0,1,0,0,0,0|1,0,0]=2 395 B10R0.91 C/C=C/C=CC(=O)NCC#N 1626a_100000734998_100000185730 [0,1,0,0,0,0|1,0,1]=3 396 B10R0.91 C/C=C/C=CC(=O)NCCC 11a_100020643023_100000185730 [0,1,0,0,0,0|1,0,0]=2 397 B10R0.91 C/C=C/C=CC(=O)NCCC 1626a_100020643023_100000185730 [0,1,0,0,0,0|1,0,0]=2 398 B10R0.91 C/C=C/C=CC(=O)NCCC 240690a_100020643023_100000185730 [0,1,0,0,0,0|1,0,0]=2 399 B10R0.91 C/C=C/C=CC(=O)NCCF 11a_100000724931_100000185730 [0,1,0,0,0,0|1,0,0]=2 400 B10R0.91 C/C=C/C=CC(=O)NCCF 1626a_100000724931_100000185730 [0,1,0,0,0,0|1,0,0]=2 401 B10R0.91 C/C=C/C=CC(=O)NCCF 240690a_100000724931_100000185730 [0,1,0,0,0,0|1,0,0]=2 402 B10R0.91 C/C=C/C=CC(=O)NCCO 240690a_100000210304_100000185730 [0,1,0,0,0,0|1,0,0]=2 403 B10R0.91 C/C=C/C=CC(=O)NNCC 22a_100000756455_100000185730 [0,1,0,0,0,0|1,0,0]=2 404 B10R0.91 C=CCCC(=O)C=C/C=C/C 1458a_100000185730_100000754431 [0,1,0,0,0,0|1,0,1]=3 405 B10R0.91 C=CCNC(=O)C=C/C=C/C 1626a_100020586998_100000185730 [0,1,0,0,0,0|1,0,1]=3 406 B10R0.91 C=CCNC(=O)C=C/C=C/C 240690a_100020586998_100000185730 [0,1,0,0,0,0|1,0,1]=3 407 B10R0.91 CC#CCC(=O)C=C/C=C/C 1458a_100000185730_100000748600 [0,1,0,0,0,0|1,0,1]=3 408 B10R0.91 CC/C=C/CC(=O)CCCC 1458a_100016274230_100000210211 [0,1,0,0,0,0|1,0,2]=4 409 B10R0.91 CC/C=C/CC(=O)CCCF 1458a_100016274230_100011934791 [0,1,0,0,0,0|1,0,2]=4 410 B10R0.91 CC/C=C/CC(=O)CCCO 1458a_100016274230_100011215043 [0,1,0,0,0,0|1,0,2]=4 411 B10R0.91 CC/C=C/CC(=O)CCOC 1458a_100016274230_100000233755 [0,1,0,0,0,0|1,0,2]=4 412 B10R0.91 CC/C=C/CC(=O)CCSC 1458a_100016274230_100000751147 [0,1,0,0,0,0|1,0,2]=4 413 B10R0.91 CC/C=C/CC(=O)NCCC 11a_100020643023_100016274230 [0,1,0,0,0,0|1,0,2]=4 414 B10R0.91 CC/C=C/CC(=O)NCCC 1626a_100020643023_100016274230 [0,1,0,0,0,0|1,0,2]=4 415 B10R0.91 CC/C=C/CC(=O)NCCC 240690a_100020643023_100016274230 [0,1,0,0,0,0|1,0,2]=4 416 B10R0.91 CC/C=C/CC(=O)NCCC 527a_100020643023_100016274230 [0,1,0,0,0,0|1,0,2]=4 417 B10R0.91 CC/C=C/CC(=O)NCCF 11a_100000724931_100016274230 [0,1,0,0,0,0|1,0,2]=4 418 B10R0.91 CC/C=C/CC(=O)NCCF 1626a_100000724931_100016274230 [0,1,0,0,0,0|1,0,2]=4 419 B10R0.91 CC/C=C/CC(=O)NCCF 240690a_100000724931_100016274230 [0,1,0,0,0,0|1,0,2]=4 420 B10R0.91 CC/C=C/CC(=O)NCCF 527a_100000724931_100016274230 [0,1,0,0,0,0|1,0,2]=4 421 B10R0.91 CC/C=C/CC(=O)NCCO 240690a_100000210304_100016274230 [0,1,0,0,0,0|1,0,2]=4 422 B10R0.91 CC/C=C/CC(=O)NCCO 527a_100000210304_100016274230 [0,1,0,0,0,0|1,0,2]=4 423 B10R0.91 CC/C=C/CC(=O)NNCC 22a_100000756455_100016274230 [0,1,0,0,0,0|1,0,2]=4 424 B10R0.91 CC/C=C\CC(=O)CCCC 1458a_100000210183_100103147603 [0,1,0,0,0,0|1,0,2]=4 425 B10R0.91 CC/C=C\CC(=O)CCOC 1458a_100000749529_100103147603 [0,1,0,0,0,0|1,0,2]=4 426 B10R0.91 CC/C=C\CC(=O)CCSC 1458a_100000174002_100103147603 [0,1,0,0,0,0|1,0,2]=4 427 B10R0.91 CC/C=C\CC(=O)COCC 1458a_100000211967_100103147603 [0,1,0,0,0,0|0,0,2]=3 428 B10R0.91 CC/C=C\CC(=O)CSCC 1458a_100000230394_100103147603 [0,1,0,0,0,0|0,1,2]=4 429 B10R0.91 CC=CCC(=O)C=C/C=C/C 1458a_100000185730_100000070051 [0,1,0,0,0,0|1,0,1]=3 430 B10R0.91 CCC#CC(=O)C/C=C\CC 1458a_100011827653_100103147603 [0,1,0,0,0,0|1,0,2]=4 431 B10R0.91 CCC=CC(=O)C/C=C\CC 1458a_100000212282_100103147603 [0,1,0,0,0,0|1,0,2]=4 432 B10R0.91 CCC=NNC(=O)COCC 4a_100000216846_100000210100 [0,1,0,0,0,0|2,0,1]=4 433 B10R0.91 CCCC=CC(=O)CCCC 1458a_100000212230_100000210211 [0,1,0,0,0,0|1,0,2]=4 434 B10R0.91 CCCC=CC(=O)CCCF 1458a_100000212230_100011934791 [0,1,0,0,0,0|1,0,2]=4 435 B10R0.91 CCCC=CC(=O)CCCO 1458a_100000212230_100011215043 [0,1,0,0,0,0|1,0,2]=4 436 B10R0.91 CCCC=CC(=O)CCOC 1458a_100000212230_100000233755 [0,1,0,0,0,0|1,0,2]=4 437 B10R0.91 CCCC=CC(=O)CCSC 1458a_100000212230_100000751147 [0,1,0,0,0,0|1,0,2]=4 438 B10R0.91 CCCC=CC(=O)NCCC 11a_100020643023_100000212230 [0,1,0,0,0,0|1,0,2]=4 439 B10R0.91 CCCC=CC(=O)NCCC 1626a_100020643023_100000212230 [0,1,0,0,0,0|1,0,2]=4 440 B10R0.91 CCCC=CC(=O)NCCC 240690a_100020643023_100000212230 [0,1,0,0,0,0|1,0,2]=4 441 B10R0.91 CCCC=CC(=O)NCCF 11a_100000724931_100000212230 [0,1,0,0,0,0|1,0,2]=4 442 B10R0.91 CCCC=CC(=O)NCCF 1626a_100000724931_100000212230 [0,1,0,0,0,0|1,0,2]=4 443 B10R0.91 CCCC=CC(=O)NCCF 240690a_100000724931_100000212230 [0,1,0,0,0,0|1,0,2]=4 444 B10R0.91 CCCC=CC(=O)NCCO 240690a_100000210304_100000212230 [0,1,0,0,0,0|1,0,2]=4 445 B10R0.91 CCCC=CC(=O)NNCC 22a_100000756455_100000212230 [0,1,0,0,0,0|1,0,2]=4 446 B10R0.91 CCCCC(=O)C=CCOC 1458a_100016285016_100000210211 [0,1,0,0,0,0|2,0,1]=4 447 B10R0.91 CCCCC(=O)C=COCC 1458a_100016266692_100000210211 [0,1,0,0,0,0|2,0,1]=4 448 B10R0.91 CCCNC(=O)C=CCOC 11a_100020643023_100016285016 [0,1,0,0,0,0|2,0,1]=4 449 B10R0.91 CCCNC(=O)C=CCOC 1626a_100020643023_100016285016 [0,1,0,0,0,0|2,0,1]=4 450 B10R0.91 CCCNC(=O)C=CCOC 240690a_100020643023_100016285016 [0,1,0,0,0,0|2,0,1]=4 451 B10R0.91 CCCNC(=O)C=COCC 11a_100020643023_100016266692 [0,1,0,0,0,0|2,0,1]=4 452 B10R0.91 CCCNC(=O)C=COCC 1626a_100020643023_100016266692 [0,1,0,0,0,0|2,0,1]=4 453 B10R0.91 CCCNC(=O)C=COCC 240690a_100020643023_100016266692 [0,1,0,0,0,0|2,0,1]=4 454 B10R0.91 CCNNC(=O)C=CCOC 22a_100000756455_100016285016 [0,1,0,0,0,0|2,0,1]=4 455 B10R0.91 CCNNC(=O)C=COCC 22a_100000756455_100016266692 [0,1,0,0,0,0|2,0,1]=4 456 B10R0.91 CCOC=CC(=O)CCCF 1458a_100016266692_100011934791 [0,1,0,0,0,0|2,0,1]=4 457 B10R0.91 CCOC=CC(=O)CCCO 1458a_100016266692_100011215043 [0,1,0,0,0,0|2,0,1]=4 458 B10R0.91 CCOC=CC(=O)CCOC 1458a_100016266692_100000233755 [0,1,0,0,0,0|2,0,1]=4 459 B10R0.91 CCOC=CC(=O)CCSC 1458a_100016266692_100000751147 [0,1,0,0,0,0|2,0,1]=4 460 B10R0.91 CCOC=CC(=O)NCCF 11a_100000724931_100016266692 [0,1,0,0,0,0|2,0,1]=4 461 B10R0.91 CCOC=CC(=O)NCCF 1626a_100000724931_100016266692 [0,1,0,0,0,0|2,0,1]=4 462 B10R0.91 CCOC=CC(=O)NCCF 240690a_100000724931_100016266692 [0,1,0,0,0,0|2,0,1]=4 463 B10R0.91 CCOC=CC(=O)NCCO 240690a_100000210304_100016266692 [0,1,0,0,0,0|2,0,1]=4 464 B10R0.91 COCC=CC(=O)CCCF 1458a_100016285016_100011934791 [0,1,0,0,0,0|2,0,1]=4 465 B10R0.91 COCC=CC(=O)CCCO 1458a_100016285016_100011215043 [0,1,0,0,0,0|2,0,1]=4 466 B10R0.91 COCC=CC(=O)CCOC 1458a_100016285016_100000233755 [0,1,0,0,0,0|2,0,1]=4 467 B10R0.91 COCC=CC(=O)CCSC 1458a_100016285016_100000751147 [0,1,0,0,0,0|2,0,1]=4 468 B10R0.91 COCC=CC(=O)NCCF 11a_100000724931_100016285016 [0,1,0,0,0,0|2,0,1]=4 469 B10R0.91 COCC=CC(=O)NCCF 1626a_100000724931_100016285016 [0,1,0,0,0,0|2,0,1]=4 470 B10R0.91 COCC=CC(=O)NCCF 240690a_100000724931_100016285016 [0,1,0,0,0,0|2,0,1]=4 471 B10R0.91 COCC=CC(=O)NCCO 240690a_100000210304_100016285016 [0,1,0,0,0,0|2,0,1]=4 472 B10R0.108 C#CCC(=O)C=CC(=CC)C 1458a_100000692105_100000184674 [0,1,0,0,0,0|1,0,2]=4 473 B10R0.108 C=CCC(=O)C=CC(=CC)C 1458a_100000692105_100000210623 [0,1,0,0,0,0|1,0,2]=4 474 B10R0.108 CC=C(C)C=CC(=O)CC#N 1458a_100000692105_100011214920 [0,1,0,0,0,0|2,0,1]=4 475 B10R0.108 CC=C(C)C=CC(=O)CCC 1458a_100000692105_100000210303 [0,1,0,0,0,0|1,0,0]=2 476 B10R0.108 CC=C(C)C=CC(=O)CCF 1458a_100000692105_100011217306 [0,1,0,0,0,0|2,0,0]=3 477 B10R0.108 CC=C(C)C=CC(=O)CCO 1458a_100000692105_100000211926 [0,1,0,0,0,0|2,0,0]=3 478 B10R0.108 CC=C(C)C=CC(=O)NNC 22a_100016993582_100000692105 [0,1,0,0,0,0|2,0,0]=3 479 B10R0.108 CCCC(=O)C=CC(=O)NC 1458a_100016259477_100000210303 [0,1,0,0,0,0|2,0,0]=3 480 B10R0.108 CCOC(=O)C=CC(=O)CC 1458a_100000210415_100000210202 [0,1,0,0,0,0|0,0,1]=2 481 B10R0.108 CCOC(=O)C=CC(=O)CF 1458a_100000210415_100015361967 [0,1,0,0,0,0|1,0,1]=3 482 B10R0.108 CCOC(=O)C=CC(=O)NC 1626a_100102657272_100000210415 [0,1,0,0,0,0|1,0,0]=2 483 B10R0.108 CCOC(=O)C=CC(=O)NC 240690a_100102657272_100000210415 [0,1,0,0,0,0|1,0,0]=2 484 B10R0.108 CCOC(=O)CCC(=O)CC 1458a_100000183558_100000210202 [0,1,0,0,0,0|0,0,3]=4 485 B10R0.108 CCOC(=O)CCC(=O)NC 11a_106832991635_100000183558 [0,1,0,0,0,0|1,0,2]=4 486 B10R0.108 CCOC(=O)CCC(=O)NC 1626a_100102657272_100000183558 [0,1,0,0,0,0|1,0,2]=4 487 B10R0.108 CCOC(=O)CCC(=O)NC 240690a_100102657272_100000183558 [0,1,0,0,0,0|1,0,2]=4 488 B10R0.108 CCOC(=O)CNC(=O)CC 188690a_100000741813_100000210414 [0,1,0,0,0,0|1,0,2]=4 489 B10R0.108 CCOC(=O)NCC(=O)CC 1458a_100000190774_100000210202 [0,1,0,0,0,0|1,0,2]=4 490 B10R0.108 CCOC(=O)NCC(=O)NC 11a_106832991635_100000190774 [0,1,0,0,0,0|2,0,1]=4 491 B10R0.108 CCOC(=O)NCC(=O)NC 1626a_100102657272_100000190774 [0,1,0,0,0,0|2,0,1]=4 492 B10R0.108 CCOC(=O)NCC(=O)NC 240690a_100102657272_100000190774 [0,1,0,0,0,0|2,0,1]=4 493 B10R0.108 CCOC(=O)NCC(=O)NC 527a_100102657272_100000190774 [0,1,0,0,0,0|2,0,1]=4 494 B10R0.108 CNC(=O)C=CC(=O)CCF 1458a_100016259477_100011217306 [0,1,0,0,0,0|3,0,0]=4 495 B10R0.108 CNC(=O)C=CC(=O)CCO 1458a_100016259477_100000211926 [0,1,0,0,0,0|3,0,0]=4 496 B10R0.108 CNNC(=O)C=CC(=O)NC 22a_100016993582_100016259477 [0,1,0,0,0,0|3,0,0]=4 497 B10R0.108 CNNC(=O)C=CC(=O)OC 22a_100016993582_100016283253 [0,1,0,0,0,0|3,0,0]=4 498 B10R1.10 CC=Cc1cc[nH]c(=O)c1 271570a_100016259895_100009816521 [0,0,0,1,0,0|1,0,2]=4 499 B10R1.10 CC=Cc1cccc(c1)C 271570a_100016259895_100011215228 [0,0,0,1,0,0|2,0,1]=4 500 B10R1.10 CC=Cc1cccc(n1)C 271570a_100016259895_100000742759 [0,0,0,1,0,0|2,0,1]=4 501 B10R1.10 CC=Cc1cn[nH]c(=O)c1 271570a_100016259895_100010197405 [0,0,0,1,0,0|2,0,1]=4 502 B10R1.10 CCCc1cccc(c1)O 271570a_203496583355_100000694964 [0,0,0,1,0,0|3,0,0]=4 503 B10R1.10 CCNc1cccc(c1)Br 34a_100000210019_100000210202 [0,0,0,1,0,0|3,0,0]=4 504 B10R1.10 CCNc1cccc(c1)C 2230a_100000188690_100000210202 [0,0,0,1,0,0|2,0,0]=3 505 B10R1.10 CCNc1cccc(c1)C 34a_100000188690_100000210202 [0,0,0,1,0,0|2,0,0]=3 506 B10R1.10 CCNc1cccc(c1)Cl 34a_100000185859_100000210202 [0,0,0,1,0,0|3,0,0]=4 507 B10R1.10 CCNc1cccc(c1)F 34a_100000210047_100000210202 [0,0,0,1,0,0|3,0,0]=4 508 B10R1.10 CCNc1cccc(c1)I 34a_100000211102_100000210202 [0,0,0,1,0,0|3,0,0]=4 509 B10R1.10 CCNc1cccc(c1)O 271570a_203496583355_100000738899 [0,0,0,1,0,0|3,0,0]=4 510 B10R1.10 CCNc1cccc(c1)O 34a_100000210217_100000210202 [0,0,0,1,0,0|3,0,0]=4 511 B10R1.10 CCNc1cccc(n1)F 27a_100015525214_100009815982 [0,0,0,1,0,0|3,0,0]=4 512 B10R1.10 CCNc1cccc(n1)O 271570a_203496583355_200020678610 [0,0,0,1,0,0|3,0,0]=4 513 B10R1.10 CCNc1ccnc(c1)C 27a_100015525214_100000758586 [0,0,0,1,0,0|3,0,0]=4 514 B10R1.10 CCNc1ccnc(n1)C 27a_100015525214_100000749937 [0,0,0,1,0,0|3,0,0]=4 515 B10R1.10 CCNc1cncc(n1)C 27a_100015525214_100000754123 [0,0,0,1,0,0|3,0,0]=4 516 B10R1.10 CCNc1nccc(n1)C 27a_100015525214_100000750684 [0,0,0,1,0,0|3,0,0]=4 517 B10R1.10 CCOc1cc(ccn1)O 271570a_203496583355_100009995528 [0,0,0,1,0,0|3,0,0]=4 518 B10R1.10 CCOc1cc(cnn1)C 34a_100000766097_100000210202 [0,0,0,1,0,0|3,0,0]=4 519 B10R1.10 CCOc1cc[nH]c(=O)c1 34a_100000032262_100000210202 [0,0,0,1,0,0|3,0,0]=4 520 B10R1.10 CCOc1ccc[n+](c1)[O-] 34a_100000039713_100000210202 [0,0,0,1,0,0|3,0,0]=4 521 B10R1.10 CCOc1ccc[n+](c1)[O-] 7a_100000039713_100000210202 [0,0,0,1,0,0|3,0,0]=4 522 B10R1.10 CCOc1cccc(=O)[nH]1 34a_100000033347_100000210202 [0,0,0,1,0,0|2,0,0]=3 523 B10R1.10 CCOc1cccc(c1)Br 34a_100000210342_100000210202 [0,0,0,1,0,0|2,0,0]=3 524 B10R1.10 CCOc1cccc(c1)Br 7a_100000210342_100000210202 [0,0,0,1,0,0|2,0,0]=3 525 B10R1.10 CCOc1cccc(c1)C 34a_100000210337_100000210202 [0,0,0,1,0,0|1,0,0]=2 526 B10R1.10 CCOc1cccc(c1)C 7a_100000210337_100000210202 [0,0,0,1,0,0|1,0,0]=2 527 B10R1.10 CCOc1cccc(c1)Cl 34a_100000210295_100000210202 [0,0,0,1,0,0|2,0,0]=3 528 B10R1.10 CCOc1cccc(c1)Cl 7a_100000210295_100000210202 [0,0,0,1,0,0|2,0,0]=3 529 B10R1.10 CCOc1cccc(c1)F 34a_100000210426_100000210202 [0,0,0,1,0,0|2,0,0]=3 530 B10R1.10 CCOc1cccc(c1)F 7a_100000210426_100000210202 [0,0,0,1,0,0|2,0,0]=3 531 B10R1.10 CCOc1cccc(c1)I 34a_100000211634_100000210202 [0,0,0,1,0,0|2,0,0]=3 532 B10R1.10 CCOc1cccc(c1)I 7a_100000211634_100000210202 [0,0,0,1,0,0|2,0,0]=3 533 B10R1.10 CCOc1cccc(c1)N 34a_100000210217_100000210202 [0,0,0,1,0,0|2,0,0]=3 534 B10R1.10 CCOc1cccc(c1)O 271570a_203496583355_100000170002 [0,0,0,1,0,0|2,0,0]=3 535 B10R1.10 CCOc1cccc(n1)F 34a_100011432558_100000210202 [0,0,0,1,0,0|2,0,0]=3 536 B10R1.10 CCOc1cccc(n1)O 271570a_203496583355_100000752924 [0,0,0,1,0,0|2,0,0]=3 537 B10R1.10 CCOc1ccnc(c1)C 34a_100000688365_100000210202 [0,0,0,1,0,0|2,0,0]=3 538 B10R1.10 CCOc1ccnc(c1)Cl 34a_100000762945_100000210202 [0,0,0,1,0,0|3,0,0]=4 539 B10R1.10 CCOc1ccnc(c1)F 34a_100000732698_100000210202 [0,0,0,1,0,0|3,0,0]=4 540 B10R1.10 CCOc1ccnc(c1)N 34a_100011834064_100000210202 [0,0,0,1,0,0|3,0,0]=4 541 B10R1.10 CCOc1ccnc(c1)O 271570a_203496583355_100011922638 [0,0,0,1,0,0|3,0,0]=4 542 B10R1.10 CCOc1ccnc(n1)O 271570a_203496583355_100011649779 [0,0,0,1,0,0|3,0,0]=4 543 B10R1.10 CCOc1cncc(c1)Br 34a_100000754920_100000210202 [0,0,0,1,0,0|3,0,0]=4 544 B10R1.10 CCOc1cncc(c1)Br 7a_100000754920_100000210202 [0,0,0,1,0,0|3,0,0]=4 545 B10R1.10 CCOc1cncc(c1)C 34a_100011830280_100000210202 [0,0,0,1,0,0|2,0,0]=3 546 B10R1.10 CCOc1cncc(c1)C 7a_100011830280_100000210202 [0,0,0,1,0,0|2,0,0]=3 547 B10R1.10 CCOc1cncc(c1)Cl 7a_100000032511_100000210202 [0,0,0,1,0,0|3,0,0]=4 548 B10R1.10 CCOc1cncc(c1)F 34a_100011830296_100000210202 [0,0,0,1,0,0|3,0,0]=4 549 B10R1.10 CCOc1cncc(c1)F 7a_100011830296_100000210202 [0,0,0,1,0,0|3,0,0]=4 550 B10R1.10 CCOc1cncc(c1)N 34a_100011997051_100000210202 [0,0,0,1,0,0|3,0,0]=4 551 B10R1.10 CCOc1cncc(c1)O 271570a_203496583355_100012029586 [0,0,0,1,0,0|3,0,0]=4 552 B10R1.10 CCOc1cncc(n1)O 271570a_203496583355_100000757043 [0,0,0,1,0,0|3,0,0]=4 553 B10R1.10 CCSc1cc(ccn1)C 62a_100000210202_100000750283 [0,0,0,1,0,0|2,1,0]=4 554 B10R1.10 CCSc1cc(ccn1)C 62a_100000750283_100000210202 [0,0,0,1,0,0|2,1,0]=4 555 B10R1.10 CCSc1ccc[n+](c1)C 62a_100000210202_100009996589 [0,0,0,1,0,0|2,1,0]=4 556 B10R1.10 CCSc1ccc[n+](c1)C 62a_100009996589_100000210202 [0,0,0,1,0,0|2,1,0]=4 557 B10R1.10 CCSc1cccc(=O)[nH]1 62a_100000210202_100000752884 [0,0,0,1,0,0|2,1,0]=4 558 B10R1.10 CCSc1cccc(c1)Br 62a_100000210202_100000691529 [0,0,0,1,0,0|2,1,0]=4 559 B10R1.10 CCSc1cccc(c1)Br 62a_100000691529_100000210202 [0,0,0,1,0,0|2,1,0]=4 560 B10R1.10 CCSc1cccc(c1)C 62a_100000210202_100011215228 [0,0,0,1,0,0|1,1,0]=3 561 B10R1.10 CCSc1cccc(c1)C 62a_100011215228_100000210202 [0,0,0,1,0,0|1,1,0]=3 562 B10R1.10 CCSc1cccc(c1)Cl 62a_100000210202_100000699651 [0,0,0,1,0,0|2,1,0]=4 563 B10R1.10 CCSc1cccc(c1)Cl 62a_100000699651_100000210202 [0,0,0,1,0,0|2,1,0]=4 564 B10R1.10 CCSc1cccc(c1)F 62a_100000210202_100000685547 [0,0,0,1,0,0|2,1,0]=4 565 B10R1.10 CCSc1cccc(c1)F 62a_100000685547_100000210202 [0,0,0,1,0,0|2,1,0]=4 566 B10R1.10 CCSc1cccc(c1)N 62a_100000210019_100000210202 [0,0,0,1,0,0|2,1,0]=4 567 B10R1.10 CCSc1cccc(c1)N 62a_100000210202_100000210019 [0,0,0,1,0,0|2,1,0]=4 568 B10R1.10 CCSc1cccc(c1)O 271570a_203496583355_100000703699 [0,0,0,1,0,0|2,1,0]=4 569 B10R1.10 CCSc1cccc(c1)O 62a_100000210202_100000211634 [0,0,0,1,0,0|2,1,0]=4 570 B10R1.10 CCSc1cccc(c1)[S] 62a_100000210202_114929384022 [0,0,0,1,0,0|2,1,0]=4 571 B10R1.10 CCSc1cccc(c1)[S] 62a_114929384022_100000210202 [0,0,0,1,0,0|2,1,0]=4 572 B10R1.10 CCSc1cccc(n1)Br 62a_100000210202_100000684672 [0,0,0,1,0,0|2,1,0]=4 573 B10R1.10 CCSc1cccc(n1)Br 62a_100000684672_100000210202 [0,0,0,1,0,0|2,1,0]=4 574 B10R1.10 CCSc1cccc(n1)C 62a_100000210202_100000742759 [0,0,0,1,0,0|1,1,0]=3 575 B10R1.10 CCSc1cccc(n1)C 62a_100000742759_100000210202 [0,0,0,1,0,0|1,1,0]=3 576 B10R1.10 CCSc1cccc(n1)Cl 62a_100000051397_100000210202 [0,0,0,1,0,0|2,1,0]=4 577 B10R1.10 CCSc1cccc(n1)Cl 62a_100000210202_100000051397 [0,0,0,1,0,0|2,1,0]=4 578 B10R1.10 CCSc1cccc(n1)F 62a_100000210202_100009815982 [0,0,0,1,0,0|2,1,0]=4 579 B10R1.10 CCSc1cccc(n1)F 62a_100009815982_100000210202 [0,0,0,1,0,0|2,1,0]=4 580 B10R1.10 CCSc1cccc(n1)N 62a_100000210202_100000740741 [0,0,0,1,0,0|2,1,0]=4 581 B10R1.10 CCSc1cccc(n1)N 62a_100000740741_100000210202 [0,0,0,1,0,0|2,1,0]=4 582 B10R1.10 CCSc1ccnc(c1)C 62a_100000210202_100000758586 [0,0,0,1,0,0|2,1,0]=4 583 B10R1.10 CCSc1ccnc(c1)C 62a_100000758586_100000210202 [0,0,0,1,0,0|2,1,0]=4 584 B10R1.10 CCSc1ccnc(n1)C 62a_100000210202_100000749937 [0,0,0,1,0,0|2,1,0]=4 585 B10R1.10 CCSc1ccnc(n1)C 62a_100000749937_100000210202 [0,0,0,1,0,0|2,1,0]=4 586 B10R1.10 CCSc1cncc(c1)C 62a_100000210202_100000760492 [0,0,0,1,0,0|2,1,0]=4 587 B10R1.10 CCSc1cncc(c1)C 62a_100000760492_100000210202 [0,0,0,1,0,0|2,1,0]=4 588 B10R1.10 CCSc1cncc(n1)C 62a_100000210202_100000754123 [0,0,0,1,0,0|2,1,0]=4 589 B10R1.10 CCSc1cncc(n1)C 62a_100000754123_100000210202 [0,0,0,1,0,0|2,1,0]=4 590 B10R1.10 CCSc1nccc(n1)C 62a_100000210202_100011243806 [0,0,0,1,0,0|2,1,0]=4 591 B10R1.10 CCSc1nccc(n1)C 62a_100011243806_100000210202 [0,0,0,1,0,0|2,1,0]=4 592 B10R1.10 CNCc1cccc(c1)C 207a_100102657272_100000211157 [0,0,0,1,0,0|3,0,0]=4 593 B10R1.10 CNCc1cccc(c1)C 2230a_100000185548_200000210301 [0,0,0,1,0,0|3,0,0]=4 594 B10R1.10 CNCc1cccc(c1)C 2230a_106832991635_100000211840 [0,0,0,1,0,0|3,0,0]=4 595 B10R1.10 CNCc1cccc(c1)C 270004a_106832991635_100000211157 [0,0,0,1,0,0|3,0,0]=4 596 B10R1.10 CNCc1cccc(c1)C 34a_100000185548_200000210301 [0,0,0,1,0,0|3,0,0]=4 597 B10R1.10 CNCc1cccc(c1)C 34a_100102657272_100000211840 [0,0,0,1,0,0|3,0,0]=4 598 B10R1.10 CNCc1cccc(c1)C 7a_106832991635_100000211840 [0,0,0,1,0,0|3,0,0]=4 599 B10R1.10 CNCc1cccc(n1)C 207a_100102657272_100011215050 [0,0,0,1,0,0|3,0,0]=4 600 B10R1.10 CNCc1cccc(n1)C 2230a_106832991635_100000757606 [0,0,0,1,0,0|3,0,0]=4 601 B10R1.10 CNCc1cccc(n1)C 270004a_106832991635_100011215050 [0,0,0,1,0,0|3,0,0]=4 602 B10R1.10 CNCc1cccc(n1)C 34a_100000701342_200000210301 [0,0,0,1,0,0|3,0,0]=4 603 B10R1.10 CNCc1cccc(n1)C 34a_100102657272_100000757606 [0,0,0,1,0,0|3,0,0]=4 604 B10R1.10 CNCc1cccc(n1)C 7a_106832991635_100000757606 [0,0,0,1,0,0|3,0,0]=4 605 B10R1.10 COCc1cccc(c1)C 34a_100011217746_200000210301 [0,0,0,1,0,0|3,0,0]=4 606 B10R1.10 COCc1cccc(c1)C 34a_100138415774_100000211840 [0,0,0,1,0,0|3,0,0]=4 607 B10R1.10 COCc1cccc(c1)C 7a_100011217746_200000210301 [0,0,0,1,0,0|3,0,0]=4 608 B10R1.10 COCc1cccc(n1)C 34a_100000690600_200000210301 [0,0,0,1,0,0|3,0,0]=4 609 B10R1.10 COCc1cccc(n1)C 34a_100138415774_100000757606 [0,0,0,1,0,0|3,0,0]=4 610 B10R1.10 CSCc1cccc(c1)C 62a_100000211840_200000210301 [0,0,0,1,0,0|3,0,0]=4 611 B10R1.10 CSCc1cccc(c1)C 62a_200000210301_100000211840 [0,0,0,1,0,0|3,0,0]=4 612 B10R1.10 CSCc1cccc(n1)C 62a_100000757606_200000210301 [0,0,0,1,0,0|3,0,0]=4 613 B10R1.10 CSCc1cccc(n1)C 62a_200000210301_100000757606 [0,0,0,1,0,0|3,0,0]=4 614 B10R1.10 Cc1cc(ccn1)OCF 34a_100000688365_100015361967 [0,0,0,1,0,0|3,0,0]=4 615 B10R1.10 Cc1cccc(c1)CN[13CH3] 2230a_100000185548_200025704644 [0,0,0,1,0,0|3,0,0]=4 616 B10R1.10 Cc1cccc(c1)CN[13CH3] 34a_100000185548_200025704644 [0,0,0,1,0,0|3,0,0]=4 617 B10R1.10 Cc1cccc(c1)CO[13CH3] 34a_100011217746_200025704644 [0,0,0,1,0,0|3,0,0]=4 618 B10R1.10 Cc1cccc(c1)CO[13CH3] 7a_100011217746_200025704644 [0,0,0,1,0,0|3,0,0]=4 619 B10R1.10 Cc1cccc(c1)CS[13CH3] 62a_100000211840_200025704644 [0,0,0,1,0,0|3,0,0]=4 620 B10R1.10 Cc1cccc(c1)CS[13CH3] 62a_200025704644_100000211840 [0,0,0,1,0,0|3,0,0]=4 621 B10R1.10 Cc1cccc(c1)NCF 34a_100000188690_100015361967 [0,0,0,1,0,0|3,0,0]=4 622 B10R1.10 Cc1cccc(c1)OCF 34a_100000210337_100015361967 [0,0,0,1,0,0|2,0,0]=3 623 B10R1.10 Cc1cccc(c1)OCF 7a_100000210337_100015361967 [0,0,0,1,0,0|2,0,0]=3 624 B10R1.10 Cc1cccc(c1)SCF 62a_100011215228_100015361967 [0,0,0,1,0,0|2,1,0]=4 625 B10R1.10 Cc1cccc(c1)SCF 62a_100015361967_100011215228 [0,0,0,1,0,0|2,1,0]=4 626 B10R1.10 Cc1cccc(n1)CN[13CH3] 34a_100000701342_200025704644 [0,0,0,1,0,0|3,0,0]=4 627 B10R1.10 Cc1cccc(n1)CO[13CH3] 34a_100000690600_200025704644 [0,0,0,1,0,0|3,0,0]=4 628 B10R1.10 Cc1cccc(n1)CS[13CH3] 62a_100000757606_200025704644 [0,0,0,1,0,0|3,0,0]=4 629 B10R1.10 Cc1cccc(n1)CS[13CH3] 62a_200025704644_100000757606 [0,0,0,1,0,0|3,0,0]=4 630 B10R1.10 Cc1cccc(n1)SCF 62a_100000742759_100015361967 [0,0,0,1,0,0|2,1,0]=4 631 B10R1.10 Cc1cccc(n1)SCF 62a_100015361967_100000742759 [0,0,0,1,0,0|2,1,0]=4 632 B10R1.10 Cc1cncc(c1)OCF 34a_100011830280_100015361967 [0,0,0,1,0,0|3,0,0]=4 633 B10R1.10 Cc1cncc(c1)OCF 7a_100011830280_100015361967 [0,0,0,1,0,0|3,0,0]=4 634 B10R1.10 FCOc1cccc(c1)Br 34a_100000210342_100015361967 [0,0,0,1,0,0|3,0,0]=4 635 B10R1.10 FCOc1cccc(c1)Br 7a_100000210342_100015361967 [0,0,0,1,0,0|3,0,0]=4 636 B10R1.10 FCOc1cccc(c1)Cl 34a_100000210295_100015361967 [0,0,0,1,0,0|3,0,0]=4 637 B10R1.10 FCOc1cccc(c1)Cl 7a_100000210295_100015361967 [0,0,0,1,0,0|3,0,0]=4 638 B10R1.10 FCOc1cccc(c1)F 34a_100000210426_100015361967 [0,0,0,1,0,0|3,0,0]=4 639 B10R1.10 FCOc1cccc(c1)F 7a_100000210426_100015361967 [0,0,0,1,0,0|3,0,0]=4 640 B10R1.10 FCOc1cccc(c1)I 34a_100000211634_100015361967 [0,0,0,1,0,0|3,0,0]=4 641 B10R1.10 FCOc1cccc(c1)I 7a_100000211634_100015361967 [0,0,0,1,0,0|3,0,0]=4 642 B10R1.10 FCOc1cccc(n1)F 34a_100011432558_100015361967 [0,0,0,1,0,0|3,0,0]=4 643 B10R1.10 Nc1cccc(c1)OCF 34a_100000210217_100015361967 [0,0,0,1,0,0|3,0,0]=4 644 B10R1.10 O=c1cccc([nH]1)OCF 34a_100000033347_100015361967 [0,0,0,1,0,0|3,0,0]=4 645 B10R1.11 CCCC(=O)C1=CCCC1 1458a_100000038896_100000210303 [0,0,0,1,0,0|1,0,2]=4 646 B10R1.11 CCCC(=O)C1=CCOC1 1458a_100000139269_100000210303 [0,0,0,1,0,0|2,0,1]=4 647 B10R1.11 CCCC(=O)C1=COCC1 1458a_100000750620_100000210303 [0,0,0,1,0,0|2,0,1]=4 648 B10R1.11 CCCC(=O)C1CC=CC1 1458a_100000759439_100000210303 [0,0,0,1,0,0|1,0,2]=4 649 B10R1.11 CCCC(=O)N1CC=CC1 1626a_100015195280_100000211992 [0,0,0,1,0,0|2,0,1]=4 650 B10R1.11 CCCC(=O)N1CC=CC1 240690a_100015195280_100000211992 [0,0,0,1,0,0|2,0,1]=4 651 B10R1.11 CCNC(=O)C1=CCCC1 11a_100015525214_100000038896 [0,0,0,1,0,0|1,0,2]=4 652 B10R1.11 CCNC(=O)C1=CCCC1 240690a_100015525214_100000038896 [0,0,0,1,0,0|1,0,2]=4 653 B10R1.11 CCNC(=O)C1=CCOC1 11a_100015525214_100000139269 [0,0,0,1,0,0|2,0,1]=4 654 B10R1.11 CCNC(=O)C1=CCOC1 240690a_100015525214_100000139269 [0,0,0,1,0,0|2,0,1]=4 655 B10R1.11 CCNC(=O)C1=COCC1 240690a_100015525214_100000750620 [0,0,0,1,0,0|2,0,1]=4 656 B10R1.11 CCNC(=O)C1CC=CC1 11a_100015525214_100000759439 [0,0,0,1,0,0|1,0,2]=4 657 B10R1.11 CCNC(=O)C1CC=CC1 240690a_100015525214_100000759439 [0,0,0,1,0,0|1,0,2]=4 658 B10R1.11 CCNC(=O)C1CC=CC1 527a_100015525214_100000759439 [0,0,0,1,0,0|1,0,2]=4 659 B10R1.11 CCNC(=O)N1CC=CC1 2708a_100015525214_100015195280 [0,0,0,1,0,0|2,0,1]=4 660 B10R1.11 CCNC(=O)N1CC=CC1 273464a_100015525214_100015195280 [0,0,0,1,0,0|2,0,1]=4 661 B10R1.11 CCO[C@@H](C)c1ccco1 34a_100000755270_100000210202 [0,0,0,1,0,0|2,0,1]=4 662 B10R1.11 CCO[C@@H](C)c1ccco1 7a_100000755270_100000210202 [0,0,0,1,0,0|2,0,1]=4 663 B10R1.11 CCO[C@H](C)c1cccs1 7a_100000750433_100000210202 [0,0,0,1,0,0|2,0,1]=4 664 B10R1.11 CNCC(=O)c1ccc[nH]1 7a_106832991635_200011262396 [0,0,0,1,0,0|3,0,0]=4 665 B10R1.11 CNCC(=O)c1ccco1 7a_106832991635_100000211439 [0,0,0,1,0,0|3,0,0]=4 666 B10R1.11 CNCC(=O)c1cccs1 2230a_106832991635_100000211436 [0,0,0,1,0,0|3,0,0]=4 667 B10R1.11 CNCC(=O)c1cccs1 7a_106832991635_100000211436 [0,0,0,1,0,0|3,0,0]=4 668 B10R1.11 CSCC(=O)c1ccc[nH]1 62a_200000210301_200011262396 [0,0,0,1,0,0|3,0,0]=4 669 B10R1.11 CSCC(=O)c1ccc[nH]1 62a_200011262396_200000210301 [0,0,0,1,0,0|3,0,0]=4 670 B10R1.11 CSCC(=O)c1ccco1 62a_100000211439_200000210301 [0,0,0,1,0,0|3,0,0]=4 671 B10R1.11 CSCC(=O)c1ccco1 62a_200000210301_100000211439 [0,0,0,1,0,0|3,0,0]=4 672 B10R1.11 CSCC(=O)c1cccs1 62a_100000211436_200000210301 [0,0,0,1,0,0|3,0,0]=4 673 B10R1.11 CSCC(=O)c1cccs1 62a_200000210301_100000211436 [0,0,0,1,0,0|3,0,0]=4 674 B10R1.11 [13CH3]SCC(=O)c1ccc[nH]1 62a_200011262396_200025704644 [0,0,0,1,0,0|3,0,0]=4 675 B10R1.11 [13CH3]SCC(=O)c1ccc[nH]1 62a_200025704644_200011262396 [0,0,0,1,0,0|3,0,0]=4 676 B10R1.11 [13CH3]SCC(=O)c1ccco1 62a_100000211439_200025704644 [0,0,0,1,0,0|3,0,0]=4 677 B10R1.11 [13CH3]SCC(=O)c1ccco1 62a_200025704644_100000211439 [0,0,0,1,0,0|3,0,0]=4 678 B10R1.11 [13CH3]SCC(=O)c1cccs1 62a_100000211436_200025704644 [0,0,0,1,0,0|3,0,0]=4 679 B10R1.11 [13CH3]SCC(=O)c1cccs1 62a_200025704644_100000211436 [0,0,0,1,0,0|3,0,0]=4 680 B10R1.19 COc1cccccc1=O 34a_100000036025_200000210301 [0,0,0,1,0,0|2,0,1]=4 681 B10R1.19 COc1cccccc1=O 7a_100000036025_200000210301 [0,0,0,1,0,0|2,0,1]=4 682 B10R1.19 [13CH3]Oc1cccccc1=O 34a_100000036025_200025704644 [0,0,0,1,0,0|2,0,1]=4 683 B10R1.19 [13CH3]Oc1cccccc1=O 7a_100000036025_200025704644 [0,0,0,1,0,0|2,0,1]=4 684 B10R1.96 C=Cc1ccc(s1)CCC 271570a_100011290941_100010157708 [0,0,0,1,0,0|1,1,1]=4 685 B10R1.96 C=Cc1csc(n1)OCC 271570a_100011290941_100011934640 [0,0,0,1,0,0|2,0,1]=4 686 B10R1.96 CCCc1ccc(s1)SC 62a_100010157708_200000210301 [0,0,0,1,0,0|2,1,0]=4 687 B10R1.96 CCCc1ccc(s1)SC 62a_200000210301_100010157708 [0,0,0,1,0,0|2,1,0]=4 688 B10R1.96 CCCc1ccc(s1)S[13CH3] 62a_100010157708_200025704644 [0,0,0,1,0,0|2,1,0]=4 689 B10R1.96 CCCc1ccc(s1)S[13CH3] 62a_200025704644_100010157708 [0,0,0,1,0,0|2,1,0]=4 690 B10R1.96 CCOc1nc(cs1)SC 62a_100011934640_200000210301 [0,0,0,1,0,0|3,0,0]=4 691 B10R1.96 CCOc1nc(cs1)SC 62a_200000210301_100011934640 [0,0,0,1,0,0|3,0,0]=4 692 B10R1.96 CCOc1nc(cs1)S[13CH3] 62a_100011934640_200025704644 [0,0,0,1,0,0|3,0,0]=4 693 B10R1.96 CCOc1nc(cs1)S[13CH3] 62a_200025704644_100011934640 [0,0,0,1,0,0|3,0,0]=4 694 B10R1.96 CCSc1ccc([nH]1)C=O 62a_100000210202_100009875417 [0,0,0,1,0,0|2,1,0]=4 695 B10R1.96 CCSc1ccc(o1)C=O 62a_100000210202_100000186757 [0,0,0,1,0,0|1,1,1]=4 696 B10R1.96 CCSc1ccc(s1)C=O 62a_100000179771_100000210202 [0,0,0,1,0,0|1,2,0]=4 697 B10R1.96 CCSc1ccc(s1)C=O 62a_100000210202_100000179771 [0,0,0,1,0,0|1,2,0]=4 698 B10R1.96 CCSc1ccc(s1)CC 62a_100000210202_100009844052 [0,0,0,1,0,0|0,2,1]=4 699 B10R1.96 CCSc1ccc(s1)CC 62a_100009844052_100000210202 [0,0,0,1,0,0|0,2,1]=4 700 B10R1.130 CC=Cc1cc(nn1C)C 271570a_100016259895_100009818511 [0,0,0,1,0,0|3,0,0]=4 701 B10R1.130 CC=Cc1cc(nn1C)N 271570a_100016259895_100116209741 [0,0,0,1,0,0|3,0,0]=4 702 B10R1.130 CC=Cc1cc(sc1C)C 271570a_100016259895_100000688054 [0,0,0,1,0,0|1,1,1]=4 703 B10R1.137 CCCC(=O)C=C1CCC1 1458a_100000686340_100000210303 [0,0,0,1,0,0|1,0,2]=4 704 B10R1.137 CCNC(=O)C=C1CCC1 11a_100015525214_100000686340 [0,0,0,1,0,0|1,0,2]=4 705 B10R1.137 CCNC(=O)C=C1CCC1 240690a_100015525214_100000686340 [0,0,0,1,0,0|1,0,2]=4 706 B10R1.138 CCCC(=O)C=CC1CC1 1458a_100102529529_100000210303 [0,0,0,1,0,0|1,0,2]=4 707 B10R1.138 CCNC(=O)C=CC1CC1 11a_100015525214_100102529529 [0,0,0,1,0,0|1,0,2]=4 708 B10R1.138 CCNC(=O)C=CC1CC1 240690a_100015525214_100102529529 [0,0,0,1,0,0|1,0,2]=4 709 B10R1.186 CC/C=C\CC(=O)C1CC1 1458a_100000210395_100103147603 [0,0,0,1,0,0|1,0,2]=4 710 B10R1.245 CNc1c(cccc1Br)C 34a_100011834072_200000210301 [0,0,0,1,0,0|3,0,0]=4 711 B10R1.245 CNc1c(cccc1C)C 34a_100000185769_200000210301 [0,0,0,1,0,0|3,0,0]=4 712 B10R1.245 CNc1c(cccc1Cl)C 34a_100000756524_200000210301 [0,0,0,1,0,0|3,0,0]=4 713 B10R1.245 CNc1c(cccc1F)C 34a_100000766463_200000210301 [0,0,0,1,0,0|3,0,0]=4 714 B10R1.245 CNc1c(cccc1O)C 34a_100000743429_200000210301 [0,0,0,1,0,0|2,0,1]=4 715 B10R1.245 COc1c(cccc1Br)C 34a_100009817157_200000210301 [0,0,0,1,0,0|3,0,0]=4 716 B10R1.245 COc1c(cccc1Br)C 7a_100009817157_200000210301 [0,0,0,1,0,0|3,0,0]=4 717 B10R1.245 COc1c(cccc1C)C 34a_100000210341_200000210301 [0,0,0,1,0,0|3,0,0]=4 718 B10R1.245 COc1c(cccc1C)C 7a_100000210341_200000210301 [0,0,0,1,0,0|3,0,0]=4 719 B10R1.245 COc1c(cccc1Cl)C 34a_100000033731_200000210301 [0,0,0,1,0,0|3,0,0]=4 720 B10R1.245 COc1c(cccc1Cl)C 7a_100000033731_200000210301 [0,0,0,1,0,0|3,0,0]=4 721 B10R1.245 COc1c(cccc1F)C 34a_100011659162_200000210301 [0,0,0,1,0,0|3,0,0]=4 722 B10R1.245 COc1c(cccc1F)C 7a_100011659162_200000210301 [0,0,0,1,0,0|3,0,0]=4 723 B10R1.245 COc1c(cccc1N)C 34a_100000756359_200000210301 [0,0,0,1,0,0|3,0,0]=4 724 B10R1.245 COc1c(cccc1N)C 7a_100000756359_200000210301 [0,0,0,1,0,0|3,0,0]=4 725 B10R1.245 COc1c(cccc1O)C 271570a_203496583355_100010141385 [0,0,0,1,0,0|2,0,1]=4 726 B10R1.245 COc1c(occc1=O)C 34a_100000031901_200000210301 [0,0,0,1,0,0|3,0,0]=4 727 B10R1.245 CSc1c(cccc1Br)C 62a_100010141302_200000210301 [0,0,0,1,0,0|3,0,0]=4 728 B10R1.245 CSc1c(cccc1Br)C 62a_200000210301_100010141302 [0,0,0,1,0,0|3,0,0]=4 729 B10R1.245 CSc1c(cccc1C)C 62a_100000033847_200000210301 [0,0,0,1,0,0|3,0,0]=4 730 B10R1.245 CSc1c(cccc1C)C 62a_200000210301_100000033847 [0,0,0,1,0,0|3,0,0]=4 731 B10R1.245 CSc1c(cccc1Cl)C 62a_100000043165_200000210301 [0,0,0,1,0,0|3,0,0]=4 732 B10R1.245 CSc1c(cccc1Cl)C 62a_200000210301_100000043165 [0,0,0,1,0,0|3,0,0]=4 733 B10R1.245 CSc1c(cccc1F)C 62a_100011218421_200000210301 [0,0,0,1,0,0|3,0,0]=4 734 B10R1.245 CSc1c(cccc1F)C 62a_200000210301_100011218421 [0,0,0,1,0,0|3,0,0]=4 735 B10R1.245 CSc1c(cccc1N)C 62a_100000684715_200000210301 [0,0,0,1,0,0|3,0,0]=4 736 B10R1.245 CSc1c(cccc1N)C 62a_200000210301_100000684715 [0,0,0,1,0,0|3,0,0]=4 737 B10R1.245 CSc1c(cccc1O)C 62a_100000686692_200000210301 [0,0,0,1,0,0|2,0,1]=4 738 B10R1.245 CSc1c(cccc1O)C 62a_200000210301_100000686692 [0,0,0,1,0,0|2,0,1]=4 739 B10R1.245 Cc1cccc(c1N[13CH3])Br 34a_100011834072_200025704644 [0,0,0,1,0,0|3,0,0]=4 740 B10R1.245 Cc1cccc(c1N[13CH3])C 34a_100000185769_200025704644 [0,0,0,1,0,0|3,0,0]=4 741 B10R1.245 Cc1cccc(c1N[13CH3])Cl 34a_100000756524_200025704644 [0,0,0,1,0,0|3,0,0]=4 742 B10R1.245 Cc1cccc(c1N[13CH3])F 34a_100000766463_200025704644 [0,0,0,1,0,0|3,0,0]=4 743 B10R1.245 Cc1cccc(c1N[13CH3])O 34a_100000743429_200025704644 [0,0,0,1,0,0|2,0,1]=4 744 B10R1.245 Cc1cccc(c1O[13CH3])Br 34a_100009817157_200025704644 [0,0,0,1,0,0|3,0,0]=4 745 B10R1.245 Cc1cccc(c1O[13CH3])Br 7a_100009817157_200025704644 [0,0,0,1,0,0|3,0,0]=4 746 B10R1.245 Cc1cccc(c1O[13CH3])C 34a_100000210341_200025704644 [0,0,0,1,0,0|3,0,0]=4 747 B10R1.245 Cc1cccc(c1O[13CH3])C 7a_100000210341_200025704644 [0,0,0,1,0,0|3,0,0]=4 748 B10R1.245 Cc1cccc(c1O[13CH3])Cl 34a_100000033731_200025704644 [0,0,0,1,0,0|3,0,0]=4 749 B10R1.245 Cc1cccc(c1O[13CH3])Cl 7a_100000033731_200025704644 [0,0,0,1,0,0|3,0,0]=4 750 B10R1.245 Cc1cccc(c1O[13CH3])F 34a_100011659162_200025704644 [0,0,0,1,0,0|3,0,0]=4 751 B10R1.245 Cc1cccc(c1O[13CH3])F 7a_100011659162_200025704644 [0,0,0,1,0,0|3,0,0]=4 752 B10R1.245 Cc1cccc(c1O[13CH3])N 34a_100000756359_200025704644 [0,0,0,1,0,0|3,0,0]=4 753 B10R1.245 Cc1cccc(c1O[13CH3])N 7a_100000756359_200025704644 [0,0,0,1,0,0|3,0,0]=4 754 B10R1.245 Cc1cccc(c1S[13CH3])Br 62a_100010141302_200025704644 [0,0,0,1,0,0|3,0,0]=4 755 B10R1.245 Cc1cccc(c1S[13CH3])Br 62a_200025704644_100010141302 [0,0,0,1,0,0|3,0,0]=4 756 B10R1.245 Cc1cccc(c1S[13CH3])C 62a_100000033847_200025704644 [0,0,0,1,0,0|3,0,0]=4 757 B10R1.245 Cc1cccc(c1S[13CH3])C 62a_200025704644_100000033847 [0,0,0,1,0,0|3,0,0]=4 758 B10R1.245 Cc1cccc(c1S[13CH3])Cl 62a_100000043165_200025704644 [0,0,0,1,0,0|3,0,0]=4 759 B10R1.245 Cc1cccc(c1S[13CH3])Cl 62a_200025704644_100000043165 [0,0,0,1,0,0|3,0,0]=4 760 B10R1.245 Cc1cccc(c1S[13CH3])F 62a_100011218421_200025704644 [0,0,0,1,0,0|3,0,0]=4 761 B10R1.245 Cc1cccc(c1S[13CH3])F 62a_200025704644_100011218421 [0,0,0,1,0,0|3,0,0]=4 762 B10R1.245 Cc1cccc(c1S[13CH3])N 62a_100000684715_200025704644 [0,0,0,1,0,0|3,0,0]=4 763 B10R1.245 Cc1cccc(c1S[13CH3])N 62a_200025704644_100000684715 [0,0,0,1,0,0|3,0,0]=4 764 B10R1.245 Cc1cccc(c1S[13CH3])O 62a_100000686692_200025704644 [0,0,0,1,0,0|2,0,1]=4 765 B10R1.245 Cc1cccc(c1S[13CH3])O 62a_200025704644_100000686692 [0,0,0,1,0,0|2,0,1]=4 766 B10R1.245 Cc1occc(=O)c1O[13CH3] 34a_100000031901_200025704644 [0,0,0,1,0,0|3,0,0]=4 767 B7R0.1 C/C=C/C=C/COC 34a_100016283227_200000210301 [2,0,0,0,0,0|0,0,1]=3 768 B7R0.1 C/C=C/C=C/CO[13CH3] 34a_100016283227_200025704644 [2,0,0,0,0,0|0,0,1]=3 769 B7R0.1 C/C=C/CCOCC 34a_100016278192_100000210202 [2,0,0,0,0,0|0,0,2]=4 770 B7R0.1 CC/C=C\COCC 34a_100016268518_100000210202 [2,0,0,0,0,0|0,0,2]=4 771 B7R0.1 CC/C=C\COCC 34a_100121572206_100103147603 [2,0,0,0,0,0|0,0,2]=4 772 B7R0.3 C/C=C/CC(=O)CC 1458a_100000210414_100102629194 [2,0,0,0,0,0|0,0,1]=3 773 B7R0.3 C/C=C/CC(=O)CO 1458a_100000210174_100102629194 [2,0,0,0,0,0|1,0,1]=4 774 B7R0.3 C=CC=CC(=O)CC 1458a_100016291481_100000210202 [2,0,0,0,0,0|0,0,0]=2 775 B7R0.3 C=CC=CC(=O)CF 1458a_100016291481_100015361967 [2,0,0,0,0,0|1,0,0]=3 776 B7R0.3 C=CC=CC(=O)NC 1626a_100102657272_100016291481 [2,0,0,0,0,0|1,0,0]=3 777 B7R0.3 C=CCCC(=O)CC 1458a_100000210414_100000754431 [2,0,0,0,0,0|0,0,2]=4 778 B7R0.3 C=CCCC(=O)CC 1458a_100000749702_100000210202 [2,0,0,0,0,0|0,0,2]=4 779 B7R0.3 C=CCNC(=O)CC 1626a_100020586998_100000210414 [2,0,0,0,0,0|1,0,1]=4 780 B7R0.3 C=CCNC(=O)CC 240690a_100020586998_100000210414 [2,0,0,0,0,0|1,0,1]=4 781 B7R0.3 C=CCNC(=O)CC 527a_100020586998_100000210414 [2,0,0,0,0,0|1,0,1]=4 782 B7R0.3 CC=CCC(=O)CC 1458a_100000210414_100000070051 [2,0,0,0,0,0|0,0,1]=3 783 B7R0.3 CC=CCC(=O)CC 1458a_100121576822_100000210202 [2,0,0,0,0,0|0,0,1]=3 784 B7R0.3 CC=CCC(=O)CF 1458a_100121576822_100015361967 [2,0,0,0,0,0|1,0,1]=4 785 B7R0.3 CC=CCC(=O)CO 1458a_100000210174_100000070051 [2,0,0,0,0,0|1,0,1]=4 786 B7R0.3 CC=CCC(=O)NC 11a_106832991635_100121576822 [2,0,0,0,0,0|1,0,1]=4 787 B7R0.3 CC=CCC(=O)NC 1626a_100102657272_100121576822 [2,0,0,0,0,0|1,0,1]=4 788 B7R0.3 CC=CCC(=O)NC 240690a_100102657272_100121576822 [2,0,0,0,0,0|1,0,1]=4 789 B7R0.3 CC=CCC(=O)NC 527a_100102657272_100121576822 [2,0,0,0,0,0|1,0,1]=4 790 B7R0.3 CC=NNC(=O)CC 4a_100000183195_200000210099 [2,0,0,0,0,0|2,0,0]=4 791 B7R0.3 CCC(=O)C=COC 1458a_100016268678_100000210202 [2,0,0,0,0,0|1,0,0]=3 792 B7R0.3 CCC=CC(=O)CC 1458a_100000212282_100000210202 [2,0,0,0,0,0|0,0,1]=3 793 B7R0.3 CCC=CC(=O)CF 1458a_100000212282_100015361967 [2,0,0,0,0,0|1,0,1]=4 794 B7R0.3 CCC=CC(=O)NC 11a_106832991635_100000212282 [2,0,0,0,0,0|1,0,1]=4 795 B7R0.3 CCC=CC(=O)NC 1626a_100102657272_100000212282 [2,0,0,0,0,0|1,0,1]=4 796 B7R0.3 CCC=CC(=O)NC 240690a_100102657272_100000212282 [2,0,0,0,0,0|1,0,1]=4 797 B7R0.3 CNC(=O)C=COC 1626a_100102657272_100016268678 [2,0,0,0,0,0|2,0,0]=4 798 B7R0.3 CNC(=O)C=COC 240690a_100102657272_100016268678 [2,0,0,0,0,0|2,0,0]=4 799 B7R0.3 COC=CC(=O)CF 1458a_100016268678_100015361967 [2,0,0,0,0,0|2,0,0]=4 800 B7R0.7 C/C=C/C(C)OCC 34a_200102604097_100000210202 [2,0,0,0,0,0|1,0,1]=4 801 B7R0.7 C=CCC(=O)CCC 1458a_100000210193_100000210303 [2,0,0,0,0,0|1,0,1]=4 802 B7R0.7 C=CCC(=O)CCC 1458a_100000211992_100000210623 [2,0,0,0,0,0|1,0,1]=4 803 B7R0.7 C=CCC(=O)NCC 11a_100015525214_100000210193 [2,0,0,0,0,0|1,0,1]=4 804 B7R0.7 C=CCC(=O)NCC 240690a_100015525214_100000210193 [2,0,0,0,0,0|1,0,1]=4 805 B7R0.7 C=CCC(=O)NCC 527a_100015525214_100000210193 [2,0,0,0,0,0|1,0,1]=4 806 B7R0.7 CC=CC(=O)CCC 1458a_100000210699_100000210303 [2,0,0,0,0,0|1,0,0]=3 807 B7R0.7 CC=CC(=O)CCF 1458a_100000210699_100011217306 [2,0,0,0,0,0|2,0,0]=4 808 B7R0.7 CC=CC(=O)CCO 1458a_100000210699_100000211926 [2,0,0,0,0,0|2,0,0]=4 809 B7R0.7 CC=CC(=O)NCC 11a_100015525214_100000210699 [2,0,0,0,0,0|1,0,0]=3 810 B7R0.7 CC=CC(=O)NCC 240690a_100015525214_100000210699 [2,0,0,0,0,0|1,0,0]=3 811 B7R0.7 CC=CC(=O)NNC 22a_100016993582_100000210699 [2,0,0,0,0,0|2,0,0]=4 812 B7R0.7 CCCC(=O)C=CBr 1458a_100016273825_100000210303 [2,0,0,0,0,0|2,0,0]=4 813 B7R0.7 CCCC(=O)C=CCl 1458a_200016279998_100000210303 [2,0,0,0,0,0|2,0,0]=4 814 B7R0.7 CCCC(=O)C=CI 1458a_100016256311_100000210303 [2,0,0,0,0,0|2,0,0]=4 815 B7R0.7 CCNC(=O)C=CBr 240690a_100015525214_100016273825 [2,0,0,0,0,0|2,0,0]=4 816 B7R0.7 CCNC(=O)C=CCl 11a_100015525214_200016279998 [2,0,0,0,0,0|2,0,0]=4 817 B7R0.7 CCNC(=O)C=CCl 240690a_100015525214_200016279998 [2,0,0,0,0,0|2,0,0]=4 818 B7R0.7 CCOC(=O)CNC 2230a_106832991635_100000188475 [2,0,0,0,0,0|1,0,1]=4 819 B7R0.7 CCOC(=O)CNC 34a_100102657272_100000188475 [2,0,0,0,0,0|1,0,1]=4 820 B7R0.7 CCOC(=O)CNC 7a_106832991635_100000188475 [2,0,0,0,0,0|1,0,1]=4 821 B7R0.7 CCOC(=O)COC 34a_100138415774_100000188475 [2,0,0,0,0,0|1,0,1]=4 822 B7R0.7 CCOC(=O)CSC 62a_100000188475_200000210301 [2,0,0,0,0,0|1,0,1]=4 823 B7R0.7 CCOC(=O)CSC 62a_200000210301_100000188475 [2,0,0,0,0,0|1,0,1]=4 824 B7R0.7 CCOC(=O)CS[13CH3] 62a_100000188475_200025704644 [2,0,0,0,0,0|1,0,1]=4 825 B7R0.7 CCOC(=O)CS[13CH3] 62a_200025704644_100000188475 [2,0,0,0,0,0|1,0,1]=4 826 B7R0.4 C/C=C/C=CC(=O)C 1458a_100000185730_200000210301 [2,0,0,0,0,0|0,0,0]=2 827 B7R0.4 C/C=C/C=CC(=O)[13CH3] 1458a_100000185730_200025704644 [2,0,0,0,0,0|0,0,0]=2 828 B7R0.4 CC/C=C/CC(=O)C 1458a_100016274230_200000210301 [2,0,0,0,0,0|0,0,2]=4 829 B7R0.4 CC/C=C/CC(=O)[13CH3] 1458a_100016274230_200025704644 [2,0,0,0,0,0|0,0,2]=4 830 B7R0.4 CC/C=C\CC(=O)C 1458a_100000070787_100103147603 [2,0,0,0,0,0|0,0,2]=4 831 B7R0.4 CCCC=CC(=O)C 1458a_100000212230_200000210301 [2,0,0,0,0,0|0,0,2]=4 832 B7R0.4 CCCC=CC(=O)[13CH3] 1458a_100000212230_200025704644 [2,0,0,0,0,0|0,0,2]=4 833 B7R0.4 CCOC=CC(=O)C 1458a_100016266692_200000210301 [2,0,0,0,0,0|1,0,1]=4 834 B7R0.4 CCOC=CC(=O)[13CH3] 1458a_100016266692_200025704644 [2,0,0,0,0,0|1,0,1]=4 835 B7R0.4 COCC=CC(=O)C 1458a_100016285016_200000210301 [2,0,0,0,0,0|1,0,1]=4 836 B7R0.4 COCC=CC(=O)[13CH3] 1458a_100016285016_200025704644 [2,0,0,0,0,0|1,0,1]=4 837 B9R0.4 C/C=C/CC(=O)CC(C)C 1458a_100000210554_100102629194 [1,1,0,0,0,0|1,0,1]=4 838 B9R0.4 C/C=C/CC(=O)C[C@@H](C)O 1458a_100011933948_100102629194 [1,1,0,0,0,0|1,0,1]=4 839 B9R0.4 C=CC=CC(=O)CC(=C)C 1458a_100016291481_100000748629 [1,1,0,0,0,0|1,0,1]=4 840 B9R0.4 C=CC=CC(=O)CC(C)C 1458a_100016291481_100000210624 [1,1,0,0,0,0|1,0,0]=3 841 B9R0.4 C=CC=CC(=O)CC(C)O 1458a_100016291481_100011218427 [1,1,0,0,0,0|1,0,0]=3 842 B9R0.4 C=CC=CC(=O)CC(F)F 1458a_100016291481_100011934356 [1,1,0,0,0,0|2,0,0]=4 843 B9R0.4 C=CC=CC(=O)NC(C)C 1626a_100138425928_100016291481 [1,1,0,0,0,0|1,0,0]=3 844 B9R0.4 CC=CCC(=O)CC(C)C 1458a_100000210554_100000070051 [1,1,0,0,0,0|1,0,1]=4 845 B9R0.4 CC=CCC(=O)CC(C)C 1458a_100121576822_100000210624 [1,1,0,0,0,0|1,0,1]=4 846 B9R0.4 CC=CCC(=O)CC(C)O 1458a_100121576822_100011218427 [1,1,0,0,0,0|1,0,1]=4 847 B9R0.4 CC=CCC(=O)C[C@@H](C)O 1458a_100011933948_100000070051 [1,1,0,0,0,0|1,0,1]=4 848 B9R0.4 CC=CCC(=O)NC(C)C 11a_100138425928_100121576822 [1,1,0,0,0,0|1,0,1]=4 849 B9R0.4 CC=CCC(=O)NC(C)C 1626a_100138425928_100121576822 [1,1,0,0,0,0|1,0,1]=4 850 B9R0.4 CC=CCC(=O)NC(C)C 240690a_100138425928_100121576822 [1,1,0,0,0,0|1,0,1]=4 851 B9R0.4 CC=CCC(=O)NC(C)C 527a_100138425928_100121576822 [1,1,0,0,0,0|1,0,1]=4 852 B9R0.4 CCC=CC(=O)CC(C)C 1458a_100000212282_100000210624 [1,1,0,0,0,0|1,0,1]=4 853 B9R0.4 CCC=CC(=O)CC(C)O 1458a_100000212282_100011218427 [1,1,0,0,0,0|1,0,1]=4 854 B9R0.4 CCC=CC(=O)NC(C)C 11a_100138425928_100000212282 [1,1,0,0,0,0|1,0,1]=4 855 B9R0.4 CCC=CC(=O)NC(C)C 1626a_100138425928_100000212282 [1,1,0,0,0,0|1,0,1]=4 856 B9R0.4 CCC=CC(=O)NC(C)C 240690a_100138425928_100000212282 [1,1,0,0,0,0|1,0,1]=4 857 B9R0.4 COC=CC(=O)CC(C)C 1458a_100016268678_100000210624 [1,1,0,0,0,0|2,0,0]=4 858 B9R0.4 COC=CC(=O)CC(C)O 1458a_100016268678_100011218427 [1,1,0,0,0,0|2,0,0]=4 859 B9R0.4 COC=CC(=O)NC(C)C 1626a_100138425928_100016268678 [1,1,0,0,0,0|2,0,0]=4 860 B9R0.4 COC=CC(=O)NC(C)C 240690a_100138425928_100016268678 [1,1,0,0,0,0|2,0,0]=4 861 B9R0.8 C/C=C/CC(=O)C(C)CC 1458a_100011192722_100102629194 [1,1,0,0,0,0|1,0,1]=4 862 B9R0.8 C/C=C/CC(=O)C(O)CC 1458a_100011196387_100102629194 [1,1,0,0,0,0|1,0,1]=4 863 B9R0.8 C=CC=CC(=O)C(C)CC 1458a_100016291481_100000758301 [1,1,0,0,0,0|1,0,0]=3 864 B9R0.8 C=CC=CC(=O)N(C)CC 1626a_100000225621_100016291481 [1,1,0,0,0,0|1,0,0]=3 865 B9R0.8 CC=CCC(=O)C(C)CC 1458a_100011192722_100000070051 [1,1,0,0,0,0|1,0,1]=4 866 B9R0.8 CC=CCC(=O)C(C)CC 1458a_100121576822_100000758301 [1,1,0,0,0,0|1,0,1]=4 867 B9R0.8 CC=CCC(=O)C(O)CC 1458a_100011196387_100000070051 [1,1,0,0,0,0|1,0,1]=4 868 B9R0.8 CC=CCC(=O)N(C)CC 11a_100000225621_100121576822 [1,1,0,0,0,0|1,0,1]=4 869 B9R0.8 CC=CCC(=O)N(C)CC 1626a_100000225621_100121576822 [1,1,0,0,0,0|1,0,1]=4 870 B9R0.8 CC=CCC(=O)N(C)CC 240690a_100000225621_100121576822 [1,1,0,0,0,0|1,0,1]=4 871 B9R0.8 CC=CCC(=O)N(C)CC 527a_100000225621_100121576822 [1,1,0,0,0,0|1,0,1]=4 872 B9R0.8 CCC(C)C(=O)C=COC 1458a_100016268678_100000758301 [1,1,0,0,0,0|2,0,0]=4 873 B9R0.8 CCC=CC(=O)C(C)CC 1458a_100000212282_100000758301 [1,1,0,0,0,0|1,0,1]=4 874 B9R0.8 CCC=CC(=O)N(C)CC 11a_100000225621_100000212282 [1,1,0,0,0,0|1,0,1]=4 875 B9R0.8 CCC=CC(=O)N(C)CC 1626a_100000225621_100000212282 [1,1,0,0,0,0|1,0,1]=4 876 B9R0.8 CCC=CC(=O)N(C)CC 240690a_100000225621_100000212282 [1,1,0,0,0,0|1,0,1]=4 877 B9R0.8 CCN(C)C(=O)C=COC 1626a_100000225621_100016268678 [1,1,0,0,0,0|2,0,0]=4 878 B9R0.8 CCN(C)C(=O)C=COC 240690a_100000225621_100016268678 [1,1,0,0,0,0|2,0,0]=4 879 B9R0.18 C#CCCC(=O)C=CC=C 1458a_100016291481_100000753159 [1,1,0,0,0,0|1,0,1]=4 880 B9R0.18 C#CCNC(=O)C=CC=C 1626a_100000212058_100016291481 [1,1,0,0,0,0|1,0,1]=4 881 B9R0.18 C/C=C/CC(=O)C#CCC 1458a_100011827653_100102629194 [1,1,0,0,0,0|1,0,1]=4 882 B9R0.18 C/C=C/CC(=O)C=CCC 1458a_100000212282_100102629194 [1,1,0,0,0,0|1,0,1]=4 883 B9R0.18 C/C=C/CC(=O)CCCC 1458a_100000210183_100102629194 [1,1,0,0,0,0|1,0,1]=4 884 B9R0.18 C/C=C/CC(=O)CCOC 1458a_100000749529_100102629194 [1,1,0,0,0,0|1,0,1]=4 885 B9R0.18 C/C=C/CC(=O)CCSC 1458a_100000174002_100102629194 [1,1,0,0,0,0|1,0,1]=4 886 B9R0.18 C/C=C/CC(=O)COCC 1458a_100000211967_100102629194 [1,1,0,0,0,0|0,0,1]=3 887 B9R0.18 C/C=C/CC(=O)CSCC 1458a_100000230394_100102629194 [1,1,0,0,0,0|0,1,1]=4 888 B9R0.18 C=CC=CC(=O)C/C=C/C 1458a_100016291481_100102629194 [1,1,0,0,0,0|1,0,1]=4 889 B9R0.18 C=CC=CC(=O)CC#CC 1458a_100016291481_100000748600 [1,1,0,0,0,0|1,0,1]=4 890 B9R0.18 C=CC=CC(=O)CC=CC 1458a_100016291481_100000070051 [1,1,0,0,0,0|1,0,1]=4 891 B9R0.18 C=CC=CC(=O)CCC#N 1458a_100016291481_100011215226 [1,1,0,0,0,0|1,0,1]=4 892 B9R0.18 C=CC=CC(=O)CCC=C 1458a_100016291481_100000754431 [1,1,0,0,0,0|1,0,1]=4 893 B9R0.18 C=CC=CC(=O)CCCC 1458a_100016291481_100000210211 [1,1,0,0,0,0|1,0,0]=3 894 B9R0.18 C=CC=CC(=O)CCCF 1458a_100016291481_100011934791 [1,1,0,0,0,0|1,0,0]=3 895 B9R0.18 C=CC=CC(=O)CCCO 1458a_100016291481_100011215043 [1,1,0,0,0,0|1,0,0]=3 896 B9R0.18 C=CC=CC(=O)CCOC 1458a_100016291481_100000233755 [1,1,0,0,0,0|1,0,0]=3 897 B9R0.18 C=CC=CC(=O)CCSC 1458a_100016291481_100000751147 [1,1,0,0,0,0|1,0,0]=3 898 B9R0.18 C=CC=CC(=O)NCC#N 1626a_100000734998_100016291481 [1,1,0,0,0,0|1,0,1]=4 899 B9R0.18 C=CC=CC(=O)NCC=C 1626a_100020586998_100016291481 [1,1,0,0,0,0|1,0,1]=4 900 B9R0.18 C=CC=CC(=O)NCCC 1626a_100020643023_100016291481 [1,1,0,0,0,0|1,0,0]=3 901 B9R0.18 C=CC=CC(=O)NCCF 1626a_100000724931_100016291481 [1,1,0,0,0,0|1,0,0]=3 902 B9R0.18 C=CC=CC(=O)NNCC 22a_100000756455_100016291481 [1,1,0,0,0,0|1,0,0]=3 903 B9R0.18 C=CCCC(=O)COCC 1458a_100000211967_100000754431 [1,1,0,0,0,0|0,0,2]=4 904 B9R0.18 C=CCNC(=O)COCC 1626a_100020586998_100000211967 [1,1,0,0,0,0|1,0,1]=4 905 B9R0.18 C=CCNC(=O)COCC 240690a_100020586998_100000211967 [1,1,0,0,0,0|1,0,1]=4 906 B9R0.18 C=CCNC(=O)COCC 527a_100020586998_100000211967 [1,1,0,0,0,0|1,0,1]=4 907 B9R0.18 C=CCOC(=O)COCC 34a_100121572206_100000033060 [1,1,0,0,0,0|1,0,1]=4 908 B9R0.18 CC=CCC(=O)C#CCC 1458a_100011827653_100000070051 [1,1,0,0,0,0|1,0,1]=4 909 B9R0.18 CC=CCC(=O)C=CCC 1458a_100000212282_100000070051 [1,1,0,0,0,0|1,0,1]=4 910 B9R0.18 CC=CCC(=O)CCCC 1458a_100000210183_100000070051 [1,1,0,0,0,0|1,0,1]=4 911 B9R0.18 CC=CCC(=O)CCCC 1458a_100121576822_100000210211 [1,1,0,0,0,0|1,0,1]=4 912 B9R0.18 CC=CCC(=O)CCCF 1458a_100121576822_100011934791 [1,1,0,0,0,0|1,0,1]=4 913 B9R0.18 CC=CCC(=O)CCCO 1458a_100121576822_100011215043 [1,1,0,0,0,0|1,0,1]=4 914 B9R0.18 CC=CCC(=O)CCOC 1458a_100000749529_100000070051 [1,1,0,0,0,0|1,0,1]=4 915 B9R0.18 CC=CCC(=O)CCOC 1458a_100121576822_100000233755 [1,1,0,0,0,0|1,0,1]=4 916 B9R0.18 CC=CCC(=O)CCSC 1458a_100000174002_100000070051 [1,1,0,0,0,0|1,0,1]=4 917 B9R0.18 CC=CCC(=O)CCSC 1458a_100121576822_100000751147 [1,1,0,0,0,0|1,0,1]=4 918 B9R0.18 CC=CCC(=O)COCC 1458a_100000211967_100000070051 [1,1,0,0,0,0|0,0,1]=3 919 B9R0.18 CC=CCC(=O)CSCC 1458a_100000230394_100000070051 [1,1,0,0,0,0|0,1,1]=4 920 B9R0.18 CC=CCC(=O)NCCC 11a_100020643023_100121576822 [1,1,0,0,0,0|1,0,1]=4 921 B9R0.18 CC=CCC(=O)NCCC 1626a_100020643023_100121576822 [1,1,0,0,0,0|1,0,1]=4 922 B9R0.18 CC=CCC(=O)NCCC 240690a_100020643023_100121576822 [1,1,0,0,0,0|1,0,1]=4 923 B9R0.18 CC=CCC(=O)NCCC 527a_100020643023_100121576822 [1,1,0,0,0,0|1,0,1]=4 924 B9R0.18 CC=CCC(=O)NCCF 11a_100000724931_100121576822 [1,1,0,0,0,0|1,0,1]=4 925 B9R0.18 CC=CCC(=O)NCCF 1626a_100000724931_100121576822 [1,1,0,0,0,0|1,0,1]=4 926 B9R0.18 CC=CCC(=O)NCCF 240690a_100000724931_100121576822 [1,1,0,0,0,0|1,0,1]=4 927 B9R0.18 CC=CCC(=O)NCCF 527a_100000724931_100121576822 [1,1,0,0,0,0|1,0,1]=4 928 B9R0.18 CC=CCC(=O)NCCO 240690a_100000210304_100121576822 [1,1,0,0,0,0|1,0,1]=4 929 B9R0.18 CC=CCC(=O)NCCO 527a_100000210304_100121576822 [1,1,0,0,0,0|1,0,1]=4 930 B9R0.18 CC=CCC(=O)NNCC 22a_100000756455_100121576822 [1,1,0,0,0,0|1,0,1]=4 931 B9R0.18 CC=NNC(=O)COCC 4a_100000216846_200000210099 [1,1,0,0,0,0|2,0,0]=4 932 B9R0.18 CCC=CC(=O)CCCC 1458a_100000212282_100000210211 [1,1,0,0,0,0|1,0,1]=4 933 B9R0.18 CCC=CC(=O)CCCF 1458a_100000212282_100011934791 [1,1,0,0,0,0|1,0,1]=4 934 B9R0.18 CCC=CC(=O)CCCO 1458a_100000212282_100011215043 [1,1,0,0,0,0|1,0,1]=4 935 B9R0.18 CCC=CC(=O)CCOC 1458a_100000212282_100000233755 [1,1,0,0,0,0|1,0,1]=4 936 B9R0.18 CCC=CC(=O)CCSC 1458a_100000212282_100000751147 [1,1,0,0,0,0|1,0,1]=4 937 B9R0.18 CCC=CC(=O)NCCC 11a_100020643023_100000212282 [1,1,0,0,0,0|1,0,1]=4 938 B9R0.18 CCC=CC(=O)NCCC 1626a_100020643023_100000212282 [1,1,0,0,0,0|1,0,1]=4 939 B9R0.18 CCC=CC(=O)NCCC 240690a_100020643023_100000212282 [1,1,0,0,0,0|1,0,1]=4 940 B9R0.18 CCC=CC(=O)NCCF 11a_100000724931_100000212282 [1,1,0,0,0,0|1,0,1]=4 941 B9R0.18 CCC=CC(=O)NCCF 1626a_100000724931_100000212282 [1,1,0,0,0,0|1,0,1]=4 942 B9R0.18 CCC=CC(=O)NCCF 240690a_100000724931_100000212282 [1,1,0,0,0,0|1,0,1]=4 943 B9R0.18 CCC=CC(=O)NCCO 240690a_100000210304_100000212282 [1,1,0,0,0,0|1,0,1]=4 944 B9R0.18 CCC=CC(=O)NNCC 22a_100000756455_100000212282 [1,1,0,0,0,0|1,0,1]=4 945 B9R0.18 CCCCC(=O)C=COC 1458a_100016268678_100000210211 [1,1,0,0,0,0|2,0,0]=4 946 B9R0.18 CCCNC(=O)C=COC 1626a_100020643023_100016268678 [1,1,0,0,0,0|2,0,0]=4 947 B9R0.18 CCCNC(=O)C=COC 240690a_100020643023_100016268678 [1,1,0,0,0,0|2,0,0]=4 948 B9R0.18 CCNNC(=O)C=COC 22a_100000756455_100016268678 [1,1,0,0,0,0|2,0,0]=4 949 B9R0.18 COC=CC(=O)CCCF 1458a_100016268678_100011934791 [1,1,0,0,0,0|2,0,0]=4 950 B9R0.18 COC=CC(=O)CCCO 1458a_100016268678_100011215043 [1,1,0,0,0,0|2,0,0]=4 951 B9R0.18 COC=CC(=O)CCOC 1458a_100016268678_100000233755 [1,1,0,0,0,0|2,0,0]=4 952 B9R0.18 COC=CC(=O)CCSC 1458a_100016268678_100000751147 [1,1,0,0,0,0|2,0,0]=4 953 B9R0.18 COC=CC(=O)NCCF 1626a_100000724931_100016268678 [1,1,0,0,0,0|2,0,0]=4 954 B9R0.18 COC=CC(=O)NCCF 240690a_100000724931_100016268678 [1,1,0,0,0,0|2,0,0]=4 955 B9R0.18 COC=CC(=O)NCCO 240690a_100000210304_100016268678 [1,1,0,0,0,0|2,0,0]=4 956 B9R0.34 C=CC(=O)CC(=O)CCC 1458a_100000185746_100000747444 [1,1,0,0,0,0|1,0,1]=4 957 B9R0.34 C=CC(=O)CC(=O)NCC 1458a_100000185746_100000183381 [1,1,0,0,0,0|1,0,1]=4 958 B9R0.34 C=CC(=O)CC(=O)OCC 1458a_100000185746_100000188475 [1,1,0,0,0,0|0,0,1]=3 959 B9R0.34 CCCC(=O)C=C(C)CC 1458a_100020758463_100000210303 [1,1,0,0,0,0|1,0,1]=4 960 B9R0.34 CCNC(=O)C=C(C)CC 11a_100015525214_100020758463 [1,1,0,0,0,0|1,0,1]=4 961 B9R0.34 CCNC(=O)C=C(C)CC 240690a_100015525214_100020758463 [1,1,0,0,0,0|1,0,1]=4 962 B9R0.34 CCOC(=O)CC(=O)CC 1458a_100000210414_100000188475 [1,1,0,0,0,0|0,0,2]=4 963 B9R0.34 CCOC(=O)CC(=O)CC 1458a_100000243816_100000210202 [1,1,0,0,0,0|0,0,2]=4 964 B9R0.34 CCOC(=O)CC(=O)NC 240690a_100102657272_100000243816 [1,1,0,0,0,0|1,0,1]=4 965 B9R0.35 C=C(CNC)C(=O)OCC 34a_100102657272_100000755967 [1,1,0,0,0,0|1,0,1]=4 966 B9R0.35 C=C(CNC)C(=O)OCC 7a_106832991635_100000755967 [1,1,0,0,0,0|1,0,1]=4 967 B9R0.35 C=C(COC)C(=O)OCC 34a_100138415774_100000755967 [1,1,0,0,0,0|1,0,1]=4 968 B9R0.35 C=C(CSC)C(=O)OCC 62a_100000755967_200000210301 [1,1,0,0,0,0|1,0,1]=4 969 B9R0.35 C=C(CSC)C(=O)OCC 62a_200000210301_100000755967 [1,1,0,0,0,0|1,0,1]=4 970 B9R0.35 C=C(CS[13CH3])C(=O)OCC 62a_100000755967_200025704644 [1,1,0,0,0,0|1,0,1]=4 971 B9R0.35 C=C(CS[13CH3])C(=O)OCC 62a_200025704644_100000755967 [1,1,0,0,0,0|1,0,1]=4 972 B9R0.35 C=CCC(=O)C(=O)NCC 1458a_200011297158_100000210623 [1,1,0,0,0,0|1,0,1]=4 973 B9R0.35 CC/C=C(\C)/C(=O)CCC 1458a_100016988807_100000210303 [1,1,0,0,0,0|1,0,1]=4 974 B9R0.35 CC/C=C(\C)/C(=O)NCC 11a_100015525214_100016988807 [1,1,0,0,0,0|1,0,1]=4 975 B9R0.35 CC/C=C(\C)/C(=O)NCC 240690a_100015525214_100016988807 [1,1,0,0,0,0|1,0,1]=4 976 B9R0.35 CC/C=C(\C)/C(=O)NCC 527a_100015525214_100016988807 [1,1,0,0,0,0|1,0,1]=4 977 B9R0.35 CCNC(=O)C(=O)OCC 11a_100015525214_100014798877 [1,1,0,0,0,0|1,0,1]=4 978 B9R0.35 CCNC(=O)C(=O)OCC 240690a_100015525214_100014798877 [1,1,0,0,0,0|1,0,1]=4 979 B9R0.35 CCOC(=O)C(=O)CSC 62a_100000211299_200000210301 [1,1,0,0,0,0|1,0,1]=4 980 B9R0.35 CCOC(=O)C(=O)CSC 62a_200000210301_100000211299 [1,1,0,0,0,0|1,0,1]=4 981 B9R0.35 CCOC(=O)C(=O)CS[13CH3] 62a_100000211299_200025704644 [1,1,0,0,0,0|1,0,1]=4 982 B9R0.35 CCOC(=O)C(=O)CS[13CH3] 62a_200025704644_100000211299 [1,1,0,0,0,0|1,0,1]=4 983 B9R0.48 CCCC(=O)C=CC(C)C 1458a_100016268746_100000210303 [1,1,0,0,0,0|1,0,1]=4 984 B9R0.48 CCCC(=O)CC=C(C)C 1458a_100000211992_100000761012 [1,1,0,0,0,0|1,0,1]=4 985 B9R0.48 CCCC(=O)CC=C(C)C 1458a_100011220947_100000210303 [1,1,0,0,0,0|1,0,1]=4 986 B9R0.48 CCNC(=O)C=CC(C)C 11a_100015525214_100016268746 [1,1,0,0,0,0|1,0,1]=4 987 B9R0.48 CCNC(=O)C=CC(C)C 240690a_100015525214_100016268746 [1,1,0,0,0,0|1,0,1]=4 988 B9R0.48 CCNC(=O)CC=C(C)C 11a_100015525214_100011220947 [1,1,0,0,0,0|1,0,1]=4 989 B9R0.48 CCNC(=O)CC=C(C)C 240690a_100015525214_100011220947 [1,1,0,0,0,0|1,0,1]=4 990 B9R0.48 CCNC(=O)CC=C(C)C 527a_100015525214_100011220947 [1,1,0,0,0,0|1,0,1]=4 991 B9R0.48 CCOC(=O)C=CC(=O)C 1458a_100000210415_200000210301 [1,1,0,0,0,0|0,0,0]=2 992 B9R0.48 CCOC(=O)C=CC(=O)[13CH3] 1458a_100000210415_200025704644 [1,1,0,0,0,0|0,0,0]=2 993 B9R0.48 CCOC(=O)CCC(=O)C 1458a_100000183558_200000210301 [1,1,0,0,0,0|0,0,2]=4 994 B9R0.48 CCOC(=O)CCC(=O)[13CH3] 1458a_100000183558_200025704644 [1,1,0,0,0,0|0,0,2]=4 995 B9R0.48 CCOC(=O)CNC(=O)C 188690a_100000741813_100015343762 [1,1,0,0,0,0|1,0,1]=4 996 B9R0.48 CCOC(=O)NCC(=O)C 1458a_100000190774_200000210301 [1,1,0,0,0,0|1,0,1]=4 997 B9R0.48 CCOC(=O)NCC(=O)[13CH3] 1458a_100000190774_200025704644 [1,1,0,0,0,0|1,0,1]=4 998 B9R0.2 C/C=C/C=C/COC(C)C 34a_100016283227_100000210206 [1,1,0,0,0,0|0,0,1]=3 999 B9R0.2 CCC/C=C/C=CC(=O)C 1458a_200016258893_200000210301 [1,1,0,0,0,0|1,0,0]=3 1000 B9R0.2 CCC/C=C/C=CC(=O)[13CH3] 1458a_200016258893_200025704644 [1,1,0,0,0,0|1,0,0]=3 1001 B9R0.45 C#CCOC/C=C/C=C/C 34a_100016283227_100000184674 [1,1,0,0,0,0|0,0,2]=4 1002 B9R0.45 C/C=C/C=C/COCC=O 34a_100016283227_200009817547 [1,1,0,0,0,0|0,0,2]=4 1003 B9R0.45 C/C=C/C=C/COCCC 34a_100016283227_100000210303 [1,1,0,0,0,0|0,0,1]=3 1004 B9R0.45 C/C=C/C=C/COCCF 34a_100016283227_100011217306 [1,1,0,0,0,0|0,0,1]=3 1005 B9R0.45 C/C=C/C=C/COCCO 34a_100016283227_100000211926 [1,1,0,0,0,0|0,0,1]=3 1006 B9R0.45 C/C=C/C=C/COCSC 34a_100016283227_100011218213 [1,1,0,0,0,0|0,0,1]=3 1007 B9R0.45 C=CCOC/C=C/C=C/C 34a_100016283227_100015514636 [1,1,0,0,0,0|0,0,2]=4 1008 B9R0.45 CC=CC=CC=NNCC 4a_100000756455_100000691131 [1,1,0,0,0,0|1,0,0]=3 1009 B9R0.45 CCC/C=C/C=C/COC 34a_100016294078_200000210301 [1,1,0,0,0,0|1,0,1]=4 1010 B9R0.45 CCC/C=C/C=C/CO[13CH3] 34a_100016294078_200025704644 [1,1,0,0,0,0|1,0,1]=4 1011 B9R0.46 CCOC/C=C/C(=O)OC 34a_100121572206_100000742655 [1,1,0,0,0,0|1,0,1]=4 1012 B9R0.1 C=C(C)C=NNC(=O)CC 4a_100000183195_100000210575 [1,1,0,0,0,0|2,0,0]=4 1013 B9R0.1 CCC(=O)C/C=C/C(C)C 1458a_100016292215_100000210202 [1,1,0,0,0,0|0,0,2]=4 1014 B9R0.1 CCC(=O)C=CCN(C)C 1458a_100000754359_100000210202 [1,1,0,0,0,0|1,0,1]=4 1015 B9R0.1 CCC(=O)CCC=C(C)C 1458a_100000210414_100011217483 [1,1,0,0,0,0|0,0,2]=4 1016 B9R0.1 CCC(=O)NCC=C(C)C 11a_100000718196_100000210414 [1,1,0,0,0,0|1,0,1]=4 1017 B9R0.1 CCC(=O)NCC=C(C)C 1626a_100000718196_100000210414 [1,1,0,0,0,0|1,0,1]=4 1018 B9R0.1 CCC(=O)NCC=C(C)C 527a_100000718196_100000210414 [1,1,0,0,0,0|1,0,1]=4 1019 B9R0.1 COC(=O)/C=C/CN(C)C 2230a_100102631434_100000742655 [1,1,0,0,0,0|1,0,1]=4 1020 B9R0.1 COC(=O)/C=C/CN(C)C 269982a_100102631434_100000742655 [1,1,0,0,0,0|1,0,1]=4 1021 B9R0.1 COC(=O)C=NNC(=O)C 4a_100000189765_200011823558 [1,1,0,0,0,0|2,0,0]=4 1022 B9R0.24 CC=C(C)C=CC(=O)CC 1458a_100000692105_100000210202 [1,1,0,0,0,0|0,0,0]=2 1023 B9R0.24 CC=C(C)C=CC(=O)CF 1458a_100000692105_100015361967 [1,1,0,0,0,0|1,0,0]=3 1024 B9R0.24 CC=C(C)C=CC(=O)NC 1626a_100102657272_100000692105 [1,1,0,0,0,0|1,0,0]=3 1025 B9R0.24 CCC(=O)C=CC(=O)NC 1458a_100016259477_100000210202 [1,1,0,0,0,0|1,0,0]=3 1026 B9R0.24 CNC(=O)C=CC(=O)CF 1458a_100016259477_100015361967 [1,1,0,0,0,0|2,0,0]=4 1027 B9R0.24 CNC(=O)C=CC(=O)NC 1626a_100102657272_100016259477 [1,1,0,0,0,0|2,0,0]=4 1028 B9R0.24 CNC(=O)C=CC(=O)OC 1626a_100102657272_100016283253 [1,1,0,0,0,0|1,0,0]=3 1029 B9R0.47 C/C=C/C=CC(=O)C(C)C 1458a_100000185730_100000210206 [1,1,0,0,0,0|0,0,0]=2 1030 B9R0.47 C/C=C/C=CC(=O)N(C)C 11a_100102631434_100000185730 [1,1,0,0,0,0|1,0,0]=3 1031 B9R0.47 C/C=C/C=CC(=O)N(C)C 1626a_100102631434_100000185730 [1,1,0,0,0,0|1,0,0]=3 1032 B9R0.47 C/C=C/C=CC(=O)N(C)C 240690a_100102631434_100000185730 [1,1,0,0,0,0|1,0,0]=3 1033 B9R0.47 CC/C=C/CC(=O)C(C)C 1458a_100016274230_100000210206 [1,1,0,0,0,0|0,0,2]=4 1034 B9R0.47 CC/C=C\CC(=O)C(C)C 1458a_100000210198_100103147603 [1,1,0,0,0,0|0,0,2]=4 1035 B9R0.47 CC/C=C\CC(=O)C(C)F 1458a_100000062450_100103147603 [1,1,0,0,0,0|0,0,2]=4 1036 B9R0.47 CC/C=C\CC(=O)[C@@H](C)O 1458a_100000717761_100103147603 [1,1,0,0,0,0|0,0,2]=4 1037 B9R0.47 CC/C=C\CC(=O)[C@H](C)O 1458a_217856618621_100103147603 [1,1,0,0,0,0|0,0,2]=4 1038 B9R0.47 CCCC=CC(=O)C(C)C 1458a_100000212230_100000210206 [1,1,0,0,0,0|0,0,2]=4 1039 B9R0.47 CCOC=CC(=O)C(C)C 1458a_100016266692_100000210206 [1,1,0,0,0,0|1,0,1]=4 1040 B9R0.47 COCC=CC(=O)C(C)C 1458a_100016285016_100000210206 [1,1,0,0,0,0|1,0,1]=4 1041 B11R0.2 C/C=C/COCC(=O)OC(C)C 34a_100016270725_100011215430 [0,2,0,0,0,0|0,0,2]=4 1042 B11R0.2 C/C=C/CSCC(=O)OC(C)C 62a_100011215430_100102629194 [0,2,0,0,0,0|0,0,2]=4 1043 B11R0.2 C/C=C/CSCC(=O)OC(C)C 62a_100102629194_100011215430 [0,2,0,0,0,0|0,0,2]=4 1044 B11R0.2 CC=CCSCC(=O)OC(C)C 62a_100000070051_100011215430 [0,2,0,0,0,0|0,0,2]=4 1045 B11R0.2 CC=CCSCC(=O)OC(C)C 62a_100011215430_100000070051 [0,2,0,0,0,0|0,0,2]=4 1046 B11R0.4 C#CCNC/C=C/C(=O)OCC 34a_100000212058_100016267167 [0,2,0,0,0,0|1,0,1]=4 1047 B11R0.4 C#CCOC/C=C/C(=O)OCC 34a_100000210247_100016267167 [0,2,0,0,0,0|1,0,1]=4 1048 B11R0.4 C#CCSC/C=C/C(=O)OCC 62a_100000038162_100016267167 [0,2,0,0,0,0|1,0,1]=4 1049 B11R0.4 C/C=C/CCOCC(=O)OCC 34a_100016278192_100000188475 [0,2,0,0,0,0|0,0,2]=4 1050 B11R0.4 C/C=C/COCCC(=O)OCC 34a_100016270725_100000765890 [0,2,0,0,0,0|0,0,2]=4 1051 B11R0.4 C/C=C/CSCCC(=O)OCC 62a_100000765890_100102629194 [0,2,0,0,0,0|0,0,2]=4 1052 B11R0.4 C/C=C/CSCCC(=O)OCC 62a_100102629194_100000765890 [0,2,0,0,0,0|0,0,2]=4 1053 B11R0.4 C/C=C/CSCOC(=O)OCC 62a_100102629194_100000075025 [0,2,0,0,0,0|0,0,2]=4 1054 B11R0.4 C=CCNC/C=C/C(=O)OCC 2230a_100020586998_100016267167 [0,2,0,0,0,0|0,0,2]=4 1055 B11R0.4 C=CCOC/C=C/C(=O)OCC 34a_200000210373_100016267167 [0,2,0,0,0,0|0,0,2]=4 1056 B11R0.4 C=CCSC/C=C/C(=O)OCC 62a_100000210623_100016267167 [0,2,0,0,0,0|0,0,2]=4 1057 B11R0.4 C=CCSC/C=C/C(=O)OCC 62a_100016267167_100000210623 [0,2,0,0,0,0|0,0,2]=4 1058 B11R0.4 CC/C=C\COCC(=O)OCC 34a_100016268518_100000188475 [0,2,0,0,0,0|0,0,2]=4 1059 B11R0.4 CC/C=C\CSCC(=O)OCC 62a_100000188475_100103147603 [0,2,0,0,0,0|0,0,2]=4 1060 B11R0.4 CC/C=C\CSCC(=O)OCC 62a_100103147603_100000188475 [0,2,0,0,0,0|0,0,2]=4 1061 B11R0.4 CC=CCSCCC(=O)OCC 62a_100000070051_100000765890 [0,2,0,0,0,0|0,0,2]=4 1062 B11R0.4 CC=CCSCCC(=O)OCC 62a_100000765890_100000070051 [0,2,0,0,0,0|0,0,2]=4 1063 B11R0.4 CC=CCSCOC(=O)OCC 62a_100000070051_100000075025 [0,2,0,0,0,0|0,0,2]=4 1064 B11R0.4 CCC/C=C/C=CC(=O)CCC 1458a_200016258893_100000210303 [0,2,0,0,0,0|1,0,0]=3 1065 B11R0.4 CCC/C=C/C=CC(=O)CCF 1458a_200016258893_100011217306 [0,2,0,0,0,0|2,0,0]=4 1066 B11R0.4 CCC/C=C/C=CC(=O)CCO 1458a_200016258893_100000211926 [0,2,0,0,0,0|2,0,0]=4 1067 B11R0.4 CCC/C=C/C=CC(=O)NCC 11a_100015525214_200016258893 [0,2,0,0,0,0|1,0,0]=3 1068 B11R0.4 CCC/C=C/C=CC(=O)NCC 240690a_100015525214_200016258893 [0,2,0,0,0,0|1,0,0]=3 1069 B11R0.4 CCC/C=C/C=CC(=O)NNC 22a_100016993582_200016258893 [0,2,0,0,0,0|2,0,0]=4 1070 B11R0.4 CCC=CC=NNC(=O)CCC 4a_100000189770_100011216943 [0,2,0,0,0,0|1,0,1]=4 1071 B11R0.4 CCCOC/C=C/C(=O)OCC 34a_100000210258_100016267167 [0,2,0,0,0,0|0,0,2]=4 1072 B11R0.4 CCCSC/C=C/C(=O)OCC 62a_100000210303_100016267167 [0,2,0,0,0,0|0,0,2]=4 1073 B11R0.4 CCCSC/C=C/C(=O)OCC 62a_100016267167_100000210303 [0,2,0,0,0,0|0,0,2]=4 1074 B11R0.4 CCNN=CC=CC(=O)OCC 4a_100000756455_100016289910 [0,2,0,0,0,0|0,0,1]=3 1075 B11R0.4 CCOC(=O)/C=C/CNCCF 34a_100000724931_100016267167 [0,2,0,0,0,0|0,0,2]=4 1076 B11R0.4 CCOC(=O)/C=C/CNCCO 2230a_100016997473_100016267167 [0,2,0,0,0,0|0,0,2]=4 1077 B11R0.4 CCOC(=O)/C=C/CNCCO 34a_100016990907_100016267167 [0,2,0,0,0,0|0,0,2]=4 1078 B11R0.4 CCOC(=O)/C=C/COCCBr 34a_100000211926_100016267167 [0,2,0,0,0,0|0,0,2]=4 1079 B11R0.4 CCOC(=O)/C=C/COCCN 34a_100000210304_100016267167 [0,2,0,0,0,0|0,0,2]=4 1080 B11R0.4 CCOC(=O)/C=C/CSCC#N 62a_100011215382_100016267167 [0,2,0,0,0,0|1,0,1]=4 1081 B11R0.4 CCOC(=O)/C=C/CSCC#N 62a_100016267167_100011215382 [0,2,0,0,0,0|1,0,1]=4 1082 B11R0.4 CCOC(=O)/C=C/CSCC=O 62a_100016267167_200015260668 [0,2,0,0,0,0|1,0,1]=4 1083 B11R0.4 CCOC(=O)/C=C/CSCC=O 62a_200015260668_100016267167 [0,2,0,0,0,0|1,0,1]=4 1084 B11R0.4 CCOC(=O)/C=C/CSCCF 62a_100011217306_100016267167 [0,2,0,0,0,0|0,0,2]=4 1085 B11R0.4 CCOC(=O)/C=C/CSCCF 62a_100016267167_100011217306 [0,2,0,0,0,0|0,0,2]=4 1086 B11R0.4 CCOC(=O)/C=C/CSCCO 62a_100000211926_100016267167 [0,2,0,0,0,0|0,0,2]=4 1087 B11R0.4 CCOC(=O)/C=C/CSCCO 62a_100016267167_100000211926 [0,2,0,0,0,0|0,0,2]=4 1088 B11R0.4 CCOC(=O)/C=C/CSCOC 62a_100000766300_100016267167 [0,2,0,0,0,0|0,0,2]=4 1089 B11R0.4 CCOC(=O)/C=C/CSCOC 62a_100016267167_100000766300 [0,2,0,0,0,0|0,0,2]=4 1090 B11R0.4 CCOC(=O)/C=C/CSCSC 62a_100011218213_100016267167 [0,2,0,0,0,0|0,0,2]=4 1091 B11R0.4 CCOC(=O)/C=C/CSCSC 62a_100016267167_100011218213 [0,2,0,0,0,0|0,0,2]=4 1092 B11R0.5 C/C=C/CC(=O)C=C(C)CCC 1458a_100020676950_100102629194 [0,2,0,0,0,0|2,0,0]=4 1093 B11R0.5 C/C=C/CC(=O)CC(=O)OCC 1458a_100000243816_100102629194 [0,2,0,0,0,0|0,0,1]=3 1094 B11R0.5 C=C(CC(=O)C=CC)OCOC 1458a_100000210699_100000042856 [0,2,0,0,0,0|1,0,1]=4 1095 B11R0.5 C=CC=CC(=O)CC(=O)CCC 1458a_100016291481_100000747444 [0,2,0,0,0,0|1,0,1]=4 1096 B11R0.5 C=CC=CC(=O)CC(=O)NCC 1458a_100016291481_100000183381 [0,2,0,0,0,0|1,0,1]=4 1097 B11R0.5 C=CC=CC(=O)CC(=O)OCC 1458a_100016291481_100000188475 [0,2,0,0,0,0|0,0,1]=3 1098 B11R0.5 C=CCOC(=O)CC(=O)C=CC 1458a_100000210699_100000033060 [0,2,0,0,0,0|0,0,2]=4 1099 B11R0.5 CC=CC(=O)CC(=O)NCCC 1458a_100000210699_100000183358 [0,2,0,0,0,0|1,0,1]=4 1100 B11R0.5 CC=CC(=O)CC(=O)OCCC 1458a_100000210699_200011215008 [0,2,0,0,0,0|0,0,1]=3 1101 B11R0.5 CC=CCC(=O)C=C(C)CCC 1458a_100020676950_100000070051 [0,2,0,0,0,0|2,0,0]=4 1102 B11R0.5 CC=CCC(=O)CC(=O)CCC 1458a_100121576822_100000747444 [0,2,0,0,0,0|1,0,1]=4 1103 B11R0.5 CC=CCC(=O)CC(=O)NCC 1458a_100121576822_100000183381 [0,2,0,0,0,0|1,0,1]=4 1104 B11R0.5 CC=CCC(=O)CC(=O)OCC 1458a_100000243816_100000070051 [0,2,0,0,0,0|0,0,1]=3 1105 B11R0.5 CC=CCC(=O)CC(=O)OCC 1458a_100121576822_100000188475 [0,2,0,0,0,0|0,0,1]=3 1106 B11R0.5 CC=CCN(C)CC(=O)OCC 2230a_100000220588_100000070051 [0,2,0,0,0,0|0,0,2]=4 1107 B11R0.5 CCC=CC(=O)CC(=O)CCC 1458a_100000212282_100000747444 [0,2,0,0,0,0|1,0,1]=4 1108 B11R0.5 CCC=CC(=O)CC(=O)NCC 1458a_100000212282_100000183381 [0,2,0,0,0,0|1,0,1]=4 1109 B11R0.5 CCC=CC(=O)CC(=O)OCC 1458a_100000212282_100000188475 [0,2,0,0,0,0|0,0,1]=3 1110 B11R0.5 CCCC(=O)CC(=O)C=COC 1458a_100016268678_100000747444 [0,2,0,0,0,0|1,0,1]=4 1111 B11R0.5 CCCOC(=O)CC(=O)C=CBr 1458a_100016273825_200011215008 [0,2,0,0,0,0|1,0,1]=4 1112 B11R0.5 CCCOC(=O)CC(=O)C=CCl 1458a_200016279998_200011215008 [0,2,0,0,0,0|1,0,1]=4 1113 B11R0.5 CCCOC(=O)CC(=O)C=CI 1458a_100016256311_200011215008 [0,2,0,0,0,0|1,0,1]=4 1114 B11R0.5 CCNC(=O)CC(=O)C=COC 1458a_100016268678_100000183381 [0,2,0,0,0,0|1,0,1]=4 1115 B11R0.5 CCNCC(=CC(=O)OCC)C 2230a_100015525214_100135422193 [0,2,0,0,0,0|0,0,2]=4 1116 B11R0.5 CCOC(=O)C=C(C)CSCC 62a_100000210202_100135422193 [0,2,0,0,0,0|0,0,2]=4 1117 B11R0.5 CCOC(=O)C=C(C)CSCC 62a_100135422193_100000210202 [0,2,0,0,0,0|0,0,2]=4 1118 B11R0.5 CCOC(=O)C=C(C)CSCF 62a_100015361967_100135422193 [0,2,0,0,0,0|1,0,1]=4 1119 B11R0.5 CCOC(=O)C=C(C)CSCF 62a_100135422193_100015361967 [0,2,0,0,0,0|1,0,1]=4 1120 B11R0.5 CCOC(=O)CC(=O)C=COC 1458a_100016268678_100000188475 [0,2,0,0,0,0|0,0,1]=3 1121 B11R0.5 CCOCC(=CC(=O)OCC)C 34a_100121572206_100135422193 [0,2,0,0,0,0|0,0,2]=4 1122 B11R0.62 C#CCC(=O)C=CC(=O)OCC 1458a_100000210415_100000184674 [0,2,0,0,0,0|0,0,2]=4 1123 B11R0.62 C/C=C/C(C)OCC(=O)OCC 34a_200102604097_100000188475 [0,2,0,0,0,0|0,0,2]=4 1124 B11R0.62 C=CCC(=O)C=CC(=O)OCC 1458a_100000210415_100000210623 [0,2,0,0,0,0|0,0,1]=3 1125 B11R0.62 CC=CC(=NNC(=O)CCC)C 4a_100000189770_100011218416 [0,2,0,0,0,0|2,0,0]=4 1126 B11R0.62 CC=CC(=O)COC(=O)CCC 1458a_100000210699_100000034017 [0,2,0,0,0,0|1,0,1]=4 1127 B11R0.62 CC=CC(=O)NCC(=O)NCC 11a_100016988866_100000210699 [0,2,0,0,0,0|1,0,1]=4 1128 B11R0.62 CC=CC(=O)NCC(=O)NCC 1626a_100016988866_100000210699 [0,2,0,0,0,0|1,0,1]=4 1129 B11R0.62 CC=CC(=O)NCC(=O)NCC 240690a_100016988866_100000210699 [0,2,0,0,0,0|1,0,1]=4 1130 B11R0.62 CC=CC(=O)NCC(=O)OCC 188690a_100000741813_100000210699 [0,2,0,0,0,0|0,0,1]=3 1131 B11R0.62 CC=CC(=O)NNC(=O)CCC 22a_100000189770_100000210699 [0,2,0,0,0,0|2,0,0]=4 1132 B11R0.62 CCCC(=O)C=CC(=O)OCC 1458a_100000210415_100000210303 [0,2,0,0,0,0|0,0,1]=3 1133 B11R0.62 CCNC(=O)C=CC(=O)OCC 240690a_100015525214_100000210415 [0,2,0,0,0,0|0,0,1]=3 1134 B11R0.62 CCOC(=O)C=CC(=O)CC#N 1458a_100000210415_100011214920 [0,2,0,0,0,0|0,0,2]=4 1135 B11R0.62 CCOC(=O)C=CC(=O)CCF 1458a_100000210415_100011217306 [0,2,0,0,0,0|0,0,1]=3 1136 B11R0.62 CCOC(=O)C=CC(=O)CCO 1458a_100000210415_100000211926 [0,2,0,0,0,0|0,0,1]=3 1137 B11R0.81 C/C=C/COCC(=O)OCCC 34a_100016270725_200011215008 [0,2,0,0,0,0|0,0,2]=4 1138 B11R0.81 C/C=C/CSCC(=O)OCCC 62a_100102629194_200011215008 [0,2,0,0,0,0|0,0,2]=4 1139 B11R0.81 C/C=C/CSCC(=O)OCCC 62a_200011215008_100102629194 [0,2,0,0,0,0|0,0,2]=4 1140 B11R0.81 CC/C=C\CCC(=O)COCC 1458a_100000211967_100015370543 [0,2,0,0,0,0|0,0,2]=4 1141 B11R0.81 CC=CCSCC(=O)OCCC 62a_100000070051_200011215008 [0,2,0,0,0,0|0,0,2]=4 1142 B11R0.81 CC=CCSCC(=O)OCCC 62a_200011215008_100000070051 [0,2,0,0,0,0|0,0,2]=4 1143 B11R0.155 C#CCN(C)C(=O)C=C/C=C/C 11a_100000225692_100000185730 [0,2,0,0,0,0|1,0,1]=4 1144 B11R0.155 C#CCN(C)C(=O)C=C/C=C/C 1626a_100000225692_100000185730 [0,2,0,0,0,0|1,0,1]=4 1145 B11R0.155 C/C=C/C=CC(=O)C(C)CC#N 1458a_100000185730_100009813641 [0,2,0,0,0,0|1,0,1]=4 1146 B11R0.155 C/C=C/C=CC(=O)C(C)CCC 1458a_100000185730_100000766640 [0,2,0,0,0,0|1,0,0]=3 1147 B11R0.155 C/C=C/C=CC(=O)C(C)CCO 1458a_100000185730_100009893172 [0,2,0,0,0,0|1,0,0]=3 1148 B11R0.155 C/C=C/C=CC(=O)C(C)COC 1458a_100000185730_100000765312 [0,2,0,0,0,0|1,0,0]=3 1149 B11R0.155 C/C=C/C=CC(=O)N(C)CC#N 11a_100000748184_100000185730 [0,2,0,0,0,0|1,0,1]=4 1150 B11R0.155 C/C=C/C=CC(=O)N(C)CC#N 1626a_100000748184_100000185730 [0,2,0,0,0,0|1,0,1]=4 1151 B11R0.155 C/C=C/C=CC(=O)N(C)CCC 11a_100000747261_100000185730 [0,2,0,0,0,0|1,0,0]=3 1152 B11R0.155 C/C=C/C=CC(=O)N(C)CCC 1626a_100000747261_100000185730 [0,2,0,0,0,0|1,0,0]=3 1153 B11R0.155 C/C=C/C=CC(=O)N(C)CCC 240690a_100000747261_100000185730 [0,2,0,0,0,0|1,0,0]=3 1154 B11R0.155 C/C=C/C=CC(=O)N(C)CCO 240690a_100000210263_100000185730 [0,2,0,0,0,0|1,0,0]=3 1155 B11R0.155 C/C=C/COC(C)C(=O)OCC 34a_100016270725_100011216346 [0,2,0,0,0,0|0,0,2]=4 1156 B11R0.155 C/C=C/COC(F)C(=O)OCC 34a_100016270725_100000760018 [0,2,0,0,0,0|0,0,2]=4 1157 B11R0.155 C/C=C/CO[C@@H](C)C(=O)OCC 7a_100000751109_100102629194 [0,2,0,0,0,0|0,0,2]=4 1158 B11R0.155 C/C=C/CSC(C)C(=O)OCC 62a_100011216346_100102629194 [0,2,0,0,0,0|0,0,2]=4 1159 B11R0.155 C/C=C/CSC(C)C(=O)OCC 62a_100102629194_100011216346 [0,2,0,0,0,0|0,0,2]=4 1160 B11R0.155 C/C=C/CSC(F)C(=O)OCC 62a_100000760018_100102629194 [0,2,0,0,0,0|0,0,2]=4 1161 B11R0.155 C/C=C/CSC(F)C(=O)OCC 62a_100102629194_100000760018 [0,2,0,0,0,0|0,0,2]=4 1162 B11R0.155 C=CCN(C)C(=O)C=C/C=C/C 11a_100000225617_100000185730 [0,2,0,0,0,0|1,0,1]=4 1163 B11R0.155 C=CCN(C)C(=O)C=C/C=C/C 1626a_100000225617_100000185730 [0,2,0,0,0,0|1,0,1]=4 1164 B11R0.155 C=CCN(C)C(=O)C=C/C=C/C 240690a_100000225617_100000185730 [0,2,0,0,0,0|1,0,1]=4 1165 B11R0.155 CC/C=C\CC(=O)C(=O)NCC 1458a_200011297158_100103147603 [0,2,0,0,0,0|1,0,1]=4 1166 B11R0.155 CC/C=C\CC(=O)C(C)OCC 1458a_100000739345_100103147603 [0,2,0,0,0,0|0,0,2]=4 1167 B11R0.155 CC=CCO[C@@H](C)C(=O)OCC 7a_100000751109_100000070051 [0,2,0,0,0,0|0,0,2]=4 1168 B11R0.155 CC=CCSC(C)C(=O)OCC 62a_100000070051_100011216346 [0,2,0,0,0,0|0,0,2]=4 1169 B11R0.155 CC=CCSC(C)C(=O)OCC 62a_100011216346_100000070051 [0,2,0,0,0,0|0,0,2]=4 1170 B11R0.155 CC=CCSC(F)C(=O)OCC 62a_100000070051_100000760018 [0,2,0,0,0,0|0,0,2]=4 1171 B11R0.155 CC=CCSC(F)C(=O)OCC 62a_100000760018_100000070051 [0,2,0,0,0,0|0,0,2]=4 1172 B11R0.174 C/C=C(\C)/C=NNC(=O)CCC 4a_100000189770_100020587592 [0,2,0,0,0,0|2,0,0]=4 1173 B11R0.174 CCOC(=O)/C=C/CN(C)CC 2230a_100000225621_100016267167 [0,2,0,0,0,0|0,0,2]=4 1174 B11R0.174 CCOC(=O)/C=C/CN(C)CC 269982a_100000225621_100016267167 [0,2,0,0,0,0|0,0,2]=4 1175 B11R0.174 CCOC(=O)C=NNC(=O)CC 4a_100000183195_100000742314 [0,2,0,0,0,0|1,0,1]=4 1176 B11R0.176 CCCC(=O)NN=CC=C(C)C 4a_100000189770_100011215525 [0,2,0,0,0,0|2,0,0]=4 1177 B11R0.176 CCOC(=O)/C=C/CNC(C)C 2230a_100138425928_100016267167 [0,2,0,0,0,0|0,0,2]=4 1178 B11R0.176 CCOC(=O)/C=C/CNC(C)C 34a_100138425928_100016267167 [0,2,0,0,0,0|0,0,2]=4 1179 B11R0.176 CCOC(=O)/C=C/COC(C)C 34a_100000212225_100016267167 [0,2,0,0,0,0|0,0,2]=4 1180 B11R0.176 CCOC(=O)/C=C/CSC(C)C 62a_100000210206_100016267167 [0,2,0,0,0,0|0,0,2]=4 1181 B11R0.176 CCOC(=O)/C=C/CSC(C)C 62a_100016267167_100000210206 [0,2,0,0,0,0|0,0,2]=4 1182 B11R0.176 CCOC(=O)CNCC=C(C)C 34a_100000718196_100000188475 [0,2,0,0,0,0|0,0,2]=4 1183 B11R0.176 CCOC(=O)COCC=C(C)C 34a_100000753907_100000188475 [0,2,0,0,0,0|0,0,2]=4 1184 B11R0.176 CCOC(=O)CSCC=C(C)C 62a_100000188475_100000761012 [0,2,0,0,0,0|0,0,2]=4 1185 B11R0.176 