0 B4R0.2 BrC=CCBr MCULE-1480697982 [0,0,0,0,0,0|2,0,1]=3 1 B4R0.2 C#CC=CC MCULE-9741359131 [0,0,0,0,0,0|1,0,1]=2 2 B4R0.2 C#CCCC MCULE-1233806896 [0,0,0,0,0,0|1,0,3]=4 3 B4R0.2 C#CCNC MCULE-9758975590 [0,0,0,0,0,0|2,0,2]=4 4 B4R0.2 C#CCOC MCULE-9172422462 [0,0,0,0,0,0|2,0,2]=4 5 B4R0.2 C#CCSC MCULE-6808040899 [0,0,0,0,0,0|2,0,2]=4 6 B4R0.2 C#COCC MCULE-1522528824 [0,0,0,0,0,0|2,0,2]=4 7 B4R0.2 C/C=C/C#N MCULE-2754343103 [0,0,0,0,0,0|1,0,1]=2 8 B4R0.2 C/C=C/C=O MCULE-9924705308 [0,0,0,0,0,0|0,0,0]=0 9 B4R0.2 C/C=C/CCl MCULE-9977493525 [0,0,0,0,0,0|1,0,1]=2 10 B4R0.2 C/C=C/CO MCULE-2383161163 [0,0,0,0,0,0|0,0,2]=2 11 B4R0.2 C/C=C/OC MCULE-3906920304 [0,0,0,0,0,0|2,0,0]=2 12 B4R0.2 C/C=C\CO MCULE-5924662327 [0,0,0,0,0,0|0,0,2]=2 13 B4R0.2 C=C=CCC MCULE-6123315571 [0,0,0,0,0,0|1,0,2]=3 14 B4R0.2 C=C=CCN MCULE-5700871644 [0,0,0,0,0,0|1,0,3]=4 15 B4R0.2 C=C=CCN MCULE-9120483529 [0,0,0,0,0,0|1,0,3]=4 16 B4R0.2 C=C=CCO MCULE-5424851896 [0,0,0,0,0,0|0,0,4]=4 17 B4R0.2 C=CC=CC MCULE-4452516287 [0,0,0,0,0,0|1,0,0]=1 18 B4R0.2 C=CCC#N MCULE-2566589348 [0,0,0,0,0,0|1,0,3]=4 19 B4R0.2 C=CCCBr MCULE-2890129103 [0,0,0,0,0,0|1,0,3]=4 20 B4R0.2 C=CCCC MCULE-8386546337 [0,0,0,0,0,0|1,0,2]=3 21 B4R0.2 C=CCCCl MCULE-5903789900 [0,0,0,0,0,0|1,0,3]=4 22 B4R0.2 C=CCCI MCULE-1055671394 [0,0,0,0,0,0|1,0,3]=4 23 B4R0.2 C=CCCN MCULE-2471716627 [0,0,0,0,0,0|1,0,3]=4 24 B4R0.2 C=CCCN MCULE-2881108697 [0,0,0,0,0,0|1,0,3]=4 25 B4R0.2 C=CCCO MCULE-4582400839 [0,0,0,0,0,0|0,0,4]=4 26 B4R0.2 C=CCNC MCULE-3335720336 [0,0,0,0,0,0|2,0,1]=3 27 B4R0.2 C=CCNN MCULE-2550690274 [0,0,0,0,0,0|2,0,2]=4 28 B4R0.2 C=CCNN MCULE-3554567414 [0,0,0,0,0,0|2,0,2]=4 29 B4R0.2 C=CCNN MCULE-8741523989 [0,0,0,0,0,0|2,0,2]=4 30 B4R0.2 C=CCOC MCULE-3321225771 [0,0,0,0,0,0|2,0,1]=3 31 B4R0.2 C=CCON MCULE-2094787759 [0,0,0,0,0,0|2,0,2]=4 32 B4R0.2 C=CCON MCULE-6222602533 [0,0,0,0,0,0|2,0,2]=4 33 B4R0.2 C=CCSC MCULE-4452023915 [0,0,0,0,0,0|2,0,1]=3 34 B4R0.2 C=CNC=O MCULE-8403928899 [0,0,0,0,0,0|1,0,1]=2 35 B4R0.2 C=COCC MCULE-2569047033 [0,0,0,0,0,0|2,0,1]=3 36 B4R0.2 C=CSCC MCULE-8927374165 [0,0,0,0,0,0|2,0,1]=3 37 B4R0.2 C=C[Te]C=C MCULE-9095868234 [0,0,0,0,0,0|2,0,1]=3 38 B4R0.2 CC#CC=O MCULE-9270622693 [0,0,0,0,0,0|0,0,2]=2 39 B4R0.2 CC#CCBr MCULE-3596191560 [0,0,0,0,0,0|1,0,3]=4 40 B4R0.2 CC#CCC MCULE-8848779220 [0,0,0,0,0,0|1,0,3]=4 41 B4R0.2 CC#CCI MCULE-3596701582 [0,0,0,0,0,0|1,0,3]=4 42 B4R0.2 CC#CCN MCULE-7027146471 [0,0,0,0,0,0|1,0,3]=4 43 B4R0.2 CC#CCN MCULE-9570644542 [0,0,0,0,0,0|1,0,3]=4 44 B4R0.2 CC#CCO MCULE-5096552076 [0,0,0,0,0,0|0,0,4]=4 45 B4R0.2 CC=CC#N MCULE-5062019142 [0,0,0,0,0,0|1,0,1]=2 46 B4R0.2 CC=CC=O MCULE-2497362981 [0,0,0,0,0,0|0,0,0]=0 47 B4R0.2 CC=CCBr MCULE-7855581866 [0,0,0,0,0,0|1,0,1]=2 48 B4R0.2 CC=CCC MCULE-5931905453 [0,0,0,0,0,0|1,0,1]=2 49 B4R0.2 CC=CCCl MCULE-3941962217 [0,0,0,0,0,0|1,0,1]=2 50 B4R0.2 CC=CCO MCULE-7490725844 [0,0,0,0,0,0|0,0,2]=2 51 B4R0.2 CC=COC MCULE-6712403535 [0,0,0,0,0,0|2,0,0]=2 52 B4R0.2 CC=CSC MCULE-5921906156 [0,0,0,0,0,0|2,0,0]=2 53 B4R0.2 CCC#CI MCULE-6466997582 [0,0,0,0,0,0|1,0,3]=4 54 B4R0.2 CCC=CBr MCULE-4471551501 [0,0,0,0,0,0|1,0,1]=2 55 B4R0.2 CCC=NO MCULE-9457280654 [0,0,0,0,0,0|1,0,2]=3 56 B4R0.2 CCCC#N MCULE-8571076087 [0,0,0,0,0,0|1,0,3]=4 57 B4R0.2 CCCC=O MCULE-8530391347 [0,0,0,0,0,0|0,0,2]=2 58 B4R0.2 CCCCBr MCULE-3390217131 [0,0,0,0,0,0|1,0,3]=4 59 B4R0.2 CCCCC MCULE-4643148765 [0,0,0,0,0,0|1,0,3]=4 60 B4R0.2 CCCCCl MCULE-5329900290 [0,0,0,0,0,0|1,0,3]=4 61 B4R0.2 CCCCF MCULE-7225760858 [0,0,0,0,0,0|1,0,3]=4 62 B4R0.2 CCCCI MCULE-1160974720 [0,0,0,0,0,0|1,0,3]=4 63 B4R0.2 CCCCN MCULE-1731874934 [0,0,0,0,0,0|1,0,3]=4 64 B4R0.2 CCCCN MCULE-4233278050 [0,0,0,0,0,0|1,0,3]=4 65 B4R0.2 CCCCN MCULE-5242069370 [0,0,0,0,0,0|1,0,3]=4 66 B4R0.2 CCCCN MCULE-7343835253 [0,0,0,0,0,0|1,0,3]=4 67 B4R0.2 CCCCO MCULE-1571156443 [0,0,0,0,0,0|0,0,4]=4 68 B4R0.2 CCCCS MCULE-9441213933 [0,0,0,0,0,0|0,1,3]=4 69 B4R0.2 CCCNC MCULE-2266616259 [0,0,0,0,0,0|2,0,2]=4 70 B4R0.2 CCCNC MCULE-7722796872 [0,0,0,0,0,0|2,0,2]=4 71 B4R0.2 CCCNN MCULE-4121438775 [0,0,0,0,0,0|2,0,2]=4 72 B4R0.2 CCCNN MCULE-5875592228 [0,0,0,0,0,0|2,0,2]=4 73 B4R0.2 CCCNN MCULE-9585694661 [0,0,0,0,0,0|2,0,2]=4 74 B4R0.2 CCCOC MCULE-5854067718 [0,0,0,0,0,0|2,0,2]=4 75 B4R0.2 CCCON MCULE-4800172637 [0,0,0,0,0,0|2,0,2]=4 76 B4R0.2 CCCON MCULE-7988781002 [0,0,0,0,0,0|2,0,2]=4 77 B4R0.2 CCCSC MCULE-8387041737 [0,0,0,0,0,0|2,0,2]=4 78 B4R0.2 CCN=C=O MCULE-6522145601 [0,0,0,0,0,0|1,0,2]=3 79 B4R0.2 CCN=C=S MCULE-9838756606 [0,0,0,0,0,0|1,1,2]=4 80 B4R0.2 CCNC=O MCULE-9309926274 [0,0,0,0,0,0|1,0,1]=2 81 B4R0.2 CCNCC MCULE-3395060353 [0,0,0,0,0,0|2,0,2]=4 82 B4R0.2 CCNCC MCULE-4374609736 [0,0,0,0,0,0|2,0,2]=4 83 B4R0.2 CCNCC MCULE-4555901025 [0,0,0,0,0,0|2,0,2]=4 84 B4R0.2 CCNCC MCULE-6895602113 [0,0,0,0,0,0|2,0,2]=4 85 B4R0.2 CCNOC MCULE-4797714235 [0,0,0,0,0,0|3,0,1]=4 86 B4R0.2 CCNOC MCULE-6486167423 [0,0,0,0,0,0|3,0,1]=4 87 B4R0.2 CCOC=N MCULE-5321655909 [0,0,0,0,0,0|2,0,1]=3 88 B4R0.2 CCOC=N MCULE-8158357614 [0,0,0,0,0,0|2,0,1]=3 89 B4R0.2 CCOC=O MCULE-6245072161 [0,0,0,0,0,0|1,0,1]=2 90 B4R0.2 CCOCBr MCULE-6644755987 [0,0,0,0,0,0|2,0,2]=4 91 B4R0.2 CCOCC MCULE-5665709021 [0,0,0,0,0,0|2,0,2]=4 92 B4R0.2 CCOCCl MCULE-5087992840 [0,0,0,0,0,0|2,0,2]=4 93 B4R0.2 CCONC MCULE-5446312516 [0,0,0,0,0,0|3,0,1]=4 94 B4R0.2 CCONC MCULE-7976027802 [0,0,0,0,0,0|3,0,1]=4 95 B4R0.2 CCSC#N MCULE-1270730084 [0,0,0,0,0,0|2,0,2]=4 96 B4R0.2 CCSCC MCULE-6480710239 [0,0,0,0,0,0|2,0,2]=4 97 B4R0.2 CCSCCl MCULE-3890542152 [0,0,0,0,0,0|2,0,2]=4 98 B4R0.2 CCSSC MCULE-9430585714 [0,0,0,0,0,0|3,0,1]=4 99 B4R0.2 CC[NH2+]CC MCULE-9899430356 [0,0,0,0,0,0|2,0,2]=4 100 B4R0.2 CNCC#N MCULE-1233170363 [0,0,0,0,0,0|2,0,2]=4 101 B4R0.2 CNCC#N MCULE-4334159739 [0,0,0,0,0,0|2,0,2]=4 102 B4R0.2 CNCC#N MCULE-8267124503 [0,0,0,0,0,0|2,0,2]=4 103 B4R0.2 CNCCBr MCULE-3708780806 [0,0,0,0,0,0|2,0,2]=4 104 B4R0.2 CNCCBr MCULE-6840755559 [0,0,0,0,0,0|2,0,2]=4 105 B4R0.2 CNCCCl MCULE-1666345560 [0,0,0,0,0,0|2,0,2]=4 106 B4R0.2 CNCCCl MCULE-8215813413 [0,0,0,0,0,0|2,0,2]=4 107 B4R0.2 CNCCF MCULE-3719880423 [0,0,0,0,0,0|2,0,2]=4 108 B4R0.2 CNCCF MCULE-3751701745 [0,0,0,0,0,0|2,0,2]=4 109 B4R0.2 CNCCI MCULE-7026781832 [0,0,0,0,0,0|2,0,2]=4 110 B4R0.2 CNCCI MCULE-8892686580 [0,0,0,0,0,0|2,0,2]=4 111 B4R0.2 CNCCN MCULE-2881688448 [0,0,0,0,0,0|2,0,2]=4 112 B4R0.2 CNCCN MCULE-7199403269 [0,0,0,0,0,0|2,0,2]=4 113 B4R0.2 CNCCO MCULE-7051900771 [0,0,0,0,0,0|1,0,3]=4 114 B4R0.2 CNCCO MCULE-7934732981 [0,0,0,0,0,0|1,0,3]=4 115 B4R0.2 CNCCS MCULE-6430516369 [0,0,0,0,0,0|1,1,2]=4 116 B4R0.2 COCC#N MCULE-9178522865 [0,0,0,0,0,0|2,0,2]=4 117 B4R0.2 COCC=O MCULE-9427361019 [0,0,0,0,0,0|1,0,1]=2 118 B4R0.2 COCCBr MCULE-8316331262 [0,0,0,0,0,0|2,0,2]=4 119 B4R0.2 COCCCl MCULE-8886627413 [0,0,0,0,0,0|2,0,2]=4 120 B4R0.2 COCCI MCULE-9391124374 [0,0,0,0,0,0|2,0,2]=4 121 B4R0.2 COCCN MCULE-5051556646 [0,0,0,0,0,0|2,0,2]=4 122 B4R0.2 COCCN MCULE-7519068386 [0,0,0,0,0,0|2,0,2]=4 123 B4R0.2 COCCO MCULE-4751927883 [0,0,0,0,0,0|1,0,3]=4 124 B4R0.2 COCCS MCULE-7803276094 [0,0,0,0,0,0|1,1,2]=4 125 B4R0.2 COCOC MCULE-8559076702 [0,0,0,0,0,0|3,0,1]=4 126 B4R0.2 COCON MCULE-6032854331 [0,0,0,0,0,0|3,0,1]=4 127 B4R0.2 CSCC#N MCULE-3607261611 [0,0,0,0,0,0|2,0,2]=4 128 B4R0.2 CSCCBr MCULE-1684461541 [0,0,0,0,0,0|2,0,2]=4 129 B4R0.2 CSCCCl MCULE-8593103756 [0,0,0,0,0,0|2,0,2]=4 130 B4R0.2 CSCCN MCULE-5168245255 [0,0,0,0,0,0|2,0,2]=4 131 B4R0.2 CSCCN MCULE-6275285732 [0,0,0,0,0,0|2,0,2]=4 132 B4R0.2 CSCCO MCULE-9706874325 [0,0,0,0,0,0|1,0,3]=4 133 B4R0.2 CSCSC MCULE-5603964020 [0,0,0,0,0,0|3,0,1]=4 134 B4R0.2 CSSSC MCULE-4175573612 [0,0,0,0,0,0|4,0,0]=4 135 B4R0.2 Cl/C=C/CCl MCULE-4516188972 [0,0,0,0,0,0|2,0,1]=3 136 B4R0.2 ClC/C=C/Br MCULE-1061414929 [0,0,0,0,0,0|2,0,1]=3 137 B4R0.2 ClC=CCCl MCULE-4655672652 [0,0,0,0,0,0|2,0,1]=3 138 B4R0.2 N/C=C/C=O MCULE-2444951625 [0,0,0,0,0,0|1,0,0]=1 139 B4R0.2 NC=CC=O MCULE-4070918342 [0,0,0,0,0,0|1,0,0]=1 140 B4R0.2 O=BOB=O MCULE-4560541361 [0,0,0,0,0,0|4,0,0]=4 141 B4R0.2 O=C=NCCl MCULE-7751104052 [0,0,0,0,0,0|2,0,2]=4 142 B4R0.2 O=CCCBr MCULE-4107157458 [0,0,0,0,0,0|1,0,2]=3 143 B4R0.2 O=CCCCl MCULE-5863929313 [0,0,0,0,0,0|1,0,2]=3 144 B4R0.2 O=CCCI MCULE-9771140462 [0,0,0,0,0,0|1,0,2]=3 145 B4R0.2 O=CCCO MCULE-1685289763 [0,0,0,0,0,0|1,0,2]=3 146 B4R0.2 O=CNC=O MCULE-3098379420 [0,0,0,0,0,0|2,0,0]=2 147 B4R0.2 O=COC=O MCULE-6311384332 [0,0,0,0,0,0|2,0,0]=2 148 B4R0.2 O=C[N-]C=O MCULE-4923470284 [0,0,0,0,0,0|2,0,0]=2 149 B4R0.2 O=[As]O[As]=O MCULE-6104708983 [0,0,0,0,0,0|4,0,0]=4 150 B4R0.2 OC=CCCl MCULE-4750991393 [0,0,0,0,0,0|1,0,2]=3 151 B4R0.2 OCC=CBr MCULE-4636104289 [0,0,0,0,0,0|1,0,2]=3 152 B4R0.2 OCC=CCl MCULE-2110127594 [0,0,0,0,0,0|1,0,2]=3 153 B4R0.2 ON=CCCl MCULE-5736695742 [0,0,0,0,0,0|2,0,2]=4 154 B4R0.2 [NH2+](CC)CC MCULE-1192179232 [0,0,0,0,0,0|2,0,2]=4 155 B3R0.1 Br/C=C/Br MCULE-6284547614 [1,0,0,0,0,0|2,0,0]=3 156 B3R0.1 BrC=CBr MCULE-4478409345 [1,0,0,0,0,0|2,0,0]=3 157 B3R0.1 C#CC=O MCULE-4187736819 [1,0,0,0,0,0|0,0,2]=3 158 B3R0.1 C#CCC MCULE-8090253856 [1,0,0,0,0,0|0,0,3]=4 159 B3R0.1 C/B=N/O MCULE-5227399299 [1,0,0,0,0,0|2,0,1]=4 160 B3R0.1 C/C=C/Br MCULE-4076369660 [1,0,0,0,0,0|1,0,0]=2 161 B3R0.1 C/C=N/O MCULE-2376410404 [1,0,0,0,0,0|1,0,1]=3 162 B3R0.1 C=CC#N MCULE-8176403366 [1,0,0,0,0,0|1,0,1]=3 163 B3R0.1 C=CC=C MCULE-4134157329 [1,0,0,0,0,0|0,0,1]=2 164 B3R0.1 C=CC=O MCULE-2104890669 [1,0,0,0,0,0|0,0,0]=1 165 B3R0.1 C=CCBr MCULE-9486454833 [1,0,0,0,0,0|1,0,1]=3 166 B3R0.1 C=CCC MCULE-8167907130 [1,0,0,0,0,0|0,0,1]=2 167 B3R0.1 C=CCCl MCULE-4067772785 [1,0,0,0,0,0|1,0,1]=3 168 B3R0.1 C=CCF MCULE-7783191980 [1,0,0,0,0,0|1,0,1]=3 169 B3R0.1 C=CCI MCULE-5037698873 [1,0,0,0,0,0|1,0,1]=3 170 B3R0.1 C=CCN MCULE-2424616806 [1,0,0,0,0,0|1,0,1]=3 171 B3R0.1 C=CCN MCULE-2473480946 [1,0,0,0,0,0|1,0,1]=3 172 B3R0.1 C=CCO MCULE-2145308838 [1,0,0,0,0,0|0,0,2]=3 173 B3R0.1 C=CCS MCULE-7270484838 [1,0,0,0,0,0|0,1,1]=3 174 B3R0.1 C=COC MCULE-4880746684 [1,0,0,0,0,0|1,0,0]=2 175 B3R0.1 CC#CC MCULE-3721942346 [1,0,0,0,0,0|0,0,3]=4 176 B3R0.1 CC#CI MCULE-4817406645 [1,0,0,0,0,0|1,0,2]=4 177 B3R0.1 CC=CBr MCULE-2098755460 [1,0,0,0,0,0|1,0,0]=2 178 B3R0.1 CC=CCl MCULE-9225887510 [1,0,0,0,0,0|1,0,0]=2 179 B3R0.1 CC=NO MCULE-9761317381 [1,0,0,0,0,0|1,0,1]=3 180 B3R0.1 CCC#N MCULE-9484970536 [1,0,0,0,0,0|1,0,2]=4 181 B3R0.1 CCC=O MCULE-4079744837 [1,0,0,0,0,0|0,0,1]=2 182 B3R0.1 CCCBr MCULE-2393970713 [1,0,0,0,0,0|1,0,2]=4 183 B3R0.1 CCCC MCULE-9760497805 [1,0,0,0,0,0|0,0,3]=4 184 B3R0.1 CCCCl MCULE-3496412829 [1,0,0,0,0,0|1,0,2]=4 185 B3R0.1 CCCF MCULE-8540338768 [1,0,0,0,0,0|1,0,2]=4 186 B3R0.1 CCCI MCULE-1721488805 [1,0,0,0,0,0|1,0,2]=4 187 B3R0.1 CCCN MCULE-2885523792 [1,0,0,0,0,0|1,0,2]=4 188 B3R0.1 CCCN MCULE-4318907091 [1,0,0,0,0,0|1,0,2]=4 189 B3R0.1 CCCN MCULE-6330457870 [1,0,0,0,0,0|1,0,2]=4 190 B3R0.1 CCCN MCULE-7146820007 [1,0,0,0,0,0|1,0,2]=4 191 B3R0.1 CCCO MCULE-6252105126 [1,0,0,0,0,0|0,0,3]=4 192 B3R0.1 CCCS MCULE-8267649092 [1,0,0,0,0,0|0,1,2]=4 193 B3R0.1 CCNC MCULE-7215376398 [1,0,0,0,0,0|1,0,2]=4 194 B3R0.1 CCNC MCULE-9811899205 [1,0,0,0,0,0|1,0,2]=4 195 B3R0.1 CCNN MCULE-4753127904 [1,0,0,0,0,0|2,0,1]=4 196 B3R0.1 CCNN MCULE-7630363192 [1,0,0,0,0,0|2,0,1]=4 197 B3R0.1 CCNN MCULE-8402230944 [1,0,0,0,0,0|2,0,1]=4 198 B3R0.1 CCNO MCULE-1215586669 [1,0,0,0,0,0|1,0,2]=4 199 B3R0.1 CCNO MCULE-7075818857 [1,0,0,0,0,0|1,0,2]=4 200 B3R0.1 CCON MCULE-5316082054 [1,0,0,0,0,0|2,0,1]=4 201 B3R0.1 CCON MCULE-6621418839 [1,0,0,0,0,0|2,0,1]=4 202 B3R0.1 CCO[NH3+] MCULE-7670481464 [1,0,0,0,0,0|2,0,1]=4 203 B3R0.1 CCO[NH3+] MCULE-7871083232 [1,0,0,0,0,0|2,0,1]=4 204 B3R0.1 CCSC MCULE-6944750263 [1,0,0,0,0,0|1,0,2]=4 205 B3R0.1 CN=C=O MCULE-7764606582 [1,0,0,0,0,0|1,0,1]=3 206 B3R0.1 CN=C=S MCULE-6174235995 [1,0,0,0,0,0|1,1,1]=4 207 B3R0.1 CNC#N MCULE-9135475289 [1,0,0,0,0,0|2,0,1]=4 208 B3R0.1 CNC=O MCULE-4739122677 [1,0,0,0,0,0|1,0,0]=2 209 B3R0.1 CNC=S MCULE-1018523469 [1,0,0,0,0,0|1,1,0]=3 210 B3R0.1 CNNC MCULE-5932476941 [1,0,0,0,0,0|2,0,1]=4 211 B3R0.1 CNNC MCULE-6419598860 [1,0,0,0,0,0|2,0,1]=4 212 B3R0.1 CNOC MCULE-1706082503 [1,0,0,0,0,0|2,0,1]=4 213 B3R0.1 CNOC MCULE-6224540090 [1,0,0,0,0,0|2,0,1]=4 214 B3R0.1 COC=O MCULE-9122749354 [1,0,0,0,0,0|1,0,0]=2 215 B3R0.1 COCBr MCULE-2566721472 [1,0,0,0,0,0|2,0,1]=4 216 B3R0.1 COCCl MCULE-5928768006 [1,0,0,0,0,0|2,0,1]=4 217 B3R0.1 COCI MCULE-5215132549 [1,0,0,0,0,0|2,0,1]=4 218 B3R0.1 CSC#N MCULE-3677411130 [1,0,0,0,0,0|2,0,1]=4 219 B3R0.1 CSCCl MCULE-1281800596 [1,0,0,0,0,0|2,0,1]=4 220 B3R0.1 CSSC MCULE-7451882535 [1,0,0,0,0,0|2,0,1]=4 221 B3R0.1 C[Se][Se]C MCULE-1189700302 [1,0,0,0,0,0|2,0,1]=4 222 B3R0.1 Cl/C=C/Cl MCULE-8326307647 [1,0,0,0,0,0|2,0,0]=3 223 B3R0.1 Cl/C=C\Cl MCULE-8638364223 [1,0,0,0,0,0|2,0,0]=3 224 B3R0.1 ClC=CCl MCULE-1709740532 [1,0,0,0,0,0|2,0,0]=3 225 B3R0.1 F/C=C/Cl MCULE-6748930384 [1,0,0,0,0,0|2,0,0]=3 226 B3R0.1 FC=CBr MCULE-3730796032 [1,0,0,0,0,0|2,0,0]=3 227 B3R0.1 FC=CCl MCULE-8668714110 [1,0,0,0,0,0|2,0,0]=3 228 B3R0.1 FC=CF MCULE-1668825245 [1,0,0,0,0,0|2,0,0]=3 229 B3R0.1 N/C=N/O MCULE-9567664507 [1,0,0,0,0,0|2,0,1]=4 230 B3R0.1 NNC=O MCULE-6986968107 [1,0,0,0,0,0|2,0,0]=3 231 B3R0.1 NOC=O MCULE-4489199776 [1,0,0,0,0,0|2,0,0]=3 232 B3R0.1 O=CC=O MCULE-3212938778 [1,0,0,0,0,0|1,0,0]=2 233 B3R0.1 O=CCBr MCULE-9076011270 [1,0,0,0,0,0|1,0,1]=3 234 B3R0.1 O=CCCl MCULE-7307216184 [1,0,0,0,0,0|1,0,1]=3 235 B3R0.1 O=CCI MCULE-1146810366 [1,0,0,0,0,0|1,0,1]=3 236 B5R0.1 C#CCC(=O)O MCULE-4680699666 [0,1,0,0,0,0|0,0,3]=4 237 B5R0.1 C/C(=C/C#N)/N MCULE-2195544039 [0,1,0,0,0,0|1,0,1]=3 238 B5R0.1 C/C(=C/CI)/I MCULE-4907089043 [0,1,0,0,0,0|1,0,1]=3 239 B5R0.1 C/C(=C/CN)/Cl MCULE-1091573118 [0,1,0,0,0,0|1,0,1]=3 240 B5R0.1 C/C(=C/CN)/Cl MCULE-8112023611 [0,1,0,0,0,0|1,0,1]=3 241 B5R0.1 C/C(=C\CCl)/Cl MCULE-6679259233 [0,1,0,0,0,0|1,0,1]=3 242 B5R0.1 C/C=C/B(O)O MCULE-6649221952 [0,1,0,0,0,0|1,0,1]=3 243 B5R0.1 C/C=C/C(=O)C MCULE-2109656516 [0,1,0,0,0,0|0,0,0]=1 244 B5R0.1 C/C=C/C(=O)Cl MCULE-8378824386 [0,1,0,0,0,0|0,0,0]=1 245 B5R0.1 C/C=C/C(=O)N MCULE-2532228624 [0,1,0,0,0,0|0,0,0]=1 246 B5R0.1 C/C=C/C(=O)O MCULE-6937494852 [0,1,0,0,0,0|0,0,0]=1 247 B5R0.1 C/C=C/C(C)C MCULE-8705863155 [0,1,0,0,0,0|1,0,1]=3 248 B5R0.1 C/C=C/C(C)O MCULE-3191147789 [0,1,0,0,0,0|0,0,2]=3 249 B5R0.1 C/C=C\B(O)O MCULE-3000711987 [0,1,0,0,0,0|1,0,1]=3 250 B5R0.1 C=C(Br)COC MCULE-5349428431 [0,1,0,0,0,0|2,0,1]=4 251 B5R0.1 C=C(C)CCBr MCULE-3439794005 [0,1,0,0,0,0|1,0,2]=4 252 B5R0.1 C=C(C)CCC MCULE-8225129744 [0,1,0,0,0,0|1,0,2]=4 253 B5R0.1 C=C(C)CCCl MCULE-2816016781 [0,1,0,0,0,0|1,0,2]=4 254 B5R0.1 C=C(C)CCI MCULE-6317205481 [0,1,0,0,0,0|1,0,2]=4 255 B5R0.1 C=C(C)CCN MCULE-4037025602 [0,1,0,0,0,0|1,0,2]=4 256 B5R0.1 C=C(C)CCN MCULE-5001503744 [0,1,0,0,0,0|1,0,2]=4 257 B5R0.1 C=C(C)CCO MCULE-2689800711 [0,1,0,0,0,0|0,0,3]=4 258 B5R0.1 C=C(C)CNC MCULE-6783886553 [0,1,0,0,0,0|2,0,1]=4 259 B5R0.1 C=C(C)CNC MCULE-8292313282 [0,1,0,0,0,0|2,0,1]=4 260 B5R0.1 C=C(C)CNN MCULE-1117931770 [0,1,0,0,0,0|2,0,1]=4 261 B5R0.1 C=C(C)CON MCULE-2773974323 [0,1,0,0,0,0|2,0,1]=4 262 B5R0.1 C=C(C)CON MCULE-5978680243 [0,1,0,0,0,0|2,0,1]=4 263 B5R0.1 C=C(C)OCC MCULE-5303468686 [0,1,0,0,0,0|2,0,1]=4 264 B5R0.1 C=CC=C(C)C MCULE-7590870659 [0,1,0,0,0,0|1,0,0]=2 265 B5R0.1 C=CC=C(Cl)Cl MCULE-3787858961 [0,1,0,0,0,0|1,0,1]=3 266 B5R0.1 C=CCC(=C)C MCULE-6294070836 [0,1,0,0,0,0|1,0,1]=3 267 B5R0.1 C=CCC(=N)N MCULE-6305125234 [0,1,0,0,0,0|1,0,2]=4 268 B5R0.1 C=CCC(=O)Cl MCULE-6033189203 [0,1,0,0,0,0|0,0,2]=3 269 B5R0.1 C=CCC(=O)N MCULE-1205335257 [0,1,0,0,0,0|0,0,2]=3 270 B5R0.1 C=CCC(=O)O MCULE-6288979337 [0,1,0,0,0,0|0,0,2]=3 271 B5R0.1 C=CCC(C)Br MCULE-5638987302 [0,1,0,0,0,0|1,0,2]=4 272 B5R0.1 C=CCC(C)C MCULE-4586731422 [0,1,0,0,0,0|1,0,2]=4 273 B5R0.1 C=CCC(C)N MCULE-5354228552 [0,1,0,0,0,0|1,0,2]=4 274 B5R0.1 C=CCC(C)N MCULE-9454660067 [0,1,0,0,0,0|1,0,2]=4 275 B5R0.1 C=CCC(C)O MCULE-7724200334 [0,1,0,0,0,0|1,0,2]=4 276 B5R0.1 C=CCC(C)O MCULE-9910771503 [0,1,0,0,0,0|1,0,2]=4 277 B5R0.1 C=CCN(C)C MCULE-6958853335 [0,1,0,0,0,0|2,0,1]=4 278 B5R0.1 C=CC[C@@H](C)O MCULE-1663575568 [0,1,0,0,0,0|1,0,2]=4 279 B5R0.1 C=CC[C@@H](C)O MCULE-3971480179 [0,1,0,0,0,0|1,0,2]=4 280 B5R0.1 C=CC[C@H](C)N MCULE-2398654329 [0,1,0,0,0,0|1,0,2]=4 281 B5R0.1 C=CC[C@H](C)N MCULE-5817451810 [0,1,0,0,0,0|1,0,2]=4 282 B5R0.1 C=CC[C@H](C)O MCULE-5783959808 [0,1,0,0,0,0|1,0,2]=4 283 B5R0.1 C=CC[C@H](C)O MCULE-6146696600 [0,1,0,0,0,0|1,0,2]=4 284 B5R0.1 C=CNC(=O)C MCULE-1260296806 [0,1,0,0,0,0|1,0,1]=3 285 B5R0.1 C=CNC(=O)N MCULE-4235216182 [0,1,0,0,0,0|1,0,1]=3 286 B5R0.1 C=COC(=O)C MCULE-7626795765 [0,1,0,0,0,0|1,0,1]=3 287 B5R0.1 C=COC(=O)Cl MCULE-9915729615 [0,1,0,0,0,0|1,0,1]=3 288 B5R0.1 C=COC(C)C MCULE-6339383821 [0,1,0,0,0,0|2,0,1]=4 289 B5R0.1 C=C[CH+]C(=O)[O-] MCULE-7935071431 [0,1,0,0,0,0|0,0,2]=3 290 B5R0.1 C=NCC(=O)N MCULE-7609497329 [0,1,0,0,0,0|1,0,2]=4 291 B5R0.1 CC#CC(=O)C MCULE-4083248904 [0,1,0,0,0,0|0,0,2]=3 292 B5R0.1 CC#CC(=O)Cl MCULE-6807810093 [0,1,0,0,0,0|0,0,2]=3 293 B5R0.1 CC#CC(=O)O MCULE-9994142213 [0,1,0,0,0,0|0,0,2]=3 294 B5R0.1 CC(=CC#N)C MCULE-7179601066 [0,1,0,0,0,0|1,0,1]=3 295 B5R0.1 CC(=CC#N)N MCULE-7342293837 [0,1,0,0,0,0|1,0,1]=3 296 B5R0.1 CC(=CC=O)C MCULE-7002222435 [0,1,0,0,0,0|0,0,0]=1 297 B5R0.1 CC(=CC=O)Cl MCULE-2279693190 [0,1,0,0,0,0|0,0,0]=1 298 B5R0.1 CC(=CC=O)N MCULE-2659507627 [0,1,0,0,0,0|0,0,0]=1 299 B5R0.1 CC(=CCBr)C MCULE-7961276795 [0,1,0,0,0,0|1,0,1]=3 300 B5R0.1 CC(=CCCl)C MCULE-1110417103 [0,1,0,0,0,0|1,0,1]=3 301 B5R0.1 CC(=CCCl)Cl MCULE-9735045489 [0,1,0,0,0,0|1,0,1]=3 302 B5R0.1 CC(=CCI)I MCULE-4204968539 [0,1,0,0,0,0|1,0,1]=3 303 B5R0.1 CC(=CCN)C MCULE-7220252581 [0,1,0,0,0,0|1,0,1]=3 304 B5R0.1 CC(=CCN)C MCULE-8394581250 [0,1,0,0,0,0|1,0,1]=3 305 B5R0.1 CC(=CCN)Cl MCULE-1749173363 [0,1,0,0,0,0|1,0,1]=3 306 B5R0.1 CC(=CCN)Cl MCULE-5722512850 [0,1,0,0,0,0|1,0,1]=3 307 B5R0.1 CC(=CCO)C MCULE-3984123588 [0,1,0,0,0,0|0,0,2]=3 308 B5R0.1 CC(=CCO)Cl MCULE-6459066496 [0,1,0,0,0,0|0,0,2]=3 309 B5R0.1 CC(=CCO)I MCULE-4600854759 [0,1,0,0,0,0|0,0,2]=3 310 B5R0.1 CC(=CCS)C MCULE-4180446913 [0,1,0,0,0,0|0,1,1]=3 311 B5R0.1 CC(=N)NC#N MCULE-7065360421 [0,1,0,0,0,0|2,0,1]=4 312 B5R0.1 CC(=O)/C=N/O MCULE-5424156575 [0,1,0,0,0,0|1,0,1]=3 313 B5R0.1 CC(=O)/C=N\O MCULE-9083768531 [0,1,0,0,0,0|1,0,1]=3 314 B5R0.1 CC(=O)C=C=O MCULE-4335598177 [0,1,0,0,0,0|0,0,1]=2 315 B5R0.1 CC(=O)C=NO MCULE-5513006918 [0,1,0,0,0,0|1,0,1]=3 316 B5R0.1 CC(=O)CC#N MCULE-7203242552 [0,1,0,0,0,0|1,0,2]=4 317 B5R0.1 CC(=O)CCBr MCULE-2615300206 [0,1,0,0,0,0|1,0,2]=4 318 B5R0.1 CC(=O)CCCl MCULE-8019748964 [0,1,0,0,0,0|1,0,2]=4 319 B5R0.1 CC(=O)CCN MCULE-7550348751 [0,1,0,0,0,0|1,0,2]=4 320 B5R0.1 CC(=O)CCN MCULE-9519063810 [0,1,0,0,0,0|1,0,2]=4 321 B5R0.1 CC(=O)CCO MCULE-6328537335 [0,1,0,0,0,0|0,0,3]=4 322 B5R0.1 CC(=O)N=C=S MCULE-7540453687 [0,1,0,0,0,0|1,1,1]=4 323 B5R0.1 CC(=O)N=S=O MCULE-1420371815 [0,1,0,0,0,0|2,0,0]=3 324 B5R0.1 CC(=O)NC#N MCULE-8444599659 [0,1,0,0,0,0|2,0,1]=4 325 B5R0.1 CC(=O)NCO MCULE-4563335540 [0,1,0,0,0,0|1,0,2]=4 326 B5R0.1 CC(=O)OCBr MCULE-9842804945 [0,1,0,0,0,0|2,0,1]=4 327 B5R0.1 CC(=O)OCCl MCULE-6822222026 [0,1,0,0,0,0|2,0,1]=4 328 B5R0.1 CC(=O)SCBr MCULE-9794607323 [0,1,0,0,0,0|2,0,1]=4 329 B5R0.1 CC(C)/C=N/O MCULE-3201457095 [0,1,0,0,0,0|1,0,2]=4 330 B5R0.1 CC(C)C=NO MCULE-9842574696 [0,1,0,0,0,0|1,0,2]=4 331 B5R0.1 CC(C)CC=O MCULE-2939497534 [0,1,0,0,0,0|0,0,2]=3 332 B5R0.1 CC(C)N=C=O MCULE-8392299675 [0,1,0,0,0,0|1,0,2]=4 333 B5R0.1 CC(C)NC=O MCULE-1764010394 [0,1,0,0,0,0|1,0,1]=3 334 B5R0.1 CC(C)OC=O MCULE-8263698122 [0,1,0,0,0,0|1,0,1]=3 335 B5R0.1 CC=CB(O)O MCULE-7417903348 [0,1,0,0,0,0|1,0,1]=3 336 B5R0.1 CC=CC(=O)C MCULE-4826977340 [0,1,0,0,0,0|0,0,0]=1 337 B5R0.1 CC=CC(=O)Cl MCULE-2747622237 [0,1,0,0,0,0|0,0,0]=1 338 B5R0.1 CC=CC(=O)N MCULE-9693879476 [0,1,0,0,0,0|0,0,0]=1 339 B5R0.1 CC=CC(=O)O MCULE-7970410217 [0,1,0,0,0,0|0,0,0]=1 340 B5R0.1 CC=CC(C)C MCULE-9898453837 [0,1,0,0,0,0|1,0,1]=3 341 B5R0.1 CC=CC(C)O MCULE-4806592836 [0,1,0,0,0,0|0,0,2]=3 342 B5R0.1 CC=C[N+](=O)[O-] MCULE-2987135481 [0,1,0,0,0,0|1,0,0]=2 343 B5R0.1 CC=NN(C)C MCULE-7039280578 [0,1,0,0,0,0|3,0,0]=4 344 B5R0.1 CCC=C(C)C MCULE-2405063894 [0,1,0,0,0,0|1,0,1]=3 345 B5R0.1 CCC=C(F)F MCULE-5180612061 [0,1,0,0,0,0|1,0,1]=3 346 B5R0.1 CCCC(=N)N MCULE-5974105638 [0,1,0,0,0,0|1,0,2]=4 347 B5R0.1 CCCC(=N)N MCULE-9230704591 [0,1,0,0,0,0|1,0,2]=4 348 B5R0.1 CCCC(=O)C MCULE-7174095676 [0,1,0,0,0,0|0,0,2]=3 349 B5R0.1 CCCC(=O)Cl MCULE-3288175193 [0,1,0,0,0,0|0,0,2]=3 350 B5R0.1 CCCC(=O)N MCULE-2712067671 [0,1,0,0,0,0|0,0,2]=3 351 B5R0.1 CCCC(=O)O MCULE-4116382006 [0,1,0,0,0,0|0,0,2]=3 352 B5R0.1 CCCC(=O)[O-] MCULE-8706538802 [0,1,0,0,0,0|0,0,2]=3 353 B5R0.1 CCCC(=O)[O-] MCULE-9764702574 [0,1,0,0,0,0|0,0,2]=3 354 B5R0.1 CCCC(=S)N MCULE-3529335988 [0,1,0,0,0,0|0,1,2]=4 355 B5R0.1 CCCC(=S)O MCULE-3382199964 [0,1,0,0,0,0|0,0,3]=4 356 B5R0.1 CCCN(=O)=O MCULE-5615753372 [0,1,0,0,0,0|1,0,2]=4 357 B5R0.1 CCCS(=O)[O-] MCULE-4306915022 [0,1,0,0,0,0|1,0,2]=4 358 B5R0.1 CCCS(=O)[O-] MCULE-9775151913 [0,1,0,0,0,0|1,0,2]=4 359 B5R0.1 CCNC(=N)N MCULE-4729418155 [0,1,0,0,0,0|2,0,1]=4 360 B5R0.1 CCNC(=N)N MCULE-5123343071 [0,1,0,0,0,0|2,0,1]=4 361 B5R0.1 CCNC(=O)C MCULE-7543656350 [0,1,0,0,0,0|1,0,1]=3 362 B5R0.1 CCNC(=O)Cl MCULE-5831262934 [0,1,0,0,0,0|1,0,1]=3 363 B5R0.1 CCNC(=O)N MCULE-1913599861 [0,1,0,0,0,0|1,0,1]=3 364 B5R0.1 CCNC(=S)N MCULE-3849517146 [0,1,0,0,0,0|1,1,1]=4 365 B5R0.1 CCOC(=N)C MCULE-3060267072 [0,1,0,0,0,0|2,0,1]=4 366 B5R0.1 CCOC(=N)C MCULE-3943786182 [0,1,0,0,0,0|2,0,1]=4 367 B5R0.1 CCOC(=N)N MCULE-3570858508 [0,1,0,0,0,0|2,0,1]=4 368 B5R0.1 CCOC(=N)N MCULE-6061063856 [0,1,0,0,0,0|2,0,1]=4 369 B5R0.1 CCOC(=O)C MCULE-6628539781 [0,1,0,0,0,0|1,0,1]=3 370 B5R0.1 CCOC(=O)Cl MCULE-4167904934 [0,1,0,0,0,0|1,0,1]=3 371 B5R0.1 CCOC(=O)N MCULE-1776877276 [0,1,0,0,0,0|1,0,1]=3 372 B5R0.1 CCOC(=S)C MCULE-3358897597 [0,1,0,0,0,0|1,1,1]=4 373 B5R0.1 CCOC(=S)N MCULE-4649285010 [0,1,0,0,0,0|1,1,1]=4 374 B5R0.1 CCOC(=S)[S-] MCULE-6247969567 [0,1,0,0,0,0|1,1,1]=4 375 B5R0.1 CCOC(=S)[S-] MCULE-6902289618 [0,1,0,0,0,0|1,1,1]=4 376 B5R0.1 CCOC(=S)[S-] MCULE-9105300958 [0,1,0,0,0,0|1,1,1]=4 377 B5R0.1 CCSC(=N)N MCULE-2161729152 [0,1,0,0,0,0|2,0,1]=4 378 B5R0.1 CCSC(=N)N MCULE-2547252984 [0,1,0,0,0,0|2,0,1]=4 379 B5R0.1 CCSC(=O)C MCULE-8015440229 [0,1,0,0,0,0|1,0,1]=3 380 B5R0.1 CCSC(=S)C MCULE-1502137460 [0,1,0,0,0,0|1,1,1]=4 381 B5R0.1 CCSC(=S)[S-] MCULE-2573650807 [0,1,0,0,0,0|1,1,1]=4 382 B5R0.1 CCSC(=S)[S-] MCULE-6172057982 [0,1,0,0,0,0|1,1,1]=4 383 B5R0.1 CC[NH2+]C(=N)N MCULE-1701852752 [0,1,0,0,0,0|2,0,1]=4 384 B5R0.1 CC[O+]=C(N)N MCULE-2484225131 [0,1,0,0,0,0|2,0,1]=4 385 B5R0.1 CC[O+]=C(N)N MCULE-6688774534 [0,1,0,0,0,0|2,0,1]=4 386 B5R0.1 CN(C)CC=O MCULE-1229218563 [0,1,0,0,0,0|1,0,1]=3 387 B5R0.1 CN(C)CC=O MCULE-3577561950 [0,1,0,0,0,0|1,0,1]=3 388 B5R0.1 CN(C)CC=O MCULE-4493766862 [0,1,0,0,0,0|1,0,1]=3 389 B5R0.1 CN(C)CC=O MCULE-8123455398 [0,1,0,0,0,0|1,0,1]=3 390 B5R0.1 CN(C)NC=O MCULE-1557896286 [0,1,0,0,0,0|2,0,0]=3 391 B5R0.1 CN=CN(C)C MCULE-2522407175 [0,1,0,0,0,0|3,0,0]=4 392 B5R0.1 CNCC(=O)C MCULE-3695443024 [0,1,0,0,0,0|1,0,1]=3 393 B5R0.1 CNCC(=O)C MCULE-7402723072 [0,1,0,0,0,0|1,0,1]=3 394 B5R0.1 CNCC(=O)N MCULE-2328887394 [0,1,0,0,0,0|1,0,1]=3 395 B5R0.1 CNCC(=O)N MCULE-3031605853 [0,1,0,0,0,0|1,0,1]=3 396 B5R0.1 CNCC(=O)N MCULE-7300977677 [0,1,0,0,0,0|1,0,1]=3 397 B5R0.1 CNCC(=O)O MCULE-3448356048 [0,1,0,0,0,0|1,0,1]=3 398 B5R0.1 CNCC(=O)O MCULE-4484444573 [0,1,0,0,0,0|1,0,1]=3 399 B5R0.1 CNCC(=O)[O-] MCULE-7993701866 [0,1,0,0,0,0|1,0,1]=3 400 B5R0.1 CNN=C(C)C MCULE-6307375856 [0,1,0,0,0,0|3,0,0]=4 401 B5R0.1 CNNC(=S)N MCULE-5838387497 [0,1,0,0,0,0|2,1,0]=4 402 B5R0.1 CNOC(=O)C MCULE-1464426541 [0,1,0,0,0,0|2,0,0]=3 403 B5R0.1 CNOC(=O)C MCULE-2976282666 [0,1,0,0,0,0|2,0,0]=3 404 B5R0.1 COC=C(C)C MCULE-6348538911 [0,1,0,0,0,0|2,0,0]=3 405 B5R0.1 COCC(=N)N MCULE-4711728356 [0,1,0,0,0,0|2,0,1]=4 406 B5R0.1 COCC(=N)N MCULE-7163250467 [0,1,0,0,0,0|2,0,1]=4 407 B5R0.1 COCC(=O)C MCULE-7262197587 [0,1,0,0,0,0|1,0,1]=3 408 B5R0.1 COCC(=O)Cl MCULE-5449267495 [0,1,0,0,0,0|1,0,1]=3 409 B5R0.1 COCC(=O)N MCULE-6674958132 [0,1,0,0,0,0|1,0,1]=3 410 B5R0.1 COCC(=O)O MCULE-3945589151 [0,1,0,0,0,0|1,0,1]=3 411 B5R0.1 COCC(=S)N MCULE-2046809269 [0,1,0,0,0,0|1,1,1]=4 412 B5R0.1 CONC(=O)C MCULE-6601866630 [0,1,0,0,0,0|2,0,0]=3 413 B5R0.1 CONC(=O)N MCULE-3063713861 [0,1,0,0,0,0|2,0,0]=3 414 B5R0.1 CONC(=S)C MCULE-1876042939 [0,1,0,0,0,0|2,1,0]=4 415 B5R0.1 CSC=[N+](C)C MCULE-3818988576 [0,1,0,0,0,0|3,0,0]=4 416 B5R0.1 CSC=[N+](C)C MCULE-8015580251 [0,1,0,0,0,0|3,0,0]=4 417 B5R0.1 CSCC(=N)N MCULE-7800929509 [0,1,0,0,0,0|2,0,1]=4 418 B5R0.1 CSCC(=N)N MCULE-8499985777 [0,1,0,0,0,0|2,0,1]=4 419 B5R0.1 CSCC(=O)C MCULE-4131794172 [0,1,0,0,0,0|1,0,1]=3 420 B5R0.1 CSCC(=O)Cl MCULE-9750052685 [0,1,0,0,0,0|1,0,1]=3 421 B5R0.1 CSCC(=O)N MCULE-4865579476 [0,1,0,0,0,0|1,0,1]=3 422 B5R0.1 CSCC(=O)O MCULE-7003418159 [0,1,0,0,0,0|1,0,1]=3 423 B5R0.1 CSCC(=S)N MCULE-5029100305 [0,1,0,0,0,0|1,1,1]=4 424 B5R0.1 CSCS(=O)C MCULE-3167702486 [0,1,0,0,0,0|2,0,1]=4 425 B5R0.1 CSNC(=O)C MCULE-7350061514 [0,1,0,0,0,0|2,0,0]=3 426 B5R0.1 ClC(=CCBr)Cl MCULE-5947456231 [0,1,0,0,0,0|2,0,1]=4 427 B5R0.1 ClCC=C(Cl)Cl MCULE-8294724084 [0,1,0,0,0,0|2,0,1]=4 428 B5R0.1 FC(=CCBr)F MCULE-1770710917 [0,1,0,0,0,0|2,0,1]=4 429 B5R0.1 N#CCC(=O)Cl MCULE-7971055738 [0,1,0,0,0,0|1,0,2]=4 430 B5R0.1 N#CCC(=O)N MCULE-8538286230 [0,1,0,0,0,0|1,0,2]=4 431 B5R0.1 N#CCC(=O)O MCULE-3440765061 [0,1,0,0,0,0|1,0,2]=4 432 B5R0.1 N#CCC(=O)[O-] MCULE-2598625909 [0,1,0,0,0,0|1,0,2]=4 433 B5R0.1 N#CCC(=O)[O-] MCULE-3532110520 [0,1,0,0,0,0|1,0,2]=4 434 B5R0.1 N=C(N)NC=O MCULE-2702198735 [0,1,0,0,0,0|2,0,0]=3 435 B5R0.1 NC(=O)C=CCl MCULE-3595468874 [0,1,0,0,0,0|1,0,0]=2 436 B5R0.1 NC(=O)C=NO MCULE-6447662753 [0,1,0,0,0,0|2,0,0]=3 437 B5R0.1 NC(=O)CCBr MCULE-3930714776 [0,1,0,0,0,0|1,0,2]=4 438 B5R0.1 NC(=O)CCCl MCULE-8300320959 [0,1,0,0,0,0|1,0,2]=4 439 B5R0.1 NC(=O)CCO MCULE-4026170350 [0,1,0,0,0,0|1,0,2]=4 440 B5R0.1 NC(=O)CCS MCULE-7451827717 [0,1,0,0,0,0|1,0,2]=4 441 B5R0.1 NC(=O)NCO MCULE-7403641101 [0,1,0,0,0,0|2,0,1]=4 442 B5R0.1 NC(=O)NN=O MCULE-2820469915 [0,1,0,0,0,0|3,0,0]=4 443 B5R0.1 NCC=C(Cl)Cl MCULE-6555955942 [0,1,0,0,0,0|2,0,1]=4 444 B5R0.1 NCC=C(Cl)Cl MCULE-9019653665 [0,1,0,0,0,0|2,0,1]=4 445 B5R0.1 NCCC(=O)Cl MCULE-1298355499 [0,1,0,0,0,0|1,0,2]=4 446 B5R0.1 NCCC(=O)N MCULE-2899414135 [0,1,0,0,0,0|1,0,2]=4 447 B5R0.1 NCCC(=O)N MCULE-6993286668 [0,1,0,0,0,0|1,0,2]=4 448 B5R0.1 NCCC(=O)O MCULE-1344289084 [0,1,0,0,0,0|1,0,2]=4 449 B5R0.1 NCCC(=O)O MCULE-2298605337 [0,1,0,0,0,0|1,0,2]=4 450 B5R0.1 NCCC(=O)O MCULE-9375577631 [0,1,0,0,0,0|1,0,2]=4 451 B5R0.1 NCCC(=O)[O-] MCULE-2492250086 [0,1,0,0,0,0|1,0,2]=4 452 B5R0.1 NNCC(=O)N MCULE-2794619708 [0,1,0,0,0,0|2,0,1]=4 453 B5R0.1 NNCC(=O)N MCULE-6773156087 [0,1,0,0,0,0|2,0,1]=4 454 B5R0.1 NNCC(=O)O MCULE-4908184724 [0,1,0,0,0,0|2,0,1]=4 455 B5R0.1 NNCC(=O)O MCULE-6315598774 [0,1,0,0,0,0|2,0,1]=4 456 B5R0.1 NOCC(=O)O MCULE-4566186819 [0,1,0,0,0,0|2,0,1]=4 457 B5R0.1 NOCC(=O)O MCULE-4824237418 [0,1,0,0,0,0|2,0,1]=4 458 B5R0.1 NOCC(=O)O MCULE-8132180423 [0,1,0,0,0,0|2,0,1]=4 459 B5R0.1 O=C(Cl)C=CCl MCULE-7984379237 [0,1,0,0,0,0|1,0,0]=2 460 B5R0.1 O=C(Cl)CCBr MCULE-4659506608 [0,1,0,0,0,0|1,0,2]=4 461 B5R0.1 O=C(Cl)CCCl MCULE-3313924878 [0,1,0,0,0,0|1,0,2]=4 462 B5R0.1 O=C(Cl)CCF MCULE-3316397790 [0,1,0,0,0,0|1,0,2]=4 463 B5R0.1 O=C(Cl)OCCl MCULE-2130588147 [0,1,0,0,0,0|2,0,1]=4 464 B5R0.1 O=C(O)/C=C/Br MCULE-7284519266 [0,1,0,0,0,0|1,0,0]=2 465 B5R0.1 O=C(O)/C=C/Cl MCULE-1625781671 [0,1,0,0,0,0|1,0,0]=2 466 B5R0.1 O=C(O)/C=C/I MCULE-3339607379 [0,1,0,0,0,0|1,0,0]=2 467 B5R0.1 O=C(O)/C=C\Br MCULE-6149049313 [0,1,0,0,0,0|1,0,0]=2 468 B5R0.1 O=C(O)/C=C\Cl MCULE-1221996674 [0,1,0,0,0,0|1,0,0]=2 469 B5R0.1 O=C(O)/C=C\I MCULE-3065405012 [0,1,0,0,0,0|1,0,0]=2 470 B5R0.1 O=C(O)/C=N/O MCULE-2471349844 [0,1,0,0,0,0|2,0,0]=3 471 B5R0.1 O=C(O)C#CBr MCULE-1997285471 [0,1,0,0,0,0|1,0,2]=4 472 B5R0.1 O=C(O)C=CBr MCULE-2956464856 [0,1,0,0,0,0|1,0,0]=2 473 B5R0.1 O=C(O)C=CCl MCULE-6369812151 [0,1,0,0,0,0|1,0,0]=2 474 B5R0.1 O=C(O)C=CI MCULE-7162332129 [0,1,0,0,0,0|1,0,0]=2 475 B5R0.1 O=C(O)C=NO MCULE-2039309679 [0,1,0,0,0,0|2,0,0]=3 476 B5R0.1 O=C(O)CCBr MCULE-2816055853 [0,1,0,0,0,0|1,0,2]=4 477 B5R0.1 O=C(O)CCCl MCULE-8511144183 [0,1,0,0,0,0|1,0,2]=4 478 B5R0.1 O=C(O)CCF MCULE-4382025684 [0,1,0,0,0,0|1,0,2]=4 479 B5R0.1 O=C(O)CCI MCULE-3371354708 [0,1,0,0,0,0|1,0,2]=4 480 B5R0.1 O=C(O)CCO MCULE-3428604829 [0,1,0,0,0,0|1,0,2]=4 481 B5R0.1 O=C(O)CCS MCULE-3211932163 [0,1,0,0,0,0|1,0,2]=4 482 B5R0.1 O=C(O)CNO MCULE-4437067339 [0,1,0,0,0,0|2,0,1]=4 483 B5R0.1 O=C([O-])C#CO MCULE-3725047218 [0,1,0,0,0,0|1,0,2]=4 484 B5R0.1 O=C([O-])C#CO MCULE-9125153565 [0,1,0,0,0,0|1,0,2]=4 485 B5R0.1 O=C([O-])C=CCl MCULE-4750072789 [0,1,0,0,0,0|1,0,0]=2 486 B5R0.1 O=C([O-])CCO MCULE-4429611588 [0,1,0,0,0,0|1,0,2]=4 487 B5R0.1 OCC=C(Cl)Cl MCULE-6473037027 [0,1,0,0,0,0|1,0,2]=4 488 B5R0.1 P(=O)(O)C=C=C MCULE-4922910477 [0,1,0,0,0,0|1,0,2]=4 489 B5R0.1 [NH+](=CN(C)C)C MCULE-8771175095 [0,1,0,0,0,0|3,0,0]=4 490 B5R0.2 BrC/C=C/CBr MCULE-9004545331 [0,1,0,0,0,0|1,0,1]=3 491 B5R0.2 BrCC=CCBr MCULE-4240565660 [0,1,0,0,0,0|1,0,1]=3 492 B5R0.2 C#CCCC=O MCULE-9994552907 [0,1,0,0,0,0|0,0,3]=4 493 B5R0.2 C(=CCCl)CN MCULE-8092426171 [0,1,0,0,0,0|1,0,1]=3 494 B5R0.2 C(=CCCl)CN MCULE-9706120646 [0,1,0,0,0,0|1,0,1]=3 495 B5R0.2 C(=C\CCl)\CN MCULE-3474871402 [0,1,0,0,0,0|1,0,1]=3 496 B5R0.2 C/C=C/C=C/C MCULE-9400628806 [0,1,0,0,0,0|1,0,0]=2 497 B5R0.2 C/C=C/CC#N MCULE-3707973146 [0,1,0,0,0,0|1,0,1]=3 498 B5R0.2 C/C=C/CCC MCULE-9851656818 [0,1,0,0,0,0|1,0,1]=3 499 B5R0.2 C/C=C/CCO MCULE-3952855392 [0,1,0,0,0,0|0,0,2]=3 500 B5R0.2 C/C=C/OCC MCULE-2891896400 [0,1,0,0,0,0|1,0,1]=3 501 B5R0.2 C/C=C\CCC MCULE-1013657748 [0,1,0,0,0,0|1,0,1]=3 502 B5R0.2 C=C/C=C/C=C MCULE-2938938774 [0,1,0,0,0,0|1,0,1]=3 503 B5R0.2 C=C/C=C/CC MCULE-5996202716 [0,1,0,0,0,0|1,0,0]=2 504 B5R0.2 C=C=CCCBr MCULE-5561919067 [0,1,0,0,0,0|1,0,2]=4 505 B5R0.2 C=C=CCCI MCULE-7583015374 [0,1,0,0,0,0|1,0,2]=4 506 B5R0.2 C=C=CCCN MCULE-5814175873 [0,1,0,0,0,0|1,0,2]=4 507 B5R0.2 C=C=CCCN MCULE-8177198091 [0,1,0,0,0,0|1,0,2]=4 508 B5R0.2 C=C=CCCO MCULE-1054355649 [0,1,0,0,0,0|1,0,2]=4 509 B5R0.2 C=C=COC=C MCULE-3691748324 [0,1,0,0,0,0|1,0,2]=4 510 B5R0.2 C=CC#CCO MCULE-5199716906 [0,1,0,0,0,0|1,0,2]=4 511 B5R0.2 C=CC/C=C/C MCULE-8732875285 [0,1,0,0,0,0|1,0,0]=2 512 B5R0.2 C=CCC=CC MCULE-8643449832 [0,1,0,0,0,0|1,0,0]=2 513 B5R0.2 C=CCCC=C MCULE-2599309974 [0,1,0,0,0,0|1,0,2]=4 514 B5R0.2 C=CCCC=O MCULE-7850336174 [0,1,0,0,0,0|0,0,2]=3 515 B5R0.2 C=CCCCBr MCULE-5027518679 [0,1,0,0,0,0|1,0,2]=4 516 B5R0.2 C=CCCCC MCULE-4750698031 [0,1,0,0,0,0|1,0,2]=4 517 B5R0.2 C=CCCCCl MCULE-3877430809 [0,1,0,0,0,0|1,0,2]=4 518 B5R0.2 C=CCCCI MCULE-8692831514 [0,1,0,0,0,0|1,0,2]=4 519 B5R0.2 C=CCCCN MCULE-5787926547 [0,1,0,0,0,0|1,0,2]=4 520 B5R0.2 C=CCCCN MCULE-7346989227 [0,1,0,0,0,0|1,0,2]=4 521 B5R0.2 C=CCCCO MCULE-5946342321 [0,1,0,0,0,0|1,0,2]=4 522 B5R0.2 C=CCCNC MCULE-2124263362 [0,1,0,0,0,0|1,0,2]=4 523 B5R0.2 C=CCCNC MCULE-5024925990 [0,1,0,0,0,0|1,0,2]=4 524 B5R0.2 C=CCCOC MCULE-4681354270 [0,1,0,0,0,0|1,0,2]=4 525 B5R0.2 C=CCN=C=O MCULE-3142552406 [0,1,0,0,0,0|0,0,3]=4 526 B5R0.2 C=CCNC=O MCULE-1911798514 [0,1,0,0,0,0|0,0,2]=3 527 B5R0.2 C=CCNCC MCULE-6987567673 [0,1,0,0,0,0|1,0,2]=4 528 B5R0.2 C=CCNCC MCULE-8318544337 [0,1,0,0,0,0|1,0,2]=4 529 B5R0.2 C=CCOC=C MCULE-7085070702 [0,1,0,0,0,0|1,0,2]=4 530 B5R0.2 C=CCOC=O MCULE-4161785970 [0,1,0,0,0,0|0,0,2]=3 531 B5R0.2 C=CCOCC MCULE-4363356618 [0,1,0,0,0,0|1,0,2]=4 532 B5R0.2 C=CCOCCl MCULE-6656252526 [0,1,0,0,0,0|2,0,1]=4 533 B5R0.2 C=CCONC MCULE-4537899476 [0,1,0,0,0,0|2,0,1]=4 534 B5R0.2 C=CCONC MCULE-9645204142 [0,1,0,0,0,0|2,0,1]=4 535 B5R0.2 C=CCSCC MCULE-3816911529 [0,1,0,0,0,0|1,0,2]=4 536 B5R0.2 C=CCSSC MCULE-8417830164 [0,1,0,0,0,0|2,0,1]=4 537 B5R0.2 C=COCCC MCULE-4423853666 [0,1,0,0,0,0|1,0,2]=4 538 B5R0.2 C=COCCCl MCULE-7782311030 [0,1,0,0,0,0|2,0,1]=4 539 B5R0.2 C=COCCN MCULE-8052872924 [0,1,0,0,0,0|2,0,1]=4 540 B5R0.2 C=COCCN MCULE-8496820259 [0,1,0,0,0,0|2,0,1]=4 541 B5R0.2 C=COCCO