CCOC(=O)CSCC=C(C)C 62a_100000761012_100000188475 [0,2,0,0,0,0|0,0,2]=4 1186 B11R0.176 CCOC(=O)[CH-]C=NNC(=O)C 4a_100000189765_100010622808 [0,2,0,0,0,0|1,0,1]=4 1187 B11R0.1 C=C(C)CC(=O)CC(=O)OCC 1458a_100000243816_100000748629 [0,2,0,0,0,0|0,0,2]=4 1188 B11R0.1 CC(C)OC(=O)CC(=O)C=CBr 1458a_100016273825_100011215430 [0,2,0,0,0,0|1,0,1]=4 1189 B11R0.1 CC(C)OC(=O)CC(=O)C=CCl 1458a_200016279998_100011215430 [0,2,0,0,0,0|1,0,1]=4 1190 B11R0.1 CC(C)OC(=O)CC(=O)C=CI 1458a_100016256311_100011215430 [0,2,0,0,0,0|1,0,1]=4 1191 B11R0.1 CC=CC(=O)CC(=O)NC(C)C 1458a_100000210699_100000183996 [0,2,0,0,0,0|1,0,1]=4 1192 B11R0.1 CC=CC(=O)CC(=O)OC(C)C 1458a_100000210699_100011215430 [0,2,0,0,0,0|0,0,1]=3 1193 B11R0.1 CCCC(=O)CC(=O)C=C(C)C 1458a_100000211388_100000747444 [0,2,0,0,0,0|1,0,1]=4 1194 B11R0.1 CCCC(=O)CC(=O)C=C(C)Cl 1458a_200042562850_100000747444 [0,2,0,0,0,0|1,0,1]=4 1195 B11R0.1 CCCC(=O)CC(=O)C=C(C)I 1458a_100025716642_100000747444 [0,2,0,0,0,0|1,0,1]=4 1196 B11R0.1 CCNC(=O)CC(=O)C=C(C)C 1458a_100000211388_100000183381 [0,2,0,0,0,0|1,0,1]=4 1197 B11R0.1 CCNC(=O)CC(=O)C=C(C)Cl 1458a_200042562850_100000183381 [0,2,0,0,0,0|1,0,1]=4 1198 B11R0.1 CCNC(=O)CC(=O)C=C(C)I 1458a_100025716642_100000183381 [0,2,0,0,0,0|1,0,1]=4 1199 B11R0.1 CCOC(=O)C=C(C)CN(C)C 2230a_100102631434_100135422193 [0,2,0,0,0,0|1,0,1]=4 1200 B11R0.1 CCOC(=O)C=C(C)CN(C)C 269982a_100102631434_100135422193 [0,2,0,0,0,0|1,0,1]=4 1201 B11R0.1 CCOC(=O)CC(=O)C=C(C)C 1458a_100000211388_100000188475 [0,2,0,0,0,0|0,0,1]=3 1202 B11R0.1 CCOC(=O)CC(=O)C=C(C)Cl 1458a_200042562850_100000188475 [0,2,0,0,0,0|0,0,1]=3 1203 B11R0.1 CCOC(=O)CC(=O)C=C(C)I 1458a_100025716642_100000188475 [0,2,0,0,0,0|0,0,1]=3 1204 B11R0.1 CCOC(=O)CC(=O)C=C(Cl)Cl 1458a_100000137448_100000188475 [0,2,0,0,0,0|1,0,1]=4 1205 B11R0.1 CCOC(=O)NC(=O)CC(=O)C 1458a_100000070787_100000010344 [0,2,0,0,0,0|1,0,1]=4 1206 B11R0.177 CC=CC(=O)C(C)C(=O)NCC 1458a_100000210699_100000230173 [0,2,0,0,0,0|1,0,1]=4 1207 B11R0.177 CC=CC(=O)C(C)C(=O)OCC 1458a_100000210699_100011216346 [0,2,0,0,0,0|0,0,1]=3 1208 B11R0.177 CC=CC(=O)C(F)C(=O)OCC 1458a_100000210699_100000760018 [0,2,0,0,0,0|0,0,1]=3 1209 B11R0.177 CCOC(=O)C(C)C(=O)C=CBr 1458a_100016273825_100011216346 [0,2,0,0,0,0|1,0,1]=4 1210 B11R0.177 CCOC(=O)C(C)C(=O)C=CCl 1458a_200016279998_100011216346 [0,2,0,0,0,0|1,0,1]=4 1211 B11R0.177 CCOC(=O)C(C)C(=O)C=CI 1458a_100016256311_100011216346 [0,2,0,0,0,0|1,0,1]=4 1212 B11R0.177 CCOC(=O)C(F)C(=O)C=CBr 1458a_100016273825_100000760018 [0,2,0,0,0,0|1,0,1]=4 1213 B11R0.177 CCOC(=O)C(F)C(=O)C=CCl 1458a_200016279998_100000760018 [0,2,0,0,0,0|1,0,1]=4 1214 B11R0.177 CCOC(=O)C(F)C(=O)C=CI 1458a_100016256311_100000760018 [0,2,0,0,0,0|1,0,1]=4 1215 B11R0.187 C/C=C(\C)/C(=O)CC(=O)CCC 1458a_100020587367_100000747444 [0,2,0,0,0,0|1,0,1]=4 1216 B11R0.187 C/C=C(\C)/C(=O)CC(=O)NCC 1458a_100020587367_100000183381 [0,2,0,0,0,0|1,0,1]=4 1217 B11R0.187 C/C=C(\C)/C(=O)CC(=O)OCC 1458a_100020587367_100000188475 [0,2,0,0,0,0|0,0,1]=3 1218 B11R0.187 C=C(CC(=O)OCC)C(=O)NC 1626a_100102657272_200000043866 [0,2,0,0,0,0|1,0,1]=4 1219 B11R0.187 CC=CC(=O)CC(=O)N(C)CC 1458a_100000210699_100011894763 [0,2,0,0,0,0|1,0,1]=4 1220 B11R0.187 CCOC(=O)CC(=O)C(=O)NC 1458a_100011218921_100000188475 [0,2,0,0,0,0|1,0,1]=4 1221 B11R0.59 C=C(C)CNC(=O)C(=O)OCC 11a_100000765925_100014798877 [0,2,0,0,0,0|1,0,1]=4 1222 B11R0.59 C=C(C)CNC(=O)C(=O)OCC 1626a_100000765925_100014798877 [0,2,0,0,0,0|1,0,1]=4 1223 B11R0.59 C=C(C)CNC(=O)C(=O)OCC 240690a_100000765925_100014798877 [0,2,0,0,0,0|1,0,1]=4 1224 B11R0.59 CCNC(=O)C(=O)CC=C(C)C 1458a_200011297158_100000761012 [0,2,0,0,0,0|1,0,1]=4 1225 B11R0.59 CCOC(=O)C(=NNC(=O)C)C 4a_100000189765_100000209952 [0,2,0,0,0,0|2,0,0]=4 1226 B11R0.141 C=C(C)C(=O)NCC(=O)OCC 188690a_100000741813_100000185857 [0,2,0,0,0,0|1,0,1]=4 1227 B11R0.141 CCCC(=O)C=CC(=O)N(C)C 1458a_100011200747_100000210303 [0,2,0,0,0,0|2,0,0]=4 1228 B11R0.141 CCOC(=O)C=CC(=O)C(C)C 1458a_100000210415_100000210206 [0,2,0,0,0,0|0,0,1]=3 1229 B11R0.141 CCOC(=O)C=CC(=O)N(C)C 1626a_100102631434_100000210415 [0,2,0,0,0,0|1,0,0]=3 1230 B11R0.141 CCOC(=O)C=CC(=O)N(C)C 240690a_100102631434_100000210415 [0,2,0,0,0,0|1,0,0]=3 1231 B11R0.147 C=C(C)C=NNC(=O)COCC 4a_100000216846_100000210575 [0,2,0,0,0,0|2,0,0]=4 1232 B11R0.147 CCNN=C(C)C=CC=C(C)C 4a_100000756455_100020616850 [0,2,0,0,0,0|2,0,0]=4 1233 B11R0.147 CCOCC(=O)CCC=C(C)C 1458a_100000211967_100011217483 [0,2,0,0,0,0|0,0,2]=4 1234 B11R0.147 CCOCC(=O)NCC=C(C)C 11a_100000718196_100000211967 [0,2,0,0,0,0|1,0,1]=4 1235 B11R0.147 CCOCC(=O)NCC=C(C)C 1626a_100000718196_100000211967 [0,2,0,0,0,0|1,0,1]=4 1236 B11R0.147 CCOCC(=O)NCC=C(C)C 527a_100000718196_100000211967 [0,2,0,0,0,0|1,0,1]=4 1237 B11R0.68 C/C=C/CC(=O)C(=O)NC(C)C 1458a_100011220036_100102629194 [0,2,0,0,0,0|1,0,1]=4 1238 B11R0.68 CC=CCC(=O)C(=O)NC(C)C 1458a_100011220036_100000070051 [0,2,0,0,0,0|1,0,1]=4 1239 B11R0.107 C=C(C)CC(=O)C=CC(=CC)C 1458a_100000692105_100000748629 [0,2,0,0,0,0|1,0,1]=4 1240 B11R0.107 CC=C(C)C=CC(=O)CC(C)C 1458a_100000692105_100000210624 [0,2,0,0,0,0|1,0,0]=3 1241 B11R0.107 CC=C(C)C=CC(=O)CC(C)O 1458a_100000692105_100011218427 [0,2,0,0,0,0|1,0,0]=3 1242 B11R0.107 CC=C(C)C=CC(=O)CC(F)F 1458a_100000692105_100011934356 [0,2,0,0,0,0|2,0,0]=4 1243 B11R0.107 CC=C(C)C=CC(=O)NC(C)C 1626a_100138425928_100000692105 [0,2,0,0,0,0|1,0,0]=3 1244 B11R0.107 CNC(=O)C=CC(=O)CC(C)C 1458a_100016259477_100000210624 [0,2,0,0,0,0|2,0,0]=4 1245 B11R0.107 CNC(=O)C=CC(=O)CC(C)O 1458a_100016259477_100011218427 [0,2,0,0,0,0|2,0,0]=4 1246 B11R0.107 CNC(=O)C=CC(=O)NC(C)C 1626a_100138425928_100016259477 [0,2,0,0,0,0|2,0,0]=4 1247 B11R0.107 CNC(=O)C=CC(=O)OC(C)C 1626a_100102657272_200016297642 [0,2,0,0,0,0|1,0,0]=3 1248 B11R0.107 COC(=O)C=CC(=O)NC(C)C 1626a_100138425928_100016283253 [0,2,0,0,0,0|2,0,0]=4 1249 B11R0.139 C/C=C/C=CC(=O)C(C)C(=O)C 1458a_100000185730_100000179758 [0,2,0,0,0,0|1,0,1]=4 1250 B11R0.139 C/C=C/C=CC(=O)N(C)C(C)C 11a_200000211004_100000185730 [0,2,0,0,0,0|1,0,0]=3 1251 B11R0.139 C/C=C/C=CC(=O)N(C)C(C)C 1626a_200000211004_100000185730 [0,2,0,0,0,0|1,0,0]=3 1252 B11R0.139 C/C=C/C=CC(=O)N(C)C(C)C 240690a_200000211004_100000185730 [0,2,0,0,0,0|1,0,0]=3 1253 B11R0.154 C#CC(C)NC(=O)C=C/C=C/C 11a_100000707721_100000185730 [0,2,0,0,0,0|1,0,0]=3 1254 B11R0.154 C#CC(C)NC(=O)C=C/C=C/C 1626a_100000707721_100000185730 [0,2,0,0,0,0|1,0,0]=3 1255 B11R0.154 C#CC(C)NC(=O)C=C/C=C/C 240690a_100000707721_100000185730 [0,2,0,0,0,0|1,0,0]=3 1256 B11R0.154 C/C=C/C=CC(=O)CC(=O)CC 1458a_100000185730_100000747405 [0,2,0,0,0,0|1,0,0]=3 1257 B11R0.154 C/C=C/C=CC(=O)CC(=O)NC 1458a_100000185730_100000183359 [0,2,0,0,0,0|1,0,1]=4 1258 B11R0.154 C/C=C/C=CC(=O)CC(=O)OC 1458a_100000185730_100000747449 [0,2,0,0,0,0|1,0,1]=4 1259 B11R0.154 C/C=C/C=CC(=O)CC(C)CC 1458a_100000185730_100000748023 [0,2,0,0,0,0|1,0,0]=3 1260 B11R0.154 C/C=C/C=CC(=O)CC(O)CC 1458a_100000185730_100011218378 [0,2,0,0,0,0|1,0,0]=3 1261 B11R0.154 C/C=C/C=CC(=O)C[C@@H](C)CC 1458a_100000185730_100009816398 [0,2,0,0,0,0|1,0,0]=3 1262 B11R0.154 C/C=C/C=CC(=O)C[C@@H](C)CO 1458a_100000185730_100000059175 [0,2,0,0,0,0|1,0,0]=3 1263 B11R0.154 C/C=C/C=CC(=O)NC(C)C#N 11a_100000737613_100000185730 [0,2,0,0,0,0|1,0,0]=3 1264 B11R0.154 C/C=C/C=CC(=O)NC(C)C#N 1626a_100000737613_100000185730 [0,2,0,0,0,0|1,0,0]=3 1265 B11R0.154 C/C=C/C=CC(=O)NC(C)CC 11a_100000209981_100000185730 [0,2,0,0,0,0|1,0,0]=3 1266 B11R0.154 C/C=C/C=CC(=O)NC(C)CC 1626a_100000209981_100000185730 [0,2,0,0,0,0|1,0,0]=3 1267 B11R0.154 C/C=C/C=CC(=O)NC(C)CC 240690a_100000209981_100000185730 [0,2,0,0,0,0|1,0,0]=3 1268 B11R0.154 C/C=C/C=CC(=O)N[C@H](C)CF 11a_100102880703_100000185730 [0,2,0,0,0,0|1,0,0]=3 1269 B11R0.154 C/C=C/C=CC(=O)N[C@H](C)CF 1626a_100102880703_100000185730 [0,2,0,0,0,0|1,0,0]=3 1270 B11R0.154 C/C=C/C=CC(=O)N[C@H](C)CF 240690a_100102880703_100000185730 [0,2,0,0,0,0|1,0,0]=3 1271 B11R0.154 C/C=C/C=CC(=O)N[C@H](C)CO 240690a_100000737577_100000185730 [0,2,0,0,0,0|1,0,0]=3 1272 B11R0.165 C/C=C/C=CC(=O)C[Si](C)(C)C 1458a_100000185730_100000233785 [0,2,0,0,0,0|1,1,0]=4 1273 B11R0.165 C/C=C/C=CC(=O)NC(C)(C)C 11a_100000715429_100000185730 [0,2,0,0,0,0|1,0,0]=3 1274 B11R0.165 C/C=C/C=CC(=O)NC(C)(C)C 1626a_100000715429_100000185730 [0,2,0,0,0,0|1,0,0]=3 1275 B11R0.165 C/C=C/C=CC(=O)NC(C)(C)C 240690a_100000715429_100000185730 [0,2,0,0,0,0|1,0,0]=3 1276 B11R0.165 C/C=C/C=CC(=O)NS(=O)(=O)C 2740a_100000171171_100000185730 [0,2,0,0,0,0|2,0,0]=4 1277 B11R0.11 C/C=C/CC(=O)C(=O)NCCC 1458a_200011297150_100102629194 [0,2,0,0,0,0|1,0,1]=4 1278 B11R0.11 CC=CCC(=O)C(=O)NCCC 1458a_200011297150_100000070051 [0,2,0,0,0,0|1,0,1]=4 1279 B11R0.120 CC=C(C)C=CC(=O)C(C)CC 1458a_100000692105_100000758301 [0,2,0,0,0,0|1,0,0]=3 1280 B11R0.120 CC=C(C)C=CC(=O)N(C)CC 1626a_100000225621_100000692105 [0,2,0,0,0,0|1,0,0]=3 1281 B11R0.120 CCC(C)C(=O)C=CC(=O)NC 1458a_100016259477_100000758301 [0,2,0,0,0,0|2,0,0]=4 1282 B11R0.120 CCN(C)C(=O)C=CC(=O)NC 1626a_100000225621_100016259477 [0,2,0,0,0,0|2,0,0]=4 1283 B11R0.120 CCN(C)C(=O)C=CC(=O)OC 1626a_100000225621_100016283253 [0,2,0,0,0,0|2,0,0]=4 1284 B11R0.157 C/C=C/C=CC(=O)C(CC)CC 1458a_100000185730_100000210505 [0,2,0,0,0,0|1,0,0]=3 1285 B11R0.157 C/C=C/C=CC(=O)N(CC)CC 11a_100000724800_100000185730 [0,2,0,0,0,0|1,0,0]=3 1286 B11R0.157 C/C=C/C=CC(=O)N(CC)CC 1626a_100000724800_100000185730 [0,2,0,0,0,0|1,0,0]=3 1287 B11R0.157 C/C=C/C=CC(=O)N(CC)CC 240690a_100000724800_100000185730 [0,2,0,0,0,0|1,0,0]=3 1288 B11R0.46 C/C=C/C=CC(=NNC(C)C)C 4a_100000741168_100016268696 [0,2,0,0,0,0|2,0,0]=4 1289 B11R0.46 C/C=C/C=CC(=O)CC=C(C)C 1458a_100000185730_100000761012 [0,2,0,0,0,0|1,0,1]=4 1290 B11R0.46 C/C=C/C=CC(=O)CCC(C)C 1458a_100000185730_100000210312 [0,2,0,0,0,0|1,0,0]=3 1291 B11R0.46 C/C=C/C=CC(=O)CCC(C)O 1458a_100000185730_100012276601 [0,2,0,0,0,0|1,0,0]=3 1292 B11R0.46 C/C=C/C=CC(=O)NCC(=O)N 11a_100000711301_100000185730 [0,2,0,0,0,0|1,0,1]=4 1293 B11R0.46 C/C=C/C=CC(=O)NCC(=O)N 240690a_100000711301_100000185730 [0,2,0,0,0,0|1,0,1]=4 1294 B11R0.46 C/C=C/C=CC(=O)NCC(C)C 11a_100000210953_100000185730 [0,2,0,0,0,0|1,0,0]=3 1295 B11R0.46 C/C=C/C=CC(=O)NCC(C)C 1626a_100000210953_100000185730 [0,2,0,0,0,0|1,0,0]=3 1296 B11R0.46 C/C=C/C=CC(=O)NCC(C)C 240690a_100000210953_100000185730 [0,2,0,0,0,0|1,0,0]=3 1297 B11R0.46 C/C=C/C=CC(=O)NCC(C)O 11a_100000210904_100000185730 [0,2,0,0,0,0|1,0,0]=3 1298 B11R0.46 C/C=C/C=CC(=O)NCC(C)O 240690a_100000210904_100000185730 [0,2,0,0,0,0|1,0,0]=3 1299 B11R0.46 C/C=C/C=CC(=O)NCC(F)F 11a_100000765723_100000185730 [0,2,0,0,0,0|1,0,0]=3 1300 B11R0.46 C/C=C/C=CC(=O)NCC(F)F 1626a_100000765723_100000185730 [0,2,0,0,0,0|1,0,0]=3 1301 B11R0.46 C/C=C/C=CC(=O)NCC(F)F 240690a_100000765723_100000185730 [0,2,0,0,0,0|1,0,0]=3 1302 B11R0.46 C/C=C/C=CC(=O)NNC(=O)C 22a_100000189765_100000185730 [0,2,0,0,0,0|1,0,1]=4 1303 B11R0.46 C/C=C/C=CC(=O)NNC(C)C 22a_100000741168_100000185730 [0,2,0,0,0,0|1,0,0]=3 1304 B11R0.46 C=C(C)CCC(=O)C=C/C=C/C 1458a_100000185730_100000730704 [0,2,0,0,0,0|1,0,0]=3 1305 B11R0.46 C=C(C)CNC(=O)C=C/C=C/C 11a_100000765925_100000185730 [0,2,0,0,0,0|1,0,0]=3 1306 B11R0.46 C=C(C)CNC(=O)C=C/C=C/C 1626a_100000765925_100000185730 [0,2,0,0,0,0|1,0,0]=3 1307 B11R0.46 C=C(C)CNC(=O)C=C/C=C/C 240690a_100000765925_100000185730 [0,2,0,0,0,0|1,0,0]=3 1308 B11R0.46 CC/C=C\CC(=O)COC(C)C 1458a_100000745533_100103147603 [0,2,0,0,0,0|0,0,2]=4 1309 B11R0.70 C#CCCC(=O)C=CC(=CC)C 1458a_100000692105_100000753159 [0,2,0,0,0,0|1,0,1]=4 1310 B11R0.70 C#CCNC(=O)C=CC(=CC)C 1626a_100000212058_100000692105 [0,2,0,0,0,0|1,0,1]=4 1311 B11R0.70 C=CCCC(=O)C=CC(=CC)C 1458a_100000692105_100000754431 [0,2,0,0,0,0|1,0,1]=4 1312 B11R0.70 C=CCNC(=O)C=CC(=CC)C 1626a_100020586998_100000692105 [0,2,0,0,0,0|1,0,1]=4 1313 B11R0.70 C=CCOC(=O)C=CC(=O)NC 1626a_100102657272_200011996189 [0,2,0,0,0,0|1,0,1]=4 1314 B11R0.70 C=CCOC(=O)C=CC(=O)NC 240690a_100102657272_200011996189 [0,2,0,0,0,0|1,0,1]=4 1315 B11R0.70 CC#CCC(=O)C=CC(=CC)C 1458a_100000692105_100000748600 [0,2,0,0,0,0|1,0,1]=4 1316 B11R0.70 CC=C(C)C=CC(=O)C/C=C/C 1458a_100000692105_100102629194 [0,2,0,0,0,0|1,0,1]=4 1317 B11R0.70 CC=C(C)C=CC(=O)CCC#N 1458a_100000692105_100011215226 [0,2,0,0,0,0|1,0,1]=4 1318 B11R0.70 CC=C(C)C=CC(=O)CCCC 1458a_100000692105_100000210211 [0,2,0,0,0,0|1,0,0]=3 1319 B11R0.70 CC=C(C)C=CC(=O)CCCF 1458a_100000692105_100011934791 [0,2,0,0,0,0|1,0,0]=3 1320 B11R0.70 CC=C(C)C=CC(=O)CCCO 1458a_100000692105_100011215043 [0,2,0,0,0,0|1,0,0]=3 1321 B11R0.70 CC=C(C)C=CC(=O)CCOC 1458a_100000692105_100000233755 [0,2,0,0,0,0|1,0,0]=3 1322 B11R0.70 CC=C(C)C=CC(=O)CCSC 1458a_100000692105_100000751147 [0,2,0,0,0,0|1,0,0]=3 1323 B11R0.70 CC=C(C)C=CC(=O)NCC#N 1626a_100000734998_100000692105 [0,2,0,0,0,0|1,0,1]=4 1324 B11R0.70 CC=C(C)C=CC(=O)NCCC 1626a_100020643023_100000692105 [0,2,0,0,0,0|1,0,0]=3 1325 B11R0.70 CC=C(C)C=CC(=O)NCCF 1626a_100000724931_100000692105 [0,2,0,0,0,0|1,0,0]=3 1326 B11R0.70 CC=C(C)C=CC(=O)NNCC 22a_100000756455_100000692105 [0,2,0,0,0,0|1,0,0]=3 1327 B11R0.70 CC=CCC(=O)C=CC(=CC)C 1458a_100000692105_100000070051 [0,2,0,0,0,0|1,0,1]=4 1328 B11R0.70 CCCCC(=O)C=CC(=O)NC 1458a_100016259477_100000210211 [0,2,0,0,0,0|2,0,0]=4 1329 B11R0.70 CCCNC(=O)C=CC(=O)NC 1626a_100020643023_100016259477 [0,2,0,0,0,0|2,0,0]=4 1330 B11R0.70 CCCNC(=O)C=CC(=O)OC 1626a_100020643023_100016283253 [0,2,0,0,0,0|2,0,0]=4 1331 B11R0.70 CCNNC(=O)C=CC(=O)NC 22a_100000756455_100016259477 [0,2,0,0,0,0|2,0,0]=4 1332 B11R0.70 CCNNC(=O)C=CC(=O)OC 22a_100000756455_100016283253 [0,2,0,0,0,0|2,0,0]=4 1333 B11R0.70 CNC(=O)C=CC(=O)CCCF 1458a_100016259477_100011934791 [0,2,0,0,0,0|2,0,0]=4 1334 B11R0.70 CNC(=O)C=CC(=O)CCCO 1458a_100016259477_100011215043 [0,2,0,0,0,0|2,0,0]=4 1335 B11R0.70 CNC(=O)C=CC(=O)CCOC 1458a_100016259477_100000233755 [0,2,0,0,0,0|2,0,0]=4 1336 B11R0.70 CNC(=O)C=CC(=O)CCSC 1458a_100016259477_100000751147 [0,2,0,0,0,0|2,0,0]=4 1337 B11R0.70 CNC(=O)C=CC(=O)NCCF 1626a_100000724931_100016259477 [0,2,0,0,0,0|2,0,0]=4 1338 B11R0.70 COC(=O)C=CC(=O)NCCF 1626a_100000724931_100016283253 [0,2,0,0,0,0|2,0,0]=4 1339 B11R0.140 C#CCCCC(=O)C=C/C=C/C 1458a_100000185730_100000731252 [0,2,0,0,0,0|1,0,0]=3 1340 B11R0.140 C#CCCNC(=O)C=C/C=C/C 11a_100000755551_100000185730 [0,2,0,0,0,0|1,0,0]=3 1341 B11R0.140 C#CCCNC(=O)C=C/C=C/C 1626a_100000755551_100000185730 [0,2,0,0,0,0|1,0,0]=3 1342 B11R0.140 C#CCCNC(=O)C=C/C=C/C 240690a_100000755551_100000185730 [0,2,0,0,0,0|1,0,0]=3 1343 B11R0.140 C/C=C/C=CC(=NNCCC)C 4a_100000740057_100016268696 [0,2,0,0,0,0|2,0,0]=4 1344 B11R0.140 C/C=C/C=CC(=NNCCO)C 4a_100000210001_100016268696 [0,2,0,0,0,0|2,0,0]=4 1345 B11R0.140 C/C=C/C=CC(=O)C/C=C\CC 1458a_100000185730_100103147603 [0,2,0,0,0,0|1,0,0]=3 1346 B11R0.140 C/C=C/C=CC(=O)CC#CCC 1458a_100000185730_100009813939 [0,2,0,0,0,0|1,0,0]=3 1347 B11R0.140 C/C=C/C=CC(=O)CC#CCO 1458a_100000185730_200000047223 [0,2,0,0,0,0|1,0,1]=4 1348 B11R0.140 C/C=C/C=CC(=O)CCCC#N 1458a_100000185730_100000211468 [0,2,0,0,0,0|1,0,0]=3 1349 B11R0.140 C/C=C/C=CC(=O)CCCCC 1458a_100000185730_100000210326 [0,2,0,0,0,0|1,0,0]=3 1350 B11R0.140 C/C=C/C=CC(=O)CCCCF 1458a_100000185730_100000729493 [0,2,0,0,0,0|1,0,0]=3 1351 B11R0.140 C/C=C/C=CC(=O)CCCCO 1458a_100000185730_100000210776 [0,2,0,0,0,0|1,0,0]=3 1352 B11R0.140 C/C=C/C=CC(=O)CCCOC 1458a_100000185730_100000740836 [0,2,0,0,0,0|1,0,0]=3 1353 B11R0.140 C/C=C/C=CC(=O)CCOCC 1458a_100000185730_100011215890 [0,2,0,0,0,0|0,0,0]=2 1354 B11R0.140 C/C=C/C=CC(=O)CCSCC 1458a_100000185730_100000757381 [0,2,0,0,0,0|0,1,0]=3 1355 B11R0.140 C/C=C/C=CC(=O)NCCC#N 11a_100000720768_100000185730 [0,2,0,0,0,0|1,0,0]=3 1356 B11R0.140 C/C=C/C=CC(=O)NCCC#N 1626a_100000720768_100000185730 [0,2,0,0,0,0|1,0,0]=3 1357 B11R0.140 C/C=C/C=CC(=O)NCCC#N 240690a_100000720768_100000185730 [0,2,0,0,0,0|1,0,0]=3 1358 B11R0.140 C/C=C/C=CC(=O)NCCCC 11a_100000102301_100000185730 [0,2,0,0,0,0|1,0,0]=3 1359 B11R0.140 C/C=C/C=CC(=O)NCCCC 1626a_100000102301_100000185730 [0,2,0,0,0,0|1,0,0]=3 1360 B11R0.140 C/C=C/C=CC(=O)NCCCC 240690a_100000102301_100000185730 [0,2,0,0,0,0|1,0,0]=3 1361 B11R0.140 C/C=C/C=CC(=O)NCCCF 11a_100015189416_100000185730 [0,2,0,0,0,0|1,0,0]=3 1362 B11R0.140 C/C=C/C=CC(=O)NCCCF 1626a_100015189416_100000185730 [0,2,0,0,0,0|1,0,0]=3 1363 B11R0.140 C/C=C/C=CC(=O)NCCCF 240690a_100015189416_100000185730 [0,2,0,0,0,0|1,0,0]=3 1364 B11R0.140 C/C=C/C=CC(=O)NCCCO 240690a_100000182051_100000185730 [0,2,0,0,0,0|1,0,0]=3 1365 B11R0.140 C/C=C/C=CC(=O)NCCOC 1626a_100000209980_100000185730 [0,2,0,0,0,0|1,0,0]=3 1366 B11R0.140 C/C=C/C=CC(=O)NCCOC 240690a_100000209980_100000185730 [0,2,0,0,0,0|1,0,0]=3 1367 B11R0.140 C/C=C/C=CC(=O)NCCSC 11a_100020590264_100000185730 [0,2,0,0,0,0|1,0,0]=3 1368 B11R0.140 C/C=C/C=CC(=O)NCCSC 1626a_100020590264_100000185730 [0,2,0,0,0,0|1,0,0]=3 1369 B11R0.140 C/C=C/C=CC(=O)NCCSC 240690a_100020590264_100000185730 [0,2,0,0,0,0|1,0,0]=3 1370 B11R0.140 C/C=C/C=CC(=O)NNCCC 22a_100000740057_100000185730 [0,2,0,0,0,0|1,0,0]=3 1371 B11R0.140 C/C=C/C=CC(=O)NNCCO 22a_100000210001_100000185730 [0,2,0,0,0,0|1,0,0]=3 1372 B11R0.140 C=CCCCC(=O)C=C/C=C/C 1458a_100000185730_100000757094 [0,2,0,0,0,0|1,0,0]=3 1373 B11R0.140 C=CCCNC(=O)C=C/C=C/C 11a_100015191253_100000185730 [0,2,0,0,0,0|1,0,0]=3 1374 B11R0.140 C=CCCNC(=O)C=C/C=C/C 1626a_100015191253_100000185730 [0,2,0,0,0,0|1,0,0]=3 1375 B11R0.140 C=CCCNC(=O)C=C/C=C/C 240690a_100015191253_100000185730 [0,2,0,0,0,0|1,0,0]=3 1376 B11R0.140 C=CCNNC(=O)C=C/C=C/C 22a_100020588587_100000185730 [0,2,0,0,0,0|1,0,1]=4 1377 B11R0.140 C=COCCC(=O)C=C/C=C/C 1458a_100000185730_100000039644 [0,2,0,0,0,0|0,0,2]=4 1378 B11R0.140 CC#CCNC(=O)C=C/C=C/C 11a_100000685387_100000185730 [0,2,0,0,0,0|1,0,0]=3 1379 B11R0.140 CC#CCNC(=O)C=C/C=C/C 1626a_100000685387_100000185730 [0,2,0,0,0,0|1,0,0]=3 1380 B11R0.140 CC/C=C/CC(=O)CCOCC 1458a_100016274230_100011215890 [0,2,0,0,0,0|0,0,2]=4 1381 B11R0.140 CC/C=C\CC(=O)C=COCC 1458a_100016266692_100103147603 [0,2,0,0,0,0|0,0,2]=4 1382 B11R0.140 CC/C=C\CC(=O)CCOCC 1458a_100000749530_100103147603 [0,2,0,0,0,0|0,0,2]=4 1383 B11R0.140 CC/C=C\CC(=O)COCCC 1458a_100000745993_100103147603 [0,2,0,0,0,0|0,0,2]=4 1384 B11R0.140 CC/C=C\CC(=O)COCCO 1458a_100000708028_100103147603 [0,2,0,0,0,0|0,0,2]=4 1385 B11R0.140 CCCC=CC(=O)CCOCC 1458a_100000212230_100011215890 [0,2,0,0,0,0|0,0,2]=4 1386 B11R0.140 CCOC=CC(=O)CCOCC 1458a_100016266692_100011215890 [0,2,0,0,0,0|1,0,1]=4 1387 B11R0.140 CCOCCC(=O)C=CCOC 1458a_100016285016_100011215890 [0,2,0,0,0,0|1,0,1]=4 1388 B9R1.7 CCOc1ccn(n1)C 34a_100012642153_100000210202 [1,0,0,1,0,0|2,0,0]=4 1389 B9R1.7 CCSc1ccc(s1)C 62a_100000031368_100000210202 [1,0,0,1,0,0|0,2,0]=4 1390 B9R1.7 CCSc1ccc(s1)C 62a_100000210202_100000031368 [1,0,0,1,0,0|0,2,0]=4 1391 B9R1.8 CCNc1ccccc1 34a_100000106764_100000210202 [1,0,0,1,0,0|2,0,0]=4 1392 B9R1.8 CCOc1ccccc1 34a_100000210340_100000210202 [1,0,0,1,0,0|1,0,0]=3 1393 B9R1.8 CCOc1ccccc1 7a_100000210340_100000210202 [1,0,0,1,0,0|1,0,0]=3 1394 B9R1.8 CCOc1cccnc1 34a_100000210849_100000210202 [1,0,0,1,0,0|2,0,0]=4 1395 B9R1.8 CCOc1cccnc1 7a_100000210849_100000210202 [1,0,0,1,0,0|2,0,0]=4 1396 B9R1.8 CCOc1ccncc1 34a_100000212176_100000210202 [1,0,0,1,0,0|2,0,0]=4 1397 B9R1.8 CCSc1ccccc1 62a_100000210202_100000041952 [1,0,0,1,0,0|1,1,0]=4 1398 B9R1.8 CCSc1ccccc1 62a_100000719477_100000210202 [1,0,0,1,0,0|1,1,0]=4 1399 B9R1.8 CCSc1ccccn1 62a_100000210202_100011216584 [1,0,0,1,0,0|1,1,0]=4 1400 B9R1.8 CCSc1ccccn1 62a_100011216584_100000210202 [1,0,0,1,0,0|1,1,0]=4 1401 B9R1.8 FCOc1ccccc1 34a_100000210340_100015361967 [1,0,0,1,0,0|2,0,0]=4 1402 B9R1.8 FCOc1ccccc1 7a_100000210340_100015361967 [1,0,0,1,0,0|2,0,0]=4 1403 B9R1.15 CCc1ccccc1O 271570a_203496583355_100011215823 [1,0,0,1,0,0|1,0,1]=4 1404 B9R1.100 C/C=C/CC(=O)C1CC1 1458a_100000210395_100102629194 [1,0,0,1,0,0|1,0,1]=4 1405 B9R1.100 CC=CCC(=O)C1CC1 1458a_100000210395_100000070051 [1,0,0,1,0,0|1,0,1]=4 1406 B9R1.3 Cc1cccc(c1C)O 271570a_203496583355_100011214922 [1,0,0,1,0,0|0,0,2]=4 1407 B9R1.3 Cn1c(cccc1=O)O 271570a_203496583355_100000726605 [1,0,0,1,0,0|2,0,0]=4 1408 B9R1.11 CCC(=O)C1=CCCC1 1458a_100000038896_100000210202 [1,0,0,1,0,0|0,0,2]=4 1409 B9R1.11 CCC(=O)C1=CCOC1 1458a_100000139269_100000210202 [1,0,0,1,0,0|1,0,1]=4 1410 B9R1.11 CCC(=O)C1=COCC1 1458a_100000750620_100000210202 [1,0,0,1,0,0|1,0,1]=4 1411 B9R1.11 CCC(=O)C1CC=CC1 1458a_100000759439_100000210202 [1,0,0,1,0,0|0,0,2]=4 1412 B9R1.11 CCC(=O)N1CC=CC1 1626a_100015195280_100000210414 [1,0,0,1,0,0|1,0,1]=4 1413 B9R1.11 CCC(=O)N1CC=CC1 240690a_100015195280_100000210414 [1,0,0,1,0,0|1,0,1]=4 1414 B9R1.21 C=Cc1ccc(s1)CC 271570a_100011290941_100009844052 [1,0,0,1,0,0|0,1,1]=4 1415 B9R1.21 CCc1ccc(s1)SC 62a_100009844052_200000210301 [1,0,0,1,0,0|1,1,0]=4 1416 B9R1.21 CCc1ccc(s1)SC 62a_200000210301_100009844052 [1,0,0,1,0,0|1,1,0]=4 1417 B9R1.21 CCc1ccc(s1)S[13CH3] 62a_100009844052_200025704644 [1,0,0,1,0,0|1,1,0]=4 1418 B9R1.21 CCc1ccc(s1)S[13CH3] 62a_200025704644_100009844052 [1,0,0,1,0,0|1,1,0]=4 1419 B9R1.79 CCC(=O)C=C1CCC1 1458a_100000686340_100000210202 [1,0,0,1,0,0|0,0,2]=4 1420 B9R1.80 CCC(=O)C=CC1CC1 1458a_100102529529_100000210202 [1,0,0,1,0,0|0,0,2]=4 1421 B11R1.16 CCCC(=O)c1ccccc1 1458a_100000185807_100000210303 [0,1,0,1,0,0|1,0,1]=4 1422 B11R1.16 CCNC(=O)c1ccccc1 11a_100015525214_100000185807 [0,1,0,1,0,0|1,0,1]=4 1423 B11R1.16 CCNC(=O)c1ccccc1 240690a_100015525214_100000185807 [0,1,0,1,0,0|1,0,1]=4 1424 B11R1.16 CCNC(=O)c1ccccc1 527a_100015525214_100000185807 [0,1,0,1,0,0|1,0,1]=4 1425 B11R1.24 C#CCOc1cccc(c1)C 34a_100000210337_100000184674 [0,1,0,1,0,0|1,0,1]=4 1426 B11R1.24 C#CCOc1cccc(c1)C 7a_100000210337_100000038162 [0,1,0,1,0,0|1,0,1]=4 1427 B11R1.24 C=CCOc1cccc(c1)C 34a_100000210337_100015514636 [0,1,0,1,0,0|1,0,1]=4 1428 B11R1.24 C=CCOc1cccc(c1)C 7a_100000210337_100015514636 [0,1,0,1,0,0|1,0,1]=4 1429 B11R1.24 CC=CCN1CCOC(=O)C1 2230a_100000131268_100000070051 [0,1,0,1,0,0|0,0,2]=4 1430 B11R1.24 CCCCc1cccc(c1)C 271570a_100020621405_100011215228 [0,1,0,1,0,0|2,0,0]=4 1431 B11R1.24 CCCCc1cccc(n1)C 271570a_100020621405_100000742759 [0,1,0,1,0,0|2,0,0]=4 1432 B11R1.24 CCCNc1cccc(c1)C 2230a_100000188690_100000210303 [0,1,0,1,0,0|2,0,0]=4 1433 B11R1.24 CCCNc1cccc(c1)C 34a_100000188690_100000210303 [0,1,0,1,0,0|2,0,0]=4 1434 B11R1.24 CCCOc1cccc(=O)[nH]1 34a_100000033347_100000210303 [0,1,0,1,0,0|2,0,0]=4 1435 B11R1.24 CCCOc1cccc(c1)Br 34a_100000210342_100000210303 [0,1,0,1,0,0|2,0,0]=4 1436 B11R1.24 CCCOc1cccc(c1)Br 7a_100000210342_100000210303 [0,1,0,1,0,0|2,0,0]=4 1437 B11R1.24 CCCOc1cccc(c1)C 34a_100000210337_100000210303 [0,1,0,1,0,0|1,0,0]=3 1438 B11R1.24 CCCOc1cccc(c1)C 7a_100000210337_100000210303 [0,1,0,1,0,0|1,0,0]=3 1439 B11R1.24 CCCOc1cccc(c1)Cl 34a_100000210295_100000210303 [0,1,0,1,0,0|2,0,0]=4 1440 B11R1.24 CCCOc1cccc(c1)Cl 7a_100000210295_100000210303 [0,1,0,1,0,0|2,0,0]=4 1441 B11R1.24 CCCOc1cccc(c1)F 34a_100000210426_100000210303 [0,1,0,1,0,0|2,0,0]=4 1442 B11R1.24 CCCOc1cccc(c1)F 7a_100000210426_100000210303 [0,1,0,1,0,0|2,0,0]=4 1443 B11R1.24 CCCOc1cccc(c1)I 34a_100000211634_100000210303 [0,1,0,1,0,0|2,0,0]=4 1444 B11R1.24 CCCOc1cccc(c1)I 7a_100000211634_100000210303 [0,1,0,1,0,0|2,0,0]=4 1445 B11R1.24 CCCOc1cccc(c1)N 34a_100000210217_100000210303 [0,1,0,1,0,0|2,0,0]=4 1446 B11R1.24 CCCOc1cccc(c1)O 271570a_203496583355_100000170004 [0,1,0,1,0,0|2,0,0]=4 1447 B11R1.24 CCCOc1cccc(n1)F 34a_100011432558_100000210303 [0,1,0,1,0,0|2,0,0]=4 1448 B11R1.24 CCCOc1cccc(n1)O 271570a_203496583355_200011960250 [0,1,0,1,0,0|2,0,0]=4 1449 B11R1.24 CCCOc1ccnc(c1)C 34a_100000688365_100000210303 [0,1,0,1,0,0|2,0,0]=4 1450 B11R1.24 CCCOc1cncc(c1)C 34a_100011830280_100000210303 [0,1,0,1,0,0|2,0,0]=4 1451 B11R1.24 CCCOc1cncc(c1)C 7a_100011830280_100000210303 [0,1,0,1,0,0|2,0,0]=4 1452 B11R1.24 CCCSc1cccc(c1)C 62a_100000210303_100011215228 [0,1,0,1,0,0|1,1,0]=4 1453 B11R1.24 CCCSc1cccc(c1)C 62a_100011215228_100000210303 [0,1,0,1,0,0|1,1,0]=4 1454 B11R1.24 CCCSc1cccc(n1)C 62a_100000210303_100000742759 [0,1,0,1,0,0|1,1,0]=4 1455 B11R1.24 CCCSc1cccc(n1)C 62a_100000742759_100000210303 [0,1,0,1,0,0|1,1,0]=4 1456 B11R1.24 CCNCc1cccc(c1)C 207a_100015525214_100000211157 [0,1,0,1,0,0|2,0,0]=4 1457 B11R1.24 CCNCc1cccc(c1)C 2230a_100000185548_100000210202 [0,1,0,1,0,0|2,0,0]=4 1458 B11R1.24 CCNCc1cccc(c1)C 2230a_100015525214_100000211840 [0,1,0,1,0,0|2,0,0]=4 1459 B11R1.24 CCNCc1cccc(c1)C 270004a_100015525214_100000211157 [0,1,0,1,0,0|2,0,0]=4 1460 B11R1.24 CCNCc1cccc(c1)C 34a_100000185548_100000210202 [0,1,0,1,0,0|2,0,0]=4 1461 B11R1.24 CCNCc1cccc(n1)C 207a_100015525214_100011215050 [0,1,0,1,0,0|2,0,0]=4 1462 B11R1.24 CCNCc1cccc(n1)C 2230a_100015525214_100000757606 [0,1,0,1,0,0|2,0,0]=4 1463 B11R1.24 CCNCc1cccc(n1)C 270004a_100015525214_100011215050 [0,1,0,1,0,0|2,0,0]=4 1464 B11R1.24 CCNCc1cccc(n1)C 34a_100000701342_100000210202 [0,1,0,1,0,0|2,0,0]=4 1465 B11R1.24 CCOCc1cc(ccn1)C 34a_100011998357_100000210202 [0,1,0,1,0,0|2,0,0]=4 1466 B11R1.24 CCOCc1cc(ccn1)C 34a_100121572206_100000718516 [0,1,0,1,0,0|2,0,0]=4 1467 B11R1.24 CCOCc1cccc(c1)Br 34a_100000687537_100000210202 [0,1,0,1,0,0|2,0,0]=4 1468 B11R1.24 CCOCc1cccc(c1)Br 34a_100121572206_100000698116 [0,1,0,1,0,0|2,0,0]=4 1469 B11R1.24 CCOCc1cccc(c1)Br 7a_100000687537_100000210202 [0,1,0,1,0,0|2,0,0]=4 1470 B11R1.24 CCOCc1cccc(c1)C 34a_100011217746_100000210202 [0,1,0,1,0,0|1,0,0]=3 1471 B11R1.24 CCOCc1cccc(c1)C 34a_100121572206_100000211840 [0,1,0,1,0,0|1,0,0]=3 1472 B11R1.24 CCOCc1cccc(c1)C 7a_100011217746_100000210202 [0,1,0,1,0,0|1,0,0]=3 1473 B11R1.24 CCOCc1cccc(c1)Cl 34a_100000241301_100000210202 [0,1,0,1,0,0|2,0,0]=4 1474 B11R1.24 CCOCc1cccc(c1)Cl 34a_100121572206_100000187163 [0,1,0,1,0,0|2,0,0]=4 1475 B11R1.24 CCOCc1cccc(c1)Cl 7a_100000241301_100000210202 [0,1,0,1,0,0|2,0,0]=4 1476 B11R1.24 CCOCc1cccc(c1)F 34a_100000210976_100000210202 [0,1,0,1,0,0|2,0,0]=4 1477 B11R1.24 CCOCc1cccc(c1)F 34a_100121572206_100000187166 [0,1,0,1,0,0|2,0,0]=4 1478 B11R1.24 CCOCc1cccc(c1)F 7a_100000210976_100000210202 [0,1,0,1,0,0|2,0,0]=4 1479 B11R1.24 CCOCc1cccc(c1)I 34a_100011215336_100000210202 [0,1,0,1,0,0|2,0,0]=4 1480 B11R1.24 CCOCc1cccc(c1)I 34a_100121572206_100011218688 [0,1,0,1,0,0|2,0,0]=4 1481 B11R1.24 CCOCc1cccc(c1)I 7a_100011215336_100000210202 [0,1,0,1,0,0|2,0,0]=4 1482 B11R1.24 CCOCc1cccc(c1)N 34a_100000211919_100000210202 [0,1,0,1,0,0|2,0,0]=4 1483 B11R1.24 CCOCc1cccc(c1)O 271570a_203496583355_100011493694 [0,1,0,1,0,0|2,0,0]=4 1484 B11R1.24 CCOCc1cccc(c1)O 34a_100121572206_100011660834 [0,1,0,1,0,0|2,0,0]=4 1485 B11R1.24 CCOCc1cccc(n1)Br 34a_100000694195_100000210202 [0,1,0,1,0,0|2,0,0]=4 1486 B11R1.24 CCOCc1cccc(n1)Br 34a_100121572206_100009889011 [0,1,0,1,0,0|2,0,0]=4 1487 B11R1.24 CCOCc1cccc(n1)C 34a_100000690600_100000210202 [0,1,0,1,0,0|1,0,0]=3 1488 B11R1.24 CCOCc1cccc(n1)C 34a_100121572206_100000757606 [0,1,0,1,0,0|1,0,0]=3 1489 B11R1.24 CCOCc1cccc(n1)Cl 34a_100011998359_100000210202 [0,1,0,1,0,0|2,0,0]=4 1490 B11R1.24 CCOCc1cccc(n1)Cl 34a_100121572206_100000086093 [0,1,0,1,0,0|2,0,0]=4 1491 B11R1.24 CCOCc1cccc(n1)F 34a_100000086748_100000210202 [0,1,0,1,0,0|2,0,0]=4 1492 B11R1.24 CCOCc1cccc(n1)F 34a_100121572206_100009819644 [0,1,0,1,0,0|2,0,0]=4 1493 B11R1.24 CCOCc1ccnc(c1)C 34a_100011998630_100000210202 [0,1,0,1,0,0|2,0,0]=4 1494 B11R1.24 CCOCc1ccnc(c1)C 34a_100121572206_200020672517 [0,1,0,1,0,0|2,0,0]=4 1495 B11R1.24 CCOCc1cncc(c1)C 34a_100011998709_100000210202 [0,1,0,1,0,0|2,0,0]=4 1496 B11R1.24 CCOCc1cncc(c1)C 34a_100121572206_100000716715 [0,1,0,1,0,0|2,0,0]=4 1497 B11R1.24 CCOCc1cncc(c1)C 7a_100011998709_100000210202 [0,1,0,1,0,0|2,0,0]=4 1498 B11R1.24 CCSCc1cccc(c1)C 62a_100000210202_100000211840 [0,1,0,1,0,0|1,1,0]=4 1499 B11R1.24 CCSCc1cccc(c1)C 62a_100000211840_100000210202 [0,1,0,1,0,0|1,1,0]=4 1500 B11R1.24 CCSCc1cccc(n1)C 62a_100000210202_100000757606 [0,1,0,1,0,0|1,1,0]=4 1501 B11R1.24 CCSCc1cccc(n1)C 62a_100000757606_100000210202 [0,1,0,1,0,0|1,1,0]=4 1502 B11R1.24 CNCCc1cccc(c1)C 2230a_100000749837_200000210301 [0,1,0,1,0,0|2,0,0]=4 1503 B11R1.24 CNCCc1cccc(c1)C 2230a_106832991635_100011713685 [0,1,0,1,0,0|2,0,0]=4 1504 B11R1.24 CNCCc1cccc(c1)C 34a_100000749837_200000210301 [0,1,0,1,0,0|2,0,0]=4 1505 B11R1.24 CNCCc1cccc(c1)C 34a_100102657272_100011713685 [0,1,0,1,0,0|2,0,0]=4 1506 B11R1.24 CNCCc1cccc(c1)C 7a_106832991635_100011713685 [0,1,0,1,0,0|2,0,0]=4 1507 B11R1.24 CNCCc1cccc(n1)C 2230a_100011824523_200000210301 [0,1,0,1,0,0|2,0,0]=4 1508 B11R1.24 CNCCc1cccc(n1)C 34a_100011824523_200000210301 [0,1,0,1,0,0|2,0,0]=4 1509 B11R1.24 COCCc1cccc(c1)C 34a_100011217157_200000210301 [0,1,0,1,0,0|2,0,0]=4 1510 B11R1.24 COCCc1cccc(c1)C 34a_100138415774_100011713685 [0,1,0,1,0,0|2,0,0]=4 1511 B11R1.24 COCCc1cccc(c1)C 7a_100011217157_200000210301 [0,1,0,1,0,0|2,0,0]=4 1512 B11R1.24 COCNc1cccc(c1)C 2230a_100000188690_100000766300 [0,1,0,1,0,0|2,0,0]=4 1513 B11R1.24 COCOc1cccc(c1)O 271570a_203496583355_100012265688 [0,1,0,1,0,0|2,0,0]=4 1514 B11R1.24 COCSc1cccc(c1)C 62a_100000766300_100011215228 [0,1,0,1,0,0|1,1,0]=4 1515 B11R1.24 COCSc1cccc(c1)C 62a_100011215228_100000766300 [0,1,0,1,0,0|1,1,0]=4 1516 B11R1.24 COCSc1cccc(n1)C 62a_100000742759_100000766300 [0,1,0,1,0,0|1,1,0]=4 1517 B11R1.24 COCSc1cccc(n1)C 62a_100000766300_100000742759 [0,1,0,1,0,0|1,1,0]=4 1518 B11R1.24 CSCCc1cccc(c1)C 62a_100011713685_200000210301 [0,1,0,1,0,0|2,0,0]=4 1519 B11R1.24 CSCCc1cccc(c1)C 62a_200000210301_100011713685 [0,1,0,1,0,0|2,0,0]=4 1520 B11R1.24 CSCNc1cccc(c1)C 2230a_100000188690_100011218213 [0,1,0,1,0,0|2,0,0]=4 1521 B11R1.24 CSCNc1cccc(c1)C 34a_100000188690_100011218213 [0,1,0,1,0,0|2,0,0]=4 1522 B11R1.24 CSCOc1cccc(=O)[nH]1 34a_100000033347_100011218213 [0,1,0,1,0,0|2,0,0]=4 1523 B11R1.24 CSCOc1cccc(c1)Br 34a_100000210342_100011218213 [0,1,0,1,0,0|2,0,0]=4 1524 B11R1.24 CSCOc1cccc(c1)C 34a_100000210337_100011218213 [0,1,0,1,0,0|1,0,0]=3 1525 B11R1.24 CSCOc1cccc(c1)Cl 34a_100000210295_100011218213 [0,1,0,1,0,0|2,0,0]=4 1526 B11R1.24 CSCOc1cccc(c1)F 34a_100000210426_100011218213 [0,1,0,1,0,0|2,0,0]=4 1527 B11R1.24 CSCOc1cccc(c1)I 34a_100000211634_100011218213 [0,1,0,1,0,0|2,0,0]=4 1528 B11R1.24 CSCOc1cccc(c1)N 34a_100000210217_100011218213 [0,1,0,1,0,0|2,0,0]=4 1529 B11R1.24 CSCOc1cccc(n1)F 34a_100011432558_100011218213 [0,1,0,1,0,0|2,0,0]=4 1530 B11R1.24 CSCOc1ccnc(c1)C 34a_100000688365_100011218213 [0,1,0,1,0,0|2,0,0]=4 1531 B11R1.24 CSCOc1cncc(c1)C 34a_100011830280_100011218213 [0,1,0,1,0,0|2,0,0]=4 1532 B11R1.24 CSCSc1cccc(c1)C 62a_100011215228_100011218213 [0,1,0,1,0,0|1,1,0]=4 1533 B11R1.24 CSCSc1cccc(c1)C 62a_100011218213_100011215228 [0,1,0,1,0,0|1,1,0]=4 1534 B11R1.24 CSCSc1cccc(n1)C 62a_100000742759_100011218213 [0,1,0,1,0,0|1,1,0]=4 1535 B11R1.24 CSCSc1cccc(n1)C 62a_100011218213_100000742759 [0,1,0,1,0,0|1,1,0]=4 1536 B11R1.24 Cc1cc(ccn1)OCCF 34a_100000688365_100011217306 [0,1,0,1,0,0|2,0,0]=4 1537 B11R1.24 Cc1cc(ccn1)OCCO 34a_100000688365_100000211926 [0,1,0,1,0,0|2,0,0]=4 1538 B11R1.24 Cc1cccc(c1)CCN[13CH3] 2230a_100000749837_200025704644 [0,1,0,1,0,0|2,0,0]=4 1539 B11R1.24 Cc1cccc(c1)CCN[13CH3] 34a_100000749837_200025704644 [0,1,0,1,0,0|2,0,0]=4 1540 B11R1.24 Cc1cccc(c1)CCO[13CH3] 34a_100011217157_200025704644 [0,1,0,1,0,0|2,0,0]=4 1541 B11R1.24 Cc1cccc(c1)CCO[13CH3] 7a_100011217157_200025704644 [0,1,0,1,0,0|2,0,0]=4 1542 B11R1.24 Cc1cccc(c1)CCS[13CH3] 62a_100011713685_200025704644 [0,1,0,1,0,0|2,0,0]=4 1543 B11R1.24 Cc1cccc(c1)CCS[13CH3] 62a_200025704644_100011713685 [0,1,0,1,0,0|2,0,0]=4 1544 B11R1.24 Cc1cccc(c1)COCF 34a_100011217746_100015361967 [0,1,0,1,0,0|2,0,0]=4 1545 B11R1.24 Cc1cccc(c1)COCF 7a_100011217746_100015361967 [0,1,0,1,0,0|2,0,0]=4 1546 B11R1.24 Cc1cccc(c1)NCCF 2230a_100000188690_100011217306 [0,1,0,1,0,0|2,0,0]=4 1547 B11R1.24 Cc1cccc(c1)NCCF 34a_100000188690_100011217306 [0,1,0,1,0,0|2,0,0]=4 1548 B11R1.24 Cc1cccc(c1)NCCO 2230a_100000188690_100000211926 [0,1,0,1,0,0|2,0,0]=4 1549 B11R1.24 Cc1cccc(c1)NCCO 34a_100000188690_100000211926 [0,1,0,1,0,0|2,0,0]=4 1550 B11R1.24 Cc1cccc(c1)OCC#N 7a_100000210337_100011215382 [0,1,0,1,0,0|1,0,1]=4 1551 B11R1.24 Cc1cccc(c1)OCC=O 34a_100000210337_200009817547 [0,1,0,1,0,0|1,0,1]=4 1552 B11R1.24 Cc1cccc(c1)OCC=O 7a_100000210337_200015260668 [0,1,0,1,0,0|1,0,1]=4 1553 B11R1.24 Cc1cccc(c1)OCCF 34a_100000210337_100011217306 [0,1,0,1,0,0|1,0,0]=3 1554 B11R1.24 Cc1cccc(c1)OCCF 7a_100000210337_100011217306 [0,1,0,1,0,0|1,0,0]=3 1555 B11R1.24 Cc1cccc(c1)OCCO 34a_100000210337_100000211926 [0,1,0,1,0,0|1,0,0]=3 1556 B11R1.24 Cc1cccc(c1)OCCO 7a_100000210337_100000211926 [0,1,0,1,0,0|1,0,0]=3 1557 B11R1.24 Cc1cccc(c1)SCCF 62a_100011215228_100011217306 [0,1,0,1,0,0|1,1,0]=4 1558 B11R1.24 Cc1cccc(c1)SCCF 62a_100011217306_100011215228 [0,1,0,1,0,0|1,1,0]=4 1559 B11R1.24 Cc1cccc(c1)SCCO 62a_100000211926_100011215228 [0,1,0,1,0,0|1,1,0]=4 1560 B11R1.24 Cc1cccc(c1)SCCO 62a_100011215228_100000211926 [0,1,0,1,0,0|1,1,0]=4 1561 B11R1.24 Cc1cccc(n1)CCN[13CH3] 2230a_100011824523_200025704644 [0,1,0,1,0,0|2,0,0]=4 1562 B11R1.24 Cc1cccc(n1)CCN[13CH3] 34a_100011824523_200025704644 [0,1,0,1,0,0|2,0,0]=4 1563 B11R1.24 Cc1cccc(n1)COCF 34a_100000690600_100015361967 [0,1,0,1,0,0|2,0,0]=4 1564 B11R1.24 Cc1cccc(n1)SCCF 62a_100000742759_100011217306 [0,1,0,1,0,0|1,1,0]=4 1565 B11R1.24 Cc1cccc(n1)SCCF 62a_100011217306_100000742759 [0,1,0,1,0,0|1,1,0]=4 1566 B11R1.24 Cc1cccc(n1)SCCO 62a_100000211926_100000742759 [0,1,0,1,0,0|1,1,0]=4 1567 B11R1.24 Cc1cccc(n1)SCCO 62a_100000742759_100000211926 [0,1,0,1,0,0|1,1,0]=4 1568 B11R1.24 Cc1cncc(c1)OCCF 34a_100011830280_100011217306 [0,1,0,1,0,0|2,0,0]=4 1569 B11R1.24 Cc1cncc(c1)OCCF 7a_100011830280_100011217306 [0,1,0,1,0,0|2,0,0]=4 1570 B11R1.24 Cc1cncc(c1)OCCO 34a_100011830280_100000211926 [0,1,0,1,0,0|2,0,0]=4 1571 B11R1.24 Cc1cncc(c1)OCCO 7a_100011830280_100000211926 [0,1,0,1,0,0|2,0,0]=4 1572 B11R1.24 FCCOc1cccc(c1)Br 34a_100000210342_100011217306 [0,1,0,1,0,0|2,0,0]=4 1573 B11R1.24 FCCOc1cccc(c1)Br 7a_100000210342_100011217306 [0,1,0,1,0,0|2,0,0]=4 1574 B11R1.24 FCCOc1cccc(c1)Cl 34a_100000210295_100011217306 [0,1,0,1,0,0|2,0,0]=4 1575 B11R1.24 FCCOc1cccc(c1)Cl 7a_100000210295_100011217306 [0,1,0,1,0,0|2,0,0]=4 1576 B11R1.24 FCCOc1cccc(c1)F 34a_100000210426_100011217306 [0,1,0,1,0,0|2,0,0]=4 1577 B11R1.24 FCCOc1cccc(c1)F 7a_100000210426_100011217306 [0,1,0,1,0,0|2,0,0]=4 1578 B11R1.24 FCCOc1cccc(c1)I 34a_100000211634_100011217306 [0,1,0,1,0,0|2,0,0]=4 1579 B11R1.24 FCCOc1cccc(c1)I 7a_100000211634_100011217306 [0,1,0,1,0,0|2,0,0]=4 1580 B11R1.24 FCCOc1cccc(n1)F 34a_100011432558_100011217306 [0,1,0,1,0,0|2,0,0]=4 1581 B11R1.24 NCCOc1cccc(c1)O 271570a_203496583355_100000743521 [0,1,0,1,0,0|2,0,0]=4 1582 B11R1.24 Nc1cccc(c1)OCCF 34a_100000210217_100011217306 [0,1,0,1,0,0|2,0,0]=4 1583 B11R1.24 Nc1cccc(c1)OCCO 34a_100000210217_100000211926 [0,1,0,1,0,0|2,0,0]=4 1584 B11R1.24 O=c1cccc([nH]1)OCCF 34a_100000033347_100011217306 [0,1,0,1,0,0|2,0,0]=4 1585 B11R1.24 O=c1cccc([nH]1)OCCO 34a_100000033347_100000211926 [0,1,0,1,0,0|2,0,0]=4 1586 B11R1.24 OCCOc1cccc(c1)Br 34a_100000210342_100000211926 [0,1,0,1,0,0|2,0,0]=4 1587 B11R1.24 OCCOc1cccc(c1)Br 7a_100000210342_100000211926 [0,1,0,1,0,0|2,0,0]=4 1588 B11R1.24 OCCOc1cccc(c1)Cl 34a_100000210295_100000211926 [0,1,0,1,0,0|2,0,0]=4 1589 B11R1.24 OCCOc1cccc(c1)Cl 7a_100000210295_100000211926 [0,1,0,1,0,0|2,0,0]=4 1590 B11R1.24 OCCOc1cccc(c1)F 34a_100000210426_100000211926 [0,1,0,1,0,0|2,0,0]=4 1591 B11R1.24 OCCOc1cccc(c1)F 7a_100000210426_100000211926 [0,1,0,1,0,0|2,0,0]=4 1592 B11R1.24 OCCOc1cccc(c1)I 34a_100000211634_100000211926 [0,1,0,1,0,0|2,0,0]=4 1593 B11R1.24 OCCOc1cccc(c1)I 7a_100000211634_100000211926 [0,1,0,1,0,0|2,0,0]=4 1594 B11R1.24 OCCOc1cccc(c1)O 271570a_203496583355_100000757546 [0,1,0,1,0,0|2,0,0]=4 1595 B11R1.24 OCCOc1cccc(n1)F 34a_100011432558_100000211926 [0,1,0,1,0,0|2,0,0]=4 1596 B11R1.30 CCCC(=O)Cc1ccc[nH]1 1458a_100000238377_100000210303 [0,1,0,1,0,0|2,0,0]=4 1597 B11R1.30 CCCC(=O)Cc1ccco1 1458a_100011217309_100000210303 [0,1,0,1,0,0|2,0,0]=4 1598 B11R1.30 CCCC(=O)Cc1cccs1 1458a_100000210189_100000210303 [0,1,0,1,0,0|2,0,0]=4 1599 B11R1.30 CCNC(=O)Cc1ccc[nH]1 11a_100015525214_100000238377 [0,1,0,1,0,0|2,0,0]=4 1600 B11R1.30 CCNC(=O)Cc1ccc[nH]1 240690a_100015525214_100000238377 [0,1,0,1,0,0|2,0,0]=4 1601 B11R1.30 CCNC(=O)Cc1ccc[nH]1 527a_100015525214_100000238377 [0,1,0,1,0,0|2,0,0]=4 1602 B11R1.30 CCNC(=O)Cc1ccco1 11a_100015525214_100011217309 [0,1,0,1,0,0|2,0,0]=4 1603 B11R1.30 CCNC(=O)Cc1ccco1 527a_100015525214_100011217309 [0,1,0,1,0,0|2,0,0]=4 1604 B11R1.30 CCNC(=O)Cc1cccs1 11a_100015525214_100000210189 [0,1,0,1,0,0|2,0,0]=4 1605 B11R1.30 CCNC(=O)Cc1cccs1 240690a_100015525214_100000210189 [0,1,0,1,0,0|2,0,0]=4 1606 B11R1.30 CCOC(=O)CN1CC=CC1 269982a_100015195280_100000188475 [0,1,0,1,0,0|0,0,2]=4 1607 B11R1.127 CC=Cc1ccc(s1)CCC 271570a_100016259895_100010157708 [0,1,0,1,0,0|1,1,0]=4 1608 B11R1.127 CC=Cc1cnc([nH]1)CCC 271570a_100016259895_200009820212 [0,1,0,1,0,0|2,0,0]=4 1609 B11R1.127 CC=Cc1csc(n1)OCC 271570a_100016259895_100011934640 [0,1,0,1,0,0|1,0,0]=3 1610 B11R1.180 C/C=C/COC1CCOC1=O 34a_100016270725_100000211211 [0,1,0,1,0,0|0,0,2]=4 1611 B11R1.180 C/C=C/CSC1CCOC1=O 62a_100000211211_100102629194 [0,1,0,1,0,0|0,0,2]=4 1612 B11R1.180 C/C=C/CSC1CCOC1=O 62a_100102629194_100000211211 [0,1,0,1,0,0|0,0,2]=4 1613 B11R1.180 CC=CCSC1CCOC1=O 62a_100000070051_100000211211 [0,1,0,1,0,0|0,0,2]=4 1614 B11R1.180 CC=CCSC1CCOC1=O 62a_100000211211_100000070051 [0,1,0,1,0,0|0,0,2]=4 1615 B11R1.189 C#Cc1cccc(c1)OCC 34a_100011216014_100000210202 [0,1,0,1,0,0|1,0,1]=4 1616 B11R1.189 C#Cc1cccc(c1)OCC 7a_100011216014_100000210202 [0,1,0,1,0,0|1,0,1]=4 1617 B11R1.189 C=Cc1cc(ccn1)OCC 271570a_100011290941_100011922638 [0,1,0,1,0,0|1,0,1]=4 1618 B11R1.189 C=Cc1cccc(c1)OCC 271570a_100011290941_100000170002 [0,1,0,1,0,0|1,0,1]=4 1619 B11R1.189 C=Cc1cccc(c1)OCC 34a_100011309434_100000210202 [0,1,0,1,0,0|1,0,1]=4 1620 B11R1.189 C=Cc1cccc(c1)OCC 7a_100011309434_100000210202 [0,1,0,1,0,0|1,0,1]=4 1621 B11R1.189 C=Cc1cccc(n1)OCC 271570a_100011290941_100000752924 [0,1,0,1,0,0|1,0,1]=4 1622 B11R1.189 C=Cc1ccnc(c1)OCC 271570a_100011290941_100009995528 [0,1,0,1,0,0|1,0,1]=4 1623 B11R1.189 C=Cc1cncc(c1)OCC 271570a_100011290941_100012029586 [0,1,0,1,0,0|1,0,1]=4 1624 B11R1.189 C=Cc1cncc(n1)OCC 271570a_100011290941_100000757043 [0,1,0,1,0,0|1,0,1]=4 1625 B11R1.189 C=Cc1nccc(n1)OCC 271570a_100011290941_100011649779 [0,1,0,1,0,0|1,0,1]=4 1626 B11R1.189 CCCc1cccc(c1)OC 34a_100000039106_200000210301 [0,1,0,1,0,0|2,0,0]=4 1627 B11R1.189 CCCc1cccc(c1)OC 7a_100000039106_200000210301 [0,1,0,1,0,0|2,0,0]=4 1628 B11R1.189 CCCc1cccc(c1)O[13CH3] 34a_100000039106_200025704644 [0,1,0,1,0,0|2,0,0]=4 1629 B11R1.189 CCCc1cccc(c1)O[13CH3] 7a_100000039106_200025704644 [0,1,0,1,0,0|2,0,0]=4 1630 B11R1.189 CCCc1cccc(c1)SC 62a_100000694964_200000210301 [0,1,0,1,0,0|2,0,0]=4 1631 B11R1.189 CCCc1cccc(c1)SC 62a_200000210301_100000694964 [0,1,0,1,0,0|2,0,0]=4 1632 B11R1.189 CCCc1cccc(c1)S[13CH3] 62a_100000694964_200025704644 [0,1,0,1,0,0|2,0,0]=4 1633 B11R1.189 CCCc1cccc(c1)S[13CH3] 62a_200025704644_100000694964 [0,1,0,1,0,0|2,0,0]=4 1634 B11R1.189 CCNc1cccc(c1)CC 2230a_100000211250_100000210202 [0,1,0,1,0,0|2,0,0]=4 1635 B11R1.189 CCNc1cccc(c1)CC 34a_100000211250_100000210202 [0,1,0,1,0,0|2,0,0]=4 1636 B11R1.189 CCNc1cccc(c1)CC 7a_100000211250_100000210202 [0,1,0,1,0,0|2,0,0]=4 1637 B11R1.189 CCNc1cccc(c1)CF 2230a_100000126320_100000210202 [0,1,0,1,0,0|2,0,0]=4 1638 B11R1.189 CCNc1cccc(c1)CF 34a_100000126320_100000210202 [0,1,0,1,0,0|2,0,0]=4 1639 B11R1.189 CCNc1cccc(c1)CF 7a_100000126320_100000210202 [0,1,0,1,0,0|2,0,0]=4 1640 B11R1.189 CCNc1cccc(c1)CO 2230a_100000211919_100000210202 [0,1,0,1,0,0|2,0,0]=4 1641 B11R1.189 CCNc1cccc(c1)CO 34a_100000211919_100000210202 [0,1,0,1,0,0|2,0,0]=4 1642 B11R1.189 CCNc1cccc(c1)OC 34a_100000210024_100000210202 [0,1,0,1,0,0|2,0,0]=4 1643 B11R1.189 CCNc1cccc(c1)OC 34a_100000717746_200000210301 [0,1,0,1,0,0|2,0,0]=4 1644 B11R1.189 CCNc1cccc(c1)OC 7a_100000717746_200000210301 [0,1,0,1,0,0|2,0,0]=4 1645 B11R1.189 CCNc1cccc(c1)O[13CH3] 34a_100000717746_200025704644 [0,1,0,1,0,0|2,0,0]=4 1646 B11R1.189 CCNc1cccc(c1)O[13CH3] 7a_100000717746_200025704644 [0,1,0,1,0,0|2,0,0]=4 1647 B11R1.189 CCNc1cccc(c1)SC 2230a_100000210049_100000210202 [0,1,0,1,0,0|2,0,0]=4 1648 B11R1.189 CCNc1cccc(c1)SC 34a_100000210049_100000210202 [0,1,0,1,0,0|2,0,0]=4 1649 B11R1.189 CCNc1cccc(c1)SC 62a_200000210301_100000738899 [0,1,0,1,0,0|2,0,0]=4 1650 B11R1.189 CCNc1cccc(c1)S[13CH3] 62a_200025704644_100000738899 [0,1,0,1,0,0|2,0,0]=4 1651 B11R1.189 CCNc1cccc(n1)SC 62a_200000210301_200020678610 [0,1,0,1,0,0|2,0,0]=4 1652 B11R1.189 CCNc1cccc(n1)SC 62a_200020678610_200000210301 [0,1,0,1,0,0|2,0,0]=4 1653 B11R1.189 CCNc1cccc(n1)S[13CH3] 62a_200020678610_200025704644 [0,1,0,1,0,0|2,0,0]=4 1654 B11R1.189 CCNc1cccc(n1)S[13CH3] 62a_200025704644_200020678610 [0,1,0,1,0,0|2,0,0]=4 1655 B11R1.189 CCOc1cc(ccn1)CN 34a_100000748557_100000210202 [0,1,0,1,0,0|2,0,0]=4 1656 B11R1.189 CCOc1cc(ccn1)SC 62a_100009995528_200000210301 [0,1,0,1,0,0|2,0,0]=4 1657 B11R1.189 CCOc1cc(ccn1)SC 62a_200000210301_100009995528 [0,1,0,1,0,0|2,0,0]=4 1658 B11R1.189 CCOc1cc(ccn1)S[13CH3] 62a_100009995528_200025704644 [0,1,0,1,0,0|2,0,0]=4 1659 B11R1.189 CCOc1cc(ccn1)S[13CH3] 62a_200025704644_100009995528 [0,1,0,1,0,0|2,0,0]=4 1660 B11R1.189 CCOc1ccc[n+](c1)CC 34a_100000731997_100000210202 [0,1,0,1,0,0|1,0,1]=4 1661 B11R1.189 CCOc1ccc[n+](c1)CC 7a_100000731997_100000210202 [0,1,0,1,0,0|1,0,1]=4 1662 B11R1.189 CCOc1cccc(c1)C#N 34a_100000184713_100000210202 [0,1,0,1,0,0|1,0,1]=4 1663 B11R1.189 CCOc1cccc(c1)C#N 7a_100000184713_100000210202 [0,1,0,1,0,0|1,0,1]=4 1664 B11R1.189 CCOc1cccc(c1)CBr 34a_100011660834_100000210202 [0,1,0,1,0,0|1,0,0]=3 1665 B11R1.189 CCOc1cccc(c1)CBr 7a_100011660834_100000210202 [0,1,0,1,0,0|1,0,0]=3 1666 B11R1.189 CCOc1cccc(c1)CC 34a_100000211550_100000210202 [0,1,0,1,0,0|1,0,0]=3 1667 B11R1.189 CCOc1cccc(c1)CC 7a_100000211550_100000210202 [0,1,0,1,0,0|1,0,0]=3 1668 B11R1.189 CCOc1cccc(c1)CCl 34a_100000084143_100000210202 [0,1,0,1,0,0|1,0,0]=3 1669 B11R1.189 CCOc1cccc(c1)CCl 7a_100000084143_100000210202 [0,1,0,1,0,0|1,0,0]=3 1670 B11R1.189 CCOc1cccc(c1)CN 34a_100000743036_100000210202 [0,1,0,1,0,0|1,0,0]=3 1671 B11R1.189 CCOc1cccc(c1)CO 34a_100011214949_100000210202 [0,1,0,1,0,0|1,0,0]=3 1672 B11R1.189 CCOc1cccc(c1)CO 7a_100011214949_100000210202 [0,1,0,1,0,0|1,0,0]=3 1673 B11R1.189 CCOc1cccc(c1)NC 2230a_100000742568_200000210301 [0,1,0,1,0,0|1,0,0]=3 1674 B11R1.189 CCOc1cccc(c1)NC 34a_100000742568_200000210301 [0,1,0,1,0,0|1,0,0]=3 1675 B11R1.189 CCOc1cccc(c1)NC 34a_100000756613_100000210202 [0,1,0,1,0,0|1,0,0]=3 1676 B11R1.189 CCOc1cccc(c1)NC 7a_100000756613_100000210202 [0,1,0,1,0,0|1,0,0]=3 1677 B11R1.189 CCOc1cccc(c1)N[13CH3] 2230a_100000742568_200025704644 [0,1,0,1,0,0|1,0,0]=3 1678 B11R1.189 CCOc1cccc(c1)N[13CH3] 34a_100000742568_200025704644 [0,1,0,1,0,0|1,0,0]=3 1679 B11R1.189 CCOc1cccc(c1)OC 34a_100000211255_100000210202 [0,1,0,1,0,0|1,0,0]=3 1680 B11R1.189 CCOc1cccc(c1)OC 34a_100011215941_200000210301 [0,1,0,1,0,0|1,0,0]=3 1681 B11R1.189 CCOc1cccc(c1)OC 7a_100000211255_100000210202 [0,1,0,1,0,0|1,0,0]=3 1682 B11R1.189 CCOc1cccc(c1)OC 7a_100011215941_200000210301 [0,1,0,1,0,0|1,0,0]=3 1683 B11R1.189 CCOc1cccc(c1)O[13CH3] 34a_100011215941_200025704644 [0,1,0,1,0,0|1,0,0]=3 1684 B11R1.189 CCOc1cccc(c1)O[13CH3] 7a_100011215941_200025704644 [0,1,0,1,0,0|1,0,0]=3 1685 B11R1.189 CCOc1cccc(c1)SC 34a_100011265683_100000210202 [0,1,0,1,0,0|1,0,0]=3 1686 B11R1.189 CCOc1cccc(c1)SC 62a_200000210301_100000170002 [0,1,0,1,0,0|1,0,0]=3 1687 B11R1.189 CCOc1cccc(c1)SC 7a_100011265683_100000210202 [0,1,0,1,0,0|1,0,0]=3 1688 B11R1.189 CCOc1cccc(c1)S[13CH3] 62a_200025704644_100000170002 [0,1,0,1,0,0|1,0,0]=3 1689 B11R1.189 CCOc1cccc(n1)SC 62a_100000752924_200000210301 [0,1,0,1,0,0|1,0,0]=3 1690 B11R1.189 CCOc1cccc(n1)SC 62a_200000210301_100000752924 [0,1,0,1,0,0|1,0,0]=3 1691 B11R1.189 CCOc1cccc(n1)S[13CH3] 62a_100000752924_200025704644 [0,1,0,1,0,0|1,0,0]=3 1692 B11R1.189 CCOc1cccc(n1)S[13CH3] 62a_200025704644_100000752924 [0,1,0,1,0,0|1,0,0]=3 1693 B11R1.189 CCOc1ccnc(c1)NC 27a_100102657272_100009995529 [0,1,0,1,0,0|2,0,0]=4 1694 B11R1.189 CCOc1ccnc(c1)OC 34a_100012181050_100000210202 [0,1,0,1,0,0|2,0,0]=4 1695 B11R1.189 CCOc1ccnc(c1)SC 62a_100009995529_200000210301 [0,1,0,1,0,0|2,0,0]=4 1696 