MCULE-9383372818 [0,1,0,0,0,0|2,0,1]=4 542 B5R0.2 CC#CCC=O MCULE-6071390808 [0,1,0,0,0,0|0,0,2]=3 543 B5R0.2 CC/C=C/C=O MCULE-5102906061 [0,1,0,0,0,0|0,0,0]=1 544 B5R0.2 CC/C=C/CC MCULE-6762040186 [0,1,0,0,0,0|1,0,1]=3 545 B5R0.2 CC/C=C\C#N MCULE-2648641382 [0,1,0,0,0,0|1,0,1]=3 546 B5R0.2 CC/C=C\CC MCULE-9418110460 [0,1,0,0,0,0|1,0,1]=3 547 B5R0.2 CC/C=C\CO MCULE-5480473249 [0,1,0,0,0,0|0,0,2]=3 548 B5R0.2 CC=CC=CC MCULE-7702675183 [0,1,0,0,0,0|1,0,0]=2 549 B5R0.2 CC=CCC#N MCULE-6960681395 [0,1,0,0,0,0|1,0,1]=3 550 B5R0.2 CC=CCCBr MCULE-7329159278 [0,1,0,0,0,0|1,0,1]=3 551 B5R0.2 CC=CCCC MCULE-8736231124 [0,1,0,0,0,0|1,0,1]=3 552 B5R0.2 CC=CCCN MCULE-5129102475 [0,1,0,0,0,0|1,0,1]=3 553 B5R0.2 CC=CCCN MCULE-8500001929 [0,1,0,0,0,0|1,0,1]=3 554 B5R0.2 CC=CCCO MCULE-4302367089 [0,1,0,0,0,0|0,0,2]=3 555 B5R0.2 CC=COCC MCULE-1473170404 [0,1,0,0,0,0|1,0,1]=3 556 B5R0.2 CC=CSSC MCULE-2442770677 [0,1,0,0,0,0|1,1,0]=3 557 B5R0.2 CCC#CC=O MCULE-3889262436 [0,1,0,0,0,0|0,0,2]=3 558 B5R0.2 CCC=CC#N MCULE-1091834842 [0,1,0,0,0,0|1,0,1]=3 559 B5R0.2 CCC=CC=O MCULE-1318250395 [0,1,0,0,0,0|0,0,0]=1 560 B5R0.2 CCC=CCBr MCULE-5326763881 [0,1,0,0,0,0|1,0,1]=3 561 B5R0.2 CCC=CCC MCULE-5435957422 [0,1,0,0,0,0|1,0,1]=3 562 B5R0.2 CCC=CCO MCULE-5633399984 [0,1,0,0,0,0|0,0,2]=3 563 B5R0.2 CCCC=NO MCULE-7364375780 [0,1,0,0,0,0|0,0,3]=4 564 B5R0.2 CCCCC=O MCULE-4736782822 [0,1,0,0,0,0|0,0,2]=3 565 B5R0.2 CCCN=C=O MCULE-9014468293 [0,1,0,0,0,0|0,0,3]=4 566 B5R0.2 CCCNC=O MCULE-6344556391 [0,1,0,0,0,0|0,0,2]=3 567 B5R0.2 CCCOC=O MCULE-3133604529 [0,1,0,0,0,0|0,0,2]=3 568 B5R0.2 CCO/C=C\Br MCULE-7396084973 [0,1,0,0,0,0|1,0,1]=3 569 B5R0.2 CCOC=CBr MCULE-5241125671 [0,1,0,0,0,0|1,0,1]=3 570 B5R0.2 CCSCC=O MCULE-8069035019 [0,1,0,0,0,0|0,0,2]=3 571 B5R0.2 COC=CC#N MCULE-4212629233 [0,1,0,0,0,0|1,0,1]=3 572 B5R0.2 COCCC=O MCULE-2812117208 [0,1,0,0,0,0|0,0,2]=3 573 B5R0.2 COCN=C=O MCULE-6951734265 [0,1,0,0,0,0|1,0,2]=4 574 B5R0.2 CSCCC=O MCULE-6273241704 [0,1,0,0,0,0|0,0,2]=3 575 B5R0.2 ClC/C=C/CCl MCULE-3586653669 [0,1,0,0,0,0|1,0,1]=3 576 B5R0.2 ClC/C=C\CCl MCULE-9193094097 [0,1,0,0,0,0|1,0,1]=3 577 B5R0.2 ClCC=CCCl MCULE-9190878082 [0,1,0,0,0,0|1,0,1]=3 578 B5R0.2 N#C/C=C/C#N MCULE-4928817243 [0,1,0,0,0,0|1,0,2]=4 579 B5R0.2 N#CC=CC#N MCULE-9328684059 [0,1,0,0,0,0|1,0,2]=4 580 B5R0.2 N#CC=CCBr MCULE-2538176669 [0,1,0,0,0,0|1,0,1]=3 581 B5R0.2 N#CCCC=O MCULE-9521735106 [0,1,0,0,0,0|0,0,3]=4 582 B5R0.2 N#CCOC=O MCULE-4453241991 [0,1,0,0,0,0|1,0,2]=4 583 B5R0.2 N#N=NCC=O MCULE-8370335984 [0,1,0,0,0,0|2,0,1]=4 584 B5R0.2 NC/C=C/CN MCULE-3194321905 [0,1,0,0,0,0|1,0,1]=3 585 B5R0.2 NC/C=C/CN MCULE-8357316852 [0,1,0,0,0,0|1,0,1]=3 586 B5R0.2 NC/C=C\CCl MCULE-7895966955 [0,1,0,0,0,0|1,0,1]=3 587 B5R0.2 NC/C=C\CN MCULE-6310541400 [0,1,0,0,0,0|1,0,1]=3 588 B5R0.2 NC/C=C\CN MCULE-8765736519 [0,1,0,0,0,0|1,0,1]=3 589 B5R0.2 NCC=CCN MCULE-3768809289 [0,1,0,0,0,0|1,0,1]=3 590 B5R0.2 NCC=CCN MCULE-4004493343 [0,1,0,0,0,0|1,0,1]=3 591 B5R0.2 NCC=CCN MCULE-6780035248 [0,1,0,0,0,0|1,0,1]=3 592 B5R0.2 NCC=CCO MCULE-4993379992 [0,1,0,0,0,0|0,0,2]=3 593 B5R0.2 NOC/C=C/Cl MCULE-3781481075 [0,1,0,0,0,0|1,0,2]=4 594 B5R0.2 NOC/C=C/Cl MCULE-8874475488 [0,1,0,0,0,0|1,0,2]=4 595 B5R0.2 NOCC=CCl MCULE-5233830243 [0,1,0,0,0,0|1,0,2]=4 596 B5R0.2 NOCC=CCl MCULE-7677577759 [0,1,0,0,0,0|1,0,2]=4 597 B5R0.2 O/N=C/C=N/O MCULE-6032089277 [0,1,0,0,0,0|2,0,1]=4 598 B5R0.2 O=C=NCCBr MCULE-9707894644 [0,1,0,0,0,0|1,0,2]=4 599 B5R0.2 O=C=NCCCl MCULE-8919918461 [0,1,0,0,0,0|1,0,2]=4 600 B5R0.2 O=CCCC=O MCULE-3362810468 [0,1,0,0,0,0|1,0,1]=3 601 B5R0.2 O=CCCC=O MCULE-3813951568 [0,1,0,0,0,0|1,0,1]=3 602 B5R0.2 O=CCCCBr MCULE-7239613396 [0,1,0,0,0,0|0,0,2]=3 603 B5R0.2 O=CCCCCl MCULE-3011225716 [0,1,0,0,0,0|0,0,2]=3 604 B5R0.2 O=CCCCI MCULE-3153720790 [0,1,0,0,0,0|0,0,2]=3 605 B5R0.2 O=CCCCO MCULE-8728420992 [0,1,0,0,0,0|0,0,2]=3 606 B5R0.2 O=CNCCO MCULE-3688614090 [0,1,0,0,0,0|1,0,1]=3 607 B5R0.2 O=CNNC=O MCULE-7634212643 [0,1,0,0,0,0|2,0,0]=3 608 B5R0.2 O=COCCO MCULE-1922672843 [0,1,0,0,0,0|1,0,1]=3 609 B5R0.2 OC/C=C/CCl MCULE-4378785113 [0,1,0,0,0,0|0,0,2]=3 610 B5R0.2 OC/C=C/CO MCULE-4752272005 [0,1,0,0,0,0|0,0,2]=3 611 B5R0.2 OC/C=C\CO MCULE-2695577582 [0,1,0,0,0,0|0,0,2]=3 612 B5R0.2 OC=CCCBr MCULE-3964604828 [0,1,0,0,0,0|0,0,2]=3 613 B5R0.2 OC=CCCBr MCULE-5728835735 [0,1,0,0,0,0|0,0,2]=3 614 B5R0.2 OCC=CCCl MCULE-7597942117 [0,1,0,0,0,0|0,0,2]=3 615 B5R0.2 OCC=CCO MCULE-9559211408 [0,1,0,0,0,0|0,0,2]=3 616 B5R0.2 ON=CC=NO MCULE-4643147888 [0,1,0,0,0,0|2,0,1]=4 617 B5R0.3 C#CC(=O)CC MCULE-1563732373 [0,1,0,0,0,0|1,0,2]=4 618 B5R0.3 C#CC(=O)NC MCULE-8852565705 [0,1,0,0,0,0|2,0,1]=4 619 B5R0.3 C#CC(=O)OC MCULE-5108326717 [0,1,0,0,0,0|2,0,1]=4 620 B5R0.3 C/C(=C\Br)/C#N MCULE-5132213304 [0,1,0,0,0,0|2,0,1]=4 621 B5R0.3 C/C(=C\N)/C=O MCULE-4713460468 [0,1,0,0,0,0|1,0,0]=2 622 B5R0.3 C/C=C(/C)\CC MCULE-9789907985 [0,1,0,0,0,0|1,0,1]=3 623 B5R0.3 C/C=C(\C)/C=O MCULE-2818872726 [0,1,0,0,0,0|0,0,0]=1 624 B5R0.3 C/C=C(\C)/CC MCULE-7119786881 [0,1,0,0,0,0|1,0,1]=3 625 B5R0.3 C/N=C(\N)/SC MCULE-1114021101 [0,1,0,0,0,0|3,0,0]=4 626 B5R0.3 C/N=C(\N)/SC MCULE-4249574209 [0,1,0,0,0,0|3,0,0]=4 627 B5R0.3 C=C(C=O)CC MCULE-2875154067 [0,1,0,0,0,0|0,0,1]=2 628 B5R0.3 C=C(CC)CBr MCULE-1652422688 [0,1,0,0,0,0|1,0,2]=4 629 B5R0.3 C=C(CC)CC MCULE-9174509622 [0,1,0,0,0,0|1,0,2]=4 630 B5R0.3 C=C(CC)CN MCULE-2269385026 [0,1,0,0,0,0|1,0,2]=4 631 B5R0.3 C=C(CC)CN MCULE-3033447984 [0,1,0,0,0,0|1,0,2]=4 632 B5R0.3 C=C(CC)CO MCULE-8127766352 [0,1,0,0,0,0|0,0,3]=4 633 B5R0.3 C=C(SC)SC MCULE-8497326619 [0,1,0,0,0,0|3,0,0]=4 634 B5R0.3 C=C/C(=C/C)/C MCULE-6445909882 [0,1,0,0,0,0|1,0,0]=2 635 B5R0.3 C=CC(=CC)C MCULE-8585683674 [0,1,0,0,0,0|1,0,0]=2 636 B5R0.3 C=CC(=O)C=C MCULE-8555160354 [0,1,0,0,0,0|1,0,1]=3 637 B5R0.3 C=CC(=O)CC MCULE-7277696617 [0,1,0,0,0,0|1,0,1]=3 638 B5R0.3 C=CC(=O)NC MCULE-5619481947 [0,1,0,0,0,0|2,0,0]=3 639 B5R0.3 C=CC(=O)NN MCULE-4327484127 [0,1,0,0,0,0|2,0,1]=4 640 B5R0.3 C=CC(=O)NN MCULE-4961696321 [0,1,0,0,0,0|2,0,1]=4 641 B5R0.3 C=CC(=O)NO MCULE-9528737042 [0,1,0,0,0,0|1,0,2]=4 642 B5R0.3 C=CC(=O)OC MCULE-6010665978 [0,1,0,0,0,0|2,0,0]=3 643 B5R0.3 C=CC(C)CC MCULE-8112547661 [0,1,0,0,0,0|1,0,2]=4 644 B5R0.3 C=CC(C)NC MCULE-1929679074 [0,1,0,0,0,0|2,0,1]=4 645 B5R0.3 C=CC(C)NC MCULE-6382339452 [0,1,0,0,0,0|2,0,1]=4 646 B5R0.3 C=CC(N)CC MCULE-6270835453 [0,1,0,0,0,0|1,0,2]=4 647 B5R0.3 C=CC(N)CC MCULE-7920121163 [0,1,0,0,0,0|1,0,2]=4 648 B5R0.3 C=CC(O)C=C MCULE-7283842025 [0,1,0,0,0,0|1,0,2]=4 649 B5R0.3 C=CC(O)CC MCULE-2794806228 [0,1,0,0,0,0|1,0,2]=4 650 B5R0.3 C=CS(=O)C=C MCULE-5650907653 [0,1,0,0,0,0|2,0,1]=4 651 B5R0.3 CC(=CBr)C#N MCULE-9263455697 [0,1,0,0,0,0|2,0,1]=4 652 B5R0.3 CC(=CCl)CCl MCULE-2732105685 [0,1,0,0,0,0|2,0,1]=4 653 B5R0.3 CC(=CI)CI MCULE-3347686188 [0,1,0,0,0,0|2,0,1]=4 654 B5R0.3 CC(=CI)CO MCULE-8491569199 [0,1,0,0,0,0|1,0,2]=4 655 B5R0.3 CC(=CN)C=O MCULE-5507488903 [0,1,0,0,0,0|1,0,0]=2 656 B5R0.3 CC/C(=N/O)/C MCULE-9139048973 [0,1,0,0,0,0|1,0,2]=4 657 B5R0.3 CC/C(=N/O)/N MCULE-2794748611 [0,1,0,0,0,0|1,0,2]=4 658 B5R0.3 CC/C(=N/O)/N MCULE-7162577220 [0,1,0,0,0,0|1,0,2]=4 659 B5R0.3 CC=C(Br)C=O MCULE-4703333701 [0,1,0,0,0,0|0,0,0]=1 660 B5R0.3 CC=C(C)C#N MCULE-4009455127 [0,1,0,0,0,0|1,0,1]=3 661 B5R0.3 CC=C(C)C=O MCULE-9453566957 [0,1,0,0,0,0|0,0,0]=1 662 B5R0.3 CC=C(C)CC MCULE-5790494157 [0,1,0,0,0,0|1,0,1]=3 663 B5R0.3 CC=C(C)CCl MCULE-2444762050 [0,1,0,0,0,0|1,0,1]=3 664 B5R0.3 CCC(=N)OC MCULE-4123543795 [0,1,0,0,0,0|2,0,1]=4 665 B5R0.3 CCC(=N)OC MCULE-5346320805 [0,1,0,0,0,0|2,0,1]=4 666 B5R0.3 CCC(=NO)C MCULE-1859652505 [0,1,0,0,0,0|1,0,2]=4 667 B5R0.3 CCC(=O)CBr MCULE-7825573294 [0,1,0,0,0,0|1,0,2]=4 668 B5R0.3 CCC(=O)CC MCULE-8236549739 [0,1,0,0,0,0|1,0,2]=4 669 B5R0.3 CCC(=O)CCl MCULE-9019890380 [0,1,0,0,0,0|1,0,2]=4 670 B5R0.3 CCC(=O)CN MCULE-1863418812 [0,1,0,0,0,0|1,0,2]=4 671 B5R0.3 CCC(=O)CN MCULE-5831164340 [0,1,0,0,0,0|1,0,2]=4 672 B5R0.3 CCC(=O)CO MCULE-8674894820 [0,1,0,0,0,0|0,0,3]=4 673 B5R0.3 CCC(=O)NC MCULE-5612060170 [0,1,0,0,0,0|2,0,1]=4 674 B5R0.3 CCC(=O)NN MCULE-1803705917 [0,1,0,0,0,0|2,0,1]=4 675 B5R0.3 CCC(=O)NO MCULE-1033164448 [0,1,0,0,0,0|1,0,2]=4 676 B5R0.3 CCC(=O)OC MCULE-7384824725 [0,1,0,0,0,0|2,0,1]=4 677 B5R0.3 CCC(=O)SC MCULE-9712192191 [0,1,0,0,0,0|2,0,1]=4 678 B5R0.3 CCC(Br)C=O MCULE-3064952987 [0,1,0,0,0,0|0,0,2]=3 679 B5R0.3 CCC(C)C=O MCULE-2523669899 [0,1,0,0,0,0|0,0,2]=3 680 B5R0.3 CCC(Cl)C=O MCULE-5238776091 [0,1,0,0,0,0|0,0,2]=3 681 B5R0.3 CCN(C)C=O MCULE-2308681384 [0,1,0,0,0,0|1,0,1]=3 682 B5R0.3 CN(C=O)C=O MCULE-7774435044 [0,1,0,0,0,0|2,0,0]=3 683 B5R0.3 CNC(=N)CO MCULE-3239749882 [0,1,0,0,0,0|1,0,2]=4 684 B5R0.3 CNC(=N)NC MCULE-7703075263 [0,1,0,0,0,0|3,0,0]=4 685 B5R0.3 CNC(=N)NN MCULE-4836793349 [0,1,0,0,0,0|3,0,0]=4 686 B5R0.3 CNC(=N)NN MCULE-5998297944 [0,1,0,0,0,0|3,0,0]=4 687 B5R0.3 CNC(=O)CBr MCULE-1439209307 [0,1,0,0,0,0|2,0,1]=4 688 B5R0.3 CNC(=O)CCl MCULE-1437904095 [0,1,0,0,0,0|2,0,1]=4 689 B5R0.3 CNC(=O)CI MCULE-1687694185 [0,1,0,0,0,0|2,0,1]=4 690 B5R0.3 CNC(=O)CN MCULE-1901033297 [0,1,0,0,0,0|2,0,1]=4 691 B5R0.3 CNC(=O)CN MCULE-8532774234 [0,1,0,0,0,0|2,0,1]=4 692 B5R0.3 CNC(=O)CO MCULE-5899226107 [0,1,0,0,0,0|1,0,2]=4 693 B5R0.3 CNC(=O)CS MCULE-7032391129 [0,1,0,0,0,0|1,1,1]=4 694 B5R0.3 CNC(=O)NC MCULE-5319497155 [0,1,0,0,0,0|3,0,0]=4 695 B5R0.3 CNC(=O)NN MCULE-2093843774 [0,1,0,0,0,0|3,0,0]=4 696 B5R0.3 CNC(=O)OC MCULE-1162861376 [0,1,0,0,0,0|3,0,0]=4 697 B5R0.3 CNC(=S)NC MCULE-7998520647 [0,1,0,0,0,0|3,0,0]=4 698 B5R0.3 CNC(=S)NN MCULE-3762018607 [0,1,0,0,0,0|3,0,0]=4 699 B5R0.3 COC(=N)CCl MCULE-2713131753 [0,1,0,0,0,0|2,0,1]=4 700 B5R0.3 COC(=N)CCl MCULE-6471252676 [0,1,0,0,0,0|2,0,1]=4 701 B5R0.3 COC(=O)C#N MCULE-8762838190 [0,1,0,0,0,0|2,0,1]=4 702 B5R0.3 COC(=O)C=O MCULE-2685327079 [0,1,0,0,0,0|1,0,0]=2 703 B5R0.3 COC(=O)CBr MCULE-2684954408 [0,1,0,0,0,0|2,0,1]=4 704 B5R0.3 COC(=O)CCl MCULE-5886832940 [0,1,0,0,0,0|2,0,1]=4 705 B5R0.3 COC(=O)CF MCULE-4367430175 [0,1,0,0,0,0|2,0,1]=4 706 B5R0.3 COC(=O)CI MCULE-9545584156 [0,1,0,0,0,0|2,0,1]=4 707 B5R0.3 COC(=O)CN MCULE-7462799100 [0,1,0,0,0,0|2,0,1]=4 708 B5R0.3 COC(=O)CN MCULE-8887061469 [0,1,0,0,0,0|2,0,1]=4 709 B5R0.3 COC(=O)CO MCULE-8734582763 [0,1,0,0,0,0|1,0,2]=4 710 B5R0.3 COC(=O)CS MCULE-3020830180 [0,1,0,0,0,0|1,1,1]=4 711 B5R0.3 COC(=O)NN MCULE-2637794839 [0,1,0,0,0,0|3,0,0]=4 712 B5R0.3 COC(=O)OC MCULE-7488725621 [0,1,0,0,0,0|3,0,0]=4 713 B5R0.3 COC(=O)SCl MCULE-1018411491 [0,1,0,0,0,0|3,0,0]=4 714 B5R0.3 COC(=S)NN MCULE-8717505617 [0,1,0,0,0,0|3,0,0]=4 715 B5R0.3 COC(=S)SC MCULE-7665194168 [0,1,0,0,0,0|3,0,0]=4 716 B5R0.3 CON(C)C=O MCULE-6743121315 [0,1,0,0,0,0|2,0,0]=3 717 B5R0.3 CS/C(=N/O)/C MCULE-8496912522 [0,1,0,0,0,0|2,0,1]=4 718 B5R0.3 CS/C(=N\N)/N MCULE-2245524081 [0,1,0,0,0,0|3,0,0]=4 719 B5R0.3 CS/C(=N\N)/N MCULE-6241847719 [0,1,0,0,0,0|3,0,0]=4 720 B5R0.3 CSC(=NO)C MCULE-1500524467 [0,1,0,0,0,0|2,0,1]=4 721 B5R0.3 CSC(=O)SC MCULE-7167992573 [0,1,0,0,0,0|3,0,0]=4 722 B5R0.3 CSC(=S)NN MCULE-2798461411 [0,1,0,0,0,0|3,0,0]=4 723 B5R0.3 CSC(=S)SC MCULE-5023087703 [0,1,0,0,0,0|3,0,0]=4 724 B5R0.3 Cl/C=C(\Cl)/CCl MCULE-8945457634 [0,1,0,0,0,0|2,0,1]=4 725 B5R0.3 ClC=C(Cl)CCl MCULE-5187224514 [0,1,0,0,0,0|2,0,1]=4 726 B5R0.3 N#CC(Br)C=O MCULE-3951653048 [0,1,0,0,0,0|1,0,2]=4 727 B5R0.3 N#CC(Cl)C=O MCULE-3516957476 [0,1,0,0,0,0|1,0,2]=4 728 B5R0.3 O=CC(=CO)Br MCULE-8777401868 [0,1,0,0,0,0|1,0,0]=2 729 B5R0.3 O=CC(=C[O-])F MCULE-8068241665 [0,1,0,0,0,0|1,0,0]=2 730 B5R0.3 O=CC(=C[O-])F MCULE-9099292239 [0,1,0,0,0,0|1,0,0]=2 731 B5R0.3 O=CC(=O)CO MCULE-7273475675 [0,1,0,0,0,0|1,0,1]=3 732 B5R0.3 O=CC(Br)C=O MCULE-4387864308 [0,1,0,0,0,0|1,0,1]=3 733 B5R0.3 O=CC(Cl)C=O MCULE-4927811862 [0,1,0,0,0,0|1,0,1]=3 734 B5R0.3 O=CC(O)CO MCULE-9581740191 [0,1,0,0,0,0|1,0,2]=4 735 B5R0.3 O=C[C@@H](O)CO MCULE-3883857491 [0,1,0,0,0,0|1,0,2]=4 736 B5R0.3 O=C[C@@H](O)CO MCULE-7852783182 [0,1,0,0,0,0|1,0,2]=4 737 B5R0.3 O=C[C@H](O)CO MCULE-4574984840 [0,1,0,0,0,0|1,0,2]=4 738 B5R1.1 C1=CCC=C1 MCULE-1776679581 [0,0,0,1,0,0|1,0,0]=2 739 B5R1.1 C1=CCCC1 MCULE-8785635218 [0,0,0,1,0,0|1,0,1]=3 740 B5R1.1 C1=CCNC1 MCULE-4645888757 [0,0,0,1,0,0|1,0,1]=3 741 B5R1.1 C1=CCNC1 MCULE-7386427096 [0,0,0,1,0,0|1,0,1]=3 742 B5R1.1 C1=CCOC1 MCULE-1252378718 [0,0,0,1,0,0|0,0,2]=3 743 B5R1.1 C1=CCSC1 MCULE-7848219599 [0,0,0,1,0,0|0,1,1]=3 744 B5R1.1 C1=CNC=C1 MCULE-7417495535 [0,0,0,1,0,0|1,0,1]=3 745 B5R1.1 C1=CNC=N1 MCULE-1256901064 [0,0,0,1,0,0|2,0,1]=4 746 B5R1.1 C1=CNC=N1 MCULE-1410806694 [0,0,0,1,0,0|2,0,1]=4 747 B5R1.1 C1=CNC=N1 MCULE-5649243123 [0,0,0,1,0,0|2,0,1]=4 748 B5R1.1 C1=CNC=N1 MCULE-6335507586 [0,0,0,1,0,0|2,0,1]=4 749 B5R1.1 C1=CNN=C1 MCULE-9342475145 [0,0,0,1,0,0|2,0,0]=3 750 B5R1.1 C1=CNN=N1 MCULE-9027372824 [0,0,0,1,0,0|3,0,0]=4 751 B5R1.1 C1=COC=C1 MCULE-6076190179 [0,0,0,1,0,0|0,0,2]=3 752 B5R1.1 C1=COC=N1 MCULE-4239266587 [0,0,0,1,0,0|1,0,2]=4 753 B5R1.1 C1=COCC1 MCULE-7714726225 [0,0,0,1,0,0|0,0,2]=3 754 B5R1.1 C1=CON=C1 MCULE-4177650025 [0,0,0,1,0,0|1,0,1]=3 755 B5R1.1 C1=CSC=C1 MCULE-5759025979 [0,0,0,1,0,0|0,1,1]=3 756 B5R1.1 C1=CSC=N1 MCULE-2839580990 [0,0,0,1,0,0|1,1,1]=4 757 B5R1.1 C1=CSN=C1 MCULE-7711497319 [0,0,0,1,0,0|1,1,0]=3 758 B5R1.1 C1=C[N-]C=N1 MCULE-2590868668 [0,0,0,1,0,0|2,0,1]=4 759 B5R1.1 C1=C[N-]C=N1 MCULE-7665637014 [0,0,0,1,0,0|2,0,1]=4 760 B5R1.1 C1=C[Se]C=C1 MCULE-2438977476 [0,0,0,1,0,0|0,1,1]=3 761 B5R1.1 C1=NC=NN1 MCULE-3522189420 [0,0,0,1,0,0|3,0,0]=4 762 B5R1.1 C1=NC=N[N-]1 MCULE-4858966495 [0,0,0,1,0,0|3,0,0]=4 763 B5R1.1 C1=NC=N[N-]1 MCULE-9511234084 [0,0,0,1,0,0|3,0,0]=4 764 B5R1.1 C1=NCCN1 MCULE-6281004177 [0,0,0,1,0,0|2,0,1]=4 765 B5R1.1 C1=NN=CO1 MCULE-2512252204 [0,0,0,1,0,0|3,0,0]=4 766 B5R1.1 C1=NN=CS1 MCULE-1697345730 [0,0,0,1,0,0|3,0,0]=4 767 B5R1.1 C1=NNCC1 MCULE-2270087414 [0,0,0,1,0,0|2,0,1]=4 768 B5R1.2 BrC1=CCC1 MCULE-7839710306 [0,0,0,1,0,0|1,0,1]=3 769 B5R1.2 C=C1CCC1 MCULE-8318650413 [0,0,0,1,0,0|1,0,2]=4 770 B5R1.2 C=C1CNC1 MCULE-1391021267 [0,0,0,1,0,0|2,0,1]=4 771 B5R1.2 C=C1CNC1 MCULE-7957953185 [0,0,0,1,0,0|2,0,1]=4 772 B5R1.2 C=C1COC1 MCULE-1822645869 [0,0,0,1,0,0|2,0,1]=4 773 B5R1.2 O=C1CCC1 MCULE-4870967355 [0,0,0,1,0,0|0,0,2]=3 774 B5R1.2 O=C1CCN1 MCULE-9053067221 [0,0,0,1,0,0|1,0,1]=3 775 B5R1.2 O=C1CCO1 MCULE-1277069147 [0,0,0,1,0,0|1,0,1]=3 776 B5R1.2 O=C1CNC1 MCULE-5171659870 [0,0,0,1,0,0|1,0,1]=3 777 B5R1.2 O=C1CNC1 MCULE-8293494956 [0,0,0,1,0,0|1,0,1]=3 778 B5R1.2 O=C1COC1 MCULE-6847248632 [0,0,0,1,0,0|1,0,1]=3 779 B5R1.2 O=C1CSC1 MCULE-4436071261 [0,0,0,1,0,0|1,0,1]=3 780 B5R1.3 C=CC1CC1 MCULE-4323158851 [0,0,0,1,0,0|1,0,2]=4 781 B5R1.3 C=CC1CO1 MCULE-1428696186 [0,0,0,1,0,0|2,0,1]=4 782 B5R1.3 O=CC1CC1 MCULE-9773190262 [0,0,0,1,0,0|0,0,2]=3 783 B5R1.3 [C@@H]1(CO1)C=C MCULE-9776744095 [0,0,0,1,0,0|2,0,1]=4 784 B5R1.3 [C@H]1(CO1)C=C MCULE-7934901088 [0,0,0,1,0,0|2,0,1]=4 785 B2R0.1 C#CC MCULE-8346460782 [2,0,0,0,0,0|0,0,2]=4 786 B2R0.1 C=C=C MCULE-2040872097 [2,0,0,0,0,0|0,0,1]=3 787 B2R0.1 C=CBr MCULE-1481946455 [2,0,0,0,0,0|1,0,0]=3 788 B2R0.1 C=CC MCULE-5223715076 [2,0,0,0,0,0|0,0,0]=2 789 B2R0.1 C=CCl MCULE-9678046268 [2,0,0,0,0,0|1,0,0]=3 790 B2R0.1 C=CI MCULE-2939062322 [2,0,0,0,0,0|1,0,0]=3 791 B2R0.1 C=CO MCULE-8167566239 [2,0,0,0,0,0|0,0,1]=3 792 B2R0.1 C=NN MCULE-4427606079 [2,0,0,0,0,0|2,0,0]=4 793 B2R0.1 C=NO MCULE-1312312591 [2,0,0,0,0,0|1,0,1]=4 794 B2R0.1 C=NO MCULE-7599902650 [2,0,0,0,0,0|1,0,1]=4 795 B2R0.1 CC#N MCULE-8803543318 [2,0,0,0,0,0|1,0,1]=4 796 B2R0.1 CC=O MCULE-6002254510 [2,0,0,0,0,0|0,0,0]=2 797 B2R0.1 CC=O MCULE-6800925955 [2,0,0,0,0,0|0,0,0]=2 798 B2R0.1 CCBr MCULE-9840669634 [2,0,0,0,0,0|1,0,1]=4 799 B2R0.1 CCC MCULE-7179517367 [2,0,0,0,0,0|0,0,2]=4 800 B2R0.1 CCCl MCULE-8087909182 [2,0,0,0,0,0|1,0,1]=4 801 B2R0.1 CCI MCULE-9405436513 [2,0,0,0,0,0|1,0,1]=4 802 B2R0.1 CCN MCULE-1774065508 [2,0,0,0,0,0|1,0,1]=4 803 B2R0.1 CCN MCULE-5999638632 [2,0,0,0,0,0|1,0,1]=4 804 B2R0.1 CCN MCULE-6233823811 [2,0,0,0,0,0|1,0,1]=4 805 B2R0.1 CCN MCULE-6444557204 [2,0,0,0,0,0|1,0,1]=4 806 B2R0.1 CCO MCULE-8818474596 [2,0,0,0,0,0|0,0,2]=4 807 B2R0.1 CCS MCULE-5717309901 [2,0,0,0,0,0|0,1,1]=4 808 B2R0.1 CNC MCULE-2809467532 [2,0,0,0,0,0|1,0,1]=4 809 B2R0.1 CNN MCULE-6163742401 [2,0,0,0,0,0|2,0,0]=4 810 B2R0.1 CNN MCULE-7217348217 [2,0,0,0,0,0|2,0,0]=4 811 B2R0.1 CNN MCULE-9086529736 [2,0,0,0,0,0|2,0,0]=4 812 B2R0.1 CNO MCULE-5310203084 [2,0,0,0,0,0|1,0,1]=4 813 B2R0.1 CNO MCULE-7072005453 [2,0,0,0,0,0|1,0,1]=4 814 B2R0.1 COC MCULE-4385003255 [2,0,0,0,0,0|1,0,1]=4 815 B2R0.1 CON MCULE-1068458971 [2,0,0,0,0,0|2,0,0]=4 816 B2R0.1 CON MCULE-8687558307 [2,0,0,0,0,0|2,0,0]=4 817 B2R0.1 CO[NH3+] MCULE-6631452734 [2,0,0,0,0,0|2,0,0]=4 818 B2R0.1 CO[NH3+] MCULE-9975010969 [2,0,0,0,0,0|2,0,0]=4 819 B2R0.1 CSC MCULE-4525381422 [2,0,0,0,0,0|1,0,1]=4 820 B2R0.1 C[Se]C MCULE-5369504805 [2,0,0,0,0,0|1,0,1]=4 821 B2R0.1 N=C=O MCULE-6805056266 [2,0,0,0,0,0|1,0,1]=4 822 B2R0.1 N=CN MCULE-3312866825 [2,0,0,0,0,0|2,0,0]=4 823 B2R0.1 N=CN MCULE-4184922761 [2,0,0,0,0,0|2,0,0]=4 824 B2R0.1 N=CN MCULE-8637660949 [2,0,0,0,0,0|2,0,0]=4 825 B2R0.1 NC=O MCULE-1633954643 [2,0,0,0,0,0|1,0,0]=3 826 B2R0.1 NC=O MCULE-4202420620 [2,0,0,0,0,0|1,0,0]=3 827 B2R0.1 NC=S MCULE-9004645073 [2,0,0,0,0,0|1,1,0]=4 828 B2R0.1 NC=[NH2+] MCULE-1491590547 [2,0,0,0,0,0|2,0,0]=4 829 B2R0.1 O=BO MCULE-1752281859 [2,0,0,0,0,0|2,0,0]=4 830 B2R0.1 O=CO MCULE-7175589186 [2,0,0,0,0,0|1,0,0]=3 831 B2R0.1 O=C[O-] MCULE-2970986504 [2,0,0,0,0,0|1,0,0]=3 832 B2R0.1 O=C[O-] MCULE-3867870864 [2,0,0,0,0,0|1,0,0]=3 833 B2R0.1 O=C[O-] MCULE-4029930501 [2,0,0,0,0,0|1,0,0]=3 834 B2R0.1 O=NO MCULE-6927518919 [2,0,0,0,0,0|2,0,0]=4 835 B2R0.1 O=N[O-] MCULE-3257981536 [2,0,0,0,0,0|2,0,0]=4 836 B2R0.1 O=N[O-] MCULE-7337131268 [2,0,0,0,0,0|2,0,0]=4 837 B2R0.1 O=PO MCULE-5287418544 [2,0,0,0,0,0|2,0,0]=4 838 B2R0.1 O=P[O-] MCULE-3840413517 [2,0,0,0,0,0|2,0,0]=4 839 B2R0.1 O=P[O-] MCULE-8243944513 [2,0,0,0,0,0|2,0,0]=4 840 B2R0.1 O=S=O MCULE-5418662043 [2,0,0,0,0,0|2,0,0]=4 841 B2R0.1 O=[Ge]=O MCULE-2024233522 [2,0,0,0,0,0|1,1,0]=4 842 B2R0.1 O=[N+]=O MCULE-8164521024 [2,0,0,0,0,0|2,0,0]=4 843 B2R0.1 O=[Se]=O MCULE-7119785212 [2,0,0,0,0,0|2,0,0]=4 844 B2R0.1 O=[Si]=O MCULE-2341844083 [2,0,0,0,0,0|1,1,0]=4 845 B2R0.1 O=[Te]=O MCULE-4837785402 [2,0,0,0,0,0|2,0,0]=4 846 B4R0.1 BrC=C(Br)Br MCULE-9536958233 [1,1,0,0,0,0|2,0,0]=4 847 B4R0.1 C#CC(=C)C MCULE-6826835331 [1,1,0,0,0,0|0,0,2]=4 848 B4R0.1 C#CC(=O)C MCULE-1296030711 [1,1,0,0,0,0|0,0,2]=4 849 B4R0.1 C#CC(=O)N MCULE-1832868146 [1,1,0,0,0,0|0,0,2]=4 850 B4R0.1 C#CC(=O)O MCULE-8764256624 [1,1,0,0,0,0|0,0,2]=4 851 B4R0.1 C#CC(=O)[O-] MCULE-3356498679 [1,1,0,0,0,0|0,0,2]=4 852 B4R0.1 C#CC(=O)[O-] MCULE-3490087346 [1,1,0,0,0,0|0,0,2]=4 853 B4R0.1 C/C(=N/O)/N MCULE-5595239824 [1,1,0,0,0,0|1,0,1]=4 854 B4R0.1 C/C(=N\O)/N MCULE-8004142092 [1,1,0,0,0,0|1,0,1]=4 855 B4R0.1 C/C=C(/C)\Cl MCULE-6841426098 [1,1,0,0,0,0|0,0,1]=3 856 B4R0.1 C/C=C(\C)/Br MCULE-3045523462 [1,1,0,0,0,0|0,0,1]=3 857 B4R0.1 C/C=C(\C)/Cl MCULE-4683862502 [1,1,0,0,0,0|0,0,1]=3 858 B4R0.1 C=C(Br)C#N MCULE-6077746884 [1,1,0,0,0,0|1,0,1]=4 859 B4R0.1 C=C(Br)C=O MCULE-9500973388 [1,1,0,0,0,0|0,0,0]=2 860 B4R0.1 C=C(Br)CBr MCULE-1222617820 [1,1,0,0,0,0|1,0,1]=4 861 B4R0.1 C=C(Br)CC MCULE-6271946451 [1,1,0,0,0,0|0,0,1]=3 862 B4R0.1 C=C(Br)CN MCULE-1170417597 [1,1,0,0,0,0|1,0,1]=4 863 B4R0.1 C=C(Br)CN MCULE-9190049156 [1,1,0,0,0,0|1,0,1]=4 864 B4R0.1 C=C(Br)CO MCULE-7763893047 [1,1,0,0,0,0|0,0,2]=4 865 B4R0.1 C=C(C)C#N MCULE-9177849910 [1,1,0,0,0,0|1,0,1]=4 866 B4R0.1 C=C(C)C=O MCULE-3758355501 [1,1,0,0,0,0|0,0,0]=2 867 B4R0.1 C=C(C)CBr MCULE-1361893863 [1,1,0,0,0,0|1,0,1]=4 868 B4R0.1 C=C(C)CCl MCULE-5586406339 [1,1,0,0,0,0|1,0,1]=4 869 B4R0.1 C=C(C)CI MCULE-3678124406 [1,1,0,0,0,0|1,0,1]=4 870 B4R0.1 C=C(C)CN MCULE-1033495975 [1,1,0,0,0,0|1,0,1]=4 871 B4R0.1 C=C(C)CN MCULE-8730181300 [1,1,0,0,0,0|1,0,1]=4 872 B4R0.1 C=C(C)CO MCULE-8641288398 [1,1,0,0,0,0|0,0,2]=4 873 B4R0.1 C=C(C)CS MCULE-5174170431 [1,1,0,0,0,0|0,1,1]=4 874 B4R0.1 C=C(C)OC MCULE-7344104255 [1,1,0,0,0,0|1,0,0]=3 875 B4R0.1 C=C(Cl)C#N MCULE-8612604639 [1,1,0,0,0,0|1,0,1]=4 876 B4R0.1 C=C(Cl)CBr MCULE-9398157024 [1,1,0,0,0,0|1,0,1]=4 877 B4R0.1 C=C(Cl)CCl MCULE-4210429118 [1,1,0,0,0,0|1,0,1]=4 878 B4R0.1 C=C(Cl)CI MCULE-1908004565 [1,1,0,0,0,0|1,0,1]=4 879 B4R0.1 C=C(Cl)CN MCULE-2159410121 [1,1,0,0,0,0|1,0,1]=4 880 B4R0.1 C=C(Cl)CN MCULE-3454023553 [1,1,0,0,0,0|1,0,1]=4 881 B4R0.1 C=C(Cl)CO MCULE-8813337564 [1,1,0,0,0,0|0,0,2]=4 882 B4R0.1 C=C(F)CBr MCULE-6528430141 [1,1,0,0,0,0|1,0,1]=4 883 B4R0.1 C=C(F)CCl MCULE-4499400030 [1,1,0,0,0,0|1,0,1]=4 884 B4R0.1 C=C(F)CN MCULE-1603171858 [1,1,0,0,0,0|1,0,1]=4 885 B4R0.1 C=C(F)CN MCULE-3878727292 [1,1,0,0,0,0|1,0,1]=4 886 B4R0.1 C=C(F)CO MCULE-2779963696 [1,1,0,0,0,0|0,0,2]=4 887 B4R0.1 C=C(I)CO MCULE-2533897125 [1,1,0,0,0,0|0,0,2]=4 888 B4R0.1 C=C=C(C)C MCULE-8705186354 [1,1,0,0,0,0|0,0,1]=3 889 B4R0.1 C=CB(O)O MCULE-2531600001 [1,1,0,0,0,0|1,0,1]=4 890 B4R0.1 C=CC(=C)C MCULE-1668999564 [1,1,0,0,0,0|0,0,0]=2 891 B4R0.1 C=CC(=O)C MCULE-4924646293 [1,1,0,0,0,0|0,0,0]=2 892 B4R0.1 C=CC(=O)Cl MCULE-3579233798 [1,1,0,0,0,0|0,0,0]=2 893 B4R0.1 C=CC(=O)N MCULE-4309430654 [1,1,0,0,0,0|0,0,0]=2 894 B4R0.1 C=CC(=O)O MCULE-9352227082 [1,1,0,0,0,0|0,0,0]=2 895 B4R0.1 C=CC(=O)[O-] MCULE-3928960314 [1,1,0,0,0,0|0,0,0]=2 896 B4R0.1 C=CC(=O)[O-] MCULE-4331301308 [1,1,0,0,0,0|0,0,0]=2 897 B4R0.1 C=CC(=O)[O-] MCULE-5516854555 [1,1,0,0,0,0|0,0,0]=2 898 B4R0.1 C=CC(C)Cl MCULE-1756172983 [1,1,0,0,0,0|0,0,1]=3 899 B4R0.1 C=CC(C)N MCULE-5748048106 [1,1,0,0,0,0|0,0,1]=3 900 B4R0.1 C=CC(C)N MCULE-6786590923 [1,1,0,0,0,0|0,0,1]=3 901 B4R0.1 C=CC(C)O MCULE-4525368256 [1,1,0,0,0,0|0,0,1]=3 902 B4R0.1 C=CN(=O)=O MCULE-1988475489 [1,1,0,0,0,0|1,0,0]=3 903 B4R0.1 C=C[C@@H](C)N MCULE-4388444035 [1,1,0,0,0,0|0,0,1]=3 904 B4R0.1 C=C[C@@H](C)N MCULE-6107415849 [1,1,0,0,0,0|0,0,1]=3 905 B4R0.1 C=C[C@@H](C)N MCULE-6707490046 [1,1,0,0,0,0|0,0,1]=3 906 B4R0.1 C=C[C@@H](C)N MCULE-9654995108 [1,1,0,0,0,0|0,0,1]=3 907 B4R0.1 C=C[C@H](C)N MCULE-1396113041 [1,1,0,0,0,0|0,0,1]=3 908 B4R0.1 C=C[C@H](C)N MCULE-2197513722 [1,1,0,0,0,0|0,0,1]=3 909 B4R0.1 C=C[C@H](C)N MCULE-4698235480 [1,1,0,0,0,0|0,0,1]=3 910 B4R0.1 C=C[C@H](C)N MCULE-8745929233 [1,1,0,0,0,0|0,0,1]=3 911 B4R0.1 C=C[C@H](C)O MCULE-2251589245 [1,1,0,0,0,0|0,0,1]=3 912 B4R0.1 C=NN(C)C MCULE-4915917395 [1,1,0,0,0,0|2,0,0]=4 913 B4R0.1 CC(=CBr)C MCULE-9508381610 [1,1,0,0,0,0|1,0,0]=3 914 B4R0.1 CC(=CCl)C MCULE-4321554138 [1,1,0,0,0,0|1,0,0]=3 915 B4R0.1 CC(=CCl)Cl MCULE-3528888685 [1,1,0,0,0,0|1,0,0]=3 916 B4R0.1 CC(=N)NN MCULE-2302306720 [1,1,0,0,0,0|2,0,0]=4 917 B4R0.1 CC(=N)NN MCULE-5362481009 [1,1,0,0,0,0|2,0,0]=4 918 B4R0.1 CC(=NN)C MCULE-8828852790 [1,1,0,0,0,0|2,0,0]=4 919 B4R0.1 CC(=NO)C MCULE-3243100216 [1,1,0,0,0,0|1,0,1]=4 920 B4R0.1 CC(=O)C#N MCULE-6317771757 [1,1,0,0,0,0|1,0,1]=4 921 B4R0.1 CC(=O)C=O MCULE-2718961814 [1,1,0,0,0,0|0,0,0]=2 922 B4R0.1 CC(=O)CBr MCULE-7812920675 [1,1,0,0,0,0|1,0,1]=4 923 B4R0.1 CC(=O)CCl MCULE-2501365933 [1,1,0,0,0,0|1,0,1]=4 924 B4R0.1 CC(=O)CF MCULE-7417279999 [1,1,0,0,0,0|1,0,1]=4 925 B4R0.1 CC(=O)CN MCULE-2715277783 [1,1,0,0,0,0|1,0,1]=4 926 B4R0.1 CC(=O)CN MCULE-6004541862 [1,1,0,0,0,0|1,0,1]=4 927 B4R0.1 CC(=O)CO MCULE-2989526028 [1,1,0,0,0,0|0,0,2]=4 928 B4R0.1 CC(=O)CS MCULE-9736174016 [1,1,0,0,0,0|0,1,1]=4 929 B4R0.1 CC(=O)NBr MCULE-6502070876 [1,1,0,0,0,0|2,0,0]=4 930 B4R0.1 CC(=O)NN MCULE-9183467120 [1,1,0,0,0,0|2,0,0]=4 931 B4R0.1 CC(=O)NO MCULE-2682231025 [1,1,0,0,0,0|1,0,1]=4 932 B4R0.1 CC(=O)OO MCULE-6028338742 [1,1,0,0,0,0|1,0,1]=4 933 B4R0.1 CC(Br)C=O MCULE-6060704330 [1,1,0,0,0,0|0,0,1]=3 934 B4R0.1 CC(C)C=O MCULE-3575731904 [1,1,0,0,0,0|0,0,1]=3 935 B4R0.1 CC(N)C=O MCULE-3421118418 [1,1,0,0,0,0|0,0,1]=3 936 B4R0.1 CC=C(C)Br MCULE-1371905211 [1,1,0,0,0,0|0,0,1]=3 937 B4R0.1 CC=C(C)C MCULE-4230157245 [1,1,0,0,0,0|0,0,1]=3 938 B4R0.1 CC=C(C)Cl MCULE-3844314543 [1,1,0,0,0,0|0,0,1]=3 939 B4R0.1 CC=C(Cl)Cl MCULE-3741261135 [1,1,0,0,0,0|1,0,0]=3 940 B4R0.1 CC=C(F)F MCULE-5544510852 [1,1,0,0,0,0|1,0,0]=3 941 B4R0.1 CCC(=N)N MCULE-1856575742 [1,1,0,0,0,0|1,0,1]=4 942 B4R0.1 CCC(=N)N MCULE-2534386807 [1,1,0,0,0,0|1,0,1]=4 943 B4R0.1 CCC(=O)Br MCULE-7870678619 [1,1,0,0,0,0|0,0,1]=3 944 B4R0.1 CCC(=O)C MCULE-8276670748 [1,1,0,0,0,0|0,0,1]=3 945 B4R0.1 CCC(=O)Cl MCULE-3081874391 [1,1,0,0,0,0|0,0,1]=3 946 B4R0.1 CCC(=O)F MCULE-8783887670 [1,1,0,0,0,0|0,0,1]=3 947 B4R0.1 CCC(=O)N MCULE-3730796130 [1,1,0,0,0,0|0,0,1]=3 948 B4R0.1 CCC(=O)O MCULE-2199051150 [1,1,0,0,0,0|0,0,1]=3 949 B4R0.1 CCC(=O)O MCULE-9800054040 [1,1,0,0,0,0|0,0,1]=3 950 B4R0.1 CCC(=O)S MCULE-3392119766 [1,1,0,0,0,0|0,0,1]=3 951 B4R0.1 CCC(=O)[O-] MCULE-6321502767 [1,1,0,0,0,0|0,0,1]=3 952 B4R0.1 CCC(=S)N MCULE-3921479699 [1,1,0,0,0,0|0,1,1]=4 953 B4R0.1 CCN(=O)=O MCULE-6603591614 [1,1,0,0,0,0|1,0,1]=4 954 B4R0.1 CCS(=O)C MCULE-4400935745 [1,1,0,0,0,0|1,0,1]=4 955 B4R0.1 CCS(=O)O MCULE-9872932319 [1,1,0,0,0,0|1,0,1]=4 956 B4R0.1 CCS(=O)[O-] MCULE-4386198822 [1,1,0,0,0,0|1,0,1]=4 957 B4R0.1 CN(C)C=O MCULE-6290117712 [1,1,0,0,0,0|1,0,0]=3 958 B4R0.1 CN(C)C=S MCULE-3571847382 [1,1,0,0,0,0|1,1,0]=4 959 B4R0.1 CN(C)N=O MCULE-1157726226 [1,1,0,0,0,0|2,0,0]=4 960 B4R0.1 CN(N)C=O MCULE-6353057165 [1,1,0,0,0,0|1,0,0]=3 961 B4R0.1 CNC(=N)N MCULE-1074994749 [1,1,0,0,0,0|2,0,0]=4 962 B4R0.1 CNC(=N)N MCULE-6149731862 [1,1,0,0,0,0|2,0,0]=4 963 B4R0.1 CNC(=N)N MCULE-7667364021 [1,1,0,0,0,0|2,0,0]=4 964 B4R0.1 CNC(=N)N MCULE-7854448694 [1,1,0,0,0,0|2,0,0]=4 965 B4R0.1 CNC(=O)C MCULE-2612997941 [1,1,0,0,0,0|1,0,0]=3 966 B4R0.1 CNC(=O)Cl MCULE-7743744606 [1,1,0,0,0,0|1,0,0]=3 967 B4R0.1 CNC(=O)N MCULE-6422331704 [1,1,0,0,0,0|1,0,0]=3 968 B4R0.1 CNC(=S)C MCULE-8699171591 [1,1,0,0,0,0|1,0,1]=4 969 B4R0.1 CNC(=S)N MCULE-7103250725 [1,1,0,0,0,0|1,1,0]=4 970 B4R0.1 CNC(=S)[S-] MCULE-4072880135 [1,1,0,0,0,0|1,1,0]=4 971 B4R0.1 CNC(=S)[S-] MCULE-4924829934 [1,1,0,0,0,0|1,1,0]=4 972 B4R0.1 COC(=N)C MCULE-2752794913 [1,1,0,0,0,0|1,0,1]=4 973 B4R0.1 COC(=N)C MCULE-2904991083 [1,1,0,0,0,0|1,0,1]=4 974 B4R0.1 COC(=N)N MCULE-1611076737 [1,1,0,0,0,0|2,0,0]=4 975 B4R0.1 COC(=N)N MCULE-4923904579 [1,1,0,0,0,0|2,0,0]=4 976 B4R0.1 COC(=N)N MCULE-6696789855 [1,1,0,0,0,0|2,0,0]=4 977 B4R0.1 COC(=N)N MCULE-9171600210 [1,1,0,0,0,0|2,0,0]=4 978 B4R0.1 COC(=O)C MCULE-7368066093 [1,1,0,0,0,0|1,0,0]=3 979 B4R0.1 COC(=O)Cl MCULE-8022274771 [1,1,0,0,0,0|1,0,0]=3 980 B4R0.1 COC(=O)N MCULE-4070607369 [1,1,0,0,0,0|1,0,0]=3 981 B4R0.1 COC(=S)N MCULE-9414558443 [1,1,0,0,0,0|1,1,0]=4 982 B4R0.1 COC(=S)[S-] MCULE-4829872223 [1,1,0,0,0,0|1,1,0]=4 983 B4R0.1 COC(=S)[S-] MCULE-6509496630 [1,1,0,0,0,0|1,1,0]=4 984 B4R0.1 CSC(=N)N MCULE-1471368384 [1,1,0,0,0,0|2,0,0]=4 985 B4R0.1 CSC(=N)N MCULE-3394284504 [1,1,0,0,0,0|2,0,0]=4 986 B4R0.1 CSC(=N)N MCULE-3752198299 [1,1,0,0,0,0|2,0,0]=4 987 B4R0.1 CSC(=N)N MCULE-5672446896 [1,1,0,0,0,0|2,0,0]=4 988 B4R0.1 CSC(=N)N MCULE-8409992127 [1,1,0,0,0,0|2,0,0]=4 989 B4R0.1 CSC(=O)C MCULE-7061634598 [1,1,0,0,0,0|1,0,0]=3 990 B4R0.1 CSC(=S)C MCULE-4836153374 [1,1,0,0,0,0|1,0,1]=4 991 B4R0.1 CSS(=O)C MCULE-6515592458 [1,1,0,0,0,0|2,0,0]=4 992 B4R0.1 C[C@@H](O)C=O MCULE-5921136435 [1,1,0,0,0,0|0,0,1]=3 993 B4R0.1 C[N+](=CBr)C MCULE-4078543172 [1,1,0,0,0,0|2,0,0]=4 994 B4R0.1 C[N+](=CBr)C MCULE-9146783444 [1,1,0,0,0,0|2,0,0]=4 995 B4R0.1 C[N+](=CCl)C MCULE-5768539789 [1,1,0,0,0,0|2,0,0]=4 996 B4R0.1 C[N+](=CCl)C MCULE-6936774679 [1,1,0,0,0,0|2,0,0]=4 997 B4R0.1 ClC=C(Cl)Cl MCULE-3945953656 [1,1,0,0,0,0|2,0,0]=4 998 B4R0.1 FC(=CBr)F MCULE-5114290777 [1,1,0,0,0,0|2,0,0]=4 999 B4R0.1 FC=C(Br)Br MCULE-3150710627 [1,1,0,0,0,0|2,0,0]=4 1000 B4R0.1 FC=C(F)F MCULE-2449532887 [1,1,0,0,0,0|2,0,0]=4 1001 B4R0.1 NC(=O)CBr MCULE-9306090536 [1,1,0,0,0,0|1,0,1]=4 1002 B4R0.1 NC(=O)CCl MCULE-3241549842 [1,1,0,0,0,0|1,0,1]=4 1003 B4R0.1 NC(=O)CF MCULE-3344212657 [1,1,0,0,0,0|1,0,1]=4 1004 B4R0.1 NC(=O)CI MCULE-4217973413 [1,1,0,0,0,0|1,0,1]=4 1005 B4R0.1 NC(=O)CO MCULE-2739878376 [1,1,0,0,0,0|1,0,1]=4 1006 B4R0.1 NC(=O)CS MCULE-2639305532 [1,1,0,0,0,0|1,0,1]=4 1007 B4R0.1 NC(=O)NO MCULE-9465284053 [1,1,0,0,0,0|2,0,0]=4 1008 B4R0.1 NCC(=O)N MCULE-1048848056 [1,1,0,0,0,0|1,0,1]=4 1009 B4R0.1 NCC(=O)N MCULE-2174395809 [1,1,0,0,0,0|1,0,1]=4 1010 B4R0.1 NCC(=O)N MCULE-6113166250 [1,1,0,0,0,0|1,0,1]=4 1011 B4R0.1 NCC(=O)O MCULE-2415764032 [1,1,0,0,0,0|1,0,1]=4 1012 B4R0.1 NCC(=O)O MCULE-3643110755 [1,1,0,0,0,0|1,0,1]=4 1013 B4R0.1 NCC(=O)O MCULE-4349255299 [1,1,0,0,0,0|1,0,1]=4 1014 B4R0.1 NCC(=O)O MCULE-9146223615 [1,1,0,0,0,0|1,0,1]=4 1015 B4R0.1 NCC(=O)O MCULE-9701991737 [1,1,0,0,0,0|1,0,1]=4 1016 B4R0.1 NCC(=O)S MCULE-9837799864 [1,1,0,0,0,0|1,0,1]=4 1017 B4R0.1 NCC(=O)[O-] MCULE-5975202378 [1,1,0,0,0,0|1,0,1]=4 1018 B4R0.1 NNC(=O)N MCULE-3392559370 [1,1,0,0,0,0|2,0,0]=4 1019 B4R0.1 NNC(=O)N MCULE-8490374775 [1,1,0,0,0,0|2,0,0]=4 1020 B4R0.1 O=C(Br)CBr MCULE-6031858200 [1,1,0,0,0,0|1,0,1]=4 1021 B4R0.1 O=C(Cl)CBr MCULE-7684029984 [1,1,0,0,0,0|1,0,1]=4 1022 B4R0.1 O=C(Cl)CCl MCULE-7076914635 [1,1,0,0,0,0|1,0,1]=4 1023 B4R0.1 O=C(Cl)CF MCULE-7182087882 [1,1,0,0,0,0|1,0,1]=4 1024 B4R0.1 O=C(Cl)CI MCULE-5719121455 [1,1,0,0,0,0|1,0,1]=4 1025 B4R0.1 O=C(Cl)SCl MCULE-5008011265 [1,1,0,0,0,0|2,0,0]=4 1026 B4R0.1 O=C(O)CBr MCULE-1503716137 [1,1,0,0,0,0|1,0,1]=4 1027 B4R0.1 O=C(O)CCl MCULE-9228754880 [1,1,0,0,0,0|1,0,1]=4 1028 B4R0.1 O=C(O)CF MCULE-6584094437 [1,1,0,0,0,0|1,0,1]=4 1029 B4R0.1 O=C(O)CI MCULE-3146792857 [1,1,0,0,0,0|1,0,1]=4 1030 B4R0.1 O=C(O)CO MCULE-9792551388 [1,1,0,0,0,0|1,0,1]=4 1031 B4R0.1 O=C(O)CS MCULE-8097997001 [1,1,0,0,0,0|1,0,1]=4 1032 B4R0.1 O=C([O-])CF MCULE-8428965857 [1,1,0,0,0,0|1,0,1]=4 1033 B4R0.1 O=C([O-])CO MCULE-2780567509 [1,1,0,0,0,0|1,0,1]=4 1034 B4R0.1 O=C([O-])CS MCULE-3314809220 [1,1,0,0,0,0|1,0,1]=4 1035 B4R0.1 O=C([O-])CS MCULE-5989133747 [1,1,0,0,0,0|1,0,1]=4 1036 B4R0.1 O=CC(=O)O MCULE-5307898766 [1,1,0,0,0,0|1,0,0]=3 1037 B4R0.1 O=CC(Cl)Cl MCULE-7925858204 [1,1,0,0,0,0|1,0,1]=4 1038 B6R0.1 C#C/C(=C\CO)/C MCULE-5643545939 [0,2,0,0,0,0|0,0,2]=4 1039 B6R0.1 C#CC(=CCO)C MCULE-7063837718 [0,2,0,0,0,0|0,0,2]=4 1040 B6R0.1 C#CC(=O)CCC MCULE-8990254228 [0,2,0,0,0,0|0,0,2]=4 1041 B6R0.1 C#CC(=O)NCC MCULE-3703208943 [0,2,0,0,0,0|1,0,1]=4 1042 B6R0.1 C#CC(=O)OCC MCULE-3783424133 [0,2,0,0,0,0|1,0,1]=4 1043 B6R0.1 C(=C/C(=O)CC)\C MCULE-9250312874 [0,2,0,0,0,0|0,0,0]=2 1044 B6R0.1 C/C(=N\O)/C=N/O MCULE-3049929204 [0,2,0,0,0,0|1,0,1]=4 1045 B6R0.1 C/C=C/C(=O)OC MCULE-8935178488 [0,2,0,0,0,0|0,0,0]=2 1046 B6R0.1 C=C=CC(=O)OC MCULE-7885631451 [0,2,0,0,0,0|0,0,2]=4 1047 B6R0.1 C=CC(=O)CCC MCULE-9373104880 [0,2,0,0,0,0|0,0,2]=4 1048 B6R0.1 C=CC(=O)COC MCULE-1933195578 [0,2,0,0,0,0|1,0,1]=4 1049 B6R0.1 C=CC(=O)NCC MCULE-3515057147 [0,2,0,0,0,0|1,0,1]=4 1050 B6R0.1 C=CC(=O)NCO MCULE-3627112877 [0,2,0,0,0,0|2,0,0]=4 1051 B6R0.1 C=CC(=O)OCC MCULE-9281713240 [0,2,0,0,0,0|1,0,1]=4 1052 B6R0.1 C=CCC(=O)CN MCULE-3960819679 [0,2,0,0,0,0|0,0,2]=4 1053 B6R0.1 C=CCC(=O)CN MCULE-8089375331 [0,2,0,0,0,0|0,0,2]=4 1054 B6R0.1 C=CCC(=O)NC MCULE-4823208577 [0,2,0,0,0,0|0,0,2]=4 1055 B6R0.1 C=CCC(=O)OC MCULE-5546680906 [0,2,0,0,0,0|0,0,2]=4 1056 B6R0.1 C=CCC(C)C=O MCULE-3981206051 [0,2,0,0,0,0|0,0,2]=4 1057 B6R0.1 C=CC[C@H](C)C=O MCULE-6968117309 [0,2,0,0,0,0|0,0,2]=4 1058 B6R0.1 C=COC(=O)CC MCULE-7662621547 [0,2,0,0,0,0|1,0,1]=4 1059 B6R0.1 C=COC(=O)CCl MCULE-7675766105 [0,2,0,0,0,0|1,0,1]=4 1060 B6R0.1 CC#CC(=O)NN MCULE-2475728417 [0,2,0,0,0,0|0,0,2]=4 1061 B6R0.1 CC#CC(=O)OC MCULE-6108678475 [0,2,0,0,0,0|0,0,2]=4 1062 B6R0.1 CC(=CCBr)CBr MCULE-6875050264 [0,2,0,0,0,0|1,0,1]=4 1063 B6R0.1 CC(=CCBr)CCl MCULE-3390489656 [0,2,0,0,0,0|1,0,1]=4 1064 B6R0.1 CC(=CCN)C#N MCULE-1319014311 [0,2,0,0,0,0|1,0,1]=4 1065 B6R0.1 CC(=CCN)C#N MCULE-4924794215 [0,2,0,0,0,0|1,0,1]=4 1066 B6R0.1 CC(=CN=O)NO MCULE-1780424821 [0,2,0,0,0,0|1,0,0]=3 1067 B6R0.1 CC(=NO)C=NO MCULE-9711224051 [0,2,0,0,0,0|1,0,1]=4 1068 B6R0.1 CC/C(=C\C#N)/[O-] MCULE-6169735980 [0,2,0,0,0,0|1,0,1]=4 1069 B6R0.1 CC/C(=C\C#N)/[O-] MCULE-7276617737 [0,2,0,0,0,0|1,0,1]=4 1070 B6R0.1 CC/C=C(\C)/C=O MCULE-6692882718 [0,2,0,0,0,0|0,0,0]=2 1071 B6R0.1 CC=CC(=O)CC MCULE-5948495959 [0,2,0,0,0,0|0,0,0]=2 1072 B6R0.1 CC=CC(=O)OC MCULE-1093700917 [0,2,0,0,0,0|0,0,0]=2 1073 B6R0.1 