B11R1.189 CCOc1ccnc(c1)SC 62a_200000210301_100011922638 [0,1,0,1,0,0|2,0,0]=4 1697 B11R1.189 CCOc1ccnc(c1)S[13CH3] 62a_100009995529_200025704644 [0,1,0,1,0,0|2,0,0]=4 1698 B11R1.189 CCOc1ccnc(c1)S[13CH3] 62a_200025704644_100011922638 [0,1,0,1,0,0|2,0,0]=4 1699 B11R1.189 CCOc1ccnc(n1)NC 27a_100102657272_100011649779 [0,1,0,1,0,0|2,0,0]=4 1700 B11R1.189 CCOc1ccnc(n1)SC 62a_100011649779_200000210301 [0,1,0,1,0,0|2,0,0]=4 1701 B11R1.189 CCOc1ccnc(n1)SC 62a_200000210301_100011649779 [0,1,0,1,0,0|2,0,0]=4 1702 B11R1.189 CCOc1ccnc(n1)S[13CH3] 62a_100011649779_200025704644 [0,1,0,1,0,0|2,0,0]=4 1703 B11R1.189 CCOc1ccnc(n1)S[13CH3] 62a_200025704644_100011649779 [0,1,0,1,0,0|2,0,0]=4 1704 B11R1.189 CCOc1cncc(c1)CC 34a_200009861530_100000210202 [0,1,0,1,0,0|1,0,1]=4 1705 B11R1.189 CCOc1cncc(c1)CC 7a_200009861530_100000210202 [0,1,0,1,0,0|1,0,1]=4 1706 B11R1.189 CCOc1cncc(c1)OC 34a_100000084572_100000210202 [0,1,0,1,0,0|2,0,0]=4 1707 B11R1.189 CCOc1cncc(c1)OC 7a_100000084572_100000210202 [0,1,0,1,0,0|2,0,0]=4 1708 B11R1.189 CCOc1cncc(c1)SC 62a_100012029586_200000210301 [0,1,0,1,0,0|2,0,0]=4 1709 B11R1.189 CCOc1cncc(c1)SC 62a_200000210301_100012029586 [0,1,0,1,0,0|2,0,0]=4 1710 B11R1.189 CCOc1cncc(c1)S[13CH3] 62a_100012029586_200025704644 [0,1,0,1,0,0|2,0,0]=4 1711 B11R1.189 CCOc1cncc(c1)S[13CH3] 62a_200025704644_100012029586 [0,1,0,1,0,0|2,0,0]=4 1712 B11R1.189 CCOc1cncc(n1)NC 27a_100102657272_100000757043 [0,1,0,1,0,0|2,0,0]=4 1713 B11R1.189 CCOc1cncc(n1)SC 62a_100000757043_200000210301 [0,1,0,1,0,0|2,0,0]=4 1714 B11R1.189 CCOc1cncc(n1)SC 62a_200000210301_100000757043 [0,1,0,1,0,0|2,0,0]=4 1715 B11R1.189 CCOc1cncc(n1)S[13CH3] 62a_100000757043_200025704644 [0,1,0,1,0,0|2,0,0]=4 1716 B11R1.189 CCOc1cncc(n1)S[13CH3] 62a_200025704644_100000757043 [0,1,0,1,0,0|2,0,0]=4 1717 B11R1.189 CCSc1cccc(c1)CC 62a_100000210202_100011263222 [0,1,0,1,0,0|1,1,0]=4 1718 B11R1.189 CCSc1cccc(c1)CC 62a_100011263222_100000210202 [0,1,0,1,0,0|1,1,0]=4 1719 B11R1.189 CCSc1cccc(c1)CF 62a_100000210202_100010878472 [0,1,0,1,0,0|1,1,0]=4 1720 B11R1.189 CCSc1cccc(c1)CF 62a_100010878472_100000210202 [0,1,0,1,0,0|1,1,0]=4 1721 B11R1.189 CCSc1cccc(c1)CN 62a_100000106179_100000210202 [0,1,0,1,0,0|1,1,0]=4 1722 B11R1.189 CCSc1cccc(c1)CN 62a_100000210202_100000106179 [0,1,0,1,0,0|1,1,0]=4 1723 B11R1.189 CCSc1cccc(c1)CO 62a_100000210202_100000687537 [0,1,0,1,0,0|1,1,0]=4 1724 B11R1.189 CCSc1cccc(c1)CO 62a_100000687537_100000210202 [0,1,0,1,0,0|1,1,0]=4 1725 B11R1.189 CCSc1cccc(c1)NC 62a_100000210202_100000219648 [0,1,0,1,0,0|1,1,0]=4 1726 B11R1.189 CCSc1cccc(c1)NC 62a_100000219648_100000210202 [0,1,0,1,0,0|1,1,0]=4 1727 B11R1.189 CCSc1cccc(c1)OC 62a_100000210202_100000170001 [0,1,0,1,0,0|1,1,0]=4 1728 B11R1.189 CCSc1cccc(c1)SC 62a_100000210202_100011215954 [0,1,0,1,0,0|1,1,0]=4 1729 B11R1.189 CCSc1cccc(c1)SC 62a_100000703699_200000210301 [0,1,0,1,0,0|1,1,0]=4 1730 B11R1.189 CCSc1cccc(c1)SC 62a_100011215954_100000210202 [0,1,0,1,0,0|1,1,0]=4 1731 B11R1.189 CCSc1cccc(c1)SC 62a_200000210301_100000703699 [0,1,0,1,0,0|1,1,0]=4 1732 B11R1.189 CCSc1cccc(c1)S[13CH3] 62a_100000703699_200025704644 [0,1,0,1,0,0|1,1,0]=4 1733 B11R1.189 CCSc1cccc(c1)S[13CH3] 62a_200025704644_100000703699 [0,1,0,1,0,0|1,1,0]=4 1734 B11R1.189 CCSc1cccc(n1)CC 62a_100000210202_100009856026 [0,1,0,1,0,0|1,1,0]=4 1735 B11R1.189 CCSc1cccc(n1)CC 62a_100009856026_100000210202 [0,1,0,1,0,0|1,1,0]=4 1736 B11R1.189 CCSc1cccc(n1)CN 62a_100000210202_100016990191 [0,1,0,1,0,0|1,1,0]=4 1737 B11R1.189 CCSc1cccc(n1)CN 62a_100016990191_100000210202 [0,1,0,1,0,0|1,1,0]=4 1738 B11R1.189 CCSc1cccc(n1)CO 62a_100000210202_100000694195 [0,1,0,1,0,0|1,1,0]=4 1739 B11R1.189 CCSc1cccc(n1)CO 62a_100000694195_100000210202 [0,1,0,1,0,0|1,1,0]=4 1740 B11R1.189 CCSc1cccc(n1)NC 62a_100000210202_100000703281 [0,1,0,1,0,0|1,1,0]=4 1741 B11R1.189 CCSc1cccc(n1)NC 62a_100000703281_100000210202 [0,1,0,1,0,0|1,1,0]=4 1742 B11R1.189 CCSc1cccc(n1)OC 62a_100000210202_100000760917 [0,1,0,1,0,0|1,1,0]=4 1743 B11R1.189 CCSc1cccc(n1)OC 62a_100000760917_100000210202 [0,1,0,1,0,0|1,1,0]=4 1744 B11R1.189 CCSc1cccc(n1)SC 62a_100000210202_100011960944 [0,1,0,1,0,0|1,1,0]=4 1745 B11R1.189 CCSc1cccc(n1)SC 62a_100011960944_100000210202 [0,1,0,1,0,0|1,1,0]=4 1746 B11R1.189 CCc1cccc(c1)OCF 34a_100000211550_100015361967 [0,1,0,1,0,0|2,0,0]=4 1747 B11R1.189 CCc1cccc(c1)OCF 7a_100000211550_100015361967 [0,1,0,1,0,0|2,0,0]=4 1748 B11R1.189 CNc1cccc(c1)OCF 34a_100000756613_100015361967 [0,1,0,1,0,0|2,0,0]=4 1749 B11R1.189 CNc1cccc(c1)OCF 7a_100000756613_100015361967 [0,1,0,1,0,0|2,0,0]=4 1750 B11R1.189 COc1cccc(c1)OCF 34a_100000211255_100015361967 [0,1,0,1,0,0|2,0,0]=4 1751 B11R1.189 COc1cccc(c1)OCF 7a_100000211255_100015361967 [0,1,0,1,0,0|2,0,0]=4 1752 B11R1.189 CSc1cccc(c1)OCF 34a_100011265683_100015361967 [0,1,0,1,0,0|2,0,0]=4 1753 B11R1.189 CSc1cccc(c1)OCF 7a_100011265683_100015361967 [0,1,0,1,0,0|2,0,0]=4 1754 B11R1.189 FCOc1cccc(c1)CBr 34a_100011660834_100015361967 [0,1,0,1,0,0|2,0,0]=4 1755 B11R1.189 FCOc1cccc(c1)CBr 7a_100011660834_100015361967 [0,1,0,1,0,0|2,0,0]=4 1756 B11R1.189 FCOc1cccc(c1)CCl 34a_100000084143_100015361967 [0,1,0,1,0,0|2,0,0]=4 1757 B11R1.189 FCOc1cccc(c1)CCl 7a_100000084143_100015361967 [0,1,0,1,0,0|2,0,0]=4 1758 B11R1.189 NCc1cccc(c1)OCF 34a_100000743036_100015361967 [0,1,0,1,0,0|2,0,0]=4 1759 B11R1.189 OCc1cccc(c1)OCF 34a_100011214949_100015361967 [0,1,0,1,0,0|2,0,0]=4 1760 B11R1.189 OCc1cccc(c1)OCF 7a_100011214949_100015361967 [0,1,0,1,0,0|2,0,0]=4 1761 B11R1.199 CC=CC(=O)C1CCCC1=O 1458a_100000210699_100000211823 [0,1,0,1,0,0|1,0,1]=4 1762 B11R1.199 CC=CC(=O)C1CCOC1=O 1458a_100000210699_100000211211 [0,1,0,1,0,0|0,0,1]=3 1763 B11R1.199 CCOC(=O)c1[nH]ncc1O 271570a_203496583355_100102524952 [0,1,0,1,0,0|2,0,0]=4 1764 B11R1.199 CCOC(=O)c1c[nH]nc1O 271570a_203496583355_100010255357 [0,1,0,1,0,0|2,0,0]=4 1765 B11R1.199 CCOC(=O)c1ccsc1O 271570a_203496583355_100010219215 [0,1,0,1,0,0|1,0,0]=3 1766 B11R1.199 CCOC(=O)c1cscc1O 271570a_203496583355_100012353568 [0,1,0,1,0,0|1,0,0]=3 1767 B11R1.199 CCOC(=O)c1ncsc1O 271570a_203496583355_100010232029 [0,1,0,1,0,0|2,0,0]=4 1768 B11R1.199 CCOC(=O)c1ocnc1O 271570a_203496583355_100010260153 [0,1,0,1,0,0|2,0,0]=4 1769 B11R1.199 CCOC(=O)c1scnc1O 271570a_203496583355_100012038550 [0,1,0,1,0,0|2,0,0]=4 1770 B11R1.199 CNCC(=O)c1cccn1C 2230a_106832991635_200011262399 [0,1,0,1,0,0|2,0,0]=4 1771 B11R1.199 CNCC(=O)c1cccn1C 34a_100102657272_200011262399 [0,1,0,1,0,0|2,0,0]=4 1772 B11R1.199 CNCC(=O)c1cccn1C 7a_106832991635_200011262399 [0,1,0,1,0,0|2,0,0]=4 1773 B11R1.199 COCC(=O)c1cccn1C 34a_100138415774_200011262399 [0,1,0,1,0,0|2,0,0]=4 1774 B11R1.199 CSCC(=O)c1cccn1C 62a_200000210301_200011262399 [0,1,0,1,0,0|2,0,0]=4 1775 B11R1.199 CSCC(=O)c1cccn1C 62a_200011262399_200000210301 [0,1,0,1,0,0|2,0,0]=4 1776 B11R1.199 Cn1cccc1C(=O)CS[13CH3] 62a_200011262399_200025704644 [0,1,0,1,0,0|2,0,0]=4 1777 B11R1.199 Cn1cccc1C(=O)CS[13CH3] 62a_200025704644_200011262399 [0,1,0,1,0,0|2,0,0]=4 1778 B11R1.199 O=C(C=CBr)C1CCOC1=O 1458a_100016273825_100000211211 [0,1,0,1,0,0|1,0,1]=4 1779 B11R1.199 O=C(C=CCl)C1CCOC1=O 1458a_200016279998_100000211211 [0,1,0,1,0,0|1,0,1]=4 1780 B11R1.199 O=C(C=CI)C1CCOC1=O 1458a_100016256311_100000211211 [0,1,0,1,0,0|1,0,1]=4 1781 B11R1.265 CSc1c(cccc1C=O)C 62a_100012186367_200000210301 [0,1,0,1,0,0|2,0,0]=4 1782 B11R1.265 CSc1c(cccc1C=O)C 62a_200000210301_100012186367 [0,1,0,1,0,0|2,0,0]=4 1783 B11R1.265 Cc1cccc(c1S[13CH3])C=O 62a_100012186367_200025704644 [0,1,0,1,0,0|2,0,0]=4 1784 B11R1.265 Cc1cccc(c1S[13CH3])C=O 62a_200025704644_100012186367 [0,1,0,1,0,0|2,0,0]=4 1785 B11R1.34 CC=Cc1cc([nH]c(=O)c1)C 271570a_100016259895_100009861981 [0,1,0,1,0,0|1,0,1]=4 1786 B11R1.34 CCNc1cc(cc(c1)Br)C 34a_100000695972_100000210202 [0,1,0,1,0,0|2,0,0]=4 1787 B11R1.34 CCNc1cc(cc(c1)Br)C 7a_100000695972_100000210202 [0,1,0,1,0,0|2,0,0]=4 1788 B11R1.34 CCNc1cc(cc(c1)C)C 2230a_100000210930_100000210202 [0,1,0,1,0,0|2,0,0]=4 1789 B11R1.34 CCNc1cc(cc(c1)C)C 34a_100000210930_100000210202 [0,1,0,1,0,0|2,0,0]=4 1790 B11R1.34 CCNc1cc(cc(c1)C)C 7a_100000210930_100000210202 [0,1,0,1,0,0|2,0,0]=4 1791 B11R1.34 CCNc1cc(cc(c1)Cl)C 2230a_100012022512_100000210202 [0,1,0,1,0,0|2,0,0]=4 1792 B11R1.34 CCNc1cc(cc(c1)Cl)C 34a_100012022512_100000210202 [0,1,0,1,0,0|2,0,0]=4 1793 B11R1.34 CCNc1cc(cc(c1)Cl)C 7a_100012022512_100000210202 [0,1,0,1,0,0|2,0,0]=4 1794 B11R1.34 CCNc1cc(cc(c1)F)C 2230a_100000742734_100000210202 [0,1,0,1,0,0|2,0,0]=4 1795 B11R1.34 CCNc1cc(cc(c1)F)C 34a_100000742734_100000210202 [0,1,0,1,0,0|2,0,0]=4 1796 B11R1.34 CCNc1cc(cc(c1)F)C 7a_100000742734_100000210202 [0,1,0,1,0,0|2,0,0]=4 1797 B11R1.34 CCNc1cc(cc(c1)O)C 34a_100011995906_100000210202 [0,1,0,1,0,0|2,0,0]=4 1798 B11R1.34 CCNc1cc(cc(c1)O)C 7a_100011995906_100000210202 [0,1,0,1,0,0|2,0,0]=4 1799 B11R1.34 CCNc1cc(cc(n1)C)C 27a_100015525214_100000069240 [0,1,0,1,0,0|2,0,0]=4 1800 B11R1.34 CCOc1cc(=O)cc(o1)C 34a_100016989201_100000210202 [0,1,0,1,0,0|0,0,1]=3 1801 B11R1.34 CCOc1cc([nH]c(=O)c1)C 34a_100000039070_100000210202 [0,1,0,1,0,0|2,0,0]=4 1802 B11R1.34 CCOc1cc(cc(c1)Br)Br 34a_100010167048_100000210202 [0,1,0,1,0,0|2,0,0]=4 1803 B11R1.34 CCOc1cc(cc(c1)Br)Br 7a_100010167048_100000210202 [0,1,0,1,0,0|2,0,0]=4 1804 B11R1.34 CCOc1cc(cc(c1)Br)C 34a_100011999630_100000210202 [0,1,0,1,0,0|1,0,0]=3 1805 B11R1.34 CCOc1cc(cc(c1)Br)C 7a_100011999630_100000210202 [0,1,0,1,0,0|1,0,0]=3 1806 B11R1.34 CCOc1cc(cc(c1)Br)Cl 34a_100010185897_100000210202 [0,1,0,1,0,0|2,0,0]=4 1807 B11R1.34 CCOc1cc(cc(c1)Br)Cl 7a_100010185897_100000210202 [0,1,0,1,0,0|2,0,0]=4 1808 B11R1.34 CCOc1cc(cc(c1)Br)F 34a_100000688818_100000210202 [0,1,0,1,0,0|2,0,0]=4 1809 B11R1.34 CCOc1cc(cc(c1)Br)F 7a_100000688818_100000210202 [0,1,0,1,0,0|2,0,0]=4 1810 B11R1.34 CCOc1cc(cc(c1)C)C 34a_100000210933_100000210202 [0,1,0,1,0,0|1,0,0]=3 1811 B11R1.34 CCOc1cc(cc(c1)C)C 7a_100000210933_100000210202 [0,1,0,1,0,0|1,0,0]=3 1812 B11R1.34 CCOc1cc(cc(c1)Cl)C 34a_100000087485_100000210202 [0,1,0,1,0,0|1,0,0]=3 1813 B11R1.34 CCOc1cc(cc(c1)Cl)C 7a_100000087485_100000210202 [0,1,0,1,0,0|1,0,0]=3 1814 B11R1.34 CCOc1cc(cc(c1)Cl)Cl 34a_100000181315_100000210202 [0,1,0,1,0,0|2,0,0]=4 1815 B11R1.34 CCOc1cc(cc(c1)Cl)Cl 7a_100000181315_100000210202 [0,1,0,1,0,0|2,0,0]=4 1816 B11R1.34 CCOc1cc(cc(c1)Cl)F 34a_100011219751_100000210202 [0,1,0,1,0,0|2,0,0]=4 1817 B11R1.34 CCOc1cc(cc(c1)Cl)F 7a_100011219751_100000210202 [0,1,0,1,0,0|2,0,0]=4 1818 B11R1.34 CCOc1cc(cc(c1)Cl)N 34a_100000123917_100000210202 [0,1,0,1,0,0|2,0,0]=4 1819 B11R1.34 CCOc1cc(cc(c1)Cl)N 7a_100000123917_100000210202 [0,1,0,1,0,0|2,0,0]=4 1820 B11R1.34 CCOc1cc(cc(c1)F)C 34a_100011830401_100000210202 [0,1,0,1,0,0|1,0,0]=3 1821 B11R1.34 CCOc1cc(cc(c1)F)C 7a_100011830401_100000210202 [0,1,0,1,0,0|1,0,0]=3 1822 B11R1.34 CCOc1cc(cc(c1)F)F 34a_100000747503_100000210202 [0,1,0,1,0,0|2,0,0]=4 1823 B11R1.34 CCOc1cc(cc(c1)F)F 7a_100000747503_100000210202 [0,1,0,1,0,0|2,0,0]=4 1824 B11R1.34 CCOc1cc(cc(c1)F)O 271570a_203496583355_100012343907 [0,1,0,1,0,0|2,0,0]=4 1825 B11R1.34 CCOc1cc(cc(c1)I)Br 34a_100010068917_100000210202 [0,1,0,1,0,0|2,0,0]=4 1826 B11R1.34 CCOc1cc(cc(c1)I)Br 7a_100010068917_100000210202 [0,1,0,1,0,0|2,0,0]=4 1827 B11R1.34 CCOc1cc(cc(c1)I)Cl 34a_100010068924_100000210202 [0,1,0,1,0,0|2,0,0]=4 1828 B11R1.34 CCOc1cc(cc(c1)I)Cl 7a_100010068924_100000210202 [0,1,0,1,0,0|2,0,0]=4 1829 B11R1.34 CCOc1cc(cc(c1)I)F 34a_100000717995_100000210202 [0,1,0,1,0,0|2,0,0]=4 1830 B11R1.34 CCOc1cc(cc(c1)I)F 7a_100000717995_100000210202 [0,1,0,1,0,0|2,0,0]=4 1831 B11R1.34 CCOc1cc(cc(c1)N)C 34a_100011995906_100000210202 [0,1,0,1,0,0|1,0,0]=3 1832 B11R1.34 CCOc1cc(cc(c1)N)C 7a_100011995906_100000210202 [0,1,0,1,0,0|1,0,0]=3 1833 B11R1.34 CCOc1cc(oc(=O)c1)C 34a_100000210952_100000210202 [0,1,0,1,0,0|2,0,0]=4 1834 B11R1.34 CCOc1cc(oc(=O)c1)C 7a_100000210952_100000210202 [0,1,0,1,0,0|2,0,0]=4 1835 B11R1.34 CCSc1cc(cc(c1)C)C 62a_100000210202_100011215608 [0,1,0,1,0,0|1,1,0]=4 1836 B11R1.34 CCSc1cc(cc(c1)C)C 62a_100011215608_100000210202 [0,1,0,1,0,0|1,1,0]=4 1837 B11R1.34 CCSc1cc(cc(c1)Cl)C 62a_100000210202_100010172791 [0,1,0,1,0,0|1,1,0]=4 1838 B11R1.34 CCSc1cc(cc(c1)Cl)C 62a_100010172791_100000210202 [0,1,0,1,0,0|1,1,0]=4 1839 B11R1.34 CCSc1cc(cc(c1)F)C 62a_100000210202_100011356977 [0,1,0,1,0,0|1,1,0]=4 1840 B11R1.34 CCSc1cc(cc(c1)F)C 62a_100011356977_100000210202 [0,1,0,1,0,0|1,1,0]=4 1841 B11R1.34 CCSc1cc(cc(c1)N)C 62a_100000210202_100000695972 [0,1,0,1,0,0|1,1,0]=4 1842 B11R1.34 CCSc1cc(cc(c1)N)C 62a_100000695972_100000210202 [0,1,0,1,0,0|1,1,0]=4 1843 B11R1.34 CCSc1cc(cc(c1)O)C 62a_100000210202_100011999630 [0,1,0,1,0,0|1,1,0]=4 1844 B11R1.34 CCSc1cc(cc(n1)C)C 62a_100000069240_100000210202 [0,1,0,1,0,0|1,1,0]=4 1845 B11R1.34 CCSc1cc(cc(n1)C)C 62a_100000210202_100000069240 [0,1,0,1,0,0|1,1,0]=4 1846 B11R1.34 CCSc1cc(cc(n1)C)N 62a_100000071261_100000210202 [0,1,0,1,0,0|1,1,0]=4 1847 B11R1.34 CCSc1cc(cc(n1)C)N 62a_100000210202_100000071261 [0,1,0,1,0,0|1,1,0]=4 1848 B11R1.34 Cc1cc(=O)cc(o1)OCF 34a_100016989201_100015361967 [0,1,0,1,0,0|1,0,1]=4 1849 B11R1.34 Cc1cc(cc(c1)OCF)Br 34a_100011999630_100015361967 [0,1,0,1,0,0|2,0,0]=4 1850 B11R1.34 Cc1cc(cc(c1)OCF)Br 7a_100011999630_100015361967 [0,1,0,1,0,0|2,0,0]=4 1851 B11R1.34 Cc1cc(cc(c1)OCF)C 34a_100000210933_100015361967 [0,1,0,1,0,0|2,0,0]=4 1852 B11R1.34 Cc1cc(cc(c1)OCF)C 7a_100000210933_100015361967 [0,1,0,1,0,0|2,0,0]=4 1853 B11R1.34 Cc1cc(cc(c1)OCF)Cl 34a_100000087485_100015361967 [0,1,0,1,0,0|2,0,0]=4 1854 B11R1.34 Cc1cc(cc(c1)OCF)Cl 7a_100000087485_100015361967 [0,1,0,1,0,0|2,0,0]=4 1855 B11R1.34 Cc1cc(cc(c1)OCF)F 34a_100011830401_100015361967 [0,1,0,1,0,0|2,0,0]=4 1856 B11R1.34 Cc1cc(cc(c1)OCF)F 7a_100011830401_100015361967 [0,1,0,1,0,0|2,0,0]=4 1857 B11R1.34 Cc1cc(cc(c1)OCF)N 34a_100011995906_100015361967 [0,1,0,1,0,0|2,0,0]=4 1858 B11R1.34 Cc1cc(cc(c1)OCF)N 7a_100011995906_100015361967 [0,1,0,1,0,0|2,0,0]=4 1859 B11R1.187 CC=Cc1cc(n(n1)CC)C 271570a_100016259895_100010781242 [0,1,0,1,0,0|2,0,0]=4 1860 B11R1.187 CC=Cc1nn(c(=O)[nH]1)CC 271570a_100016259895_100009830087 [0,1,0,1,0,0|2,0,0]=4 1861 B11R1.334 CC=CC(=O)CC(=O)C1CC1 1458a_100000210699_100000746382 [0,1,0,1,0,0|1,0,1]=4 1862 B11R1.15 CCNC(=O)c1ccc(s1)O 271570a_203496583355_200000155171 [0,1,0,1,0,0|2,0,0]=4 1863 B11R1.15 CCOC(=O)c1c[nH]c(n1)O 271570a_203496583355_100010231773 [0,1,0,1,0,0|2,0,0]=4 1864 B11R1.15 CCOC(=O)c1cc([nH]n1)O 271570a_203496583355_100010743333 [0,1,0,1,0,0|2,0,0]=4 1865 B11R1.15 CCOC(=O)c1cc(cs1)O 271570a_203496583355_100009815474 [0,1,0,1,0,0|1,0,0]=3 1866 B11R1.15 CCOC(=O)c1ccc([nH]1)O 271570a_203496583355_200000687776 [0,1,0,1,0,0|1,0,0]=3 1867 B11R1.15 CCOC(=O)c1ccc(o1)O 271570a_203496583355_200000170220 [0,1,0,1,0,0|1,0,0]=3 1868 B11R1.15 CCOC(=O)c1ccc(s1)O 271570a_203496583355_100000172375 [0,1,0,1,0,0|1,0,0]=3 1869 B11R1.15 CCOC(=O)c1cnc(o1)O 271570a_203496583355_100010205802 [0,1,0,1,0,0|2,0,0]=4 1870 B11R1.15 CCOC(=O)c1cnc(s1)O 271570a_203496583355_100009814955 [0,1,0,1,0,0|2,0,0]=4 1871 B11R1.15 CCOC(=O)c1coc(n1)O 271570a_203496583355_100011935043 [0,1,0,1,0,0|2,0,0]=4 1872 B11R1.15 CCOC(=O)c1csc(c1)O 271570a_203496583355_100011228516 [0,1,0,1,0,0|1,0,1]=4 1873 B11R1.15 CCOC(=O)c1csc(n1)O 271570a_203496583355_100009814092 [0,1,0,1,0,0|2,0,0]=4 1874 B11R1.15 CCOC(=O)c1nc(cs1)O 271570a_203496583355_200012359684 [0,1,0,1,0,0|2,0,0]=4 1875 B11R1.15 CCOC(=O)c1ncc([nH]1)O 271570a_203496583355_100010172669 [0,1,0,1,0,0|2,0,0]=4 1876 B11R1.15 CCOC(=O)c1ncc(s1)O 271570a_203496583355_100012362614 [0,1,0,1,0,0|2,0,0]=4 1877 B11R1.15 CNCC(=O)c1ccc(s1)C 2230a_106832991635_100011262362 [0,1,0,1,0,0|2,0,0]=4 1878 B11R1.15 CNCC(=O)c1ccc(s1)C 34a_100102657272_100011262362 [0,1,0,1,0,0|2,0,0]=4 1879 B11R1.15 CNCC(=O)c1ccc(s1)C 7a_106832991635_100011262362 [0,1,0,1,0,0|2,0,0]=4 1880 B11R1.15 COCC(=O)c1ccc(s1)C 34a_100138415774_100011262362 [0,1,0,1,0,0|2,0,0]=4 1881 B11R1.15 CSCC(=O)c1ccc(s1)C 62a_100011262362_200000210301 [0,1,0,1,0,0|2,0,0]=4 1882 B11R1.15 CSCC(=O)c1ccc(s1)C 62a_200000210301_100011262362 [0,1,0,1,0,0|2,0,0]=4 1883 B11R1.15 Cc1ccc(s1)C(=O)CS[13CH3] 62a_100011262362_200025704644 [0,1,0,1,0,0|2,0,0]=4 1884 B11R1.15 Cc1ccc(s1)C(=O)CS[13CH3] 62a_200025704644_100011262362 [0,1,0,1,0,0|2,0,0]=4 1885 B11R1.124 C=C(C)c1ccc(s1)CCC 271570a_100000694244_100010157708 [0,1,0,1,0,0|1,1,0]=4 1886 B11R1.124 C=C(C)c1csc(n1)OCC 271570a_100000694244_100011934640 [0,1,0,1,0,0|2,0,0]=4 1887 B11R1.124 CCSc1ccc([nH]1)C(=O)C 62a_200010494458_100000210202 [0,1,0,1,0,0|1,1,0]=4 1888 B11R1.124 CCSc1ccc(o1)C(=O)C 62a_100000210202_100000229899 [0,1,0,1,0,0|0,1,1]=4 1889 B11R1.124 CCSc1ccc(s1)C(=O)C 62a_100000183331_100000210202 [0,1,0,1,0,0|0,2,0]=4 1890 B11R1.124 CCSc1ccc(s1)C(=O)C 62a_100000210202_200000034408 [0,1,0,1,0,0|0,2,0]=4 1891 B11R1.157 CC(C)Oc1cccc(=O)[nH]1 34a_100000033347_100000210206 [0,1,0,1,0,0|2,0,0]=4 1892 B11R1.157 CC(C)Oc1cccc(c1)Br 34a_100000210342_100000210206 [0,1,0,1,0,0|2,0,0]=4 1893 B11R1.157 CC(C)Oc1cccc(c1)Br 7a_100000210342_100000210206 [0,1,0,1,0,0|2,0,0]=4 1894 B11R1.157 CC(C)Oc1cccc(c1)Cl 34a_100000210295_100000210206 [0,1,0,1,0,0|2,0,0]=4 1895 B11R1.157 CC(C)Oc1cccc(c1)Cl 7a_100000210295_100000210206 [0,1,0,1,0,0|2,0,0]=4 1896 B11R1.157 CC(C)Oc1cccc(c1)F 34a_100000210426_100000210206 [0,1,0,1,0,0|2,0,0]=4 1897 B11R1.157 CC(C)Oc1cccc(c1)F 7a_100000210426_100000210206 [0,1,0,1,0,0|2,0,0]=4 1898 B11R1.157 CC(C)Oc1cccc(c1)I 34a_100000211634_100000210206 [0,1,0,1,0,0|2,0,0]=4 1899 B11R1.157 CC(C)Oc1cccc(c1)I 7a_100000211634_100000210206 [0,1,0,1,0,0|2,0,0]=4 1900 B11R1.157 CC(C)Oc1cccc(c1)N 34a_100000210217_100000210206 [0,1,0,1,0,0|2,0,0]=4 1901 B11R1.157 CC(C)Oc1cccc(c1)O 271570a_203496583355_100000170003 [0,1,0,1,0,0|2,0,0]=4 1902 B11R1.157 CC(C)Oc1cccc(n1)F 34a_100011432558_100000210206 [0,1,0,1,0,0|2,0,0]=4 1903 B11R1.157 CC(C)Oc1cccc(n1)O 271570a_203496583355_100000703025 [0,1,0,1,0,0|2,0,0]=4 1904 B11R1.157 Cc1cc(ccn1)OC(C)C 34a_100000688365_100000210206 [0,1,0,1,0,0|2,0,0]=4 1905 B11R1.157 Cc1cccc(c1)NC(C)C 2230a_100000188690_100000210206 [0,1,0,1,0,0|2,0,0]=4 1906 B11R1.157 Cc1cccc(c1)NC(C)C 34a_100000188690_100000210206 [0,1,0,1,0,0|2,0,0]=4 1907 B11R1.157 Cc1cccc(c1)OC(C)C 34a_100000210337_100000210206 [0,1,0,1,0,0|1,0,0]=3 1908 B11R1.157 Cc1cccc(c1)OC(C)C 7a_100000210337_100000210206 [0,1,0,1,0,0|1,0,0]=3 1909 B11R1.157 Cc1cccc(c1)SC(C)C 62a_100000210206_100011215228 [0,1,0,1,0,0|1,1,0]=4 1910 B11R1.157 Cc1cccc(c1)SC(C)C 62a_100011215228_100000210206 [0,1,0,1,0,0|1,1,0]=4 1911 B11R1.157 Cc1cccc(n1)SC(C)C 62a_100000210206_100000742759 [0,1,0,1,0,0|1,1,0]=4 1912 B11R1.157 Cc1cccc(n1)SC(C)C 62a_100000742759_100000210206 [0,1,0,1,0,0|1,1,0]=4 1913 B11R1.157 Cc1cncc(c1)OC(C)C 34a_100011830280_100000210206 [0,1,0,1,0,0|2,0,0]=4 1914 B11R1.157 Cc1cncc(c1)OC(C)C 7a_100011830280_100000210206 [0,1,0,1,0,0|2,0,0]=4 1915 B11R1.301 C/C=C/C=CC(=O)CC1CC1 1458a_100000185730_100000742324 [0,1,0,1,0,0|1,0,0]=3 1916 B11R1.301 C/C=C/C=CC(=O)CC1CO1 1458a_100000185730_100011216344 [0,1,0,1,0,0|1,0,0]=3 1917 B11R1.301 C/C=C/C=CC(=O)CC1CS1 1458a_100000185730_100000031435 [0,1,0,1,0,0|1,0,0]=3 1918 B11R1.301 C/C=C/C=CC(=O)C[C@@H]1CO1 1458a_100000185730_100000745022 [0,1,0,1,0,0|1,0,0]=3 1919 B11R1.301 C/C=C/C=CC(=O)NC1CC1 1626a_100000212008_100000185730 [0,1,0,1,0,0|1,0,0]=3 1920 B11R1.301 C/C=C/C=CC(=O)NC1CC1 240690a_100000212008_100000185730 [0,1,0,1,0,0|1,0,0]=3 1921 B11R1.5 CCOc1cccccc1=O 34a_100000036025_100000210202 [0,1,0,1,0,0|0,0,1]=3 1922 B11R1.5 CCOc1cccccc1=O 7a_100000036025_100000210202 [0,1,0,1,0,0|0,0,1]=3 1923 B11R1.5 O=c1cccccc1OCF 34a_100000036025_100015361967 [0,1,0,1,0,0|1,0,1]=4 1924 B11R1.5 O=c1cccccc1OCF 7a_100000036025_100015361967 [0,1,0,1,0,0|1,0,1]=4 1925 B11R1.13 CCNc1cccc(c1Br)C 34a_100000684715_100000210202 [0,1,0,1,0,0|2,0,0]=4 1926 B11R1.13 CCNc1cccc(c1C)C 2230a_100000210026_100000210202 [0,1,0,1,0,0|2,0,0]=4 1927 B11R1.13 CCNc1cccc(c1C)C 34a_100000210026_100000210202 [0,1,0,1,0,0|2,0,0]=4 1928 B11R1.13 CCNc1cccc(c1C)C 7a_100000210026_100000210202 [0,1,0,1,0,0|2,0,0]=4 1929 B11R1.13 CCNc1cccc(c1Cl)C 34a_100000765562_100000210202 [0,1,0,1,0,0|2,0,0]=4 1930 B11R1.13 CCNc1cccc(c1Cl)C 7a_100000765562_100000210202 [0,1,0,1,0,0|2,0,0]=4 1931 B11R1.13 CCNc1cccc(c1F)C 2230a_100000697159_100000210202 [0,1,0,1,0,0|2,0,0]=4 1932 B11R1.13 CCNc1cccc(c1F)C 34a_100000697159_100000210202 [0,1,0,1,0,0|2,0,0]=4 1933 B11R1.13 CCNc1cccc(c1F)C 7a_100000697159_100000210202 [0,1,0,1,0,0|2,0,0]=4 1934 B11R1.13 CCNc1cccc(c1I)C 34a_100000761888_100000210202 [0,1,0,1,0,0|2,0,0]=4 1935 B11R1.13 CCNc1cccc(c1O)C 34a_100000756359_100000210202 [0,1,0,1,0,0|1,0,1]=4 1936 B11R1.13 CCOc1cccc(c1Br)Br 34a_100010187966_100000210202 [0,1,0,1,0,0|2,0,0]=4 1937 B11R1.13 CCOc1cccc(c1Br)Br 7a_100010187966_100000210202 [0,1,0,1,0,0|2,0,0]=4 1938 B11R1.13 CCOc1cccc(c1Br)C 34a_100000686692_100000210202 [0,1,0,1,0,0|1,0,0]=3 1939 B11R1.13 CCOc1cccc(c1Br)C 7a_100000686692_100000210202 [0,1,0,1,0,0|1,0,0]=3 1940 B11R1.13 CCOc1cccc(c1Br)Cl 34a_100012348804_100000210202 [0,1,0,1,0,0|2,0,0]=4 1941 B11R1.13 CCOc1cccc(c1Br)Cl 7a_100012348804_100000210202 [0,1,0,1,0,0|2,0,0]=4 1942 B11R1.13 CCOc1cccc(c1Br)F 34a_100009820682_100000210202 [0,1,0,1,0,0|2,0,0]=4 1943 B11R1.13 CCOc1cccc(c1Br)F 7a_100009820682_100000210202 [0,1,0,1,0,0|2,0,0]=4 1944 B11R1.13 CCOc1cccc(c1Br)I 34a_100010187914_100000210202 [0,1,0,1,0,0|2,0,0]=4 1945 B11R1.13 CCOc1cccc(c1Br)I 7a_100010187914_100000210202 [0,1,0,1,0,0|2,0,0]=4 1946 B11R1.13 CCOc1cccc(c1Br)N 34a_100012183704_100000210202 [0,1,0,1,0,0|2,0,0]=4 1947 B11R1.13 CCOc1cccc(c1Br)N 7a_100012183704_100000210202 [0,1,0,1,0,0|2,0,0]=4 1948 B11R1.13 CCOc1cccc(c1C)Br 34a_100012002258_100000210202 [0,1,0,1,0,0|2,0,0]=4 1949 B11R1.13 CCOc1cccc(c1C)Br 7a_100012002258_100000210202 [0,1,0,1,0,0|2,0,0]=4 1950 B11R1.13 CCOc1cccc(c1C)C 34a_100000185855_100000210202 [0,1,0,1,0,0|1,0,0]=3 1951 B11R1.13 CCOc1cccc(c1C)C 7a_100000185855_100000210202 [0,1,0,1,0,0|1,0,0]=3 1952 B11R1.13 CCOc1cccc(c1C)Cl 34a_100011265684_100000210202 [0,1,0,1,0,0|2,0,0]=4 1953 B11R1.13 CCOc1cccc(c1C)Cl 7a_100011265684_100000210202 [0,1,0,1,0,0|2,0,0]=4 1954 B11R1.13 CCOc1cccc(c1C)F 34a_100011217231_100000210202 [0,1,0,1,0,0|2,0,0]=4 1955 B11R1.13 CCOc1cccc(c1C)F 7a_100011217231_100000210202 [0,1,0,1,0,0|2,0,0]=4 1956 B11R1.13 CCOc1cccc(c1C)N 34a_100011216573_100000210202 [0,1,0,1,0,0|2,0,0]=4 1957 B11R1.13 CCOc1cccc(c1C)N 7a_100011216573_100000210202 [0,1,0,1,0,0|2,0,0]=4 1958 B11R1.13 CCOc1cccc(c1Cl)Br 34a_100010187913_100000210202 [0,1,0,1,0,0|2,0,0]=4 1959 B11R1.13 CCOc1cccc(c1Cl)Br 7a_100010187913_100000210202 [0,1,0,1,0,0|2,0,0]=4 1960 B11R1.13 CCOc1cccc(c1Cl)C 34a_100000695629_100000210202 [0,1,0,1,0,0|1,0,0]=3 1961 B11R1.13 CCOc1cccc(c1Cl)C 7a_100000695629_100000210202 [0,1,0,1,0,0|1,0,0]=3 1962 B11R1.13 CCOc1cccc(c1Cl)Cl 34a_100000211076_100000210202 [0,1,0,1,0,0|2,0,0]=4 1963 B11R1.13 CCOc1cccc(c1Cl)Cl 7a_100000211076_100000210202 [0,1,0,1,0,0|2,0,0]=4 1964 B11R1.13 CCOc1cccc(c1Cl)F 34a_100000087408_100000210202 [0,1,0,1,0,0|2,0,0]=4 1965 B11R1.13 CCOc1cccc(c1Cl)F 7a_100000087408_100000210202 [0,1,0,1,0,0|2,0,0]=4 1966 B11R1.13 CCOc1cccc(c1Cl)I 34a_100000049636_100000210202 [0,1,0,1,0,0|2,0,0]=4 1967 B11R1.13 CCOc1cccc(c1Cl)I 7a_100000049636_100000210202 [0,1,0,1,0,0|2,0,0]=4 1968 B11R1.13 CCOc1cccc(c1Cl)N 34a_100012002038_100000210202 [0,1,0,1,0,0|2,0,0]=4 1969 B11R1.13 CCOc1cccc(c1Cl)N 7a_100012002038_100000210202 [0,1,0,1,0,0|2,0,0]=4 1970 B11R1.13 CCOc1cccc(c1F)Br 34a_100009817021_100000210202 [0,1,0,1,0,0|2,0,0]=4 1971 B11R1.13 CCOc1cccc(c1F)Br 7a_100009817021_100000210202 [0,1,0,1,0,0|2,0,0]=4 1972 B11R1.13 CCOc1cccc(c1F)C 34a_100000751311_100000210202 [0,1,0,1,0,0|1,0,0]=3 1973 B11R1.13 CCOc1cccc(c1F)C 7a_100000751311_100000210202 [0,1,0,1,0,0|1,0,0]=3 1974 B11R1.13 CCOc1cccc(c1F)Cl 34a_100000687438_100000210202 [0,1,0,1,0,0|2,0,0]=4 1975 B11R1.13 CCOc1cccc(c1F)Cl 7a_100000687438_100000210202 [0,1,0,1,0,0|2,0,0]=4 1976 B11R1.13 CCOc1cccc(c1F)F 34a_100000751161_100000210202 [0,1,0,1,0,0|2,0,0]=4 1977 B11R1.13 CCOc1cccc(c1F)F 7a_100000751161_100000210202 [0,1,0,1,0,0|2,0,0]=4 1978 B11R1.13 CCOc1cccc(c1I)Br 34a_100010187912_100000210202 [0,1,0,1,0,0|2,0,0]=4 1979 B11R1.13 CCOc1cccc(c1I)Br 7a_100010187912_100000210202 [0,1,0,1,0,0|2,0,0]=4 1980 B11R1.13 CCOc1cccc(c1I)C 34a_100010083724_100000210202 [0,1,0,1,0,0|1,0,0]=3 1981 B11R1.13 CCOc1cccc(c1I)C 7a_100010083724_100000210202 [0,1,0,1,0,0|1,0,0]=3 1982 B11R1.13 CCOc1cccc(c1I)Cl 34a_100000050174_100000210202 [0,1,0,1,0,0|2,0,0]=4 1983 B11R1.13 CCOc1cccc(c1I)Cl 7a_100000050174_100000210202 [0,1,0,1,0,0|2,0,0]=4 1984 B11R1.13 CCOc1cccc(c1I)F 34a_100000690913_100000210202 [0,1,0,1,0,0|2,0,0]=4 1985 B11R1.13 CCOc1cccc(c1I)F 7a_100000690913_100000210202 [0,1,0,1,0,0|2,0,0]=4 1986 B11R1.13 CCOc1cccc(c1N)Br 34a_100011934926_100000210202 [0,1,0,1,0,0|2,0,0]=4 1987 B11R1.13 CCOc1cccc(c1N)Br 7a_100011934926_100000210202 [0,1,0,1,0,0|2,0,0]=4 1988 B11R1.13 CCOc1cccc(c1N)C 34a_100000743429_100000210202 [0,1,0,1,0,0|1,0,0]=3 1989 B11R1.13 CCOc1cccc(c1N)C 7a_100000743429_100000210202 [0,1,0,1,0,0|1,0,0]=3 1990 B11R1.13 CCOc1cccc(c1N)Cl 34a_100012022510_100000210202 [0,1,0,1,0,0|2,0,0]=4 1991 B11R1.13 CCOc1cccc(c1N)Cl 7a_100012022510_100000210202 [0,1,0,1,0,0|2,0,0]=4 1992 B11R1.13 CCOc1cccc(c1N)F 34a_100020591140_100000210202 [0,1,0,1,0,0|2,0,0]=4 1993 B11R1.13 CCOc1cccc(c1N)F 7a_100020591140_100000210202 [0,1,0,1,0,0|2,0,0]=4 1994 B11R1.13 CCOc1cccc(c1N)I 34a_200000049512_100000210202 [0,1,0,1,0,0|2,0,0]=4 1995 B11R1.13 CCOc1cccc(c1N)I 7a_200000049512_100000210202 [0,1,0,1,0,0|2,0,0]=4 1996 B11R1.13 CCOc1cccc(c1N)N 34a_100000033209_100000210202 [0,1,0,1,0,0|2,0,0]=4 1997 B11R1.13 CCOc1cccc(c1N)O 271570a_203496583355_200103155331 [0,1,0,1,0,0|2,0,0]=4 1998 B11R1.13 CCOc1cccn(c1=O)C 34a_100000117616_100000210202 [0,1,0,1,0,0|1,0,0]=3 1999 B11R1.13 CCOc1cccn(c1=O)C 7a_100000117616_100000210202 [0,1,0,1,0,0|1,0,0]=3 2000 B11R1.13 CCOc1nccc(c1Br)C 34a_100012000493_100000210202 [0,1,0,1,0,0|2,0,0]=4 2001 B11R1.13 CCSc1cccc(c1Br)C 62a_100000210202_100012362457 [0,1,0,1,0,0|1,1,0]=4 2002 B11R1.13 CCSc1cccc(c1Br)C 62a_100012362457_100000210202 [0,1,0,1,0,0|1,1,0]=4 2003 B11R1.13 CCSc1cccc(c1C)C 62a_100000210202_100011214922 [0,1,0,1,0,0|1,1,0]=4 2004 B11R1.13 CCSc1cccc(c1C)C 62a_100011214922_100000210202 [0,1,0,1,0,0|1,1,0]=4 2005 B11R1.13 CCSc1cccc(c1Cl)C 62a_100000210202_200012352035 [0,1,0,1,0,0|1,1,0]=4 2006 B11R1.13 CCSc1cccc(c1Cl)C 62a_200012352035_100000210202 [0,1,0,1,0,0|1,1,0]=4 2007 B11R1.13 CCSc1cccc(c1F)C 62a_100000210202_100000717567 [0,1,0,1,0,0|1,1,0]=4 2008 B11R1.13 CCSc1cccc(c1F)C 62a_100000717567_100000210202 [0,1,0,1,0,0|1,1,0]=4 2009 B11R1.13 CCSc1cccc(c1N)C 62a_100000210202_100011834072 [0,1,0,1,0,0|1,1,0]=4 2010 B11R1.13 CCSc1cccc(c1N)C 62a_100011834072_100000210202 [0,1,0,1,0,0|1,1,0]=4 2011 B11R1.13 CCSc1cccc(c1O)C 62a_100000210202_100009817157 [0,1,0,1,0,0|0,1,1]=4 2012 B11R1.13 CCSc1cccc(c1O)C 62a_100009817157_100000210202 [0,1,0,1,0,0|0,1,1]=4 2013 B11R1.13 CCSc1cccn(c1=O)C 62a_100000210202_100000687173 [0,1,0,1,0,0|1,1,0]=4 2014 B11R1.13 CCSc1cccn(c1=O)C 62a_100000687173_100000210202 [0,1,0,1,0,0|1,1,0]=4 2015 B11R1.13 Cc1cccc(c1Br)OCF 34a_100000686692_100015361967 [0,1,0,1,0,0|2,0,0]=4 2016 B11R1.13 Cc1cccc(c1Br)OCF 7a_100000686692_100015361967 [0,1,0,1,0,0|2,0,0]=4 2017 B11R1.13 Cc1cccc(c1C)OCF 34a_100000185855_100015361967 [0,1,0,1,0,0|2,0,0]=4 2018 B11R1.13 Cc1cccc(c1C)OCF 7a_100000185855_100015361967 [0,1,0,1,0,0|2,0,0]=4 2019 B11R1.13 Cc1cccc(c1Cl)OCF 34a_100000695629_100015361967 [0,1,0,1,0,0|2,0,0]=4 2020 B11R1.13 Cc1cccc(c1Cl)OCF 7a_100000695629_100015361967 [0,1,0,1,0,0|2,0,0]=4 2021 B11R1.13 Cc1cccc(c1F)OCF 34a_100000751311_100015361967 [0,1,0,1,0,0|2,0,0]=4 2022 B11R1.13 Cc1cccc(c1F)OCF 7a_100000751311_100015361967 [0,1,0,1,0,0|2,0,0]=4 2023 B11R1.13 Cc1cccc(c1I)OCF 34a_100010083724_100015361967 [0,1,0,1,0,0|2,0,0]=4 2024 B11R1.13 Cc1cccc(c1I)OCF 7a_100010083724_100015361967 [0,1,0,1,0,0|2,0,0]=4 2025 B11R1.13 Cc1cccc(c1N)OCF 34a_100000743429_100015361967 [0,1,0,1,0,0|2,0,0]=4 2026 B11R1.13 Cc1cccc(c1N)OCF 7a_100000743429_100015361967 [0,1,0,1,0,0|2,0,0]=4 2027 B11R1.13 Cn1cccc(c1=O)OCF 34a_100000117616_100015361967 [0,1,0,1,0,0|2,0,0]=4 2028 B11R1.13 Cn1cccc(c1=O)OCF 7a_100000117616_100015361967 [0,1,0,1,0,0|2,0,0]=4 2029 B11R1.29 CCNCC(=O)c1cccs1 2230a_100015525214_100000211436 [0,1,0,1,0,0|2,0,0]=4 2030 B11R1.29 CCOCC(=O)N1CC=CC1 1626a_100015195280_100000211967 [0,1,0,1,0,0|1,0,1]=4 2031 B11R1.29 CCOCC(=O)N1CC=CC1 240690a_100015195280_100000211967 [0,1,0,1,0,0|1,0,1]=4 2032 B11R1.29 CCOCC(=O)c1ccsc1 34a_100121572206_100011219462 [0,1,0,1,0,0|1,0,1]=4 2033 B11R1.29 CCSCC(=O)c1ccc[nH]1 62a_100000210202_200011262396 [0,1,0,1,0,0|1,1,0]=4 2034 B11R1.29 CCSCC(=O)c1ccc[nH]1 62a_200011262396_100000210202 [0,1,0,1,0,0|1,1,0]=4 2035 B11R1.29 CCSCC(=O)c1ccco1 62a_100000210202_100000211439 [0,1,0,1,0,0|1,1,0]=4 2036 B11R1.29 CCSCC(=O)c1ccco1 62a_100000211439_100000210202 [0,1,0,1,0,0|1,1,0]=4 2037 B11R1.29 CCSCC(=O)c1cccs1 62a_100000210202_100000211436 [0,1,0,1,0,0|1,1,0]=4 2038 B11R1.29 CCSCC(=O)c1cccs1 62a_100000211436_100000210202 [0,1,0,1,0,0|1,1,0]=4 2039 B11R1.29 CNCCC(=O)c1cccs1 2230a_106832991635_100011290775 [0,1,0,1,0,0|2,0,0]=4 2040 B11R1.29 CNCCC(=O)c1cccs1 7a_106832991635_100011290775 [0,1,0,1,0,0|2,0,0]=4 2041 B11R1.29 CSCCC(=O)c1cccs1 62a_100011290775_200000210301 [0,1,0,1,0,0|2,0,0]=4 2042 B11R1.29 CSCCC(=O)c1cccs1 62a_200000210301_100011290775 [0,1,0,1,0,0|2,0,0]=4 2043 B11R1.29 [13CH3]SCCC(=O)c1cccs1 62a_100011290775_200025704644 [0,1,0,1,0,0|2,0,0]=4 2044 B11R1.29 [13CH3]SCCC(=O)c1cccs1 62a_200025704644_100011290775 [0,1,0,1,0,0|2,0,0]=4 2045 B11R1.182 CCNc1cc(ccc1Br)C 34a_100000745044_100000210202 [0,1,0,1,0,0|2,0,0]=4 2046 B11R1.182 CCNc1cc(ccc1C)C 2230a_100000185781_100000210202 [0,1,0,1,0,0|2,0,0]=4 2047 B11R1.182 CCNc1cc(ccc1C)C 34a_100000185781_100000210202 [0,1,0,1,0,0|2,0,0]=4 2048 B11R1.182 CCNc1cc(ccc1C)C 7a_100000185781_100000210202 [0,1,0,1,0,0|2,0,0]=4 2049 B11R1.182 CCNc1cc(ccc1Cl)C 34a_100011215360_100000210202 [0,1,0,1,0,0|2,0,0]=4 2050 B11R1.182 CCNc1cc(ccc1F)C 34a_100000211285_100000210202 [0,1,0,1,0,0|2,0,0]=4 2051 B11R1.182 CCNc1cc(ccc1I)C 34a_100011216686_100000210202 [0,1,0,1,0,0|2,0,0]=4 2052 B11R1.182 CCNc1cc(ccc1O)C 34a_100011215204_100000210202 [0,1,0,1,0,0|2,0,0]=4 2053 B11R1.182 CCOc1cc(ccc1Br)Br 34a_100011220040_100000210202 [0,1,0,1,0,0|2,0,0]=4 2054 B11R1.182 CCOc1cc(ccc1Br)Br 7a_100011220040_100000210202 [0,1,0,1,0,0|2,0,0]=4 2055 B11R1.182 CCOc1cc(ccc1Br)C 34a_100012002257_100000210202 [0,1,0,1,0,0|1,0,0]=3 2056 B11R1.182 CCOc1cc(ccc1Br)C 7a_100012002257_100000210202 [0,1,0,1,0,0|1,0,0]=3 2057 B11R1.182 CCOc1cc(ccc1Br)Cl 34a_100012339455_100000210202 [0,1,0,1,0,0|2,0,0]=4 2058 B11R1.182 CCOc1cc(ccc1Br)Cl 7a_100012339455_100000210202 [0,1,0,1,0,0|2,0,0]=4 2059 B11R1.182 CCOc1cc(ccc1Br)F 34a_100000690578_100000210202 [0,1,0,1,0,0|2,0,0]=4 2060 B11R1.182 CCOc1cc(ccc1Br)F 7a_100000690578_100000210202 [0,1,0,1,0,0|2,0,0]=4 2061 B11R1.182 CCOc1cc(ccc1Br)I 34a_100012356990_100000210202 [0,1,0,1,0,0|2,0,0]=4 2062 B11R1.182 CCOc1cc(ccc1Br)I 7a_100012356990_100000210202 [0,1,0,1,0,0|2,0,0]=4 2063 B11R1.182 CCOc1cc(ccc1C)Br 34a_100000685420_100000210202 [0,1,0,1,0,0|2,0,0]=4 2064 B11R1.182 CCOc1cc(ccc1C)Br 7a_100000685420_100000210202 [0,1,0,1,0,0|2,0,0]=4 2065 B11R1.182 CCOc1cc(ccc1C)C 34a_100000210931_100000210202 [0,1,0,1,0,0|1,0,0]=3 2066 B11R1.182 CCOc1cc(ccc1C)C 7a_100000210931_100000210202 [0,1,0,1,0,0|1,0,0]=3 2067 B11R1.182 CCOc1cc(ccc1C)Cl 34a_100000756515_100000210202 [0,1,0,1,0,0|2,0,0]=4 2068 B11R1.182 CCOc1cc(ccc1C)Cl 7a_100000756515_100000210202 [0,1,0,1,0,0|2,0,0]=4 2069 B11R1.182 CCOc1cc(ccc1C)F 34a_100000690566_100000210202 [0,1,0,1,0,0|2,0,0]=4 2070 B11R1.182 CCOc1cc(ccc1C)F 7a_100000690566_100000210202 [0,1,0,1,0,0|2,0,0]=4 2071 B11R1.182 CCOc1cc(ccc1C)I 7a_100000766334_100000210202 [0,1,0,1,0,0|2,0,0]=4 2072 B11R1.182 CCOc1cc(ccc1C)N 34a_100000759471_100000210202 [0,1,0,1,0,0|2,0,0]=4 2073 B11R1.182 CCOc1cc(ccc1C)N 7a_100000759471_100000210202 [0,1,0,1,0,0|2,0,0]=4 2074 B11R1.182 CCOc1cc(ccc1C)O 271570a_203496583355_100012361169 [0,1,0,1,0,0|2,0,0]=4 2075 B11R1.182 CCOc1cc(ccc1Cl)Br 34a_100000738945_100000210202 [0,1,0,1,0,0|2,0,0]=4 2076 B11R1.182 CCOc1cc(ccc1Cl)Br 7a_100000738945_100000210202 [0,1,0,1,0,0|2,0,0]=4 2077 B11R1.182 CCOc1cc(ccc1Cl)C 34a_100000211493_100000210202 [0,1,0,1,0,0|1,0,0]=3 2078 B11R1.182 CCOc1cc(ccc1Cl)C 7a_100000211493_100000210202 [0,1,0,1,0,0|1,0,0]=3 2079 B11R1.182 CCOc1cc(ccc1Cl)Cl 34a_100000211422_100000210202 [0,1,0,1,0,0|2,0,0]=4 2080 B11R1.182 CCOc1cc(ccc1Cl)Cl 7a_100000211422_100000210202 [0,1,0,1,0,0|2,0,0]=4 2081 B11R1.182 CCOc1cc(ccc1Cl)F 34a_100000692107_100000210202 [0,1,0,1,0,0|2,0,0]=4 2082 B11R1.182 CCOc1cc(ccc1Cl)F 7a_100000692107_100000210202 [0,1,0,1,0,0|2,0,0]=4 2083 B11R1.182 CCOc1cc(ccc1Cl)I 34a_100011356854_100000210202 [0,1,0,1,0,0|2,0,0]=4 2084 B11R1.182 CCOc1cc(ccc1Cl)I 7a_100011356854_100000210202 [0,1,0,1,0,0|2,0,0]=4 2085 B11R1.182 CCOc1cc(ccc1Cl)N 34a_100011934209_100000210202 [0,1,0,1,0,0|2,0,0]=4 2086 B11R1.182 CCOc1cc(ccc1F)Br 34a_100000686035_100000210202 [0,1,0,1,0,0|2,0,0]=4 2087 B11R1.182 CCOc1cc(ccc1F)Br 7a_100000686035_100000210202 [0,1,0,1,0,0|2,0,0]=4 2088 B11R1.182 CCOc1cc(ccc1F)C 34a_100000759540_100000210202 [0,1,0,1,0,0|1,0,0]=3 2089 B11R1.182 CCOc1cc(ccc1F)C 7a_100000759540_100000210202 [0,1,0,1,0,0|1,0,0]=3 2090 B11R1.182 CCOc1cc(ccc1F)Cl 34a_100000757397_100000210202 [0,1,0,1,0,0|2,0,0]=4 2091 B11R1.182 CCOc1cc(ccc1F)Cl 7a_100000757397_100000210202 [0,1,0,1,0,0|2,0,0]=4 2092 B11R1.182 CCOc1cc(ccc1F)F 34a_100000752141_100000210202 [0,1,0,1,0,0|2,0,0]=4 2093 B11R1.182 CCOc1cc(ccc1F)F 7a_100000752141_100000210202 [0,1,0,1,0,0|2,0,0]=4 2094 B11R1.182 CCOc1cc(ccc1F)I 34a_100009958187_100000210202 [0,1,0,1,0,0|2,0,0]=4 2095 B11R1.182 CCOc1cc(ccc1F)I 7a_100009958187_100000210202 [0,1,0,1,0,0|2,0,0]=4 2096 B11R1.182 CCOc1cc(ccc1F)N 34a_100012017398_100000210202 [0,1,0,1,0,0|2,0,0]=4 2097 B11R1.182 CCOc1cc(ccc1F)N 7a_100012017398_100000210202 [0,1,0,1,0,0|2,0,0]=4 2098 B11R1.182 CCOc1cc(ccc1F)O 271570a_203496583355_200012344967 [0,1,0,1,0,0|2,0,0]=4 2099 B11R1.182 CCOc1cc(ccc1I)Br 34a_100012344904_100000210202 [0,1,0,1,0,0|2,0,0]=4 2100 B11R1.182 CCOc1cc(ccc1I)Br 7a_100012344904_100000210202 [0,1,0,1,0,0|2,0,0]=4 2101 B11R1.182 CCOc1cc(ccc1I)Cl 34a_100000050036_100000210202 [0,1,0,1,0,0|2,0,0]=4 2102 B11R1.182 CCOc1cc(ccc1I)Cl 7a_100000050036_100000210202 [0,1,0,1,0,0|2,0,0]=4 2103 B11R1.182 CCOc1cc(ccc1I)F 34a_100010084537_100000210202 [0,1,0,1,0,0|2,0,0]=4 2104 B11R1.182 CCOc1cc(ccc1I)F 7a_100010084537_100000210202 [0,1,0,1,0,0|2,0,0]=4 2105 B11R1.182 CCOc1cc(ccc1N)Br 34a_100000739049_100000210202 [0,1,0,1,0,0|2,0,0]=4 2106 B11R1.182 CCOc1cc(ccc1N)Br 7a_100000739049_100000210202 [0,1,0,1,0,0|2,0,0]=4 2107 B11R1.182 CCOc1cc(ccc1N)C 34a_100000211527_100000210202 [0,1,0,1,0,0|1,0,0]=3 2108 B11R1.182 CCOc1cc(ccc1N)C 7a_100000211527_100000210202 [0,1,0,1,0,0|1,0,0]=3 2109 B11R1.182 CCOc1cc(ccc1N)Cl 34a_100000185728_100000210202 [0,1,0,1,0,0|2,0,0]=4 2110 B11R1.182 CCOc1cc(ccc1N)Cl 7a_100000185728_100000210202 [0,1,0,1,0,0|2,0,0]=4 2111 B11R1.182 CCOc1cc(ccc1N)F 34a_100000753323_100000210202 [0,1,0,1,0,0|2,0,0]=4 2112 B11R1.182 CCOc1cc(ccc1N)F 7a_100000753323_100000210202 [0,1,0,1,0,0|2,0,0]=4 2113 B11R1.182 CCOc1cc(ccc1N)I 34a_100000057187_100000210202 [0,1,0,1,0,0|2,0,0]=4 2114 B11R1.182 CCOc1cc(ccc1N)I 7a_100000057187_100000210202 [0,1,0,1,0,0|2,0,0]=4 2115 B11R1.182 CCOc1cc(ccc1N)N 34a_100025717382_100000210202 [0,1,0,1,0,0|2,0,0]=4 2116 B11R1.182 CCOc1cc(ccc1N)O 271570a_203496583355_100000688918 [0,1,0,1,0,0|2,0,0]=4 2117 B11R1.182 CCOc1cc(ccc1O)C 271570a_203496583355_200010713166 [0,1,0,1,0,0|1,0,0]=3 2118 B11R1.182 CCOc1cc(ccc1O)F 271570a_203496583355_200012340411 [0,1,0,1,0,0|2,0,0]=4 2119 B11R1.182 CCOc1cc(ccc1O)N 271570a_203496583355_200016990551 [0,1,0,1,0,0|2,0,0]=4 2120 B11R1.182 CCOc1cc(cnc1Cl)C 34a_100012000487_100000210202 [0,1,0,1,0,0|2,0,0]=4 2121 B11R1.182 CCOc1cc(cnc1Cl)C 7a_100012000487_100000210202 [0,1,0,1,0,0|2,0,0]=4 2122 B11R1.182 CCOc1cc(cnc1F)C 34a_100009849810_100000210202 [0,1,0,1,0,0|2,0,0]=4 2123 B11R1.182 CCOc1cc(cnc1F)C 7a_100009849810_100000210202 [0,1,0,1,0,0|2,0,0]=4 2124 B11R1.182 CCOc1cc(ncc1Br)C 34a_100011016184_100000210202 [0,1,0,1,0,0|2,0,0]=4 2125 B11R1.182 CCOc1nc(ccc1Br)C 34a_100009817604_100000210202 [0,1,0,1,0,0|1,0,0]=3 2126 B11R1.182 CCOc1nc(ccc1F)Cl 34a_100010729010_100000210202 [0,1,0,1,0,0|2,0,0]=4 2127 B11R1.182 CCOc1nc(ccc1N)C 34a_100000687486_100000210202 [0,1,0,1,0,0|1,0,0]=3 2128 B11R1.182 CCSc1cc(ccc1Br)C 62a_100000210202_100012353751 [0,1,0,1,0,0|1,1,0]=4 2129 B11R1.182 CCSc1cc(ccc1Br)C 62a_100012353751_100000210202 [0,1,0,1,0,0|1,1,0]=4 2130 B11R1.182 CCSc1cc(ccc1C)C 62a_100000210202_100000210833 [0,1,0,1,0,0|1,1,0]=4 2131 B11R1.182 CCSc1cc(ccc1C)C 62a_100000210833_100000210202 [0,1,0,1,0,0|1,1,0]=4 2132 B11R1.182 CCSc1cc(ccc1Cl)C 62a_100000210202_100012356289 [0,1,0,1,0,0|1,1,0]=4 2133 B11R1.182 CCSc1cc(ccc1Cl)C 62a_100012356289_100000210202 [0,1,0,1,0,0|1,1,0]=4 2134 B11R1.182 CCSc1cc(ccc1F)C 62a_100000210202_100000736223 [0,1,0,1,0,0|1,1,0]=4 2135 B11R1.182 CCSc1cc(ccc1F)C 62a_100000736223_100000210202 [0,1,0,1,0,0|1,1,0]=4 2136 B11R1.182 CCSc1cc(ccc1N)C 62a_100000210202_100011356834 [0,1,0,1,0,0|1,1,0]=4 2137 B11R1.182 CCSc1cc(ccc1N)C 62a_100011356834_100000210202 [0,1,0,1,0,0|1,1,0]=4 2138 B11R1.182 CCSc1cc(ccc1O)C 62a_100000210202_100000765521 [0,1,0,1,0,0|1,1,0]=4 2139 B11R1.182 CCSc1cc(ccc1O)C 62a_100000765521_100000210202 [0,1,0,1,0,0|1,1,0]=4 2140 B11R1.182 CCSc1nc(ccc1C)C 62a_100000210202_100009854376 [0,1,0,1,0,0|1,1,0]=4 2141 B11R1.182 CCSc1nc(ccc1C)C 62a_100009854376_100000210202 [0,1,0,1,0,0|1,1,0]=4 2142 B11R1.182 CCSc1nc(ccc1F)C 62a_100000210202_100009817602 [0,1,0,1,0,0|1,1,0]=4 2143 B11R1.182 CCSc1nc(ccc1F)C 62a_100009817602_100000210202 [0,1,0,1,0,0|1,1,0]=4 2144 B11R1.182 CCSc1nc(ccc1N)C 62a_100000210202_100000685570 [0,1,0,1,0,0|1,1,0]=4 2145 B11R1.182 CCSc1nc(ccc1N)C 62a_100000685570_100000210202 [0,1,0,1,0,0|1,1,0]=4 2146 B11R1.182 CCSc1nc(ccc1O)C 62a_100000210202_100000702858 [0,1,0,1,0,0|1,1,0]=4 2147 B11R1.182 CCSc1nc(ccc1O)C 62a_100000702858_100000210202 [0,1,0,1,0,0|1,1,0]=4 2148 B11R1.182 Cc1ccc(c(c1)OCF)Br 34a_100012002257_100015361967 [0,1,0,1,0,0|2,0,0]=4 2149 B11R1.182 Cc1ccc(c(c1)OCF)Br 7a_100012002257_100015361967 [0,1,0,1,0,0|2,0,0]=4 2150 B11R1.182 Cc1ccc(c(c1)OCF)C 34a_100000210931_100015361967 [0,1,0,1,0,0|2,0,0]=4 2151 B11R1.182 Cc1ccc(c(c1)OCF)C 7a_100000210931_100015361967 [0,1,0,1,0,0|2,0,0]=4 2152 B11R1.182 Cc1ccc(c(c1)OCF)Cl 34a_100000211493_100015361967 [0,1,0,1,0,0|2,0,0]=4 2153 B11R1.182 Cc1ccc(c(c1)OCF)Cl 7a_100000211493_100015361967 [0,1,0,1,0,0|2,0,0]=4 2154 B11R1.182 Cc1ccc(c(c1)OCF)F 34a_100000759540_100015361967 [0,1,0,1,0,0|2,0,0]=4 2155 B11R1.182 Cc1ccc(c(c1)OCF)F 7a_100000759540_100015361967 [0,1,0,1,0,0|2,0,0]=4 2156 B11R1.182 Cc1ccc(c(c1)OCF)N 34a_100000211527_100015361967 [0,1,0,1,0,0|2,0,0]=4 2157 B11R1.182 Cc1ccc(c(c1)OCF)N 7a_100000211527_100015361967 [0,1,0,1,0,0|2,0,0]=4 2158 B11R1.182 Cc1ccc(c(n1)OCF)Br 34a_100009817604_100015361967 [0,1,0,1,0,0|2,0,0]=4 2159 B11R1.182 Cc1ccc(c(n1)OCF)N 34a_100000687486_100015361967 [0,1,0,1,0,0|2,0,0]=4 2160 B11R1.185 CC=Cc1cc(sc1C)C=O 271570a_100016259895_100000708457 [0,1,0,1,0,0|0,1,1]=4 2161 B11R1.83 C=Cc1ccc(cc1)OCC 271570a_100011290941_100000169946 [0,1,0,1,0,0|1,0,1]=4 2162 B11R1.83 C=Cc1ccc(cc1)OCC 34a_100000189437_100000210202 [0,1,0,1,0,0|1,0,1]=4 2163 B11R1.83 C=Cc1ccc(cc1)OCC 7a_100000189437_100000210202 [0,1,0,1,0,0|1,0,1]=4 2164 B11R1.83 C=Cc1ccc(cn1)OCC 271570a_100011290941_100000753957 [0,1,0,1,0,0|1,0,1]=4 2165 B11R1.83 C=Cc1ccc(nc1)OCC 271570a_100011290941_100011219444 [0,1,0,1,0,0|1,0,1]=4 2166 B11R1.83 C=Cc1ccc(nn1)OCC 271570a_100011290941_100000757289 [0,1,0,1,0,0|1,0,1]=4 2167 B11R1.83 CCOc1ccc(cc1)CC 34a_100000211359_100000210202 [0,1,0,1,0,0|1,0,1]=4 2168 B11R1.83 CCOc1ccc(cc1)CC 7a_100000211359_100000210202 [0,1,0,1,0,0|1,0,1]=4 2169 B11R1.83 CCOc1ccc(cc1)NC 2230a_100000739623_200000210301 [0,1,0,1,0,0|2,0,0]=4 2170 B11R1.83 CCOc1ccc(cc1)NC 34a_100000182112_100000210202 [0,1,0,1,0,0|2,0,0]=4 2171 B11R1.83 CCOc1ccc(cc1)NC 34a_100000739623_200000210301 [0,1,0,1,0,0|2,0,0]=4 2172 B11R1.83 CCOc1ccc(cc1)N[13CH3] 2230a_100000739623_200025704644 [0,1,0,1,0,0|2,0,0]=4 2173 B11R1.83 CCOc1ccc(cc1)N[13CH3] 34a_100000739623_200025704644 [0,1,0,1,0,0|2,0,0]=4 2174 B11R1.83 CCOc1ccc(cc1)OC 34a_100000185467_200000210301 [0,1,0,1,0,0|2,0,0]=4 2175 B11R1.83 CCOc1ccc(cc1)OC 34a_100000210503_100000210202 [0,1,0,1,0,0|2,0,0]=4 2176 B11R1.83 CCOc1ccc(cc1)O[13CH3] 34a_100000185467_200025704644 [0,1,0,1,0,0|2,0,0]=4 2177 B11R1.83 CCOc1ccc(cc1)SC 34a_100000211864_100000210202 [0,1,0,1,0,0|2,0,0]=4 2178 B11R1.83 CCOc1ccc(cc1)SC 62a_200000210301_100000171712 [0,1,0,1,0,0|2,0,0]=4 2179 B11R1.83 CCOc1ccc(cc1)S[13CH3] 62a_200025704644_100000171712 [0,1,0,1,0,0|2,0,0]=4 2180 B11R1.83 CCOc1ccc(cn1)OC 34a_100012002028_100000210202 [0,1,0,1,0,0|2,0,0]=4 2181 B11R1.83 CCOc1ccc(cn1)SC 62a_100011219444_200000210301 [0,1,0,1,0,0|2,0,0]=4 2182 B11R1.83 CCOc1ccc(cn1)SC 62a_200000210301_100011219444 [0,1,0,1,0,0|2,0,0]=4 2183 B11R1.83 CCOc1ccc(cn1)S[13CH3] 62a_100011219444_200025704644 [0,1,0,1,0,0|2,0,0]=4 2184 B11R1.83 CCOc1ccc(cn1)S[13CH3] 62a_200025704644_100011219444 [0,1,0,1,0,0|2,0,0]=4 2185 B11R1.83 CCOc1ccc(nc1)OC 34a_100011934560_100000210202 [0,1,0,1,0,0|2,0,0]=4 2186 B11R1.83 CCOc1ccc(nc1)SC 62a_100012355646_200000210301 [0,1,0,1,0,0|2,0,0]=4 2187 B11R1.83 CCOc1ccc(nc1)SC 62a_200000210301_100000753957 [0,1,0,1,0,0|2,0,0]=4 2188 B11R1.83 CCOc1ccc(nc1)S[13CH3] 62a_100012355646_200025704644 [0,1,0,1,0,0|2,0,0]=4 2189 B11R1.83 CCOc1ccc(nc1)S[13CH3] 62a_200025704644_100000753957 [0,1,0,1,0,0|2,0,0]=4 2190 B11R1.83 CCOc1ccc(nn1)NC 27a_100102657272_100000757289 [0,1,0,1,0,0|2,0,0]=4 2191 B11R1.83 CCOc1ccc(nn1)SC 62a_200000210301_100000757289 [0,1,0,1,0,0|2,0,0]=4 2192 B11R1.83 CCOc1ccc(nn1)S[13CH3] 62a_200025704644_100000757289 [0,1,0,1,0,0|2,0,0]=4 2193 B11R1.23 CCC(=O)c1cccc(c1)C 1458a_100000189346_100000210202 [0,1,0,1,0,0|2,0,0]=4 2194 B11R1.23 CCN(C)c1cccc(c1)C 2230a_100000182157_200000210301 [0,1,0,1,0,0|2,0,0]=4 2195 B11R1.23 CCN(C)c1cccc(c1)C 2230a_100000219674_100000210202 [0,1,0,1,0,0|2,0,0]=4 2196 B11R1.23 CCN(C)c1cccc(c1)C 269982a_100000182157_200000210301 [0,1,0,1,0,0|2,0,0]=4 2197 B11R1.23 CCN(C)c1cccc(c1)C 269982a_100000219674_100000204670 [0,1,0,1,0,0|2,0,0]=4 2198 B11R1.23 CCN(C)c1cccc(c1)C 34a_100000182157_200000210301 [0,1,0,1,0,0|2,0,0]=4 2199 B11R1.23 CCN(C)c1cccc(c1)C 34a_100000219674_100000210202 [0,1,0,1,0,0|2,0,0]=4 2200 B11R1.23 CCN(C)c1cccc(c1)C 7a_100000182157_200000210301 [0,1,0,1,0,0|2,0,0]=4 2201 B11R1.23 CCN([13CH3])c1cccc(c1)C 2230a_100000182157_200025704644 [0,1,0,1,0,0|2,0,0]=4 2202 B11R1.23 CCN([13CH3])c1cccc(c1)C 269982a_100000182157_200025704644 [0,1,0,1,0,0|2,0,0]=4 2203 B11R1.23 CCN([13CH3])c1cccc(c1)C 34a_100000182157_200025704644 [0,1,0,1,0,0|2,0,0]=4 2204 B11R1.23 CCN([13CH3])c1cccc(c1)C 7a_100000182157_200025704644 [0,1,0,1,0,0|2,0,0]=4 2205 B11R1.192 CCNc1ccc(c(c1)C)Br 2230a_100000210723_100000210202 [0,1,0,1,0,0|2,0,0]=4 2206 B11R1.192 CCNc1ccc(c(c1)C)Br 34a_100000210723_100000210202 [0,1,0,1,0,0|2,0,0]=4 2207 B11R1.192 CCNc1ccc(c(c1)C)Br 7a_100000210723_100000210202 [0,1,0,1,0,0|2,0,0]=4 2208 B11R1.192 CCNc1ccc(c(c1)C)C 2230a_100000724040_100000210202 [0,1,0,1,0,0|2,0,0]=4 2209 B11R1.192 CCNc1ccc(c(c1)C)C 34a_100000724040_100000210202 [0,1,0,1,0,0|2,0,0]=4 2210 B11R1.192 CCNc1ccc(c(c1)C)C 7a_100000724040_100000210202 [0,1,0,1,0,0|2,0,0]=4 2211 B11R1.192 CCNc1ccc(c(c1)C)Cl 2230a_100000187808_100000210202 [0,1,0,1,0,0|2,0,0]=4 2212 B11R1.192 CCNc1ccc(c(c1)C)Cl 34a_100000187808_100000210202 [0,1,0,1,0,0|2,0,0]=4 2213 B11R1.192 CCNc1ccc(c(c1)C)Cl 7a_100000187808_100000210202 [0,1,0,1,0,0|2,0,0]=4 2214 B11R1.192 CCNc1ccc(c(c1)C)F 2230a_100000750164_100000210202 [0,1,0,1,0,0|2,0,0]=4 2215 B11R1.192 CCNc1ccc(c(c1)C)F 34a_100000750164_100000210202 [0,1,0,1,0,0|2,0,0]=4 2216 B11R1.192 CCNc1ccc(c(c1)C)F 