CC=C[C@@H](N)CO MCULE-4690559736 [0,2,0,0,0,0|0,0,2]=4 1074 B6R0.1 CC=C[C@@H](N)CO MCULE-5852475953 [0,2,0,0,0,0|0,0,2]=4 1075 B6R0.1 CC=C[C@H](N)CO MCULE-6168992245 [0,2,0,0,0,0|0,0,2]=4 1076 B6R0.1 CC=C[C@H](N)CO MCULE-6971252398 [0,2,0,0,0,0|0,0,2]=4 1077 B6R0.1 CCC(=CCO)C MCULE-5264054153 [0,2,0,0,0,0|0,0,2]=4 1078 B6R0.1 CCC(=O)CNC MCULE-3030105640 [0,2,0,0,0,0|1,0,1]=4 1079 B6R0.1 CCC(=O)CNC MCULE-6945295017 [0,2,0,0,0,0|1,0,1]=4 1080 B6R0.1 CCC(=O)COC MCULE-1087802011 [0,2,0,0,0,0|1,0,1]=4 1081 B6R0.1 CCC(=O)CSC MCULE-3230433182 [0,2,0,0,0,0|1,0,1]=4 1082 B6R0.1 CCC(=O)NOC MCULE-4440074406 [0,2,0,0,0,0|2,0,0]=4 1083 B6R0.1 CCC(C)CC=O MCULE-9143756592 [0,2,0,0,0,0|0,0,2]=4 1084 B6R0.1 CCC(C)NC=O MCULE-2197007756 [0,2,0,0,0,0|0,0,2]=4 1085 B6R0.1 CCC(C)OC=O MCULE-9361787208 [0,2,0,0,0,0|0,0,2]=4 1086 B6R0.1 CCC=C(C)C=O MCULE-1636090264 [0,2,0,0,0,0|0,0,0]=2 1087 B6R0.1 CCCC(=O)CBr MCULE-6276592955 [0,2,0,0,0,0|0,0,2]=4 1088 B6R0.1 CCCC(=O)CC MCULE-7121523805 [0,2,0,0,0,0|0,0,2]=4 1089 B6R0.1 CCCC(=O)CCl MCULE-3021809695 [0,2,0,0,0,0|0,0,2]=4 1090 B6R0.1 CCCC(=O)CN MCULE-4663263123 [0,2,0,0,0,0|0,0,2]=4 1091 B6R0.1 CCCC(=O)CN MCULE-6326368932 [0,2,0,0,0,0|0,0,2]=4 1092 B6R0.1 CCCC(=O)CO MCULE-6518249412 [0,2,0,0,0,0|0,0,2]=4 1093 B6R0.1 CCCC(=O)NC MCULE-5770149071 [0,2,0,0,0,0|0,0,2]=4 1094 B6R0.1 CCCC(=O)NN MCULE-3660167295 [0,2,0,0,0,0|0,0,2]=4 1095 B6R0.1 CCCC(=O)NO MCULE-8710375368 [0,2,0,0,0,0|0,0,2]=4 1096 B6R0.1 CCCC(=O)OC MCULE-1092030267 [0,2,0,0,0,0|0,0,2]=4 1097 B6R0.1 CCCC(=O)SC MCULE-1490654381 [0,2,0,0,0,0|0,0,2]=4 1098 B6R0.1 CCCC(C)C=O MCULE-9756444218 [0,2,0,0,0,0|0,0,2]=4 1099 B6R0.1 CCNC(=O)CBr MCULE-5393521747 [0,2,0,0,0,0|1,0,1]=4 1100 B6R0.1 CCNC(=O)CC MCULE-8820594723 [0,2,0,0,0,0|1,0,1]=4 1101 B6R0.1 CCNC(=O)CCl MCULE-7288703153 [0,2,0,0,0,0|1,0,1]=4 1102 B6R0.1 CCNC(=O)CN MCULE-1913543460 [0,2,0,0,0,0|1,0,1]=4 1103 B6R0.1 CCNC(=O)CN MCULE-5473845751 [0,2,0,0,0,0|1,0,1]=4 1104 B6R0.1 CCNC(=O)CO MCULE-1386307800 [0,2,0,0,0,0|1,0,1]=4 1105 B6R0.1 CCNC(=O)NC MCULE-7197803115 [0,2,0,0,0,0|1,0,1]=4 1106 B6R0.1 CCNC(=O)NN MCULE-9055200574 [0,2,0,0,0,0|1,0,1]=4 1107 B6R0.1 CCNC(=O)NO MCULE-3264850022 [0,2,0,0,0,0|1,0,1]=4 1108 B6R0.1 CCNC(=O)OC MCULE-7110705188 [0,2,0,0,0,0|1,0,1]=4 1109 B6R0.1 CCOC(=O)C#N MCULE-4506452376 [0,2,0,0,0,0|1,0,1]=4 1110 B6R0.1 CCOC(=O)C=O MCULE-3433596669 [0,2,0,0,0,0|0,0,1]=3 1111 B6R0.1 CCOC(=O)CBr MCULE-1369687761 [0,2,0,0,0,0|1,0,1]=4 1112 B6R0.1 CCOC(=O)CC MCULE-1639864693 [0,2,0,0,0,0|1,0,1]=4 1113 B6R0.1 CCOC(=O)CCl MCULE-2200524105 [0,2,0,0,0,0|1,0,1]=4 1114 B6R0.1 CCOC(=O)CF MCULE-1926097423 [0,2,0,0,0,0|1,0,1]=4 1115 B6R0.1 CCOC(=O)CI MCULE-9898762324 [0,2,0,0,0,0|1,0,1]=4 1116 B6R0.1 CCOC(=O)CN MCULE-2185173056 [0,2,0,0,0,0|1,0,1]=4 1117 B6R0.1 CCOC(=O)CN MCULE-2628607025 [0,2,0,0,0,0|1,0,1]=4 1118 B6R0.1 CCOC(=O)CO MCULE-8121340151 [0,2,0,0,0,0|1,0,1]=4 1119 B6R0.1 CCOC(=O)CS MCULE-3354026239 [0,2,0,0,0,0|1,0,1]=4 1120 B6R0.1 CCOC(=O)NC MCULE-5506841198 [0,2,0,0,0,0|1,0,1]=4 1121 B6R0.1 CCOC(=O)NN MCULE-9872948119 [0,2,0,0,0,0|1,0,1]=4 1122 B6R0.1 CCOC(=O)NO MCULE-4701193610 [0,2,0,0,0,0|1,0,1]=4 1123 B6R0.1 CCOC(=O)OC MCULE-1185162684 [0,2,0,0,0,0|1,0,1]=4 1124 B6R0.1 CCSC(=O)CC MCULE-6361738004 [0,2,0,0,0,0|1,0,1]=4 1125 B6R0.1 CN(C=O)CCO MCULE-3588371476 [0,2,0,0,0,0|1,0,1]=4 1126 B6R0.1 CNCC(=O)NC MCULE-4579550577 [0,2,0,0,0,0|1,0,1]=4 1127 B6R0.1 CNCC(=O)NC MCULE-7833395637 [0,2,0,0,0,0|1,0,1]=4 1128 B6R0.1 CNCC(=O)NN MCULE-8639164023 [0,2,0,0,0,0|1,0,1]=4 1129 B6R0.1 CNCC(=O)OC MCULE-1667683926 [0,2,0,0,0,0|1,0,1]=4 1130 B6R0.1 CNCC(=O)OC MCULE-5530863658 [0,2,0,0,0,0|1,0,1]=4 1131 B6R0.1 CNNC(=O)OC MCULE-4763095719 [0,2,0,0,0,0|2,0,0]=4 1132 B6R0.1 COC(=O)/C=C/Br MCULE-8282646495 [0,2,0,0,0,0|1,0,0]=3 1133 B6R0.1 COC(=O)/C=C/I MCULE-2652779390 [0,2,0,0,0,0|1,0,0]=3 1134 B6R0.1 COC(=O)/C=C\Br MCULE-8147758029 [0,2,0,0,0,0|1,0,0]=3 1135 B6R0.1 COC(=O)/C=C\I MCULE-9091408550 [0,2,0,0,0,0|1,0,0]=3 1136 B6R0.1 COC(=O)C=CBr MCULE-6878439912 [0,2,0,0,0,0|1,0,0]=3 1137 B6R0.1 COC(=O)C=CCl MCULE-6895925134 [0,2,0,0,0,0|1,0,0]=3 1138 B6R0.1 COC(=O)C=CI MCULE-1616048599 [0,2,0,0,0,0|1,0,0]=3 1139 B6R0.1 COC(=O)C=CN MCULE-4685220707 [0,2,0,0,0,0|1,0,0]=3 1140 B6R0.1 COC(=O)CC=O MCULE-6624474559 [0,2,0,0,0,0|0,0,1]=3 1141 B6R0.1 COC(=O)CSC MCULE-6735536033 [0,2,0,0,0,0|1,0,1]=4 1142 B6R0.1 COC(=O)NC=O MCULE-9852632340 [0,2,0,0,0,0|1,0,0]=3 1143 B6R0.1 COC(C)CC=O MCULE-7243333697 [0,2,0,0,0,0|0,0,2]=4 1144 B6R0.1 COCC(=O)CCl MCULE-7542636020 [0,2,0,0,0,0|1,0,1]=4 1145 B6R0.1 COCC(=O)NN MCULE-4127487886 [0,2,0,0,0,0|1,0,1]=4 1146 B6R0.1 COCC(=O)OC MCULE-8337685268 [0,2,0,0,0,0|1,0,1]=4 1147 B6R0.1 COCC(C)C=O MCULE-7679332713 [0,2,0,0,0,0|0,0,2]=4 1148 B6R0.1 CONC(=O)OC MCULE-9304532248 [0,2,0,0,0,0|2,0,0]=4 1149 B6R0.1 CSC(C)CC=O MCULE-9433914892 [0,2,0,0,0,0|0,0,2]=4 1150 B6R0.1 CSCC(=O)NN MCULE-8151954663 [0,2,0,0,0,0|1,0,1]=4 1151 B6R0.1 O=C(C=CCl)CCl MCULE-6121304267 [0,2,0,0,0,0|1,0,0]=3 1152 B6R0.1 O=C=NC(=O)CCl MCULE-8927897165 [0,2,0,0,0,0|1,0,1]=4 1153 B6R0.1 O=CC[C@H](O)CCl MCULE-6385696769 [0,2,0,0,0,0|0,0,2]=4 1154 B6R0.2 C/C(=C\C(=S)N)/N MCULE-9311101194 [0,2,0,0,0,0|0,1,0]=3 1155 B6R0.2 C=C(C)C=C(C)C MCULE-1842732141 [0,2,0,0,0,0|1,0,0]=3 1156 B6R0.2 C=C(C)CC(=O)C MCULE-3534735279 [0,2,0,0,0,0|0,0,1]=3 1157 B6R0.2 C=C(C)CC(=O)O MCULE-5404023928 [0,2,0,0,0,0|0,0,1]=3 1158 B6R0.2 C=C(C)OC(=O)C MCULE-9345377025 [0,2,0,0,0,0|1,0,0]=3 1159 B6R0.2 C=C(I)CC(=O)O MCULE-3849925169 [0,2,0,0,0,0|0,0,2]=4 1160 B6R0.2 CC(=CB(O)O)C MCULE-5305023524 [0,2,0,0,0,0|1,0,1]=4 1161 B6R0.2 CC(=CC(=O)Cl)C MCULE-7644585609 [0,2,0,0,0,0|0,0,0]=2 1162 B6R0.2 CC(=CC(=O)N)C MCULE-6264319579 [0,2,0,0,0,0|0,0,0]=2 1163 B6R0.2 CC(=CC(=O)O)C MCULE-4772426340 [0,2,0,0,0,0|0,0,0]=2 1164 B6R0.2 CC(=CC(=O)O)Cl MCULE-7503760292 [0,2,0,0,0,0|0,0,0]=2 1165 B6R0.2 CC(=CC(=O)O)I MCULE-2652373771 [0,2,0,0,0,0|0,0,0]=2 1166 B6R0.2 CC(=CC(=O)O)N MCULE-5894724848 [0,2,0,0,0,0|0,0,0]=2 1167 B6R0.2 CC(=CC(=S)N)N MCULE-2731073832 [0,2,0,0,0,0|0,1,0]=3 1168 B6R0.2 CC(=CC(C)C)C MCULE-5460531772 [0,2,0,0,0,0|1,0,1]=4 1169 B6R0.2 CC(=CC(C)O)C MCULE-5270694894 [0,2,0,0,0,0|0,0,2]=4 1170 B6R0.2 CC(=CN(=O)=O)C MCULE-7745125648 [0,2,0,0,0,0|1,0,0]=3 1171 B6R0.2 CC(=C[N+](=O)[O-])[O-] MCULE-1079281493 [0,2,0,0,0,0|1,0,0]=3 1172 B6R0.2 CC(=C[N+](=O)[O-])[O-] MCULE-4355961794 [0,2,0,0,0,0|1,0,0]=3 1173 B6R0.2 CC(=N)CC(=O)C MCULE-4678643052 [0,2,0,0,0,0|0,0,1]=3 1174 B6R0.2 CC(=O)/C=C(/C)\N MCULE-1235186190 [0,2,0,0,0,0|0,0,0]=2 1175 B6R0.2 CC(=O)/C=C(/C)\[O-] MCULE-3445340105 [0,2,0,0,0,0|0,0,0]=2 1176 B6R0.2 CC(=O)/C=C(/C)\[O-] MCULE-7833799417 [0,2,0,0,0,0|0,0,0]=2 1177 B6R0.2 CC(=O)/C=C(\C)/N MCULE-6412393370 [0,2,0,0,0,0|0,0,0]=2 1178 B6R0.2 CC(=O)C=C(C)C MCULE-4922478422 [0,2,0,0,0,0|0,0,0]=2 1179 B6R0.2 CC(=O)C=C(C)N MCULE-2247743178 [0,2,0,0,0,0|0,0,0]=2 1180 B6R0.2 CC(=O)C=C(C)O MCULE-7345258397 [0,2,0,0,0,0|0,0,0]=2 1181 B6R0.2 CC(=O)C=C(C)[O-] MCULE-7733093724 [0,2,0,0,0,0|0,0,0]=2 1182 B6R0.2 CC(=O)CC(=O)C MCULE-6481204381 [0,2,0,0,0,0|0,0,1]=3 1183 B6R0.2 CC(=O)CC(=O)N MCULE-1618058771 [0,2,0,0,0,0|0,0,1]=3 1184 B6R0.2 CC(=O)CC(=O)O MCULE-2601276539 [0,2,0,0,0,0|0,0,1]=3 1185 B6R0.2 CC(=O)CC(=O)[O-] MCULE-6317885864 [0,2,0,0,0,0|0,0,1]=3 1186 B6R0.2 CC(=O)CC(=O)[O-] MCULE-8448177875 [0,2,0,0,0,0|0,0,1]=3 1187 B6R0.2 CC(=O)CC(C)C MCULE-2172909634 [0,2,0,0,0,0|0,0,2]=4 1188 B6R0.2 CC(=O)CC(C)N MCULE-1028280795 [0,2,0,0,0,0|0,0,2]=4 1189 B6R0.2 CC(=O)CC(C)N MCULE-7911343070 [0,2,0,0,0,0|0,0,2]=4 1190 B6R0.2 CC(=O)CC(C)O MCULE-5175367575 [0,2,0,0,0,0|0,0,2]=4 1191 B6R0.2 CC(=O)CN(=O)=O MCULE-3153232896 [0,2,0,0,0,0|1,0,1]=4 1192 B6R0.2 CC(=O)CN(C)C MCULE-8561521241 [0,2,0,0,0,0|1,0,1]=4 1193 B6R0.2 CC(=O)C[C@@H](C)N MCULE-1260669737 [0,2,0,0,0,0|0,0,2]=4 1194 B6R0.2 CC(=O)C[C@@H](C)N MCULE-6556661125 [0,2,0,0,0,0|0,0,2]=4 1195 B6R0.2 CC(=O)NC(=N)N MCULE-9300028018 [0,2,0,0,0,0|2,0,0]=4 1196 B6R0.2 CC(=O)NC(=O)C MCULE-3040534108 [0,2,0,0,0,0|1,0,0]=3 1197 B6R0.2 CC(=O)NC(=O)N MCULE-8999775359 [0,2,0,0,0,0|1,0,0]=3 1198 B6R0.2 CC(=O)NC(=S)N MCULE-8448117000 [0,2,0,0,0,0|1,1,0]=4 1199 B6R0.2 CC(=O)NC(C)C MCULE-2095134698 [0,2,0,0,0,0|1,0,1]=4 1200 B6R0.2 CC(=O)NN(C)C MCULE-3444969121 [0,2,0,0,0,0|2,0,0]=4 1201 B6R0.2 CC(=O)NN(C)C MCULE-5383938091 [0,2,0,0,0,0|2,0,0]=4 1202 B6R0.2 CC(=O)OC(=O)C MCULE-9184217748 [0,2,0,0,0,0|1,0,0]=3 1203 B6R0.2 CC(=O)OC(C)Br MCULE-6494616843 [0,2,0,0,0,0|1,0,1]=4 1204 B6R0.2 CC(=O)OC(C)C MCULE-6152257819 [0,2,0,0,0,0|1,0,1]=4 1205 B6R0.2 CC(=O)OC(C)Cl MCULE-3738479003 [0,2,0,0,0,0|1,0,1]=4 1206 B6R0.2 CC(=O)SC(=O)C MCULE-5749449964 [0,2,0,0,0,0|1,0,0]=3 1207 B6R0.2 CC(=O)[CH-]C(=O)C MCULE-4855074933 [0,2,0,0,0,0|0,0,1]=3 1208 B6R0.2 CC(=O)[CH-]C(=O)C MCULE-6905854247 [0,2,0,0,0,0|0,0,1]=3 1209 B6R0.2 CC(Br)CC(=O)O MCULE-3353526571 [0,2,0,0,0,0|0,0,2]=4 1210 B6R0.2 CC(C)CC(=O)Cl MCULE-8821231794 [0,2,0,0,0,0|0,0,2]=4 1211 B6R0.2 CC(C)CC(=O)N MCULE-7790849976 [0,2,0,0,0,0|0,0,2]=4 1212 B6R0.2 CC(C)CC(=O)O MCULE-5805071360 [0,2,0,0,0,0|0,0,2]=4 1213 B6R0.2 CC(C)NC(=O)N MCULE-2725741897 [0,2,0,0,0,0|1,0,1]=4 1214 B6R0.2 CC(C)OC(=O)Cl MCULE-3303340398 [0,2,0,0,0,0|1,0,1]=4 1215 B6R0.2 CC(C)OC(=O)N MCULE-9996500963 [0,2,0,0,0,0|1,0,1]=4 1216 B6R0.2 CC(C)SC(=O)Cl MCULE-9803882280 [0,2,0,0,0,0|1,0,1]=4 1217 B6R0.2 CC(Cl)CC(=O)Cl MCULE-3323045052 [0,2,0,0,0,0|0,0,2]=4 1218 B6R0.2 CC(Cl)CC(=O)O MCULE-1436146199 [0,2,0,0,0,0|0,0,2]=4 1219 B6R0.2 CC(Cl)OC(=O)Cl MCULE-8020850544 [0,2,0,0,0,0|1,0,1]=4 1220 B6R0.2 CC(F)CC(=O)O MCULE-9214258715 [0,2,0,0,0,0|0,0,2]=4 1221 B6R0.2 CC(N)CC(=O)N MCULE-8604112274 [0,2,0,0,0,0|0,0,2]=4 1222 B6R0.2 CC(N)CC(=O)N MCULE-8651032460 [0,2,0,0,0,0|0,0,2]=4 1223 B6R0.2 CC(N)CC(=O)O MCULE-2960589915 [0,2,0,0,0,0|0,0,2]=4 1224 B6R0.2 CC(N)CC(=O)O MCULE-5772407106 [0,2,0,0,0,0|0,0,2]=4 1225 B6R0.2 CC(N)CC(=O)O MCULE-7818257350 [0,2,0,0,0,0|0,0,2]=4 1226 B6R0.2 CC(N)CC(=O)O MCULE-7847644131 [0,2,0,0,0,0|0,0,2]=4 1227 B6R0.2 CC(O)CC(=O)N MCULE-7442557911 [0,2,0,0,0,0|0,0,2]=4 1228 B6R0.2 CC(O)CC(=O)O MCULE-3566732882 [0,2,0,0,0,0|0,0,2]=4 1229 B6R0.2 CC(O)CC(=O)O MCULE-6537877725 [0,2,0,0,0,0|0,0,2]=4 1230 B6R0.2 CC(O)CC(=O)[O-] MCULE-1109368801 [0,2,0,0,0,0|0,0,2]=4 1231 B6R0.2 CC(O)CC(=O)[O-] MCULE-5681138302 [0,2,0,0,0,0|0,0,2]=4 1232 B6R0.2 CN(C)CC(=O)Cl MCULE-2168217529 [0,2,0,0,0,0|1,0,1]=4 1233 B6R0.2 CN(C)CC(=O)Cl MCULE-6810056185 [0,2,0,0,0,0|1,0,1]=4 1234 B6R0.2 CN(C)CC(=O)N MCULE-3894706713 [0,2,0,0,0,0|1,0,1]=4 1235 B6R0.2 CN(C)CC(=O)O MCULE-2303978039 [0,2,0,0,0,0|1,0,1]=4 1236 B6R0.2 CN(C)CC(=O)O MCULE-3368936600 [0,2,0,0,0,0|1,0,1]=4 1237 B6R0.2 CN(C)CC(=O)[O-] MCULE-3077067854 [0,2,0,0,0,0|1,0,1]=4 1238 B6R0.2 CN(C)NC(=O)N MCULE-4462686977 [0,2,0,0,0,0|2,0,0]=4 1239 B6R0.2 C[C@@H](N)CC(=O)O MCULE-2652696372 [0,2,0,0,0,0|0,0,2]=4 1240 B6R0.2 C[C@@H](N)CC(=O)O MCULE-7054489636 [0,2,0,0,0,0|0,0,2]=4 1241 B6R0.2 C[C@@H](N)CC(=O)O MCULE-7621851215 [0,2,0,0,0,0|0,0,2]=4 1242 B6R0.2 C[C@@H](N)CC(=O)O MCULE-8671397640 [0,2,0,0,0,0|0,0,2]=4 1243 B6R0.2 C[C@@H](O)CC(=O)O MCULE-2545577683 [0,2,0,0,0,0|0,0,2]=4 1244 B6R0.2 C[C@@H](O)CC(=O)O MCULE-4159227891 [0,2,0,0,0,0|0,0,2]=4 1245 B6R0.2 C[C@@H](O)CC(=O)[O-] MCULE-7081161048 [0,2,0,0,0,0|0,0,2]=4 1246 B6R0.2 C[C@@H](O)CC(=O)[O-] MCULE-7886150665 [0,2,0,0,0,0|0,0,2]=4 1247 B6R0.2 C[C@H](Br)CC(=O)O MCULE-1601745040 [0,2,0,0,0,0|0,0,2]=4 1248 B6R0.2 C[C@H](Br)CC(=O)O MCULE-2894930407 [0,2,0,0,0,0|0,0,2]=4 1249 B6R0.2 C[C@H](N)CC(=O)O MCULE-2656839691 [0,2,0,0,0,0|0,0,2]=4 1250 B6R0.2 C[C@H](N)CC(=O)O MCULE-4695512293 [0,2,0,0,0,0|0,0,2]=4 1251 B6R0.2 C[C@H](N)CC(=O)O MCULE-5288044169 [0,2,0,0,0,0|0,0,2]=4 1252 B6R0.2 C[C@H](N)CC(=O)O MCULE-6641912058 [0,2,0,0,0,0|0,0,2]=4 1253 B6R0.2 C[C@H](O)CC(=O)O MCULE-2857686566 [0,2,0,0,0,0|0,0,2]=4 1254 B6R0.2 C[C@H](O)CC(=O)O MCULE-3362266278 [0,2,0,0,0,0|0,0,2]=4 1255 B6R0.2 C[C@H](O)CC(=O)[O-] MCULE-3624690550 [0,2,0,0,0,0|0,0,2]=4 1256 B6R0.2 C[C@H](O)CC(=O)[O-] MCULE-5550257128 [0,2,0,0,0,0|0,0,2]=4 1257 B6R0.2 C[S+](C)CC(=O)[O-] MCULE-1975585935 [0,2,0,0,0,0|1,0,1]=4 1258 B6R0.2 C[S+](C)CC(=O)[O-] MCULE-7679949306 [0,2,0,0,0,0|1,0,1]=4 1259 B6R0.2 N=C(N)CC(=O)N MCULE-9200673939 [0,2,0,0,0,0|1,0,1]=4 1260 B6R0.2 N=C(N)NC(=O)N MCULE-1919966850 [0,2,0,0,0,0|2,0,0]=4 1261 B6R0.2 N=C(N)NC(=O)N MCULE-3428379172 [0,2,0,0,0,0|2,0,0]=4 1262 B6R0.2 N=C(N)NC(=O)N MCULE-6044803486 [0,2,0,0,0,0|2,0,0]=4 1263 B6R0.2 N=C(N)NC(=O)N MCULE-8893931961 [0,2,0,0,0,0|2,0,0]=4 1264 B6R0.2 N=C([NH3+])CC(=O)N MCULE-7769639649 [0,2,0,0,0,0|1,0,1]=4 1265 B6R0.2 NC(=CN(=O)=O)N MCULE-9629386307 [0,2,0,0,0,0|2,0,0]=4 1266 B6R0.2 NC(=O)CC(=O)N MCULE-7675159766 [0,2,0,0,0,0|1,0,1]=4 1267 B6R0.2 NC(=O)CC(=O)O MCULE-1168254626 [0,2,0,0,0,0|1,0,1]=4 1268 B6R0.2 NC(=O)CC(=S)N MCULE-9383188328 [0,2,0,0,0,0|1,0,1]=4 1269 B6R0.2 NC(=O)NC(=O)N MCULE-4571627886 [0,2,0,0,0,0|2,0,0]=4 1270 B6R0.2 O=C(Cl)CC(=O)Cl MCULE-8779098368 [0,2,0,0,0,0|1,0,1]=4 1271 B6R0.2 O=C(O)C=C(Br)Br MCULE-4379078717 [0,2,0,0,0,0|1,0,0]=3 1272 B6R0.2 O=C(O)C=C(Cl)Cl MCULE-5096440659 [0,2,0,0,0,0|1,0,0]=3 1273 B6R0.2 O=C(O)CC(=O)O MCULE-5893043131 [0,2,0,0,0,0|1,0,1]=4 1274 B6R0.2 O=C([O-])CC(=O)[O-] MCULE-2327820884 [0,2,0,0,0,0|1,0,1]=4 1275 B6R0.2 O=C([O-])CC(=O)[O-] MCULE-6849635529 [0,2,0,0,0,0|1,0,1]=4 1276 B6R0.2 O=N(=O)C=C(Cl)Cl MCULE-9907270101 [0,2,0,0,0,0|2,0,0]=4 1277 B6R0.3 C(C)(OC)C(=O)O MCULE-4852209230 [0,2,0,0,0,0|1,0,1]=4 1278 B6R0.3 C/C=C(/C)\C(=O)O MCULE-2116066534 [0,2,0,0,0,0|0,0,0]=2 1279 B6R0.3 C/C=C(\Br)/C(=O)O MCULE-5940308548 [0,2,0,0,0,0|0,0,0]=2 1280 B6R0.3 C/C=C(\C)/C(=O)O MCULE-4890719796 [0,2,0,0,0,0|0,0,0]=2 1281 B6R0.3 C/C=C(\O)/C(=O)O MCULE-9596699660 [0,2,0,0,0,0|0,0,0]=2 1282 B6R0.3 C=C(Br)C(=O)OC MCULE-6192595524 [0,2,0,0,0,0|2,0,0]=4 1283 B6R0.3 C=C(C#N)C(=O)O MCULE-1746285232 [0,2,0,0,0,0|1,0,1]=4 1284 B6R0.3 C=C(C)C(=O)NC MCULE-9515227181 [0,2,0,0,0,0|2,0,0]=4 1285 B6R0.3 C=C(C)C(=O)NN MCULE-5114453960 [0,2,0,0,0,0|2,0,0]=4 1286 B6R0.3 C=C(C)C(=O)OC MCULE-9286083206 [0,2,0,0,0,0|2,0,0]=4 1287 B6R0.3 C=C(CBr)C(=O)O MCULE-7257367588 [0,2,0,0,0,0|1,0,1]=4 1288 B6R0.3 C=C(CC)C(=O)O MCULE-7335567367 [0,2,0,0,0,0|0,0,1]=3 1289 B6R0.3 C=C(CO)C(=O)O MCULE-9731648602 [0,2,0,0,0,0|1,0,1]=4 1290 B6R0.3 C=C(Cl)C(=O)OC MCULE-6494333767 [0,2,0,0,0,0|2,0,0]=4 1291 B6R0.3 C=C(F)C(=O)OC MCULE-8485282148 [0,2,0,0,0,0|2,0,0]=4 1292 B6R0.3 C=C(OC)C(=O)O MCULE-9965334560 [0,2,0,0,0,0|1,0,0]=3 1293 B6R0.3 C=CC(=O)C(=O)O MCULE-9816982424 [0,2,0,0,0,0|0,0,1]=3 1294 B6R0.3 C=CC(=O)C(C)C MCULE-8577593172 [0,2,0,0,0,0|1,0,1]=4 1295 B6R0.3 C=CC(=O)N(C)C MCULE-3105693382 [0,2,0,0,0,0|2,0,0]=4 1296 B6R0.3 C=CC(C)C(=O)O MCULE-7280145889 [0,2,0,0,0,0|0,0,2]=4 1297 B6R0.3 C=CC(N)C(=O)O MCULE-2000511750 [0,2,0,0,0,0|0,0,2]=4 1298 B6R0.3 C=CC(N)C(=O)O MCULE-7504415267 [0,2,0,0,0,0|0,0,2]=4 1299 B6R0.3 C=CC(N)C(=O)O MCULE-9012490000 [0,2,0,0,0,0|0,0,2]=4 1300 B6R0.3 C=CC(N)C(=O)O MCULE-9978294266 [0,2,0,0,0,0|0,0,2]=4 1301 B6R0.3 C=CC(O)C(=O)O MCULE-3847595710 [0,2,0,0,0,0|0,0,2]=4 1302 B6R0.3 C=CN(C)C(=O)C MCULE-2418332000 [0,2,0,0,0,0|1,0,1]=4 1303 B6R0.3 C=C[C@@H](C)C(=O)O MCULE-9719548038 [0,2,0,0,0,0|0,0,2]=4 1304 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-3678761806 [0,2,0,0,0,0|0,0,2]=4 1305 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-6682447306 [0,2,0,0,0,0|0,0,2]=4 1306 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-6779191781 [0,2,0,0,0,0|0,0,2]=4 1307 B6R0.3 C=C[C@H](C)C(=O)O MCULE-1694697840 [0,2,0,0,0,0|0,0,2]=4 1308 B6R0.3 C=C[C@H](C)C(=O)O MCULE-2601438258 [0,2,0,0,0,0|0,0,2]=4 1309 B6R0.3 C=C[C@H](C)C(=O)O MCULE-6098133430 [0,2,0,0,0,0|0,0,2]=4 1310 B6R0.3 C=C[C@H](N)C(=O)O MCULE-2657488498 [0,2,0,0,0,0|0,0,2]=4 1311 B6R0.3 C=C[C@H](N)C(=O)O MCULE-5103456570 [0,2,0,0,0,0|0,0,2]=4 1312 B6R0.3 C=C[C@H](N)C(=O)O MCULE-5936124947 [0,2,0,0,0,0|0,0,2]=4 1313 B6R0.3 C=C[C@H](N)C(=O)O MCULE-9631686254 [0,2,0,0,0,0|0,0,2]=4 1314 B6R0.3 CC(=C(Br)CBr)C MCULE-2575044530 [0,2,0,0,0,0|1,0,1]=4 1315 B6R0.3 CC(=C(Br)CN)C MCULE-2433306744 [0,2,0,0,0,0|1,0,1]=4 1316 B6R0.3 CC(=C(C)CO)C MCULE-2852322197 [0,2,0,0,0,0|0,0,2]=4 1317 