7a_100000750164_100000210202 [0,1,0,1,0,0|2,0,0]=4 2217 B11R1.192 CCNc1ccc(c(c1)C)I 34a_100000198070_100000210202 [0,1,0,1,0,0|2,0,0]=4 2218 B11R1.192 CCNc1ccc(c(c1)C)I 7a_100000198070_100000210202 [0,1,0,1,0,0|2,0,0]=4 2219 B11R1.192 CCNc1ccc(c(c1)C)O 271570a_203496583355_100015183089 [0,1,0,1,0,0|2,0,0]=4 2220 B11R1.192 CCNc1ccc(c(c1)C)O 34a_100011218179_100000210202 [0,1,0,1,0,0|2,0,0]=4 2221 B11R1.192 CCNc1ccc(c(c1)C)O 7a_100011218179_100000210202 [0,1,0,1,0,0|2,0,0]=4 2222 B11R1.192 CCOc1cc(c(cn1)Br)C 34a_100000766222_100000210202 [0,1,0,1,0,0|2,0,0]=4 2223 B11R1.192 CCOc1cc(c(cn1)Cl)C 34a_200000085746_100000210202 [0,1,0,1,0,0|2,0,0]=4 2224 B11R1.192 CCOc1cc(c(cn1)O)C 271570a_203496583355_200012351029 [0,1,0,1,0,0|2,0,0]=4 2225 B11R1.192 CCOc1ccc(c(c1)Br)C 34a_100011380479_100000210202 [0,1,0,1,0,0|2,0,0]=4 2226 B11R1.192 CCOc1ccc(c(c1)Br)C 7a_100011380479_100000210202 [0,1,0,1,0,0|2,0,0]=4 2227 B11R1.192 CCOc1ccc(c(c1)Br)Cl 34a_100011933957_100000210202 [0,1,0,1,0,0|2,0,0]=4 2228 B11R1.192 CCOc1ccc(c(c1)Br)Cl 7a_100011933957_100000210202 [0,1,0,1,0,0|2,0,0]=4 2229 B11R1.192 CCOc1ccc(c(c1)Br)F 34a_100000693481_100000210202 [0,1,0,1,0,0|2,0,0]=4 2230 B11R1.192 CCOc1ccc(c(c1)Br)F 7a_100000693481_100000210202 [0,1,0,1,0,0|2,0,0]=4 2231 B11R1.192 CCOc1ccc(c(c1)Br)I 34a_100000701344_100000210202 [0,1,0,1,0,0|2,0,0]=4 2232 B11R1.192 CCOc1ccc(c(c1)Br)I 7a_100000701344_100000210202 [0,1,0,1,0,0|2,0,0]=4 2233 B11R1.192 CCOc1ccc(c(c1)Br)N 34a_100012001276_100000210202 [0,1,0,1,0,0|2,0,0]=4 2234 B11R1.192 CCOc1ccc(c(c1)Br)N 7a_100012001276_100000210202 [0,1,0,1,0,0|2,0,0]=4 2235 B11R1.192 CCOc1ccc(c(c1)C)Br 34a_100000690111_100000210202 [0,1,0,1,0,0|1,0,0]=3 2236 B11R1.192 CCOc1ccc(c(c1)C)Br 7a_100000690111_100000210202 [0,1,0,1,0,0|1,0,0]=3 2237 B11R1.192 CCOc1ccc(c(c1)C)C 34a_100000210932_100000210202 [0,1,0,1,0,0|1,0,0]=3 2238 B11R1.192 CCOc1ccc(c(c1)C)C 7a_100000210932_100000210202 [0,1,0,1,0,0|1,0,0]=3 2239 B11R1.192 CCOc1ccc(c(c1)C)Cl 34a_100000211092_100000210202 [0,1,0,1,0,0|1,0,0]=3 2240 B11R1.192 CCOc1ccc(c(c1)C)Cl 7a_100000211092_100000210202 [0,1,0,1,0,0|1,0,0]=3 2241 B11R1.192 CCOc1ccc(c(c1)C)F 34a_100000751312_100000210202 [0,1,0,1,0,0|1,0,0]=3 2242 B11R1.192 CCOc1ccc(c(c1)C)F 7a_100000751312_100000210202 [0,1,0,1,0,0|1,0,0]=3 2243 B11R1.192 CCOc1ccc(c(c1)C)I 34a_100000729255_100000210202 [0,1,0,1,0,0|1,0,0]=3 2244 B11R1.192 CCOc1ccc(c(c1)C)I 7a_100000729255_100000210202 [0,1,0,1,0,0|1,0,0]=3 2245 B11R1.192 CCOc1ccc(c(c1)C)N 34a_100000756630_100000210202 [0,1,0,1,0,0|1,0,0]=3 2246 B11R1.192 CCOc1ccc(c(c1)C)N 7a_100000756630_100000210202 [0,1,0,1,0,0|1,0,0]=3 2247 B11R1.192 CCOc1ccc(c(c1)C)O 271570a_203496583355_100012344538 [0,1,0,1,0,0|1,0,0]=3 2248 B11R1.192 CCOc1ccc(c(c1)Cl)Br 34a_100011215161_100000210202 [0,1,0,1,0,0|2,0,0]=4 2249 B11R1.192 CCOc1ccc(c(c1)Cl)Br 7a_100011215161_100000210202 [0,1,0,1,0,0|2,0,0]=4 2250 B11R1.192 CCOc1ccc(c(c1)Cl)C 34a_100011265682_100000210202 [0,1,0,1,0,0|2,0,0]=4 2251 B11R1.192 CCOc1ccc(c(c1)Cl)C 7a_100011265682_100000210202 [0,1,0,1,0,0|2,0,0]=4 2252 B11R1.192 CCOc1ccc(c(c1)Cl)Cl 34a_100000211054_100000210202 [0,1,0,1,0,0|2,0,0]=4 2253 B11R1.192 CCOc1ccc(c(c1)Cl)Cl 7a_100000211054_100000210202 [0,1,0,1,0,0|2,0,0]=4 2254 B11R1.192 CCOc1ccc(c(c1)Cl)F 34a_100000211030_100000210202 [0,1,0,1,0,0|2,0,0]=4 2255 B11R1.192 CCOc1ccc(c(c1)Cl)F 7a_100000211030_100000210202 [0,1,0,1,0,0|2,0,0]=4 2256 B11R1.192 CCOc1ccc(c(c1)Cl)I 34a_100000047559_100000210202 [0,1,0,1,0,0|2,0,0]=4 2257 B11R1.192 CCOc1ccc(c(c1)Cl)I 7a_100000047559_100000210202 [0,1,0,1,0,0|2,0,0]=4 2258 B11R1.192 CCOc1ccc(c(c1)Cl)N 34a_100011215599_100000210202 [0,1,0,1,0,0|2,0,0]=4 2259 B11R1.192 CCOc1ccc(c(c1)Cl)N 7a_100011215599_100000210202 [0,1,0,1,0,0|2,0,0]=4 2260 B11R1.192 CCOc1ccc(c(c1)F)Br 34a_100000755031_100000210202 [0,1,0,1,0,0|2,0,0]=4 2261 B11R1.192 CCOc1ccc(c(c1)F)Br 7a_100000755031_100000210202 [0,1,0,1,0,0|2,0,0]=4 2262 B11R1.192 CCOc1ccc(c(c1)F)C 34a_100000722560_100000210202 [0,1,0,1,0,0|2,0,0]=4 2263 B11R1.192 CCOc1ccc(c(c1)F)C 7a_100000722560_100000210202 [0,1,0,1,0,0|2,0,0]=4 2264 B11R1.192 CCOc1ccc(c(c1)F)Cl 34a_100000691581_100000210202 [0,1,0,1,0,0|2,0,0]=4 2265 B11R1.192 CCOc1ccc(c(c1)F)Cl 7a_100000691581_100000210202 [0,1,0,1,0,0|2,0,0]=4 2266 B11R1.192 CCOc1ccc(c(c1)F)F 34a_100000181275_100000210202 [0,1,0,1,0,0|2,0,0]=4 2267 B11R1.192 CCOc1ccc(c(c1)F)F 7a_100000181275_100000210202 [0,1,0,1,0,0|2,0,0]=4 2268 B11R1.192 CCOc1ccc(c(c1)F)I 34a_100009990212_100000210202 [0,1,0,1,0,0|2,0,0]=4 2269 B11R1.192 CCOc1ccc(c(c1)F)I 7a_100009990212_100000210202 [0,1,0,1,0,0|2,0,0]=4 2270 B11R1.192 CCOc1ccc(c(c1)F)N 34a_100000759473_100000210202 [0,1,0,1,0,0|2,0,0]=4 2271 B11R1.192 CCOc1ccc(c(c1)F)N 7a_100000759473_100000210202 [0,1,0,1,0,0|2,0,0]=4 2272 B11R1.192 CCOc1ccc(c(c1)F)O 271570a_203496583355_100000692347 [0,1,0,1,0,0|2,0,0]=4 2273 B11R1.192 CCOc1ccc(c(c1)I)Br 34a_100012339312_100000210202 [0,1,0,1,0,0|2,0,0]=4 2274 B11R1.192 CCOc1ccc(c(c1)I)Br 7a_100012339312_100000210202 [0,1,0,1,0,0|2,0,0]=4 2275 B11R1.192 CCOc1ccc(c(c1)I)Cl 34a_100000049588_100000210202 [0,1,0,1,0,0|2,0,0]=4 2276 B11R1.192 CCOc1ccc(c(c1)I)Cl 7a_100000049588_100000210202 [0,1,0,1,0,0|2,0,0]=4 2277 B11R1.192 CCOc1ccc(c(c1)I)N 34a_100010084370_100000210202 [0,1,0,1,0,0|2,0,0]=4 2278 B11R1.192 CCOc1ccc(c(c1)I)N 7a_100010084370_100000210202 [0,1,0,1,0,0|2,0,0]=4 2279 B11R1.192 CCOc1ccc(c(c1)N)Br 34a_100011999798_100000210202 [0,1,0,1,0,0|2,0,0]=4 2280 B11R1.192 CCOc1ccc(c(c1)N)Br 7a_100011999798_100000210202 [0,1,0,1,0,0|2,0,0]=4 2281 B11R1.192 CCOc1ccc(c(c1)N)C 34a_100011216113_100000210202 [0,1,0,1,0,0|2,0,0]=4 2282 B11R1.192 CCOc1ccc(c(c1)N)C 7a_100011216113_100000210202 [0,1,0,1,0,0|2,0,0]=4 2283 B11R1.192 CCOc1ccc(c(c1)N)Cl 34a_100011934297_100000210202 [0,1,0,1,0,0|2,0,0]=4 2284 B11R1.192 CCOc1ccc(c(c1)N)F 34a_100012017239_100000210202 [0,1,0,1,0,0|2,0,0]=4 2285 B11R1.192 CCOc1ccc(c(c1)N)F 7a_100012017239_100000210202 [0,1,0,1,0,0|2,0,0]=4 2286 B11R1.192 CCOc1ccc(c(c1)N)N 34a_100025771000_100000210202 [0,1,0,1,0,0|2,0,0]=4 2287 B11R1.192 CCOc1ccc(c(c1)O)C 271570a_203496583355_100011099959 [0,1,0,1,0,0|2,0,0]=4 2288 B11R1.192 CCOc1ccc(c(n1)C)Br 34a_100000691680_100000210202 [0,1,0,1,0,0|1,0,0]=3 2289 B11R1.192 CCOc1ccc(c(n1)C)Cl 34a_200009863735_100000210202 [0,1,0,1,0,0|1,0,0]=3 2290 B11R1.192 CCOc1ccc(c(n1)F)Br 34a_100009879308_100000210202 [0,1,0,1,0,0|2,0,0]=4 2291 B11R1.192 CCOc1cnc(c(c1)C)Br 34a_100012000486_100000210202 [0,1,0,1,0,0|2,0,0]=4 2292 B11R1.192 CCOc1cnc(c(c1)C)Br 7a_100012000486_100000210202 [0,1,0,1,0,0|2,0,0]=4 2293 B11R1.192 CCOc1cnc(c(c1)C)C 34a_100009854398_100000210202 [0,1,0,1,0,0|2,0,0]=4 2294 B11R1.192 CCOc1cnc(c(c1)C)C 7a_100009854398_100000210202 [0,1,0,1,0,0|2,0,0]=4 2295 B11R1.192 CCOc1cnc(c(c1)C)Cl 34a_100012002680_100000210202 [0,1,0,1,0,0|2,0,0]=4 2296 B11R1.192 CCOc1cnc(c(c1)C)Cl 7a_100012002680_100000210202 [0,1,0,1,0,0|2,0,0]=4 2297 B11R1.192 CCOc1cnc(c(c1)C)F 34a_100000094615_100000210202 [0,1,0,1,0,0|2,0,0]=4 2298 B11R1.192 CCOc1cnc(c(c1)C)F 7a_100000094615_100000210202 [0,1,0,1,0,0|2,0,0]=4 2299 B11R1.192 CCOc1cnc(c(n1)C)C 34a_200000700380_100000210202 [0,1,0,1,0,0|2,0,0]=4 2300 B11R1.192 CCSc1ccc(c(c1)C)Br 62a_100000210202_100009813585 [0,1,0,1,0,0|1,1,0]=4 2301 B11R1.192 CCSc1ccc(c(c1)C)Br 62a_100009813585_100000210202 [0,1,0,1,0,0|1,1,0]=4 2302 B11R1.192 CCSc1ccc(c(c1)C)C 62a_100000210202_100011215607 [0,1,0,1,0,0|1,1,0]=4 2303 B11R1.192 CCSc1ccc(c(c1)C)C 62a_100011215607_100000210202 [0,1,0,1,0,0|1,1,0]=4 2304 B11R1.192 CCSc1ccc(c(c1)C)Cl 62a_100000049509_100000210202 [0,1,0,1,0,0|1,1,0]=4 2305 B11R1.192 CCSc1ccc(c(c1)C)Cl 62a_100000210202_100000049509 [0,1,0,1,0,0|1,1,0]=4 2306 B11R1.192 CCSc1ccc(c(c1)C)F 62a_100000210202_100011218330 [0,1,0,1,0,0|1,1,0]=4 2307 B11R1.192 CCSc1ccc(c(c1)C)F 62a_100011218330_100000210202 [0,1,0,1,0,0|1,1,0]=4 2308 B11R1.192 CCSc1ccc(c(c1)C)N 62a_100000210202_100000211769 [0,1,0,1,0,0|1,1,0]=4 2309 B11R1.192 CCSc1ccc(c(c1)C)N 62a_100000211769_100000210202 [0,1,0,1,0,0|1,1,0]=4 2310 B11R1.192 CCSc1ccc(c(c1)C)O 62a_100000210202_100000186361 [0,1,0,1,0,0|1,1,0]=4 2311 B11R1.192 CCSc1ccc(c(n1)C)Br 62a_100000210202_100012360386 [0,1,0,1,0,0|1,1,0]=4 2312 B11R1.192 CCSc1ccc(c(n1)C)Br 62a_100012360386_100000210202 [0,1,0,1,0,0|1,1,0]=4 2313 B11R1.192 CCSc1ccc(c(n1)C)C 62a_100000103781_100000210202 [0,1,0,1,0,0|1,1,0]=4 2314 B11R1.192 CCSc1ccc(c(n1)C)C 62a_100000210202_100000103781 [0,1,0,1,0,0|1,1,0]=4 2315 B11R1.192 CCSc1ccc(c(n1)C)F 62a_100000210202_100009814307 [0,1,0,1,0,0|1,1,0]=4 2316 B11R1.192 CCSc1ccc(c(n1)C)F 62a_100009814307_100000210202 [0,1,0,1,0,0|1,1,0]=4 2317 B11R1.192 CCSc1ccc(c(n1)C)N 62a_100000210202_100000720120 [0,1,0,1,0,0|1,1,0]=4 2318 B11R1.192 CCSc1ccc(c(n1)C)N 62a_100000720120_100000210202 [0,1,0,1,0,0|1,1,0]=4 2319 B11R1.192 CCSc1ccc(c(n1)C)O 62a_100000210202_100010233687 [0,1,0,1,0,0|1,1,0]=4 2320 B11R1.192 CCSc1ccc(c(n1)C)O 62a_100010233687_100000210202 [0,1,0,1,0,0|1,1,0]=4 2321 B11R1.192 Cc1cc(ccc1Br)OCF 34a_100000690111_100015361967 [0,1,0,1,0,0|2,0,0]=4 2322 B11R1.192 Cc1cc(ccc1Br)OCF 7a_100000690111_100015361967 [0,1,0,1,0,0|2,0,0]=4 2323 B11R1.192 Cc1cc(ccc1Cl)OCF 34a_100000211092_100015361967 [0,1,0,1,0,0|2,0,0]=4 2324 B11R1.192 Cc1cc(ccc1Cl)OCF 7a_100000211092_100015361967 [0,1,0,1,0,0|2,0,0]=4 2325 B11R1.192 Cc1cc(ccc1F)OCF 34a_100000751312_100015361967 [0,1,0,1,0,0|2,0,0]=4 2326 B11R1.192 Cc1cc(ccc1F)OCF 7a_100000751312_100015361967 [0,1,0,1,0,0|2,0,0]=4 2327 B11R1.192 Cc1cc(ccc1I)OCF 34a_100000729255_100015361967 [0,1,0,1,0,0|2,0,0]=4 2328 B11R1.192 Cc1cc(ccc1I)OCF 7a_100000729255_100015361967 [0,1,0,1,0,0|2,0,0]=4 2329 B11R1.192 Cc1cc(ccc1N)OCF 34a_100000756630_100015361967 [0,1,0,1,0,0|2,0,0]=4 2330 B11R1.192 Cc1cc(ccc1N)OCF 7a_100000756630_100015361967 [0,1,0,1,0,0|2,0,0]=4 2331 B11R1.192 Cc1ccc(cc1C)OCF 34a_100000210932_100015361967 [0,1,0,1,0,0|2,0,0]=4 2332 B11R1.192 Cc1ccc(cc1C)OCF 7a_100000210932_100015361967 [0,1,0,1,0,0|2,0,0]=4 2333 B11R1.192 Cc1nc(ccc1Br)OCF 34a_100000691680_100015361967 [0,1,0,1,0,0|2,0,0]=4 2334 B11R1.192 Cc1nc(ccc1Cl)OCF 34a_200009863735_100015361967 [0,1,0,1,0,0|2,0,0]=4 2335 B11R1.280 C=Cc1ccc(=O)n(c1)CC 271570a_100011290941_100000231005 [0,1,0,1,0,0|1,0,1]=4 2336 B11R1.280 CCn1cc(ccc1=O)SC 62a_100000231005_200000210301 [0,1,0,1,0,0|2,0,0]=4 2337 B11R1.280 CCn1cc(ccc1=O)SC 62a_200000210301_100000231005 [0,1,0,1,0,0|2,0,0]=4 2338 B11R1.280 CCn1cc(ccc1=O)S[13CH3] 62a_100000231005_200025704644 [0,1,0,1,0,0|2,0,0]=4 2339 B11R1.280 CCn1cc(ccc1=O)S[13CH3] 62a_200025704644_100000231005 [0,1,0,1,0,0|2,0,0]=4 2340 B11R1.299 C/C=C/C=CC(=O)C1CCC1 1458a_100000185730_100000749161 [0,1,0,1,0,0|1,0,0]=3 2341 B11R1.299 C/C=C/C=CC(=O)C1COC1 1458a_100000185730_100000687716 [0,1,0,1,0,0|1,0,0]=3 2342 B11R1.299 C/C=C/C=CC(=O)N1CCC1 11a_100000754969_100000185730 [0,1,0,1,0,0|1,0,0]=3 2343 B11R1.299 C/C=C/C=CC(=O)N1CCC1 240690a_100000754969_100000185730 [0,1,0,1,0,0|1,0,0]=3 2344 B11R1.299 CC/C=C\CC(=O)C1CCO1 1458a_100000089072_100103147603 [0,1,0,1,0,0|0,0,2]=4 2345 B11R1.214 CCOCc1ccc(o1)C=O 34a_100121572206_200000079136 [0,1,0,1,0,0|1,0,1]=4 2346 B11R1.605 CCNc1c(cccc1Br)C 34a_100011834072_100000210202 [0,1,0,1,0,0|2,0,0]=4 2347 B11R1.605 CCNc1c(cccc1C)C 34a_100000185769_100000210202 [0,1,0,1,0,0|2,0,0]=4 2348 B11R1.605 CCNc1c(cccc1Cl)C 34a_100000756524_100000210202 [0,1,0,1,0,0|2,0,0]=4 2349 B11R1.605 CCNc1c(cccc1F)C 34a_100000766463_100000210202 [0,1,0,1,0,0|2,0,0]=4 2350 B11R1.605 CCNc1c(cccc1O)C 34a_100000743429_100000210202 [0,1,0,1,0,0|1,0,1]=4 2351 B11R1.605 CCOc1c(cccc1Br)Br 34a_100000736428_100000210202 [0,1,0,1,0,0|2,0,0]=4 2352 B11R1.605 CCOc1c(cccc1Br)Br 7a_100000736428_100000210202 [0,1,0,1,0,0|2,0,0]=4 2353 B11R1.605 CCOc1c(cccc1Br)C 34a_100009817157_100000210202 [0,1,0,1,0,0|1,0,0]=3 2354 B11R1.605 CCOc1c(cccc1Br)C 7a_100009817157_100000210202 [0,1,0,1,0,0|1,0,0]=3 2355 B11R1.605 CCOc1c(cccc1Br)Cl 34a_100010214474_100000210202 [0,1,0,1,0,0|2,0,0]=4 2356 B11R1.605 CCOc1c(cccc1Br)Cl 7a_100010214474_100000210202 [0,1,0,1,0,0|2,0,0]=4 2357 B11R1.605 CCOc1c(cccc1Br)F 34a_100009813666_100000210202 [0,1,0,1,0,0|2,0,0]=4 2358 B11R1.605 CCOc1c(cccc1Br)F 7a_100009813666_100000210202 [0,1,0,1,0,0|2,0,0]=4 2359 B11R1.605 CCOc1c(cccc1Br)N 34a_100011934915_100000210202 [0,1,0,1,0,0|2,0,0]=4 2360 B11R1.605 CCOc1c(cccc1C)C 34a_100000210341_100000210202 [0,1,0,1,0,0|1,0,0]=3 2361 B11R1.605 CCOc1c(cccc1C)C 7a_100000210341_100000210202 [0,1,0,1,0,0|1,0,0]=3 2362 B11R1.605 CCOc1c(cccc1Cl)C 34a_100000033731_100000210202 [0,1,0,1,0,0|1,0,0]=3 2363 B11R1.605 CCOc1c(cccc1Cl)C 7a_100000033731_100000210202 [0,1,0,1,0,0|1,0,0]=3 2364 B11R1.605 CCOc1c(cccc1Cl)Cl 34a_100000211709_100000210202 [0,1,0,1,0,0|2,0,0]=4 2365 B11R1.605 CCOc1c(cccc1Cl)Cl 7a_100000211709_100000210202 [0,1,0,1,0,0|2,0,0]=4 2366 B11R1.605 CCOc1c(cccc1Cl)F 34a_100000694953_100000210202 [0,1,0,1,0,0|2,0,0]=4 2367 B11R1.605 CCOc1c(cccc1Cl)F 7a_100000694953_100000210202 [0,1,0,1,0,0|2,0,0]=4 2368 B11R1.605 CCOc1c(cccc1Cl)N 34a_100000754742_100000210202 [0,1,0,1,0,0|2,0,0]=4 2369 B11R1.605 CCOc1c(cccc1F)C 34a_100011659162_100000210202 [0,1,0,1,0,0|1,0,0]=3 2370 B11R1.605 CCOc1c(cccc1F)C 7a_100011659162_100000210202 [0,1,0,1,0,0|1,0,0]=3 2371 B11R1.605 CCOc1c(cccc1F)F 34a_100000230165_100000210202 [0,1,0,1,0,0|2,0,0]=4 2372 B11R1.605 CCOc1c(cccc1F)F 7a_100000230165_100000210202 [0,1,0,1,0,0|2,0,0]=4 2373 B11R1.605 CCOc1c(cccc1F)N 34a_100011934987_100000210202 [0,1,0,1,0,0|2,0,0]=4 2374 B11R1.605 CCOc1c(cccc1F)O 271570a_203496583355_100010232518 [0,1,0,1,0,0|1,0,1]=4 2375 B11R1.605 CCOc1c(cccc1I)Br 34a_100010084509_100000210202 [0,1,0,1,0,0|2,0,0]=4 2376 B11R1.605 CCOc1c(cccc1I)Br 7a_100010084509_100000210202 [0,1,0,1,0,0|2,0,0]=4 2377 B11R1.605 CCOc1c(cccc1I)Cl 34a_100010202889_100000210202 [0,1,0,1,0,0|2,0,0]=4 2378 B11R1.605 CCOc1c(cccc1I)Cl 7a_100010202889_100000210202 [0,1,0,1,0,0|2,0,0]=4 2379 B11R1.605 CCOc1c(cccc1I)F 34a_100010186298_100000210202 [0,1,0,1,0,0|2,0,0]=4 2380 B11R1.605 CCOc1c(cccc1I)F 7a_100010186298_100000210202 [0,1,0,1,0,0|2,0,0]=4 2381 B11R1.605 CCOc1c(cccc1I)N 34a_100010084371_100000210202 [0,1,0,1,0,0|2,0,0]=4 2382 B11R1.605 CCOc1c(cccc1N)C 34a_100000756359_100000210202 [0,1,0,1,0,0|1,0,0]=3 2383 B11R1.605 CCOc1c(cccc1N)C 7a_100000756359_100000210202 [0,1,0,1,0,0|1,0,0]=3 2384 B11R1.605 CCOc1c(cccc1N)N 34a_200016994477_100000210202 [0,1,0,1,0,0|2,0,0]=4 2385 B11R1.605 CCOc1c(ccnc1C)C 34a_100011934651_100000210202 [0,1,0,1,0,0|2,0,0]=4 2386 B11R1.605 CCOc1c(ccnc1C)C 7a_100011934651_100000210202 [0,1,0,1,0,0|2,0,0]=4 2387 B11R1.605 CCOc1c(ccnc1Cl)C 34a_100000696282_100000210202 [0,1,0,1,0,0|2,0,0]=4 2388 B11R1.605 CCOc1c(ccnc1Cl)C 7a_100000696282_100000210202 [0,1,0,1,0,0|2,0,0]=4 2389 B11R1.605 CCOc1c(occc1=O)C 34a_100000031901_100000210202 [0,1,0,1,0,0|1,0,0]=3 2390 B11R1.605 CCSc1c(cccc1Br)C 62a_100000210202_100010141302 [0,1,0,1,0,0|1,1,0]=4 2391 B11R1.605 CCSc1c(cccc1Br)C 62a_100010141302_100000210202 [0,1,0,1,0,0|1,1,0]=4 2392 B11R1.605 CCSc1c(cccc1C)C 62a_100000033847_100000210202 [0,1,0,1,0,0|1,1,0]=4 2393 B11R1.605 CCSc1c(cccc1C)C 62a_100000210202_100000033847 [0,1,0,1,0,0|1,1,0]=4 2394 B11R1.605 CCSc1c(cccc1Cl)C 62a_100000043165_100000210202 [0,1,0,1,0,0|1,1,0]=4 2395 B11R1.605 CCSc1c(cccc1Cl)C 62a_100000210202_100000043165 [0,1,0,1,0,0|1,1,0]=4 2396 B11R1.605 CCSc1c(cccc1F)C 62a_100000210202_100011218421 [0,1,0,1,0,0|1,1,0]=4 2397 B11R1.605 CCSc1c(cccc1F)C 62a_100011218421_100000210202 [0,1,0,1,0,0|1,1,0]=4 2398 B11R1.605 CCSc1c(cccc1N)C 62a_100000210202_100000684715 [0,1,0,1,0,0|1,1,0]=4 2399 B11R1.605 CCSc1c(cccc1N)C 62a_100000684715_100000210202 [0,1,0,1,0,0|1,1,0]=4 2400 B11R1.605 CCSc1c(cccc1O)C 62a_100000210202_100000686692 [0,1,0,1,0,0|0,1,1]=4 2401 B11R1.605 CCSc1c(cccc1O)C 62a_100000686692_100000210202 [0,1,0,1,0,0|0,1,1]=4 2402 B11R1.605 CNCc1c(cccc1Br)C 207a_100102657272_100009881667 [0,1,0,1,0,0|2,0,0]=4 2403 B11R1.605 CNCc1c(cccc1Br)C 2230a_106832991635_100010146847 [0,1,0,1,0,0|2,0,0]=4 2404 B11R1.605 CNCc1c(cccc1Br)C 26a_100102657272_100009817157 [0,1,0,1,0,0|2,0,0]=4 2405 B11R1.605 CNCc1c(cccc1Br)C 270004a_106832991635_100009881667 [0,1,0,1,0,0|2,0,0]=4 2406 B11R1.605 CNCc1c(cccc1Br)C 34a_100102657272_100010146847 [0,1,0,1,0,0|2,0,0]=4 2407 B11R1.605 CNCc1c(cccc1Br)C 7a_106832991635_100010146847 [0,1,0,1,0,0|2,0,0]=4 2408 B11R1.605 CNCc1c(cccc1C)C 207a_100102657272_100000758299 [0,1,0,1,0,0|2,0,0]=4 2409 B11R1.605 CNCc1c(cccc1C)C 2230a_106832991635_100000758300 [0,1,0,1,0,0|2,0,0]=4 2410 B11R1.605 CNCc1c(cccc1C)C 270004a_106832991635_100000758299 [0,1,0,1,0,0|2,0,0]=4 2411 B11R1.605 CNCc1c(cccc1C)C 34a_100000689800_200000210301 [0,1,0,1,0,0|2,0,0]=4 2412 B11R1.605 CNCc1c(cccc1C)C 34a_100102657272_100000758300 [0,1,0,1,0,0|2,0,0]=4 2413 B11R1.605 CNCc1c(cccc1C)C 7a_106832991635_100000758300 [0,1,0,1,0,0|2,0,0]=4 2414 B11R1.605 CNCc1c(cccc1Cl)C 207a_100102657272_100000041122 [0,1,0,1,0,0|2,0,0]=4 2415 B11R1.605 CNCc1c(cccc1Cl)C 270004a_106832991635_100000041122 [0,1,0,1,0,0|2,0,0]=4 2416 B11R1.605 CNCc1c(cccc1F)C 207a_100102657272_100000069827 [0,1,0,1,0,0|2,0,0]=4 2417 B11R1.605 CNCc1c(cccc1F)C 2230a_106832991635_100009814554 [0,1,0,1,0,0|2,0,0]=4 2418 B11R1.605 CNCc1c(cccc1F)C 270004a_106832991635_100000069827 [0,1,0,1,0,0|2,0,0]=4 2419 B11R1.605 CNCc1c(cccc1F)C 34a_100000762012_200000210301 [0,1,0,1,0,0|2,0,0]=4 2420 B11R1.605 CNCc1c(cccc1F)C 34a_100102657272_100009814554 [0,1,0,1,0,0|2,0,0]=4 2421 B11R1.605 CNCc1c(cccc1F)C 7a_106832991635_100009814554 [0,1,0,1,0,0|2,0,0]=4 2422 B11R1.605 CNCc1c(cccc1I)C 2230a_106832991635_100010150146 [0,1,0,1,0,0|2,0,0]=4 2423 B11R1.605 CNCc1c(cccc1I)C 34a_100102657272_100010150146 [0,1,0,1,0,0|2,0,0]=4 2424 B11R1.605 CNCc1c(cccc1I)C 7a_106832991635_100010150146 [0,1,0,1,0,0|2,0,0]=4 2425 B11R1.605 COCc1c(cccc1Br)C 34a_100138415774_100010146847 [0,1,0,1,0,0|2,0,0]=4 2426 B11R1.605 COCc1c(cccc1C)C 34a_100011933981_200000210301 [0,1,0,1,0,0|2,0,0]=4 2427 B11R1.605 COCc1c(cccc1C)C 34a_100138415774_100000758300 [0,1,0,1,0,0|2,0,0]=4 2428 B11R1.605 COCc1c(cccc1C)C 7a_100011933981_200000210301 [0,1,0,1,0,0|2,0,0]=4 2429 B11R1.605 COCc1c(cccc1Cl)C 34a_100000082531_200000210301 [0,1,0,1,0,0|2,0,0]=4 2430 B11R1.605 COCc1c(cccc1Cl)C 7a_100000082531_200000210301 [0,1,0,1,0,0|2,0,0]=4 2431 B11R1.605 COCc1c(cccc1F)C 34a_100000057874_200000210301 [0,1,0,1,0,0|2,0,0]=4 2432 B11R1.605 COCc1c(cccc1F)C 34a_100138415774_100009814554 [0,1,0,1,0,0|2,0,0]=4 2433 B11R1.605 COCc1c(cccc1F)C 7a_100000057874_200000210301 [0,1,0,1,0,0|2,0,0]=4 2434 B11R1.605 COCc1c(cccc1I)C 34a_100138415774_100010150146 [0,1,0,1,0,0|2,0,0]=4 2435 B11R1.605 CSCc1c(cccc1Br)C 62a_100010146847_200000210301 [0,1,0,1,0,0|2,0,0]=4 2436 B11R1.605 CSCc1c(cccc1Br)C 62a_200000210301_100010146847 [0,1,0,1,0,0|2,0,0]=4 2437 B11R1.605 CSCc1c(cccc1C)C 62a_100000758300_200000210301 [0,1,0,1,0,0|2,0,0]=4 2438 B11R1.605 CSCc1c(cccc1C)C 62a_200000210301_100000758300 [0,1,0,1,0,0|2,0,0]=4 2439 B11R1.605 CSCc1c(cccc1F)C 62a_100009814554_200000210301 [0,1,0,1,0,0|2,0,0]=4 2440 B11R1.605 CSCc1c(cccc1F)C 62a_200000210301_100009814554 [0,1,0,1,0,0|2,0,0]=4 2441 B11R1.605 CSCc1c(cccc1I)C 62a_100010150146_200000210301 [0,1,0,1,0,0|2,0,0]=4 2442 B11R1.605 CSCc1c(cccc1I)C 62a_200000210301_100010150146 [0,1,0,1,0,0|2,0,0]=4 2443 B11R1.605 Cc1cccc(c1CN[13CH3])C 34a_100000689800_200025704644 [0,1,0,1,0,0|2,0,0]=4 2444 B11R1.605 Cc1cccc(c1CN[13CH3])F 34a_100000762012_200025704644 [0,1,0,1,0,0|2,0,0]=4 2445 B11R1.605 Cc1cccc(c1CO[13CH3])C 34a_100011933981_200025704644 [0,1,0,1,0,0|2,0,0]=4 2446 B11R1.605 Cc1cccc(c1CO[13CH3])C 7a_100011933981_200025704644 [0,1,0,1,0,0|2,0,0]=4 2447 B11R1.605 Cc1cccc(c1CO[13CH3])Cl 34a_100000082531_200025704644 [0,1,0,1,0,0|2,0,0]=4 2448 B11R1.605 Cc1cccc(c1CO[13CH3])Cl 7a_100000082531_200025704644 [0,1,0,1,0,0|2,0,0]=4 2449 B11R1.605 Cc1cccc(c1CO[13CH3])F 34a_100000057874_200025704644 [0,1,0,1,0,0|2,0,0]=4 2450 B11R1.605 Cc1cccc(c1CO[13CH3])F 7a_100000057874_200025704644 [0,1,0,1,0,0|2,0,0]=4 2451 B11R1.605 Cc1cccc(c1CS[13CH3])Br 62a_100010146847_200025704644 [0,1,0,1,0,0|2,0,0]=4 2452 B11R1.605 Cc1cccc(c1CS[13CH3])Br 62a_200025704644_100010146847 [0,1,0,1,0,0|2,0,0]=4 2453 B11R1.605 Cc1cccc(c1CS[13CH3])C 62a_100000758300_200025704644 [0,1,0,1,0,0|2,0,0]=4 2454 B11R1.605 Cc1cccc(c1CS[13CH3])C 62a_200025704644_100000758300 [0,1,0,1,0,0|2,0,0]=4 2455 B11R1.605 Cc1cccc(c1CS[13CH3])F 62a_100009814554_200025704644 [0,1,0,1,0,0|2,0,0]=4 2456 B11R1.605 Cc1cccc(c1CS[13CH3])F 62a_200025704644_100009814554 [0,1,0,1,0,0|2,0,0]=4 2457 B11R1.605 Cc1cccc(c1CS[13CH3])I 62a_100010150146_200025704644 [0,1,0,1,0,0|2,0,0]=4 2458 B11R1.605 Cc1cccc(c1CS[13CH3])I 62a_200025704644_100010150146 [0,1,0,1,0,0|2,0,0]=4 2459 B11R1.605 Cc1cccc(c1OCF)Br 34a_100009817157_100015361967 [0,1,0,1,0,0|2,0,0]=4 2460 B11R1.605 Cc1cccc(c1OCF)Br 7a_100009817157_100015361967 [0,1,0,1,0,0|2,0,0]=4 2461 B11R1.605 Cc1cccc(c1OCF)C 34a_100000210341_100015361967 [0,1,0,1,0,0|2,0,0]=4 2462 B11R1.605 Cc1cccc(c1OCF)C 7a_100000210341_100015361967 [0,1,0,1,0,0|2,0,0]=4 2463 B11R1.605 Cc1cccc(c1OCF)Cl 34a_100000033731_100015361967 [0,1,0,1,0,0|2,0,0]=4 2464 B11R1.605 Cc1cccc(c1OCF)Cl 7a_100000033731_100015361967 [0,1,0,1,0,0|2,0,0]=4 2465 B11R1.605 Cc1cccc(c1OCF)F 34a_100011659162_100015361967 [0,1,0,1,0,0|2,0,0]=4 2466 B11R1.605 Cc1cccc(c1OCF)F 7a_100011659162_100015361967 [0,1,0,1,0,0|2,0,0]=4 2467 B11R1.605 Cc1cccc(c1OCF)N 34a_100000756359_100015361967 [0,1,0,1,0,0|2,0,0]=4 2468 B11R1.605 Cc1cccc(c1OCF)N 7a_100000756359_100015361967 [0,1,0,1,0,0|2,0,0]=4 2469 B11R1.605 Cc1occc(=O)c1OCF 34a_100000031901_100015361967 [0,1,0,1,0,0|2,0,0]=4 2470 B11R2.35 Cc1cccc(c1)C2CC2 271570a_100011220607_100011215228 [0,0,0,2,0,0|2,0,0]=4 2471 B11R2.35 Cc1cccc(n1)C2CC2 271570a_100011220607_100000742759 [0,0,0,2,0,0|2,0,0]=4 2472 B11R2.36 Oc1ccc2c(c1)OCC2 271570a_203496583355_100009818566 [0,0,0,2,0,0|2,0,0]=4 2473 B11R2.106 Oc1cccc2c1CCC2 271570a_203496583355_100010343934 [0,0,0,2,0,0|1,0,1]=4 2474 B11R2.106 Oc1cccc2c1CCO2 271570a_203496583355_100009819624 [0,0,0,2,0,0|2,0,0]=4