B6R0.3 CC(=C(F)CN)C MCULE-8503104664 [0,2,0,0,0,0|1,0,1]=4 1318 B6R0.3 CC(=C(F)CN)C MCULE-8932417146 [0,2,0,0,0,0|1,0,1]=4 1319 B6R0.3 CC(=C(F)CO)C MCULE-3552996593 [0,2,0,0,0,0|0,0,2]=4 1320 B6R0.3 CC(=CBr)C(=O)O MCULE-3682516046 [0,2,0,0,0,0|1,0,0]=3 1321 B6R0.3 CC(=NO)C(=O)O MCULE-8264934008 [0,2,0,0,0,0|2,0,0]=4 1322 B6R0.3 CC(=O)/C(=N/O)/C MCULE-2017881701 [0,2,0,0,0,0|1,0,1]=4 1323 B6R0.3 CC(=O)/C(=N\O)/C MCULE-6814264333 [0,2,0,0,0,0|1,0,1]=4 1324 B6R0.3 CC(=O)C(=NO)C MCULE-3626428375 [0,2,0,0,0,0|1,0,1]=4 1325 B6R0.3 CC(=O)C(=NO)Cl MCULE-9930401042 [0,2,0,0,0,0|1,0,1]=4 1326 B6R0.3 CC(=O)C(=O)CBr MCULE-8560925164 [0,2,0,0,0,0|1,0,1]=4 1327 B6R0.3 CC(=O)C(=O)CCl MCULE-2778551811 [0,2,0,0,0,0|1,0,1]=4 1328 B6R0.3 CC(=O)C(Br)C=O MCULE-6904531970 [0,2,0,0,0,0|0,0,1]=3 1329 B6R0.3 CC(=O)C(C)C=O MCULE-7133682970 [0,2,0,0,0,0|0,0,1]=3 1330 B6R0.3 CC(C)C(Br)C=O MCULE-2054791376 [0,2,0,0,0,0|0,0,2]=4 1331 B6R0.3 CC(C)[C@H](N)C=O MCULE-6686967175 [0,2,0,0,0,0|0,0,2]=4 1332 B6R0.3 CC=C(Br)C(=O)O MCULE-5368794596 [0,2,0,0,0,0|0,0,0]=2 1333 B6R0.3 CC=C(C)B(O)O MCULE-7915552360 [0,2,0,0,0,0|1,0,1]=4 1334 B6R0.3 CC=C(C)C(=O)C MCULE-8950290711 [0,2,0,0,0,0|0,0,0]=2 1335 B6R0.3 CC=C(C)C(=O)Cl MCULE-2974704783 [0,2,0,0,0,0|0,0,0]=2 1336 B6R0.3 CC=C(C)C(=O)O MCULE-2390677360 [0,2,0,0,0,0|0,0,0]=2 1337 B6R0.3 CC=C(C)C(C)C MCULE-4070109813 [0,2,0,0,0,0|1,0,1]=4 1338 B6R0.3 CC=C(Cl)C(=O)O MCULE-5827690088 [0,2,0,0,0,0|0,0,0]=2 1339 B6R0.3 CC=C(F)C(=O)O MCULE-5053310707 [0,2,0,0,0,0|0,0,0]=2 1340 B6R0.3 CC=C(O)C(=O)O MCULE-7886990963 [0,2,0,0,0,0|0,0,0]=2 1341 B6R0.3 CCC(=C(C)C)C MCULE-7258057243 [0,2,0,0,0,0|1,0,1]=4 1342 B6R0.3 CCC(=O)C(=O)C MCULE-3065014067 [0,2,0,0,0,0|0,0,1]=3 1343 B6R0.3 CCC(=O)C(=O)O MCULE-8360398438 [0,2,0,0,0,0|0,0,1]=3 1344 B6R0.3 CCC(=O)C(=O)[O-] MCULE-7571698792 [0,2,0,0,0,0|0,0,1]=3 1345 B6R0.3 CCC(Br)C(=O)Br MCULE-2627972929 [0,2,0,0,0,0|0,0,2]=4 1346 B6R0.3 CCC(Br)C(=O)C MCULE-7759811805 [0,2,0,0,0,0|0,0,2]=4 1347 B6R0.3 CCC(Br)C(=O)Cl MCULE-1448867234 [0,2,0,0,0,0|0,0,2]=4 1348 B6R0.3 CCC(Br)C(=O)N MCULE-5823441392 [0,2,0,0,0,0|0,0,2]=4 1349 B6R0.3 CCC(Br)C(=O)O MCULE-4214463814 [0,2,0,0,0,0|0,0,2]=4 1350 B6R0.3 CCC(C)C(=O)C MCULE-5294244024 [0,2,0,0,0,0|0,0,2]=4 1351 B6R0.3 CCC(C)C(=O)Cl MCULE-3594098886 [0,2,0,0,0,0|0,0,2]=4 1352 B6R0.3 CCC(C)C(=O)N MCULE-9298244547 [0,2,0,0,0,0|0,0,2]=4 1353 B6R0.3 CCC(C)C(=O)O MCULE-5615925204 [0,2,0,0,0,0|0,0,2]=4 1354 B6R0.3 CCC(C)C(=O)O MCULE-7434436828 [0,2,0,0,0,0|0,0,2]=4 1355 B6R0.3 CCC(Cl)C(=O)Cl MCULE-6260726168 [0,2,0,0,0,0|0,0,2]=4 1356 B6R0.3 CCC(Cl)C(=O)N MCULE-7941338456 [0,2,0,0,0,0|0,0,2]=4 1357 B6R0.3 CCC(Cl)C(=O)O MCULE-6325944516 [0,2,0,0,0,0|0,0,2]=4 1358 B6R0.3 CCC(F)C(=O)O MCULE-3947852767 [0,2,0,0,0,0|0,0,2]=4 1359 B6R0.3 CCC(N)C(=O)N MCULE-2662930657 [0,2,0,0,0,0|0,0,2]=4 1360 B6R0.3 CCC(N)C(=O)N MCULE-5136248706 [0,2,0,0,0,0|0,0,2]=4 1361 B6R0.3 CCC(N)C(=O)N MCULE-8876361903 [0,2,0,0,0,0|0,0,2]=4 1362 B6R0.3 CCC(N)C(=O)N MCULE-9704177556 [0,2,0,0,0,0|0,0,2]=4 1363 B6R0.3 CCC(N)C(=O)O MCULE-2132009026 [0,2,0,0,0,0|0,0,2]=4 1364 B6R0.3 CCC(N)C(=O)O MCULE-7397078475 [0,2,0,0,0,0|0,0,2]=4 1365 B6R0.3 CCC(N)C(=O)O MCULE-8052711911 [0,2,0,0,0,0|0,0,2]=4 1366 B6R0.3 CCC(N)C(=O)O MCULE-9815187967 [0,2,0,0,0,0|0,0,2]=4 1367 B6R0.3 CCC(O)C(=O)N MCULE-4290959224 [0,2,0,0,0,0|0,0,2]=4 1368 B6R0.3 CCC(O)C(=O)O MCULE-1958918710 [0,2,0,0,0,0|0,0,2]=4 1369 B6R0.3 CCC(O)C(=O)O MCULE-2006594131 [0,2,0,0,0,0|0,0,2]=4 1370 B6R0.3 CCC(O)C(=O)[O-] MCULE-5297669254 [0,2,0,0,0,0|0,0,2]=4 1371 B6R0.3 CCC(O)C(=O)[O-] MCULE-5740032698 [0,2,0,0,0,0|0,0,2]=4 1372 B6R0.3 CCC(S)C(=O)C MCULE-4243782106 [0,2,0,0,0,0|0,0,2]=4 1373 B6R0.3 CCC(S)C(=O)O MCULE-9887370695 [0,2,0,0,0,0|0,0,2]=4 1374 B6R0.3 CCN(C)C(=O)C MCULE-6881823095 [0,2,0,0,0,0|1,0,1]=4 1375 B6R0.3 CCN(C)C(=O)Cl MCULE-3697487267 [0,2,0,0,0,0|1,0,1]=4 1376 B6R0.3 CCN(N)C(=O)N MCULE-8674876262 [0,2,0,0,0,0|1,0,1]=4 1377 B6R0.3 CCN(O)C(=O)C MCULE-8547381969 [0,2,0,0,0,0|1,0,1]=4 1378 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-3890418201 [0,2,0,0,0,0|0,0,2]=4 1379 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-5910145154 [0,2,0,0,0,0|0,0,2]=4 1380 B6R0.3 CC[C@@H](C)C(=O)N MCULE-3083676357 [0,2,0,0,0,0|0,0,2]=4 1381 B6R0.3 CC[C@@H](C)C(=O)N MCULE-4584753474 [0,2,0,0,0,0|0,0,2]=4 1382 B6R0.3 CC[C@@H](C)C(=O)O MCULE-4225604875 [0,2,0,0,0,0|0,0,2]=4 1383 B6R0.3 CC[C@@H](C)C(=O)O MCULE-6581991788 [0,2,0,0,0,0|0,0,2]=4 1384 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-2496023102 [0,2,0,0,0,0|0,0,2]=4 1385 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-9719915588 [0,2,0,0,0,0|0,0,2]=4 1386 B6R0.3 CC[C@@H](N)C(=O)N MCULE-2790345262 [0,2,0,0,0,0|0,0,2]=4 1387 B6R0.3 CC[C@@H](N)C(=O)N MCULE-3501293124 [0,2,0,0,0,0|0,0,2]=4 1388 B6R0.3 CC[C@@H](N)C(=O)N MCULE-4913204798 [0,2,0,0,0,0|0,0,2]=4 1389 B6R0.3 CC[C@@H](N)C(=O)N MCULE-5005994513 [0,2,0,0,0,0|0,0,2]=4 1390 B6R0.3 CC[C@@H](N)C(=O)O MCULE-3824768448 [0,2,0,0,0,0|0,0,2]=4 1391 B6R0.3 CC[C@@H](N)C(=O)O MCULE-7078248621 [0,2,0,0,0,0|0,0,2]=4 1392 B6R0.3 CC[C@@H](N)C(=O)O MCULE-8856363896 [0,2,0,0,0,0|0,0,2]=4 1393 B6R0.3 CC[C@@H](N)C(=O)O MCULE-9662763952 [0,2,0,0,0,0|0,0,2]=4 1394 B6R0.3 CC[C@@H](O)C(=O)O MCULE-8118182602 [0,2,0,0,0,0|0,0,2]=4 1395 B6R0.3 CC[C@@H](O)C(=O)O MCULE-9744322272 [0,2,0,0,0,0|0,0,2]=4 1396 B6R0.3 CC[C@H](Br)C(=O)O MCULE-2859668715 [0,2,0,0,0,0|0,0,2]=4 1397 B6R0.3 CC[C@H](Br)C(=O)O MCULE-9989821197 [0,2,0,0,0,0|0,0,2]=4 1398 B6R0.3 CC[C@H](C)C(=O)O MCULE-5170193492 [0,2,0,0,0,0|0,0,2]=4 1399 B6R0.3 CC[C@H](C)C(=O)O MCULE-6595467867 [0,2,0,0,0,0|0,0,2]=4 1400 B6R0.3 CC[C@H](Cl)C(=O)O MCULE-8870390851 [0,2,0,0,0,0|0,0,2]=4 1401 B6R0.3 CC[C@H](N)C(=O)N MCULE-1934671300 [0,2,0,0,0,0|0,0,2]=4 1402 B6R0.3 CC[C@H](N)C(=O)N MCULE-3034729287 [0,2,0,0,0,0|0,0,2]=4 1403 B6R0.3 CC[C@H](N)C(=O)N MCULE-6902117665 [0,2,0,0,0,0|0,0,2]=4 1404 B6R0.3 CC[C@H](N)C(=O)N MCULE-9419812665 [0,2,0,0,0,0|0,0,2]=4 1405 B6R0.3 CC[C@H](N)C(=O)O MCULE-3597025691 [0,2,0,0,0,0|0,0,2]=4 1406 B6R0.3 CC[C@H](N)C(=O)O MCULE-5445914617 [0,2,0,0,0,0|0,0,2]=4 1407 B6R0.3 CC[C@H](N)C(=O)O MCULE-7781302707 [0,2,0,0,0,0|0,0,2]=4 1408 B6R0.3 CC[C@H](N)C(=O)O MCULE-8446392822 [0,2,0,0,0,0|0,0,2]=4 1409 B6R0.3 CC[C@H](O)C(=O)O MCULE-4284991317 [0,2,0,0,0,0|0,0,2]=4 1410 B6R0.3 CC[C@H](O)C(=O)O MCULE-6782147427 [0,2,0,0,0,0|0,0,2]=4 1411 B6R0.3 CC[C@H](O)C(=O)[O-] MCULE-6073275709 [0,2,0,0,0,0|0,0,2]=4 1412 B6R0.3 CNC(=O)C(=O)O MCULE-5436132271 [0,2,0,0,0,0|1,0,0]=3 1413 B6R0.3 CNC(C)C(=O)N MCULE-1426280147 [0,2,0,0,0,0|1,0,1]=4 1414 B6R0.3 CNC(C)C(=O)N MCULE-2344663168 [0,2,0,0,0,0|1,0,1]=4 1415 B6R0.3 CNC(C)C(=O)O MCULE-4088114502 [0,2,0,0,0,0|1,0,1]=4 1416 B6R0.3 CNC(C)C(=O)O MCULE-7300169560 [0,2,0,0,0,0|1,0,1]=4 1417 B6R0.3 CNC(C)C(=O)O MCULE-8623956615 [0,2,0,0,0,0|1,0,1]=4 1418 B6R0.3 CN[C@@H](C)C(=O)N MCULE-3316985921 [0,2,0,0,0,0|1,0,1]=4 1419 B6R0.3 CN[C@@H](C)C(=O)O MCULE-2079366664 [0,2,0,0,0,0|1,0,1]=4 1420 B6R0.3 CN[C@@H](C)C(=O)O MCULE-4072364377 [0,2,0,0,0,0|1,0,1]=4 1421 B6R0.3 CN[C@@H](C)C(=O)O MCULE-4518259073 [0,2,0,0,0,0|1,0,1]=4 1422 B6R0.3 CN[C@@H](C)C(=O)O MCULE-8200069325 [0,2,0,0,0,0|1,0,1]=4 1423 B6R0.3 CN[C@H](C)C(=O)O MCULE-2777429698 [0,2,0,0,0,0|1,0,1]=4 1424 B6R0.3 CN[C@H](C)C(=O)O MCULE-7282734154 [0,2,0,0,0,0|1,0,1]=4 1425 B6R0.3 CN[C@H](C)C(=O)O MCULE-9709122579 [0,2,0,0,0,0|1,0,1]=4 1426 B6R0.3 COC(=O)C(=N)N MCULE-3129647301 [0,2,0,0,0,0|2,0,0]=4 1427 B6R0.3 COC(=O)C(=N)N MCULE-4942451868 [0,2,0,0,0,0|2,0,0]=4 1428 B6R0.3 COC(=O)C(=O)C MCULE-5423483210 [0,2,0,0,0,0|1,0,0]=3 1429 B6R0.3 COC(=O)C(=O)Cl MCULE-1380456689 [0,2,0,0,0,0|1,0,0]=3 1430 B6R0.3 COC(=O)C(=O)O MCULE-8527842270 [0,2,0,0,0,0|1,0,0]=3 1431 B6R0.3 COC(=O)C(=O)[O-] MCULE-5187907456 [0,2,0,0,0,0|1,0,0]=3 1432 B6R0.3 COC(=O)C(=S)N MCULE-8900860523 [0,2,0,0,0,0|1,1,0]=4 1433 B6R0.3 COC(Br)C(=O)C MCULE-1220922171 [0,2,0,0,0,0|1,0,1]=4 1434 B6R0.3 COC(Br)C(=O)O MCULE-9018983840 [0,2,0,0,0,0|1,0,1]=4 1435 B6R0.3 COC(C)C(=O)C MCULE-8058502137 [0,2,0,0,0,0|1,0,1]=4 1436 B6R0.3 COC(C)C(=O)N MCULE-5955494048 [0,2,0,0,0,0|1,0,1]=4 1437 B6R0.3 COC(C)C(=O)O MCULE-8913745653 [0,2,0,0,0,0|1,0,1]=4 1438 B6R0.3 CON(C)C(=O)C MCULE-8559238750 [0,2,0,0,0,0|2,0,0]=4 1439 B6R0.3 CON(C)C(=O)Cl MCULE-7217619495 [0,2,0,0,0,0|2,0,0]=4 1440 B6R0.3 CO[C@@H](C)C(=O)Cl MCULE-9335923061 [0,2,0,0,0,0|1,0,1]=4 1441 B6R0.3 CO[C@@H](C)C(=O)O MCULE-7456458246 [0,2,0,0,0,0|1,0,1]=4 1442 B6R0.3 CO[C@@H](C)C(=O)O MCULE-8108977564 [0,2,0,0,0,0|1,0,1]=4 1443 B6R0.3 CO[C@H](C)C(=O)O MCULE-3078851913 [0,2,0,0,0,0|1,0,1]=4 1444 B6R0.3 CO[C@H](C)C(=O)O MCULE-5370950850 [0,2,0,0,0,0|1,0,1]=4 1445 B6R0.3 CSC(C)C(=O)C MCULE-8567808254 [0,2,0,0,0,0|1,0,1]=4 1446 B6R0.3 CSC(C)C(=O)O MCULE-8062487948 [0,2,0,0,0,0|1,0,1]=4 1447 B6R0.3 NC(=O)/C(=N/O)/N MCULE-6909019905 [0,2,0,0,0,0|2,0,0]=4 1448 B6R0.3 NNC(=O)C(=O)N MCULE-5080628360 [0,2,0,0,0,0|2,0,0]=4 1449 B6R0.3 O=C(Cl)/C(=C/Cl)/Cl MCULE-1765210878 [0,2,0,0,0,0|1,0,0]=3 1450 B6R0.3 O=C(Cl)C(=O)CBr MCULE-1637788630 [0,2,0,0,0,0|1,0,1]=4 1451 B6R0.3 O=C(O)/C(=C/Cl)/Cl MCULE-4317518344 [0,2,0,0,0,0|1,0,0]=3 1452 B6R0.3 O=C(O)C(=CCl)Cl MCULE-2693859334 [0,2,0,0,0,0|1,0,0]=3 1453 B6R0.3 O=C(O)C(=O)CBr MCULE-4768170572 [0,2,0,0,0,0|1,0,1]=4 1454 B6R0.3 O=C(O)C(=O)CCl MCULE-7853426045 [0,2,0,0,0,0|1,0,1]=4 1455 B6R0.3 O=C(O)C(=O)CF MCULE-5884987827 [0,2,0,0,0,0|1,0,1]=4 1456 B6R0.3 O=C(O)C(=O)CO MCULE-2263002631 [0,2,0,0,0,0|1,0,1]=4 1457 B6R0.3 O=C(O)C(=O)CS MCULE-7466669113 [0,2,0,0,0,0|1,0,1]=4 1458 B6R0.3 O=C([O-])C(=O)CF MCULE-9109967389 [0,2,0,0,0,0|1,0,1]=4 1459 B6R0.3 O=C([O-])C(=O)CS MCULE-4375165973 [0,2,0,0,0,0|1,0,1]=4 1460 B6R0.3 [C@@H](N)(C=C)C(=O)O MCULE-9406839633 [0,2,0,0,0,0|0,0,2]=4 1461 B6R0.3 [C@H](C)(NC)C(=O)O MCULE-3677465746 [0,2,0,0,0,0|1,0,1]=4 1462 B6R0.3 [C@H](S)(CC)C(=O)O MCULE-4267293279 [0,2,0,0,0,0|0,0,2]=4 1463 B6R0.4 C#CC=CC(C)C MCULE-6714802798 [0,2,0,0,0,0|1,0,1]=4 1464 B6R0.4 C/C=C/CC(=O)Cl MCULE-5377125313 [0,2,0,0,0,0|0,0,0]=2 1465 B6R0.4 C/C=C/CC(=O)N MCULE-1942934157 [0,2,0,0,0,0|0,0,0]=2 1466 B6R0.4 C/C=C/CC(=O)O MCULE-4626577048 [0,2,0,0,0,0|0,0,0]=2 1467 B6R0.4 C/C=N/NC(=O)N MCULE-5855402964 [0,2,0,0,0,0|1,0,0]=3 1468 B6R0.4 C=C/C=C/C(=O)O MCULE-7975593411 [0,2,0,0,0,0|0,0,1]=3 1469 B6R0.4 C=C=CCC(=O)O MCULE-2611659307 [0,2,0,0,0,0|0,0,2]=4 1470 B6R0.4 C=CC=CC(=O)Cl MCULE-6383997047 [0,2,0,0,0,0|0,0,1]=3 1471 B6R0.4 C=CC=CC(=O)O MCULE-5189540617 [0,2,0,0,0,0|0,0,1]=3 1472 B6R0.4 C=CCCC(=C)C MCULE-2323382963 [0,2,0,0,0,0|1,0,1]=4 1473 B6R0.4 C=CCCC(=O)C MCULE-9598399930 [0,2,0,0,0,0|0,0,2]=4 1474 B6R0.4 C=CCCC(=O)Cl MCULE-7378353157 [0,2,0,0,0,0|0,0,2]=4 1475 B6R0.4 C=CCCC(=O)N MCULE-7202462484 [0,2,0,0,0,0|0,0,2]=4 1476 B6R0.4 C=CCCC(=O)O MCULE-6221951425 [0,2,0,0,0,0|0,0,2]=4 1477 B6R0.4 C=CCNC(=O)C MCULE-7903624915 [0,2,0,0,0,0|0,0,2]=4 1478 B6R0.4 C=CCNC(=O)N MCULE-1210131291 [0,2,0,0,0,0|0,0,2]=4 1479 B6R0.4 C=CCOC(=O)C MCULE-9991130828 [0,2,0,0,0,0|0,0,2]=4 1480 B6R0.4 C=CCOC(=O)Cl MCULE-3513251417 [0,2,0,0,0,0|0,0,2]=4 1481 B6R0.4 C=CCOC(=O)N MCULE-4119124558 [0,2,0,0,0,0|0,0,2]=4 1482 B6R0.4 C=CNCC(=O)O MCULE-5142273921 [0,2,0,0,0,0|0,0,2]=4 1483 B6R0.4 C=CON=C(C)C MCULE-5340817509 [0,2,0,0,0,0|2,0,0]=4 1484 B6R0.4 CC#CCC(=O)O MCULE-8576178825 [0,2,0,0,0,0|0,0,2]=4 1485 B6R0.4 CC(=CCC#N)C MCULE-1406666578 [0,2,0,0,0,0|1,0,1]=4 1486 B6R0.4 CC(=CCCBr)C MCULE-9403575147 [0,2,0,0,0,0|1,0,1]=4 1487 B6R0.4 CC(=CCCN)C MCULE-9185531904 [0,2,0,0,0,0|1,0,1]=4 1488 B6R0.4 CC(=CCCO)C MCULE-2493404466 [0,2,0,0,0,0|0,0,2]=4 1489 B6R0.4 CC(=CCCO)C MCULE-8497528596 [0,2,0,0,0,0|0,0,2]=4 1490 B6R0.4 CC(=NNC=O)C MCULE-6194074981 [0,2,0,0,0,0|1,0,0]=3 1491 B6R0.4 CC(=O)CCC=O MCULE-4767690464 [0,2,0,0,0,0|0,0,1]=3 1492 B6R0.4 CC(=O)CCCBr MCULE-7143092097 [0,2,0,0,0,0|0,0,2]=4 1493 B6R0.4 CC(=O)CCCCl MCULE-7158553745 [0,2,0,0,0,0|0,0,2]=4 1494 B6R0.4 CC(=O)CCCO MCULE-1335342150 [0,2,0,0,0,0|0,0,2]=4 1495 B6R0.4 CC(=O)NCCCl MCULE-7865062188 [0,2,0,0,0,0|1,0,1]=4 1496 B6R0.4 CC(=O)NCCN MCULE-2230084818 [0,2,0,0,0,0|1,0,1]=4 1497 B6R0.4 CC(=O)NCCO MCULE-5968518415 [0,2,0,0,0,0|1,0,1]=4 1498 B6R0.4 CC(=O)NCCS MCULE-3345813615 [0,2,0,0,0,0|1,0,1]=4 1499 B6R0.4 CC(=O)OCCBr MCULE-3760449773 [0,2,0,0,0,0|1,0,1]=4 1500 B6R0.4 CC(=O)OCCCl MCULE-4570139017 [0,2,0,0,0,0|1,0,1]=4 1501 B6R0.4 CC(=O)OCCN MCULE-4530529900 [0,2,0,0,0,0|1,0,1]=4 1502 B6R0.4 CC(=O)OCCN MCULE-6854340494 [0,2,0,0,0,0|1,0,1]=4 1503 B6R0.4 CC(=O)OCCO MCULE-1251660436 [0,2,0,0,0,0|1,0,1]=4 1504 B6R0.4 CC(=O)SCCBr MCULE-1786480878 [0,2,0,0,0,0|1,0,1]=4 1505 B6R0.4 CC(=O)SCCN MCULE-3819903256 [0,2,0,0,0,0|1,0,1]=4 1506 B6R0.4 CC(=O)SCCN MCULE-4872130470 [0,2,0,0,0,0|1,0,1]=4 1507 B6R0.4 CC(=O)SCCN MCULE-7084821345 [0,2,0,0,0,0|1,0,1]=4 1508 B6R0.4 CC(C)C=CC=O MCULE-5034551905 [0,2,0,0,0,0|0,0,0]=2 1509 B6R0.4 CC(C)C=CCBr MCULE-9812152361 [0,2,0,0,0,0|1,0,1]=4 1510 B6R0.4 CC(C)CCC=O MCULE-9664145623 [0,2,0,0,0,0|0,0,2]=4 1511 B6R0.4 CC(C)CNC=O MCULE-2156996206 [0,2,0,0,0,0|0,0,2]=4 1512 B6R0.4 CC(C)COC=O MCULE-8234906771 [0,2,0,0,0,0|0,0,2]=4 1513 B6R0.4 CC(C)OCC=O MCULE-5974054323 [0,2,0,0,0,0|0,0,2]=4 1514 B6R0.4 CC(C)SCC=O MCULE-3174965592 [0,2,0,0,0,0|0,0,2]=4 1515 B6R0.4 CC/C=C/C(=N)N MCULE-7871697378 [0,2,0,0,0,0|1,0,0]=3 1516 B6R0.4 CC/C=C/C(=N)N MCULE-9276291098 [0,2,0,0,0,0|1,0,0]=3 1517 B6R0.4 CC/C=C/C(=O)Cl MCULE-8929214872 [0,2,0,0,0,0|0,0,0]=2 1518 B6R0.4 CC/C=C/C(=O)O MCULE-4888215476 [0,2,0,0,0,0|0,0,0]=2 1519 B6R0.4 CC=CCC(=O)O MCULE-9174714653 [0,2,0,0,0,0|0,0,0]=2 1520 B6R0.4 CC=CCC(C)C MCULE-7145682250 [0,2,0,0,0,0|1,0,1]=4 1521 B6R0.4 CC=NNC(=O)N MCULE-3878774235 [0,2,0,0,0,0|1,0,0]=3 1522 B6R0.4 CC=NNC(=S)N MCULE-3128372277 [0,2,0,0,0,0|1,1,0]=4 1523 B6R0.4 CCC#CC(=O)C MCULE-7788224704 [0,2,0,0,0,0|0,0,2]=4 1524 B6R0.4 CCC#CC(=O)O MCULE-1053283381 [0,2,0,0,0,0|0,0,2]=4 1525 B6R0.4 CCC=CB(O)O MCULE-6166989227 [0,2,0,0,0,0|0,0,2]=4 1526 B6R0.4 CCC=CC(=O)C MCULE-2986269826 [0,2,0,0,0,0|0,0,0]=2 1527 B6R0.4 CCC=CC(=O)Cl MCULE-5159865849 [0,2,0,0,0,0|0,0,0]=2 1528 B6R0.4 CCC=CC(=O)O MCULE-3920494238 [0,2,0,0,0,0|0,0,0]=2 1529 B6R0.4 CCCC=C(C)C MCULE-2110588796 [0,2,0,0,0,0|1,0,1]=4 1530 B6R0.4 CCCCC(=O)Br MCULE-2980405081 [0,2,0,0,0,0|0,0,2]=4 1531 B6R0.4 CCCCC(=O)C MCULE-3554390184 [0,2,0,0,0,0|0,0,2]=4 1532 B6R0.4 CCCCC(=O)Cl MCULE-3875407102 [0,2,0,0,0,0|0,0,2]=4 1533 B6R0.4 CCCCC(=O)N MCULE-6419483436 [0,2,0,0,0,0|0,0,2]=4 1534 B6R0.4 CCCCC(=O)O MCULE-2333640078 [0,2,0,0,0,0|0,0,2]=4 1535 B6R0.4 CCCCC(=O)[O-] MCULE-4817107962 [0,2,0,0,0,0|0,0,2]=4 1536 B6R0.4 CCCNC(=O)C MCULE-5899703886 [0,2,0,0,0,0|0,0,2]=4 1537 B6R0.4 CCCNC(=O)Cl MCULE-2937184966 [0,2,0,0,0,0|0,0,2]=4 1538 B6R0.4 CCCNC(=O)N MCULE-8528844765 [0,2,0,0,0,0|0,0,2]=4 1539 B6R0.4 CCCOC(=O)C MCULE-7327042566 [0,2,0,0,0,0|0,0,2]=4 1540 B6R0.4 CCCOC(=O)Cl MCULE-1312686139 [0,2,0,0,0,0|0,0,2]=4 1541 B6R0.4 CCCOC(=O)N MCULE-2760622567 [0,2,0,0,0,0|0,0,2]=4 1542 B6R0.4 CCCSC(=O)C MCULE-4329646671 [0,2,0,0,0,0|0,0,2]=4 1543 B6R0.4 CCCSC(=O)Cl MCULE-5971141999 [0,2,0,0,0,0|0,0,2]=4 1544 B6R0.4 CCNCC(=O)C MCULE-5799315547 [0,2,0,0,0,0|0,0,2]=4 1545 B6R0.4 CCNCC(=O)C MCULE-9258294157 [0,2,0,0,0,0|0,0,2]=4 1546 B6R0.4 CCNCC(=O)N MCULE-1787248899 [0,2,0,0,0,0|0,0,2]=4 1547 B6R0.4 CCNCC(=O)N MCULE-3821700273 [0,2,0,0,0,0|0,0,2]=4 1548 B6R0.4 CCNCC(=O)O MCULE-5989480216 [0,2,0,0,0,0|0,0,2]=4 1549 B6R0.4 CCNCC(=O)O MCULE-8087863397 [0,2,0,0,0,0|0,0,2]=4 1550 B6R0.4 CCOCC(=O)C MCULE-2825677443 [0,2,0,0,0,0|0,0,2]=4 1551 B6R0.4 CCOCC(=O)Cl MCULE-2172268229 [0,2,0,0,0,0|0,0,2]=4 1552 B6R0.4 CCOCC(=O)O MCULE-1726530898 [0,2,0,0,0,0|0,0,2]=4 1553 B6R0.4 CCSCC(=O)C MCULE-9872082780 [0,2,0,0,0,0|0,0,2]=4 1554 B6R0.4 CCSCC(=O)O MCULE-7471335718 [0,2,0,0,0,0|0,0,2]=4 1555 B6R0.4 CN(C)/C=C/C#N MCULE-6362841128 [0,2,0,0,0,0|1,0,1]=4 1556 B6R0.4 CN(C)/C=C/C=O MCULE-2048385164 [0,2,0,0,0,0|0,0,0]=2 1557 B6R0.4 CN(C)C=CC#N MCULE-7232815292 [0,2,0,0,0,0|1,0,1]=4 1558 B6R0.4 CN(C)C=CC=O MCULE-3308636651 [0,2,0,0,0,0|0,0,0]=2 1559 B6R0.4 CN(C)CCC=O MCULE-6830649526 [0,2,0,0,0,0|0,0,2]=4 1560 B6R0.4 CNCCC(=O)N MCULE-1118876220 [0,2,0,0,0,0|0,0,2]=4 1561 B6R0.4 CNCCC(=O)N MCULE-6679713144 [0,2,0,0,0,0|0,0,2]=4 1562 B6R0.4 CNCCC(=O)O MCULE-3627988097 [0,2,0,0,0,0|0,0,2]=4 1563 B6R0.4 CNCCC(=O)O MCULE-9858204248 [0,2,0,0,0,0|0,0,2]=4 1564 B6R0.4 CO/C=C/C(=O)C MCULE-1215649803 [0,2,0,0,0,0|0,0,0]=2 1565 B6R0.4 CO/C=C/C(=O)O MCULE-3681049176 [0,2,0,0,0,0|0,0,0]=2 1566 B6R0.4 COC=CC(=O)C MCULE-4868833764 [0,2,0,0,0,0|0,0,0]=2 1567 B6R0.4 COC=CC(=O)Cl MCULE-4966577139 [0,2,0,0,0,0|0,0,0]=2 1568 B6R0.4 COC=CC(=O)O MCULE-4252899122 [0,2,0,0,0,0|0,0,0]=2 1569 B6R0.4 COCCC(=O)C MCULE-5939812376 [0,2,0,0,0,0|0,0,2]=4 1570 B6R0.4 COCCC(=O)Cl MCULE-9454266286 [0,2,0,0,0,0|0,0,2]=4 1571 B6R0.4 COCCC(=O)N MCULE-7556483675 [0,2,0,0,0,0|0,0,2]=4 1572 B6R0.4 COCCC(=O)O MCULE-3436347115 [0,2,0,0,0,0|0,0,2]=4 1573 B6R0.4 COCNC(=O)N MCULE-8367032240 [0,2,0,0,0,0|1,0,1]=4 1574 B6R0.4 COCOC(=O)C MCULE-8876091916 [0,2,0,0,0,0|1,0,1]=4 1575 B6R0.4 CON=CC(=O)O MCULE-6800819509 [0,2,0,0,0,0|1,0,0]=3 1576 B6R0.4 CSCCC(=O)C MCULE-6178663156 [0,2,0,0,0,0|0,0,2]=4 1577 B6R0.4 CSCCC(=O)Cl MCULE-9732512141 [0,2,0,0,0,0|0,0,2]=4 1578 B6R0.4 CSCCC(=O)N MCULE-7105035733 [0,2,0,0,0,0|0,0,2]=4 1579 B6R0.4 CSCCC(=O)O MCULE-9550032941 [0,2,0,0,0,0|0,0,2]=4 1580 B6R0.4 CSCOC(=O)C MCULE-1498769347 [0,2,0,0,0,0|1,0,1]=4 1581 B6R0.4 CSSCC(=O)O MCULE-5829510166 [0,2,0,0,0,0|1,0,1]=4 1582 B6R0.4 FC(=CCCBr)F MCULE-2616028843 [0,2,0,0,0,0|1,0,1]=4 1583 B6R0.4 FC(=CCCCl)F MCULE-2193644602 [0,2,0,0,0,0|1,0,1]=4 1584 B6R0.4 N#CC=CC(=O)O MCULE-9790502930 [0,2,0,0,0,0|0,0,1]=3 1585 B6R0.4 N/N=C/NC(=O)N MCULE-6272806279 [0,2,0,0,0,0|2,0,0]=4 1586 B6R0.4 N/N=C/NC(=O)N MCULE-7518775080 [0,2,0,0,0,0|2,0,0]=4 1587 B6R0.4 NC(=O)CCCCl MCULE-2774705212 [0,2,0,0,0,0|0,0,2]=4 1588 B6R0.4 NC(=O)CCCO MCULE-3779341561 [0,2,0,0,0,0|0,0,2]=4 1589 B6R0.4 NC(=O)NCCCl MCULE-6117142945 [0,2,0,0,0,0|1,0,1]=4 1590 B6R0.4 NC(=O)NCCF MCULE-9526714989 [0,2,0,0,0,0|1,0,1]=4 1591 B6R0.4 NC(=O)NCCO MCULE-2353513655 [0,2,0,0,0,0|1,0,1]=4 1592 B6R0.4 NC(=O)OCCCl MCULE-4259077420 [0,2,0,0,0,0|1,0,1]=4 1593 B6R0.4 NC(=O)OCCO MCULE-7565460845 [0,2,0,0,0,0|1,0,1]=4 1594 B6R0.4 NC(=S)NNC=O MCULE-5309261345 [0,2,0,0,0,0|2,0,0]=4 1595 B6R0.4 NC/C=C/C(=O)O MCULE-1249244912 [0,2,0,0,0,0|0,0,0]=2 1596 B6R0.4 NCC#CC(=O)O MCULE-8511125702 [0,2,0,0,0,0|0,0,2]=4 1597 B6R0.4 NCC=CC(=O)O MCULE-3049811576 [0,2,0,0,0,0|0,0,0]=2 1598 B6R0.4 NCC=CC(=O)O MCULE-5171717036 [0,2,0,0,0,0|0,0,0]=2 1599 B6R0.4 NCCCC(=O)Cl MCULE-1312882775 [0,2,0,0,0,0|0,0,2]=4 1600 B6R0.4 NCCCC(=O)Cl MCULE-6405362906 [0,2,0,0,0,0|0,0,2]=4 1601 B6R0.4 NCCCC(=O)N MCULE-8039142092 [0,2,0,0,0,0|0,0,2]=4 1602 B6R0.4 NCCCC(=O)N MCULE-8262250872 [0,2,0,0,0,0|0,0,2]=4 1603 B6R0.4 NCCCC(=O)O MCULE-3615304273 [0,2,0,0,0,0|0,0,2]=4 1604 B6R0.4 NCCCC(=O)O MCULE-7613134021 [0,2,0,0,0,0|0,0,2]=4 1605 B6R0.4 NCCNC(=O)N MCULE-1197396950 [0,2,0,0,0,0|1,0,1]=4 1606 B6R0.4 NCCNC(=O)N MCULE-2171700183 [0,2,0,0,0,0|1,0,1]=4 1607 B6R0.4 NCCNC(=O)N MCULE-3799764813 [0,2,0,0,0,0|1,0,1]=4 1608 B6R0.4 NCCOC(=O)N MCULE-4144808257 [0,2,0,0,0,0|1,0,1]=4 1609 B6R0.4 NCCOC(=O)N MCULE-5815053840 [0,2,0,0,0,0|1,0,1]=4 1610 B6R0.4 O=C(Cl)CCCBr MCULE-1389049838 [0,2,0,0,0,0|0,0,2]=4 1611 B6R0.4 O=C(Cl)CCCCl MCULE-5885932072 [0,2,0,0,0,0|0,0,2]=4 1612 B6R0.4 O=C(Cl)OCCBr MCULE-6758010852 [0,2,0,0,0,0|1,0,1]=4 1613 B6R0.4 O=C(Cl)OCCCl MCULE-1505786385 [0,2,0,0,0,0|1,0,1]=4 1614 B6R0.4 O=C(Cl)OCCF MCULE-5233366139 [0,2,0,0,0,0|1,0,1]=4 1615 B6R0.4 O=C(O)/C=C/CBr MCULE-2012997584 [0,2,0,0,0,0|0,0,0]=2 1616 B6R0.4 O=C(O)/C=C/CCl MCULE-5651159998 [0,2,0,0,0,0|0,0,0]=2 1617 B6R0.4 O=C(O)/C=C/CO MCULE-1612823053 [0,2,0,0,0,0|0,0,0]=2 1618 B6R0.4 O=C(O)C#CCCl MCULE-6341675394 [0,2,0,0,0,0|0,0,2]=4 1619 B6R0.4 O=C(O)C#CCF MCULE-8744045229 [0,2,0,0,0,0|0,0,2]=4 1620 B6R0.4 O=C(O)C#CCO MCULE-1849362182 [0,2,0,0,0,0|0,0,2]=4 1621 B6R0.4 O=C(O)C=CCBr MCULE-3029375430 [0,2,0,0,0,0|0,0,0]=2 1622 B6R0.4 O=C(O)C=CCCl MCULE-1050913038 [0,2,0,0,0,0|0,0,0]=2 1623 B6R0.4 O=C(O)C=CCO MCULE-3375515425 [0,2,0,0,0,0|0,0,0]=2 1624 B6R0.4 O=C(O)CCCBr MCULE-5669825022 [0,2,0,0,0,0|0,0,2]=4 1625 B6R0.4 O=C(O)CCCCl MCULE-7721427391 [0,2,0,0,0,0|0,0,2]=4 1626 B6R0.4 O=C(O)CCCF MCULE-2415675768 [0,2,0,0,0,0|0,0,2]=4 1627 B6R0.4 O=C(O)CCCI MCULE-7794841553 [0,2,0,0,0,0|0,0,2]=4 1628 B6R0.4 O=C(O)CCCS MCULE-3352840152 [0,2,0,0,0,0|0,0,2]=4 1629 B6R0.4 O=C(O)CNCO MCULE-4092998319 [0,2,0,0,0,0|1,0,1]=4 1630 B6R0.4 O=C([O-])CCCCl MCULE-4131322715 [0,2,0,0,0,0|0,0,2]=4 1631 B6R0.4 O=C([O-])CNCO MCULE-2804068565 [0,2,0,0,0,0|1,0,1]=4 1632 B6R0.4 O=CC=CB(O)O MCULE-4655446000 [0,2,0,0,0,0|1,0,0]=3 1633 B6R0.4 O=CCCC(=O)O MCULE-7183864722 [0,2,0,0,0,0|1,0,1]=4 1634 B6R0.4 O=CCCC(F)F MCULE-4743402824 [0,2,0,0,0,0|0,0,2]=4 1635 B6R0.4 O=CNCC(=O)O MCULE-3251128290 [0,2,0,0,0,0|1,0,1]=4 1636 B6R0.4 OB(O)/C=C/CCl MCULE-9221515028 [0,2,0,0,0,0|1,0,1]=4 1637 B6R0.4 OB(O)C=CCCl MCULE-3662189757 [0,2,0,0,0,0|1,0,1]=4 1638 B6R0.5 C/C=C/C(F)(F)F MCULE-2905049653 [0,2,0,0,0,0|1,0,1]=4 1639 B6R0.5 C/C=C/[B-](F)(F)F MCULE-3335611121 [0,2,0,0,0,0|2,0,0]=4 1640 B6R0.5 C/C=C/[B-](F)(F)F MCULE-4141205615 [0,2,0,0,0,0|2,0,0]=4 1641 B6R0.5 C/C=C\P(=O)(O)O MCULE-8382984782 [0,2,0,0,0,0|1,0,0]=3 1642 B6R0.5 C/C=C\[B-](F)(F)F MCULE-6788579856 [0,2,0,0,0,0|2,0,0]=4 1643 B6R0.5 C/C=C\[B-](F)(F)F MCULE-7047692338 [0,2,0,0,0,0|2,0,0]=4 1644 B6R0.5 CC(C)(C)CC=O MCULE-6726853595 [0,2,0,0,0,0|0,0,2]=4 1645 B6R0.5 CC(C)(C)NC=O MCULE-4474324800 [0,2,0,0,0,0|1,0,1]=4 1646 B6R0.5 CC(C)(C)OC=O MCULE-3317941666 [0,2,0,0,0,0|1,0,1]=4 1647 B6R0.5 CC=CC(F)(F)F MCULE-9621139720 [0,2,0,0,0,0|1,0,1]=4 1648 B6R0.5 CC=CP(=O)(O)O MCULE-3593796042 [0,2,0,0,0,0|1,0,0]=3 1649 B6R0.5 CC=CS(=O)(=O)Cl MCULE-2808966547 [0,2,0,0,0,0|1,0,0]=3 1650 B6R0.5 CC=C[B-](F)(F)F MCULE-1518170629 [0,2,0,0,0,0|2,0,0]=4 1651 B6R0.5 CC=C[B-](F)(F)F MCULE-4523990415 [0,2,0,0,0,0|2,0,0]=4 1652 B6R0.5 C[N+](C)(C)CC=O MCULE-1973623516 [0,2,0,0,0,0|1,0,1]=4 1653 B6R0.5 C[N+](C)(C)CC=O MCULE-6964542865 [0,2,0,0,0,0|1,0,1]=4 1654 B6R0.5 C[Si](C)(C)/C=C/Br MCULE-9830897857 [0,2,0,0,0,0|1,1,0]=4 1655 B6R0.5 C[Si](C)(C)/C=C/I MCULE-3087366011 [0,2,0,0,0,0|1,1,0]=4 1656 B6R0.5 C[Si](C)(C)C=CBr MCULE-7908301119 [0,2,0,0,0,0|1,1,0]=4 1657 B6R0.5 C[Si](C)(C)C=CI MCULE-2274079570 [0,2,0,0,0,0|1,1,0]=4 1658 B6R0.6 C#CCCCC=O MCULE-4075029417 [0,2,0,0,0,0|0,0,2]=4 1659 B6R0.6 C(=C/CCC)\CO MCULE-6491762150 [0,2,0,0,0,0|0,0,2]=4 1660 B6R0.6 C/C=C/C=C/C#N MCULE-3461215979 [0,2,0,0,0,0|1,0,0]=3 1661 B6R0.6 C/C=C/C=C/C=O MCULE-9837225903 [0,2,0,0,0,0|0,0,0]=2 1662 B6R0.6 C/C=C/C=C/CO MCULE-3717958585 [0,2,0,0,0,0|0,0,1]=3 1663 B6R0.6 C/C=C/CCCC MCULE-6900331316 [0,2,0,0,0,0|1,0,1]=4 1664 B6R0.6 C/C=C/CCCO MCULE-9865436125 [0,2,0,0,0,0|0,0,2]=4 1665 B6R0.6 C/C=C\CCCC MCULE-8426867799 [0,2,0,0,0,0|1,0,1]=4 1666 B6R0.6 C/C=C\CCCO MCULE-3169839661 [0,2,0,0,0,0|0,0,2]=4 1667 B6R0.6 C=CC=CCCBr MCULE-8528821525 [0,2,0,0,0,0|1,0,0]=3 1668 B6R0.6 C=CC=CCCN MCULE-8129949310 [0,2,0,0,0,0|1,0,0]=3 1669 B6R0.6 C=CC=CCCO MCULE-5956097722 [0,2,0,0,0,0|1,0,0]=3 1670 B6R0.6 C=CCC/C=C/C MCULE-3936427871 [0,2,0,0,0,0|1,0,0]=3 1671 B6R0.6 C=CCCC=CC MCULE-6481809840 [0,2,0,0,0,0|1,0,0]=3 1672 B6R0.6 C=CCCCC=O MCULE-8676840281 [0,2,0,0,0,0|0,0,2]=4 1673 B6R0.6 C=CCOCC=O MCULE-8507800253 [0,2,0,0,0,0|0,0,2]=4 1674 B6R0.6 CC/C=C/CCC MCULE-5222700461 [0,2,0,0,0,0|1,0,1]=4 1675 B6R0.6 CC/C=C/CCO MCULE-9853729917 [0,2,0,0,0,0|0,0,2]=4 1676 B6R0.6 CC/C=C\CC=O MCULE-1715953159 [0,2,0,0,0,0|0,0,0]=2 1677 B6R0.6 CC/C=C\CCO MCULE-9206958060 [0,2,0,0,0,0|0,0,2]=4 1678 B6R0.6 CC=CC=CC#N MCULE-2944741082 [0,2,0,0,0,0|1,0,0]=3 1679 B6R0.6 CC=CC=CC=O MCULE-7370101773 [0,2,0,0,0,0|0,0,0]=2 1680 B6R0.6 CC=CC=CCN MCULE-9780064235 [0,2,0,0,0,0|1,0,0]=3 1681 B6R0.6 CC=CC=CCO MCULE-1802738822 [0,2,0,0,0,0|0,0,1]=3 1682 B6R0.6 CC=CCCCBr MCULE-1109208969 [0,2,0,0,0,0|1,0,1]=4 1683 B6R0.6 CC=CCCCC MCULE-7277981733 [0,2,0,0,0,0|1,0,1]=4 1684 B6R0.6 CC=CCCCCl MCULE-7487798637 [0,2,0,0,0,0|1,0,1]=4 1685 B6R0.6 CC=CCCCO MCULE-1401303632 [0,2,0,0,0,0|0,0,2]=4 1686 B6R0.6 CC=CSCCC MCULE-3534082442 [0,2,0,0,0,0|1,0,1]=4 1687 B6R0.6 CCC#CCC=O MCULE-4049790039 [0,2,0,0,0,0|0,0,2]=4 1688 B6R0.6 CCC/C=C/C=O MCULE-3059768922 [0,2,0,0,0,0|0,0,0]=2 1689 B6R0.6 CCC=CCC=O MCULE-5764198290 [0,2,0,0,0,0|0,0,0]=2 1690 B6R0.6 CCC=CCCBr MCULE-7873583643 [0,2,0,0,0,0|1,0,1]=4 1691 B6R0.6 CCC=CCCC MCULE-3739501724 [0,2,0,0,0,0|1,0,1]=4 1692 B6R0.6 CCC=CCCI MCULE-9416216252 [0,2,0,0,0,0|1,0,1]=4 1693 B6R0.6 CCC=CCCO MCULE-1781375433 [0,2,0,0,0,0|0,0,2]=4 1694 B6R0.6 CCC=COCC MCULE-1991976030 [0,2,0,0,0,0|0,0,2]=4 1695 B6R0.6 CCCC=CC=O MCULE-5273169296 [0,2,0,0,0,0|0,0,0]=2 1696 B6R0.6 CCCC=CCBr MCULE-2474104566 [0,2,0,0,0,0|1,0,1]=4 1697 B6R0.6 CCCC=CCO MCULE-3204738641 [0,2,0,0,0,0|0,0,2]=4 1698 B6R0.6 CCCCCC=O MCULE-6770578514 [0,2,0,0,0,0|0,0,2]=4 1699 B6R0.6 CCCCNC=O MCULE-8821792924 [0,2,0,0,0,0|0,0,2]=4 1700 B6R0.6 CCCCOC=O MCULE-4633421026 [0,2,0,0,0,0|0,0,2]=4 1701 B6R0.6 CCO/C=C/C#N MCULE-4278586794 [0,2,0,0,0,0|1,0,1]=4 1702 B6R0.6 CCOC=CC#N MCULE-5002780993 [0,2,0,0,0,0|1,0,1]=4 1703 B6R0.6 CCOCCC=O MCULE-1664130148 [0,2,0,0,0,0|0,0,2]=4 1704 B6R0.6 CCSCCC=O MCULE-2493452950 [0,2,0,0,0,0|0,0,2]=4 1705 B6R0.6 COC=CCC#N MCULE-8939260341 [0,2,0,0,0,0|1,0,1]=4 1706 B6R0.6 COCCCC=O MCULE-2055914202 [0,2,0,0,0,0|0,0,2]=4 1707 B6R0.6 COCCNC=O MCULE-9003279073 [0,2,0,0,0,0|0,0,2]=4 1708 B6R0.6 CSCCCC=O MCULE-6353729217 [0,2,0,0,0,0|0,0,2]=4 1709 B6R0.6 N#CCC=CCO MCULE-6995751332 [0,2,0,0,0,0|0,0,2]=4 1710 B6R0.6 NCC=CCCN MCULE-5058870063 [0,2,0,0,0,0|1,0,1]=4 1711 B6R0.6 NCC=CCCN MCULE-6332692206 [0,2,0,0,0,0|1,0,1]=4 1712 B6R0.6 NCCCNC=O MCULE-9651299205 [0,2,0,0,0,0|0,0,2]=4 1713 B6R0.6 O=CC=CC=C[O-] MCULE-1735082795 [0,2,0,0,0,0|0,0,1]=3 1714 B6R0.6 O=CC=CC=C[O-] MCULE-1943976542 [0,2,0,0,0,0|0,0,1]=3 1715 B6R0.6 O=CCCCC=O MCULE-6802048757 [0,2,0,0,0,0|0,0,2]=4 1716 B6R0.6 O=CCCCCCl MCULE-1257670284 [0,2,0,0,0,0|0,0,2]=4 1717 B6R0.6 O=CCCCCO MCULE-7959082228 [0,2,0,0,0,0|0,0,2]=4 1718 B6R0.6 O=CNCCCO MCULE-7926485528 [0,2,0,0,0,0|0,0,2]=4 1719 B6R0.6 O=CNCNC=O MCULE-3123960034 [0,2,0,0,0,0|1,0,1]=4 1720 B6R0.8 CCC(Br)(Br)C=O MCULE-5893364801 [0,2,0,0,0,0|0,0,2]=4 1721 B6R0.8 CCC(C)(C)C=O MCULE-4902007320 [0,2,0,0,0,0|0,0,2]=4 1722 B6R0.8 CSC(C)(C)C=O MCULE-7777472638 [0,2,0,0,0,0|1,0,1]=4 1723 B6R0.8 O=CC(O)(O)C=O MCULE-5955049749 [0,2,0,0,0,0|1,0,1]=4 1724 B6R0.9 C/C=C(/C=O)\CC MCULE-4811305564 [0,2,0,0,0,0|0,0,0]=2 1725 B6R0.9 CC=C(C#N)C#N MCULE-3385318156 [0,2,0,0,0,0|1,0,1]=4 1726 B6R0.9 CC=C(C#N)CC MCULE-7873183675 [0,2,0,0,0,0|1,0,1]=4 1727 B6R0.9 CC=C(C=O)CC MCULE-3354209980 [0,2,0,0,0,0|0,0,0]=2 1728 B6R0.9 CC=C(CC)CC MCULE-5609717261 [0,2,0,0,0,0|1,0,1]=4 1729 B6R0.9 CCC(=CO)CC MCULE-4973169590 [0,2,0,0,0,0|0,0,2]=4 1730 B6R0.9 CCC(=CO)CC MCULE-8459100577 [0,2,0,0,0,0|0,0,2]=4 1731 B6R0.9 CCC(C=O)CC MCULE-3529464122 [0,2,0,0,0,0|0,0,2]=4 1732 B6R0.9 CCN(C=O)CC MCULE-9053231156 [0,2,0,0,0,0|1,0,1]=4 1733 B6R0.9 COC(C=O)OC MCULE-7354932286 [0,2,0,0,0,0|1,0,1]=4 1734 B6R0.9 N#CC(=CN)C=O MCULE-8372425513 [0,2,0,0,0,0|1,0,0]=3 1735 B6R0.9 O=CC(C=O)C=O MCULE-4159404366 [0,2,0,0,0,0|1,0,1]=4 1736 B6R1.2 BrC1=CC=CN1 MCULE-5264580992 [0,1,0,1,0,0|1,0,1]=4 1737 B6R1.2 BrC1=CC=CO1 MCULE-5734064318 [0,1,0,1,0,0|0,0,2]=4 1738 B6R1.2 BrC1=CC=CS1 MCULE-1364150691 [0,1,0,1,0,0|0,1,1]=4 1739 B6R1.2 BrC1=CC=C[Se]1 MCULE-9011330064 [0,1,0,1,0,0|0,1,1]=4 1740 B6R1.2 BrC1=CC=NN1 MCULE-9341716246 [0,1,0,1,0,0|2,0,0]=4 1741 B6R1.2 BrC1=CC=NO1 MCULE-9219362534 [0,1,0,1,0,0|1,0,1]=4 1742 B6R1.2 BrC1=CC=NS1 MCULE-2346915540 [0,1,0,1,0,0|1,1,0]=4 1743 B6R1.2 BrC1=CCCC1 MCULE-1008379150 [0,1,0,1,0,0|1,0,1]=4 1744 B6R1.2 BrC1=CN=CO1 MCULE-5651145478 [0,1,0,1,0,0|1,0,1]=4 1745 B6R1.2 BrC1=CN=CO1 MCULE-8656599411 [0,1,0,1,0,0|1,0,1]=4 1746 B6R1.2 BrC1=CN=CS1 MCULE-2394006568 [0,1,0,1,0,0|1,1,0]=4 1747 B6R1.2 BrC1=CNC=C1 MCULE-2704154564 [0,1,0,1,0,0|1,0,1]=4 1748 B6R1.2 BrC1=CNC=N1 MCULE-7584078883 [0,1,0,1,0,0|2,0,0]=4 1749 B6R1.2 BrC1=CNN=C1 MCULE-2600716492 [0,1,0,1,0,0|2,0,0]=4 1750 B6R1.2 BrC1=COC=C1 MCULE-7282301463 [0,1,0,1,0,0|0,0,2]=4 1751 B6R1.2 BrC1=COC=N1 MCULE-3389578396 [0,1,0,1,0,0|2,0,0]=4 1752 B6R1.2 BrC1=COC=N1 MCULE-5006735396 [0,1,0,1,0,0|2,0,0]=4 1753 B6R1.2 BrC1=COCC1 MCULE-8057569313 [0,1,0,1,0,0|0,0,2]=4 1754 B6R1.2 BrC1=CON=C1 MCULE-7025802564 [0,1,0,1,0,0|1,0,1]=4 1755 B6R1.2 BrC1=CSC=C1 MCULE-6680927224 [0,1,0,1,0,0|0,1,1]=4 1756 B6R1.2 BrC1=CSC=N1 MCULE-6952917931 [0,1,0,1,0,0|2,0,0]=4 1757 B6R1.2 BrC1=CSN=C1 MCULE-2285235944 [0,1,0,1,0,0|1,1,0]=4 1758 B6R1.2 BrC1=NC=CN1 MCULE-6985395799 [0,1,0,1,0,0|2,0,0]=4 1759 B6R1.2 BrC1=NC=CN1 MCULE-8632789036 [0,1,0,1,0,0|2,0,0]=4 1760 B6R1.2 BrC1=NC=CO1 MCULE-2104886923 [0,1,0,1,0,0|1,0,1]=4 1761 B6R1.2 BrC1=NC=CO1 MCULE-2745860961 [0,1,0,1,0,0|1,0,1]=4 1762 B6R1.2 BrC1=NC=CS1 MCULE-9214561330 [0,1,0,1,0,0|1,1,0]=4 1763 B6R1.2 BrC1=NOC=C1 MCULE-1786338778 [0,1,0,1,0,0|1,0,1]=4 1764 B6R1.2 BrC1=NSC=C1 MCULE-5948625316 [0,1,0,1,0,0|1,1,0]=4 1765 B6R1.2 BrC1CC=CC1 MCULE-8834603275 [0,1,0,1,0,0|1,0,1]=4 1766 B6R1.2 BrN1CC=CS1 MCULE-6872896536 [0,1,0,1,0,0|2,0,0]=4 1767 B6R1.2 CC1=CC=CC1 MCULE-3765599626 [0,1,0,1,0,0|1,0,0]=3 1768 B6R1.2 CC1=CC=CN1 MCULE-7608248575 [0,1,0,1,0,0|1,0,0]=3 1769 B6R1.2 CC1=CC=CO1 MCULE-3620289319 [0,1,0,1,0,0|0,0,1]=3 1770 B6R1.2 CC1=CC=CS1 MCULE-7297776024 [0,1,0,1,0,0|0,1,0]=3 1771 B6R1.2 CC1=CC=NN1 MCULE-1457877312 [0,1,0,1,0,0|1,0,0]=3 1772 B6R1.2 CC1=CC=NN1 MCULE-3441401586 [0,1,0,1,0,0|1,0,0]=3 1773 B6R1.2 CC1=CC=NO1 MCULE-3188314923 [0,1,0,1,0,0|0,0,1]=3 1774 B6R1.2 CC1=CC=NS1 MCULE-4163670775 [0,1,0,1,0,0|0,1,0]=3 1775 B6R1.2 CC1=CCCC1 MCULE-8508688474 [0,1,0,1,0,0|1,0,1]=4 1776 B6R1.2 CC1=CCCO1 MCULE-7276659214 [0,1,0,1,0,0|0,0,2]=4 1777 B6R1.2 CC1=CCNC1 MCULE-5892113847 [0,1,0,1,0,0|1,0,1]=4 1778 B6R1.2 CC1=CCNC1 MCULE-9225220351 [0,1,0,1,0,0|1,0,1]=4 1779 B6R1.2 CC1=CN=CO1 MCULE-4609626879 [0,1,0,1,0,0|0,0,1]=3 1780 B6R1.2 CC1=CN=CS1 MCULE-8510377651 [0,1,0,1,0,0|0,1,0]=3 1781 B6R1.2 CC1=CN=NS1 MCULE-3290022680 [0,1,0,1,0,0|1,1,0]=4 1782 B6R1.2 CC1=CNC=C1 MCULE-9114555776 [0,1,0,1,0,0|1,0,0]=3 1783 B6R1.2 CC1=CNC=N1 MCULE-9375719449 [0,1,0,1,0,0|1,0,0]=3 1784 B6R1.2 CC1=CNN=C1 MCULE-2732751720 [0,1,0,1,0,0|2,0,0]=4 1785 B6R1.2 CC1=CNN=C1 MCULE-3538959589 [0,1,0,1,0,0|2,0,0]=4 1786 B6R1.2 CC1=CNN=N1 MCULE-2819973344 [0,1,0,1,0,0|2,0,0]=4 1787 B6R1.2 CC1=COC=C1 MCULE-1597223627 [0,1,0,1,0,0|0,0,1]=3 1788 B6R1.2 CC1=COC=N1 MCULE-3497089982 [0,1,0,1,0,0|1,0,0]=3 1789 B6R1.2 CC1=CON=C1 MCULE-4312100714 [0,1,0,1,0,0|1,0,1]=4 1790 B6R1.2 CC1=CSC=C1 MCULE-1408158529 [0,1,0,1,0,0|0,1,0]=3 1791 B6R1.2 CC1=CSC=N1 MCULE-3711308900 [0,1,0,1,0,0|1,0,0]=3 1792 B6R1.2 CC1=CSN=C1 MCULE-2603580928 [0,1,0,1,0,0|1,1,0]=4 1793 B6R1.2 CC1=CSN=N1 MCULE-9634894252 [0,1,0,1,0,0|2,0,0]=4 1794 B6R1.2 CC1=NC=CN1 MCULE-4484196639 [0,1,0,1,0,0|1,0,0]=3 1795 B6R1.2 CC1=NC=CO1 MCULE-7894525701 [0,1,0,1,0,0|0,0,1]=3 1796 B6R1.2 CC1=NC=CS1 MCULE-6863408892 [0,1,0,1,0,0|0,1,0]=3 1797 B6R1.2 CC1=NN=CN1 MCULE-4297826922 [0,1,0,1,0,0|2,0,0]=4 1798 B6R1.2 CC1=NN=CO1 MCULE-5138394000 [0,1,0,1,0,0|1,0,1]=4 1799 B6R1.2 CC1=NN=CS1 MCULE-5068390093 [0,1,0,1,0,0|1,1,0]=4 1800 B6R1.2 CC1=NOC=C1 MCULE-1572732397 [0,1,0,1,0,0|0,0,1]=3 1801 B6R1.2 CC1=NOC=N1 MCULE-5841548711 [0,1,0,1,0,0|1,0,1]=4 1802 B6R1.2 CC1=NON=C1 MCULE-7563934145 [0,1,0,1,0,0|1,0,1]=4 1803 B6R1.2 CC1=NSC=C1 MCULE-6941128185 [0,1,0,1,0,0|0,1,0]=3 1804 B6R1.2 CC1=NSN=C1 MCULE-8318780980 [0,1,0,1,0,0|1,1,0]=4 1805 B6R1.2 CC1C=CCC1 MCULE-1638534048 [0,1,0,1,0,0|1,0,1]=4 1806 B6R1.2 CN1C=CC=C1 MCULE-4929965979 [0,1,0,1,0,0|1,0,0]=3 1807 B6R1.2 CN1C=CC=N1 MCULE-9409141633 [0,1,0,1,0,0|1,0,0]=3 1808 B6R1.2 CN1C=CN=C1 MCULE-1468573178 [0,1,0,1,0,0|2,0,0]=4 1809 B6R1.2 CN1C=CN=C1 MCULE-1857627459 [0,1,0,1,0,0|2,0,0]=4 1810 B6R1.2 CN1C=CN=C1 MCULE-3087755909 [0,1,0,1,0,0|2,0,0]=4 1811 B6R1.2 CN1C=CN=C1 MCULE-7326970566 [0,1,0,1,0,0|2,0,0]=4 1812 B6R1.2 CN1C=CN=C1 MCULE-7347723440 [0,1,0,1,0,0|2,0,0]=4 1813 B6R1.2 CN1C=CN=N1 MCULE-5243651327 [0,1,0,1,0,0|2,0,0]=4 1814 B6R1.2 CN1C=C[NH+]=C1 MCULE-1511454799 [0,1,0,1,0,0|2,0,0]=4 1815 B6R1.2 CN1C=NC=N1 MCULE-7058833727 [0,1,0,1,0,0|2,0,0]=4 1816 B6R1.2 CN1CC=CC1 MCULE-2586884916 [0,1,0,1,0,0|1,0,1]=4 1817 B6R1.2 ClC1=CC=CO1 MCULE-3538307465 [0,1,0,1,0,0|0,0,2]=4 1818 B6R1.2 ClC1=CC=CS1 MCULE-2640438050 [0,1,0,1,0,0|0,1,1]=4 1819 B6R1.2 ClC1=CC=NN1 MCULE-3560728451 [0,1,0,1,0,0|2,0,0]=4 1820 B6R1.2 ClC1=CCCC1 MCULE-7680993065 [0,1,0,1,0,0|1,0,1]=4 1821 B6R1.2 ClC1=CN=CS1 MCULE-6088272612 [0,1,0,1,0,0|1,1,0]=4 1822 B6R1.2 ClC1=CNC=N1 MCULE-3072422179 [0,1,0,1,0,0|2,0,0]=4 1823 B6R1.2 ClC1=CNC=N1 MCULE-8453567278 [0,1,0,1,0,0|2,0,0]=4 1824 B6R1.2 ClC1=CNN=C1 MCULE-2092045123 [0,1,0,1,0,0|2,0,0]=4 1825 B6R1.2 ClC1=CSC=C1 MCULE-1998275400 [0,1,0,1,0,0|0,1,1]=4 1826 B6R1.2 ClC1=CSC=N1 MCULE-9647338017 [0,1,0,1,0,0|2,0,0]=4 1827 B6R1.2 ClC1=CSN=C1 MCULE-6113180722 [0,1,0,1,0,0|1,1,0]=4 1828 B6R1.2 ClC1=NC=CN1 MCULE-6072122645 [0,1,0,1,0,0|2,0,0]=4 1829 B6R1.2 ClC1=NC=CO1 MCULE-1860416745 [0,1,0,1,0,0|1,0,1]=4 1830 B6R1.2 ClC1=NC=CO1 MCULE-4765528658 [0,1,0,1,0,0|1,0,1]=4 1831 B6R1.2 ClC1=NC=CS1 MCULE-6673458969 [0,1,0,1,0,0|1,1,0]=4 1832 B6R1.2 ClC1=NNC=C1 MCULE-6678816051 [0,1,0,1,0,0|2,0,0]=4 1833 B6R1.2 ClC1=NSC=C1 MCULE-5743382341 [0,1,0,1,0,0|1,1,0]=4 1834 B6R1.2 FC1=CC=CS1 MCULE-5362233873 [0,1,0,1,0,0|0,1,1]=4 1835 B6R1.2 FC1=CN=CN1 MCULE-9951835141 [0,1,0,1,0,0|2,0,0]=4 1836 B6R1.2 FC1=CNN=C1 MCULE-7981107171 [0,1,0,1,0,0|2,0,0]=4 1837 B6R1.2 FC1=CNN=C1 MCULE-9509914186 [0,1,0,1,0,0|2,0,0]=4 1838 B6R1.2 FC1=CSC=C1 MCULE-3342972910 [0,1,0,1,0,0|0,1,1]=4 1839 B6R1.2 FC1=NC=CN1 MCULE-1860701993 [0,1,0,1,0,0|2,0,0]=4 1840 B6R1.2 FC1=NC=CN1 MCULE-5026249596 [0,1,0,1,0,0|2,0,0]=4 1841 B6R1.2 FC1=NC=CS1 MCULE-3710058771 [0,1,0,1,0,0|1,1,0]=4 1842 B6R1.2 FC1=NNC=C1 MCULE-3532126949 [0,1,0,1,0,0|2,0,0]=4 1843 B6R1.2 IC1=CC=CO1 MCULE-6467830719 [0,1,0,1,0,0|0,0,2]=4 1844 B6R1.2 IC1=CC=CS1 MCULE-6025659368 [0,1,0,1,0,0|0,1,1]=4 1845 B6R1.2 IC1=CC=NN1 MCULE-9744954898 [0,1,0,1,0,0|2,0,0]=4 1846 B6R1.2 IC1=CC=NS1 MCULE-7758361866 [0,1,0,1,0,0|1,1,0]=4 1847 B6R1.2 IC1=CCCC1 MCULE-5953451970 [0,1,0,1,0,0|1,0,1]=4 1848 B6R1.2 IC1=CN=CS1 MCULE-1577269526 [0,1,0,1,0,0|1,1,0]=4 1849 B6R1.2 IC1=CNC=C1 MCULE-4230351559 [0,1,0,1,0,0|1,0,1]=4 1850 B6R1.2 IC1=CNC=N1 MCULE-9964164089 [0,1,0,1,0,0|2,0,0]=4 1851 B6R1.2 IC1=CNN=C1 MCULE-4755201793 [0,1,0,1,0,0|2,0,0]=4 1852 B6R1.2 IC1=COC=N1 MCULE-1363022741 [0,1,0,1,0,0|2,0,0]=4 1853 B6R1.2 IC1=COC=N1 MCULE-8108166687 [0,1,0,1,0,0|2,0,0]=4 1854 B6R1.2 IC1=COCC1 MCULE-3076361502 [0,1,0,1,0,0|0,0,2]=4 1855 B6R1.2 IC1=CON=C1 MCULE-4450603437 [0,1,0,1,0,0|1,0,1]=4 1856 B6R1.2 IC1=CSC=C1 MCULE-1100365117 [0,1,0,1,0,0|0,1,1]=4 1857 B6R1.2 IC1=CSN=C1 MCULE-5646861702 [0,1,0,1,0,0|1,1,0]=4 1858 B6R1.2 IC1=NC=CN1 MCULE-1690537323 [0,1,0,1,0,0|2,0,0]=4 1859 B6R1.2 IC1=NC=CO1 MCULE-2254947090 [0,1,0,1,0,0|1,0,1]=4 1860 B6R1.2 IC1=NC=CS1 MCULE-9500451238 [0,1,0,1,0,0|1,1,0]=4 1861 B6R1.2 IC1=NNC=C1 MCULE-9771094813 [0,1,0,1,0,0|2,0,0]=4 1862 B6R1.2 NC1=CC=CN1 MCULE-5653620818 [0,1,0,1,0,0|1,0,1]=4 1863 B6R1.2 NC1=CC=CN1 MCULE-9753432085 [0,1,0,1,0,0|1,0,1]=4 1864 B6R1.2 NC1=CC=CO1 MCULE-2421139965 [0,1,0,1,0,0|0,0,2]=4 1865 B6R1.2 NC1=CC=CS1 MCULE-1649510352 [0,1,0,1,0,0|0,1,1]=4 1866 B6R1.2 NC1=CC=CS1 MCULE-9501271303 [0,1,0,1,0,0|0,1,1]=4 1867 B6R1.2 NC1=CC=NO1 MCULE-3638275568 [0,1,0,1,0,0|1,0,1]=4 1868 B6R1.2 NC1=CC=NS1 MCULE-2159626770 [0,1,0,1,0,0|1,1,0]=4 1869 B6R1.2 NC1=CC=NS1 MCULE-8733584582 [0,1,0,1,0,0|1,1,0]=4 1870 B6R1.2 NC1=CCNN1 MCULE-1539779543 [0,1,0,1,0,0|2,0,0]=4 1871 B6R1.2 NC1=CCNN1 MCULE-3460056890 [0,1,0,1,0,0|2,0,0]=4 1872 B6R1.2 NC1=CCNN1 MCULE-5423983278 [0,1,0,1,0,0|2,0,0]=4 1873 B6R1.2 NC1=CN=CN1 MCULE-3029255616 [0,1,0,1,0,0|2,0,0]=4 1874 B6R1.2 NC1=CN=CN1 MCULE-8873453977 [0,1,0,1,0,0|2,0,0]=4 1875 B6R1.2 NC1=CN=CN1 MCULE-9206811415 [0,1,0,1,0,0|2,0,0]=4 1876 B6R1.2 NC1=CN=CO1 MCULE-4492961257 [0,1,0,1,0,0|1,0,1]=4 1877 B6R1.2 NC1=CN=CS1 MCULE-1239962681 [0,1,0,1,0,0|1,1,0]=4 1878 B6R1.2 NC1=CN=CS1 MCULE-3685342495 [0,1,0,1,0,0|1,1,0]=4 1879 B6R1.2 NC1=CN=CS1 MCULE-7122700564 [0,1,0,1,0,0|1,1,0]=4 1880 B6R1.2 NC1=CNC=C1 MCULE-1411730985 [0,1,0,1,0,0|1,0,1]=4 1881 B6R1.2 NC1=CNC=C1 MCULE-7701316156 [0,1,0,1,0,0|1,0,1]=4 1882 B6R1.2 NC1=CNN=C1 MCULE-4119655375 [0,1,0,1,0,0|2,0,0]=4 1883 B6R1.2 NC1=CNN=C1 MCULE-5097217370 [0,1,0,1,0,0|2,0,0]=4 1884 B6R1.2 NC1=CNN=C1 MCULE-6287007700 [0,1,0,1,0,0|2,0,0]=4 1885 B6R1.2 NC1=COC=C1 MCULE-1858324031 [0,1,0,1,0,0|0,0,2]=4 1886 B6R1.2 NC1=COC=C1 MCULE-3985426542 [0,1,0,1,0,0|0,0,2]=4 1887 B6R1.2 NC1=COC=N1 MCULE-2511021171 [0,1,0,1,0,0|2,0,0]=4 1888 B6R1.2 NC1=COC=N1 MCULE-3099880728 [0,1,0,1,0,0|2,0,0]=4 1889 B6R1.2 NC1=CON=C1 MCULE-2373604754 [0,1,0,1,0,0|1,0,1]=4 1890 B6R1.2 NC1=CON=C1 MCULE-7932471087 [0,1,0,1,0,0|1,0,1]=4 1891 B6R1.2 NC1=CSC=C1 MCULE-1673174137 [0,1,0,1,0,0|0,1,1]=4 1892 B6R1.2 NC1=CSC=C1 MCULE-5461897385 [0,1,0,1,0,0|0,1,1]=4 1893 B6R1.2 NC1=CSC=C1 MCULE-6200615331 [0,1,0,1,0,0|0,1,1]=4 1894 B6R1.2 NC1=CSC=C1 MCULE-9439581665 [0,1,0,1,0,0|0,1,1]=4 1895 B6R1.2 NC1=CSC=N1 MCULE-3316985941 [0,1,0,1,0,0|2,0,0]=4 1896 B6R1.2 NC1=CSC=N1 MCULE-4767298680 [0,1,0,1,0,0|2,0,0]=4 1897 B6R1.2 NC1=CSN=C1 MCULE-8555779572 [0,1,0,1,0,0|1,1,0]=4 1898 B6R1.2 NC1=CSN=C1 MCULE-9110365089 [0,1,0,1,0,0|1,1,0]=4 1899 B6R1.2 NC1=CSN=C1 MCULE-9229676240 [0,1,0,1,0,0|1,1,0]=4 1900 B6R1.2 NC1=NC=CN1 MCULE-4937045321 [0,1,0,1,0,0|2,0,0]=4 1901 B6R1.2 NC1=NC=CN1 MCULE-6371804569 [0,1,0,1,0,0|2,0,0]=4 1902 B6R1.2 NC1=NC=CN1 MCULE-7485953374 [0,1,0,1,0,0|2,0,0]=4 1903 B6R1.2 NC1=NC=CN1 MCULE-9607974759 [0,1,0,1,0,0|2,0,0]=4 1904 B6R1.2 NC1=NC=CO1 MCULE-7316590930 [0,1,0,1,0,0|1,0,1]=4 1905 B6R1.2 NC1=NC=CS1 MCULE-1506905792 [0,1,0,1,0,0|1,1,0]=4 1906 B6R1.2 NC1=NC=CS1 MCULE-8550608343 [0,1,0,1,0,0|1,1,0]=4 1907 B6R1.2 NC1=NNC=C1 MCULE-1507683823 [0,1,0,1,0,0|2,0,0]=4 1908 B6R1.2 NC1=NNC=C1 MCULE-5117516307 [0,1,0,1,0,0|2,0,0]=4 1909 B6R1.2 NC1=NNC=C1 MCULE-7091290697 [0,1,0,1,0,0|2,0,0]=4 1910 B6R1.2 NC1=NOC=C1 MCULE-5363092492 [0,1,0,1,0,0|1,0,1]=4 1911 B6R1.2 NC1=NSC=C1 MCULE-2731864153 [0,1,0,1,0,0|1,1,0]=4 1912 B6R1.2 NC1=NSC=C1 MCULE-4778941442 [0,1,0,1,0,0|1,1,0]=4 1913 B6R1.2 NC1C=CCC1 MCULE-2537724380 [0,1,0,1,0,0|1,0,1]=4 1914 B6R1.2 NC1C=CCC1 MCULE-5017993489 [0,1,0,1,0,0|1,0,1]=4 1915 B6R1.2 NC1C=CN=N1 MCULE-8618625416 [0,1,0,1,0,0|2,0,0]=4 1916 B6R1.2 NC1CC=CC1 MCULE-3815719332 [0,1,0,1,0,0|1,0,1]=4 1917 B6R1.2 NC1CC=CC1 MCULE-9984030144 [0,1,0,1,0,0|1,0,1]=4 1918 B6R1.2 NN1C=CC=C1 MCULE-9328309132 [0,1,0,1,0,0|1,0,1]=4 1919 B6R1.2 NN1C=CC=N1 MCULE-1897324593 [0,1,0,1,0,0|2,0,0]=4 1920 B6R1.2 O=C1C=CCC1 MCULE-1844779047 [0,1,0,1,0,0|0,0,0]=2 1921 B6R1.2 O=C1C=CCN1 MCULE-4338701003 [0,1,0,1,0,0|0,0,0]=2 1922 B6R1.2 O=C1C=CCO1 MCULE-4296503663 [0,1,0,1,0,0|0,0,0]=2 1923 B6R1.2 O=C1C=CCS1 MCULE-5623095583 [0,1,0,1,0,0|0,0,0]=2 1924 B6R1.2 O=C1C=CNN1 MCULE-8045056316 [0,1,0,1,0,0|1,0,0]=3 1925 B6R1.2 O=C1C=CSC1 MCULE-6580304664 [0,1,0,1,0,0|0,0,0]=2 1926 B6R1.2 O=C1C=CSN1 MCULE-6820517860 [0,1,0,1,0,0|1,0,0]=3 1927 B6R1.2 O=C1CC=CC1 MCULE-7606670114 [0,1,0,1,0,0|0,0,0]=2 1928 B6R1.2 O=C1CC=NN1 MCULE-1672455504 [0,1,0,1,0,0|1,0,0]=3 1929 B6R1.2 O=C1CCCC1 MCULE-9455227735 [0,1,0,1,0,0|0,0,2]=4 1930 B6R1.2 O=C1CCCN1 MCULE-3061780794 [0,1,0,1,0,0|0,0,2]=4 1931 B6R1.2 O=C1CCCO1 MCULE-6795890265 [0,1,0,1,0,0|0,0,2]=4 1932 B6R1.2 O=C1CCCS1 MCULE-5361654550 [0,1,0,1,0,0|0,0,2]=4 1933 B6R1.2 O=C1CCNC1 MCULE-2947789259 [0,1,0,1,0,0|0,0,2]=4 1934 B6R1.2 O=C1CCNC1 MCULE-7192595052 [0,1,0,1,0,0|0,0,2]=4 1935 B6R1.2 O=C1CCNN1 MCULE-7030953666 [0,1,0,1,0,0|1,0,1]=4 1936 B6R1.2 O=C1CCOC1 MCULE-2031733910 [0,1,0,1,0,0|0,0,2]=4 1937 B6R1.2 O=C1CCON1 MCULE-6799359324 [0,1,0,1,0,0|1,0,1]=4 1938 B6R1.2 O=C1CCSC1 MCULE-2059655624 [0,1,0,1,0,0|0,0,2]=4 1939 B6R1.2 O=C1CC[NH2+]N1 MCULE-5327505055 [0,1,0,1,0,0|1,0,1]=4 1940 B6R1.2 O=C1CNCN1 MCULE-2645891847 [0,1,0,1,0,0|1,0,1]=4 1941 B6R1.2 O=C1CNCN1 MCULE-9269137129 [0,1,0,1,0,0|1,0,1]=4 1942 B6R1.2 O=C1CSCN1 MCULE-3946660854 [0,1,0,1,0,0|1,0,1]=4 1943 B6R1.2 O=C1N=CN=N1 MCULE-3721166402 [0,1,0,1,0,0|2,0,0]=4 1944 B6R1.2 O=C1NC=CN1 MCULE-6249170076 [0,1,0,1,0,0|1,0,0]=3 1945 B6R1.2 O=C1NC=CO1 MCULE-4371023805 [0,1,0,1,0,0|1,0,0]=3 1946 B6R1.2 O=C1NC=CS1 MCULE-2039347995 [0,1,0,1,0,0|1,0,0]=3 1947 B6R1.2 O=C1NC=NN1 MCULE-8685001700 [0,1,0,1,0,0|2,0,0]=4 1948 B6R1.2 O=C1NCCN1 MCULE-9806791551 [0,1,0,1,0,0|1,0,1]=4 1949 B6R1.2 O=C1NCCO1 MCULE-3934923008 [0,1,0,1,0,0|1,0,1]=4 1950 B6R1.2 O=C1NCCS1 MCULE-6732478086 [0,1,0,1,0,0|1,0,1]=4 1951 B6R1.2 O=C1OC=CO1 MCULE-1924277704 [0,1,0,1,0,0|1,0,0]=3 1952 B6R1.2 O=C1OCCO1 MCULE-9493253045 [0,1,0,1,0,0|1,0,1]=4 1953 B6R1.2 OC1=CC=CO1 MCULE-7591676996 [0,1,0,1,0,0|0,0,2]=4 1954 B6R1.2 OC1=CC=CS1 MCULE-8044830478 [0,1,0,1,0,0|0,0,2]=4 1955 B6R1.2 OC1=CC=NN1 MCULE-9109008036 [0,1,0,1,0,0|1,0,1]=4 1956 B6R1.2 OC1=CN=CS1 MCULE-4004908551 [0,1,0,1,0,0|1,0,1]=4 1957 B6R1.2 OC1=CNC=C1 MCULE-3938204755 [0,1,0,1,0,0|0,0,2]=4 1958 B6R1.2 OC1=CNC=N1 MCULE-1911765165 [0,1,0,1,0,0|1,0,1]=4 1959 B6R1.2 OC1=CNN=C1 MCULE-5672706063 [0,1,0,1,0,0|2,0,0]=4 1960 B6R1.2 OC1=CNN=C1 MCULE-5774317326 [0,1,0,1,0,0|2,0,0]=4 1961 B6R1.2 OC1=CON=C1 MCULE-9622003135 [0,1,0,1,0,0|1,0,1]=4 1962 B6R1.2 OC1=CSC=C1 MCULE-2226095386 [0,1,0,1,0,0|0,0,2]=4 1963 B6R1.2 OC1=NOC=C1 MCULE-6441945551 [0,1,0,1,0,0|1,0,1]=4 1964 B6R1.2 OC1C=CCC1 MCULE-3857764876 [0,1,0,1,0,0|0,0,2]=4 1965 B6R1.2 OC1C=CCO1 MCULE-4636930669 [0,1,0,1,0,0|0,0,2]=4 1966 B6R1.2 OC1CC=CC1 MCULE-6176562196 [0,1,0,1,0,0|0,0,2]=4 1967 B6R1.2 ON1C=CC=N1 MCULE-8533909959 [0,1,0,1,0,0|1,0,1]=4 1968 B6R1.2 S=C1NC=CO1 MCULE-6706918798 [0,1,0,1,0,0|1,0,1]=4 1969 B6R1.2 S=C1SC=CS1 MCULE-7239273248 [0,1,0,1,0,0|1,1,0]=4 1970 B6R1.2 SC1=CC=CS1 MCULE-8882266878 [0,1,0,1,0,0|0,1,1]=4 1971 B6R1.2 SC1=CNN=C1 MCULE-7844673145 [0,1,0,1,0,0|2,0,0]=4 1972 B6R1.2 SC1=CSC=C1 MCULE-8930005512 [0,1,0,1,0,0|0,1,1]=4 1973 B6R1.2 SC1=NC=CN1 MCULE-1550904171 [0,1,0,1,0,0|1,1,0]=4 1974 B6R1.2 SC1=NC=CS1 MCULE-4142949987 [0,1,0,1,0,0|1,1,0]=4 1975 B6R1.2 [Li]C1C=CC=C1 MCULE-1100709751 [0,1,0,1,0,0|1,0,0]=3 1976 B6R1.2 [TlH2]C1=CC=CC1 MCULE-7402896981 [0,1,0,1,0,0|1,0,0]=3 1977 B6R1.3 Br/C=C/C1CC1 MCULE-8231904960 [0,1,0,1,0,0|1,0,1]=4 1978 B6R1.3 BrC=CC1CC1 MCULE-7061395349 [0,1,0,1,0,0|1,0,1]=4 1979 B6R1.3 O=CCC1CC1 MCULE-3319649937 [0,1,0,1,0,0|0,0,2]=4 1980 B6R1.3 O=CNC1CC1 MCULE-6602451187 [0,1,0,1,0,0|0,0,2]=4 1981 B6R1.5 C=C1CC(=O)O1 MCULE-7149487095 [0,1,0,1,0,0|1,0,0]=3 1982 B6R1.5 CC1CC(=O)C1 MCULE-2159393653 [0,1,0,1,0,0|0,0,2]=4 1983 B6R1.5 CC1CC(=O)N1 MCULE-6139592633 [0,1,0,1,0,0|0,0,2]=4 1984 B6R1.5 CC1CC(=O)O1 MCULE-9285847382 [0,1,0,1,0,0|0,0,2]=4 1985 B6R1.5 CN1CC(=O)C1 MCULE-1685267969 [0,1,0,1,0,0|1,0,1]=4 1986 B6R1.5 CN1CC(=O)C1 MCULE-2242594777 [0,1,0,1,0,0|1,0,1]=4 1987 B6R1.5 C[C@@H]1CC(=O)O1 MCULE-3257475519 [0,1,0,1,0,0|0,0,2]=4 1988 B6R1.5 NC1CC(=O)C1 MCULE-3450860282 [0,1,0,1,0,0|0,0,2]=4 1989 B6R1.5 NC1CC(=O)C1 MCULE-5974961836 [0,1,0,1,0,0|0,0,2]=4 1990 B6R1.5 O=C1CC(C1)Br MCULE-1715982282 [0,1,0,1,0,0|0,0,2]=4 1991 B6R1.5 O=C1CC(C1)F MCULE-2541516698 [0,1,0,1,0,0|0,0,2]=4 1992 B6R1.5 O=C1CC(C1)O MCULE-7099112258 [0,1,0,1,0,0|0,0,2]=4 1993 B6R1.8 CC1CC1C=O MCULE-2600627355 [0,1,0,1,0,0|0,0,2]=4 1994 B6R1.8 O=CC1CC1Cl MCULE-5539872961 [0,1,0,1,0,0|0,0,2]=4 1995 B6R1.10 O=S1(=O)C=CC1 MCULE-7285340589 [0,1,0,1,0,0|1,0,0]=3 1996 B6R1.11 CC(=O)C1CC1 MCULE-3846146416 [0,1,0,1,0,0|0,0,2]=4 1997 B6R1.11 CC(=O)C1CO1 MCULE-4329154079 [0,1,0,1,0,0|1,0,1]=4 1998 B6R1.11 NC(=O)C1CC1 MCULE-9911054913 [0,1,0,1,0,0|0,0,2]=4 1999 B6R1.11 NC(=O)C1CO1 MCULE-6911744868 [0,1,0,1,0,0|1,0,1]=4 2000 B6R1.11 O=C(Cl)C1CC1 MCULE-8675746452 [0,1,0,1,0,0|0,0,2]=4 2001 B6R1.11 O=C(O)C1CC1 MCULE-4677373694 [0,1,0,1,0,0|0,0,2]=4 2002 B6R1.11 O=C(O)C1CN1 MCULE-3236125597 [0,1,0,1,0,0|1,0,1]=4 2003 B6R1.11 O=C(O)C1CO1 MCULE-2152916793 [0,1,0,1,0,0|1,0,1]=4 2004 B6R1.11 O=C(O)[C@@H]1CN1 MCULE-4363753412 [0,1,0,1,0,0|1,0,1]=4 2005 B6R1.11 O=C(O)[C@H]1CN1 MCULE-4830347195 [0,1,0,1,0,0|1,0,1]=4 2006 B6R1.11 O=C(O)[C@H]1CO1 MCULE-5204459723 [0,1,0,1,0,0|1,0,1]=4 2007 B6R1.11 O=C(O)[C@H]1CO1 MCULE-6983707093 [0,1,0,1,0,0|1,0,1]=4 2008 B6R1.11 O=C([O-])C1CN1 MCULE-6490437892 [0,1,0,1,0,0|1,0,1]=4 2009 B6R1.11 O=C([O-])C1CO1 MCULE-4586459966 [0,1,0,1,0,0|1,0,1]=4 2010 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-1647975669 [0,1,0,1,0,0|1,0,1]=4 2011 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-1906997950 [0,1,0,1,0,0|1,0,1]=4 2012 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-4899800766 [0,1,0,1,0,0|1,0,1]=4 2013 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-9148170094 [0,1,0,1,0,0|1,0,1]=4 2014 B6R1.11 O=C([O-])[C@H]1CO1 MCULE-6663734494 [0,1,0,1,0,0|1,0,1]=4 2015 B6R1.11 O=C([O-])[C@H]1CO1 MCULE-8580451361 [0,1,0,1,0,0|1,0,1]=4 2016 B6R1.1 C1=CC=CC=C1 MCULE-4899719484 [0,1,0,1,0,0|1,0,1]=4 2017 B6R1.1 C1=CC=NC=C1 MCULE-4028120692 [0,1,0,1,0,0|1,0,1]=4 2018 B6R1.1 C1=CC=NN=C1 MCULE-8903555610 [0,1,0,1,0,0|1,0,1]=4 2019 B6R1.1 C1=CC=[O+]C=C1 MCULE-1614244243 [0,1,0,1,0,0|0,0,2]=4 2020 B6R1.1 C1=CC=[O+]C=C1 MCULE-7104367772 [0,1,0,1,0,0|0,0,2]=4 2021 B6R1.1 C1=CCC=CC1 MCULE-5587669746 [0,1,0,1,0,0|1,0,0]=3 2022 B6R1.1 C1=CCCC=C1 MCULE-9111393952 [0,1,0,1,0,0|1,0,0]=3 2023 B6R1.1 C1=CCCCC1 MCULE-3564016252 [0,1,0,1,0,0|1,0,1]=4 2024 B6R1.1 C1=CCNCC1 MCULE-4850984502 [0,1,0,1,0,0|1,0,1]=4 2025 B6R1.1 C1=CCNCC1 MCULE-9744767398 [0,1,0,1,0,0|1,0,1]=4 2026 B6R1.1 C1=CCOCC1 MCULE-7723901693 [0,1,0,1,0,0|0,0,2]=4 2027 B6R1.1 C1=CCONC1 MCULE-7264346127 [0,1,0,1,0,0|0,0,2]=4 2028 B6R1.1 C1=CCONC1 MCULE-7621269131 [0,1,0,1,0,0|0,0,2]=4 2029 B6R1.1 C1=CN=CC=N1 MCULE-7343822850 [0,1,0,1,0,0|1,0,1]=4 2030 B6R1.1 C1=CN=CN=C1 MCULE-4261708822 [0,1,0,1,0,0|1,0,1]=4 2031 B6R1.1 C1=CN=NC=C1 MCULE-3487470460 [0,1,0,1,0,0|1,0,1]=4 2032 B6R1.1 C1=CN=NC=N1 MCULE-1276893342 [0,1,0,1,0,0|2,0,0]=4 2033 B6R1.1 C1=COCCC1 MCULE-1260841717 [0,1,0,1,0,0|0,0,2]=4 2034 B6R1.1 C1=COCCO1 MCULE-2562788031 [0,1,0,1,0,0|0,0,2]=4 2035 B6R1.1 C1=COCOC1 MCULE-9916358884 [0,1,0,1,0,0|0,0,2]=4 2036 B6R1.4 CC1CCC1=O MCULE-4548181715 [0,1,0,1,0,0|0,0,2]=4 2037 B6R1.4 CC1CNC1=O MCULE-5523309752 [0,1,0,1,0,0|0,0,2]=4 2038 B6R1.4 CC1COC1=O MCULE-9711165188 [0,1,0,1,0,0|0,0,2]=4 2039 B6R1.4 CC1OCC1=O MCULE-7718609686 [0,1,0,1,0,0|0,0,2]=4 2040 B6R1.4 NC1CCC1=O MCULE-3868209809 [0,1,0,1,0,0|0,0,2]=4 2041 B6R1.4 NC1CCC1=O MCULE-9741389143 [0,1,0,1,0,0|0,0,2]=4 2042 B6R1.4 NC1CNC1=O MCULE-2761616663 [0,1,0,1,0,0|1,0,1]=4 2043 B6R1.4 NC1CNC1=O MCULE-3021306383 [0,1,0,1,0,0|1,0,1]=4 2044 B6R1.4 NC1CNC1=O MCULE-3943057121 [0,1,0,1,0,0|1,0,1]=4 2045 B6R1.4 NC1COC1=O MCULE-6998565452 [0,1,0,1,0,0|1,0,1]=4 2046 B6R1.4 NN1CCC1=O MCULE-6200802911 [0,1,0,1,0,0|1,0,1]=4 2047 B6R1.4 NN1CCC1=O MCULE-8249778821 [0,1,0,1,0,0|1,0,1]=4 2048 B6R1.4 N[C@@H]1CNC1=O MCULE-3645662662 [0,1,0,1,0,0|1,0,1]=4 2049 B6R1.4 N[C@@H]1CNC1=O MCULE-4399212271 [0,1,0,1,0,0|1,0,1]=4 2050 B6R1.4 N[C@@H]1CNC1=O MCULE-6332076219 [0,1,0,1,0,0|1,0,1]=4 2051 B6R1.4 N[C@@H]1CNC1=O MCULE-6365012530 [0,1,0,1,0,0|1,0,1]=4 2052 B6R1.4 N[C@@H]1COC1=O MCULE-8080548213 [0,1,0,1,0,0|1,0,1]=4 2053 B6R1.4 N[C@@H]1COC1=O MCULE-9370092691 [0,1,0,1,0,0|1,0,1]=4 2054 B6R1.4 N[C@H]1CNC1=O MCULE-2792436534 [0,1,0,1,0,0|1,0,1]=4 2055 B6R1.4 N[C@H]1CNC1=O MCULE-6881316562 [0,1,0,1,0,0|1,0,1]=4 2056 B6R1.4 N[C@H]1CNC1=O MCULE-8864053661 [0,1,0,1,0,0|1,0,1]=4 2057 B6R1.4 N[C@H]1CNC1=O MCULE-9014449253 [0,1,0,1,0,0|1,0,1]=4 2058 B6R1.4 N[C@H]1COC1=O MCULE-4812631526 [0,1,0,1,0,0|1,0,1]=4 2059 B6R1.4 O=C1CCC1Br MCULE-1088592133 [0,1,0,1,0,0|0,0,2]=4 2060 B6R1.4 O=C1CCC1F MCULE-6197375881 [0,1,0,1,0,0|0,0,2]=4 2061 B6R1.4 O=C1CCC1O MCULE-1248327203 [0,1,0,1,0,0|0,0,2]=4 2062 B6R1.4 O=C1CC[C@@H]1Br MCULE-3455449754 [0,1,0,1,0,0|0,0,2]=4 2063 B6R1.4 [C@@H]1(COC1=O)N MCULE-7456320845 [0,1,0,1,0,0|1,0,1]=4 2064 B6R1.6 O=CC1CCC1 MCULE-8678026416 [0,1,0,1,0,0|0,0,2]=4 2065 B6R1.6 O=CC1COC1 MCULE-3773699476 [0,1,0,1,0,0|0,0,2]=4 2066 B6R1.6 O=CC1CSC1 MCULE-2648443908 [0,1,0,1,0,0|0,0,2]=4 2067 B6R1.7 CC1(CC1)C=O MCULE-3651219428 [0,1,0,1,0,0|0,0,2]=4 2068 B6R1.7 O=CC1(CC1)F MCULE-5455667660 [0,1,0,1,0,0|0,0,2]=4