0 B4R0.2 BrC=CCBr MCULE-1480697982 [0,0,0,0,0,0|3,0,1]=4 1 B4R0.2 BrCOCBr MCULE-2371209322 [0,0,0,0,0,0|2,0,2]=4 2 B4R0.2 C#CC=CC MCULE-9741359131 [0,0,0,0,0,0|1,0,3]=4 3 B4R0.2 C#COCC MCULE-1522528824 [0,0,0,0,0,0|0,0,4]=4 4 B4R0.2 C/C=C/C#N MCULE-2754343103 [0,0,0,0,0,0|2,0,2]=4 5 B4R0.2 C/C=C/C=O MCULE-9924705308 [0,0,0,0,0,0|2,0,1]=3 6 B4R0.2 C/C=C/CCl MCULE-9977493525 [0,0,0,0,0,0|2,0,2]=4 7 B4R0.2 C/C=C/CO MCULE-2383161163 [0,0,0,0,0,0|2,0,2]=4 8 B4R0.2 C/C=C/OC MCULE-3906920304 [0,0,0,0,0,0|2,0,2]=4 9 B4R0.2 C/C=C\CO MCULE-5924662327 [0,0,0,0,0,0|2,0,2]=4 10 B4R0.2 C=C=CCC MCULE-6123315571 [0,0,0,0,0,0|1,0,3]=4 11 B4R0.2 C=C=CCN MCULE-5700871644 [0,0,0,0,0,0|2,0,2]=4 12 B4R0.2 C=C=CCN MCULE-9120483529 [0,0,0,0,0,0|2,0,2]=4 13 B4R0.2 C=C=CCO MCULE-5424851896 [0,0,0,0,0,0|2,0,2]=4 14 B4R0.2 C=CC=CC MCULE-4452516287 [0,0,0,0,0,0|1,0,1]=2 15 B4R0.2 C=CCC#N MCULE-2566589348 [0,0,0,0,0,0|2,0,1]=3 16 B4R0.2 C=CCCBr MCULE-2890129103 [0,0,0,0,0,0|2,0,1]=3 17 B4R0.2 C=CCCC MCULE-8386546337 [0,0,0,0,0,0|1,0,2]=3 18 B4R0.2 C=CCCCl MCULE-5903789900 [0,0,0,0,0,0|2,0,1]=3 19 B4R0.2 C=CCCI MCULE-1055671394 [0,0,0,0,0,0|2,0,1]=3 20 B4R0.2 C=CCCN MCULE-2471716627 [0,0,0,0,0,0|2,0,1]=3 21 B4R0.2 C=CCCN MCULE-2881108697 [0,0,0,0,0,0|2,0,1]=3 22 B4R0.2 C=CCCO MCULE-4582400839 [0,0,0,0,0,0|2,0,1]=3 23 B4R0.2 C=CCNC MCULE-3335720336 [0,0,0,0,0,0|2,0,1]=3 24 B4R0.2 C=CCNN MCULE-2550690274 [0,0,0,0,0,0|3,0,0]=3 25 B4R0.2 C=CCNN MCULE-3554567414 [0,0,0,0,0,0|3,0,0]=3 26 B4R0.2 C=CCNN MCULE-8741523989 [0,0,0,0,0,0|3,0,0]=3 27 B4R0.2 C=CCOC MCULE-3321225771 [0,0,0,0,0,0|2,0,1]=3 28 B4R0.2 C=CCON MCULE-2094787759 [0,0,0,0,0,0|3,0,0]=3 29 B4R0.2 C=CCON MCULE-6222602533 [0,0,0,0,0,0|3,0,0]=3 30 B4R0.2 C=CCSC MCULE-4452023915 [0,0,0,0,0,0|2,0,1]=3 31 B4R0.2 C=CNC=O MCULE-8403928899 [0,0,0,0,0,0|2,0,0]=2 32 B4R0.2 C=COCC MCULE-2569047033 [0,0,0,0,0,0|0,0,2]=2 33 B4R0.2 C=CSCC MCULE-8927374165 [0,0,0,0,0,0|0,1,2]=3 34 B4R0.2 C=C[Te]C=C MCULE-9095868234 [0,0,0,0,0,0|0,1,0]=1 35 B4R0.2 C=NCC#N MCULE-3686954074 [0,0,0,0,0,0|3,0,1]=4 36 B4R0.2 CC#CC=O MCULE-9270622693 [0,0,0,0,0,0|2,0,2]=4 37 B4R0.2 CC=CC#N MCULE-5062019142 [0,0,0,0,0,0|2,0,2]=4 38 B4R0.2 CC=CC=O MCULE-2497362981 [0,0,0,0,0,0|2,0,1]=3 39 B4R0.2 CC=CCBr MCULE-7855581866 [0,0,0,0,0,0|2,0,2]=4 40 B4R0.2 CC=CCC MCULE-5931905453 [0,0,0,0,0,0|1,0,3]=4 41 B4R0.2 CC=CCCl MCULE-3941962217 [0,0,0,0,0,0|2,0,2]=4 42 B4R0.2 CC=CCO MCULE-7490725844 [0,0,0,0,0,0|2,0,2]=4 43 B4R0.2 CC=COC MCULE-6712403535 [0,0,0,0,0,0|2,0,2]=4 44 B4R0.2 CC=CSC MCULE-5921906156 [0,0,0,0,0,0|2,0,2]=4 45 B4R0.2 CCC=CBr MCULE-4471551501 [0,0,0,0,0,0|2,0,2]=4 46 B4R0.2 CCCC=O MCULE-8530391347 [0,0,0,0,0,0|2,0,2]=4 47 B4R0.2 CCNC=O MCULE-9309926274 [0,0,0,0,0,0|2,0,2]=4 48 B4R0.2 CCOC=N MCULE-5321655909 [0,0,0,0,0,0|1,0,2]=3 49 B4R0.2 CCOC=N MCULE-8158357614 [0,0,0,0,0,0|1,0,2]=3 50 B4R0.2 CCOC=O MCULE-6245072161 [0,0,0,0,0,0|1,0,2]=3 51 B4R0.2 CCOCBr MCULE-6644755987 [0,0,0,0,0,0|1,0,3]=4 52 B4R0.2 CCOCC MCULE-5665709021 [0,0,0,0,0,0|0,0,4]=4 53 B4R0.2 CCOCCl MCULE-5087992840 [0,0,0,0,0,0|1,0,3]=4 54 B4R0.2 CCONC MCULE-5446312516 [0,0,0,0,0,0|1,0,3]=4 55 B4R0.2 CCONC MCULE-7976027802 [0,0,0,0,0,0|1,0,3]=4 56 B4R0.2 COCC=O MCULE-9427361019 [0,0,0,0,0,0|3,0,1]=4 57 B4R0.2 Cl/C=C/CCl MCULE-4516188972 [0,0,0,0,0,0|3,0,1]=4 58 B4R0.2 ClC/C=C/Br MCULE-1061414929 [0,0,0,0,0,0|3,0,1]=4 59 B4R0.2 ClC=CCCl MCULE-4655672652 [0,0,0,0,0,0|3,0,1]=4 60 B4R0.2 ICOCI MCULE-4901830231 [0,0,0,0,0,0|2,0,2]=4 61 B4R0.2 N/C=C/C=O MCULE-2444951625 [0,0,0,0,0,0|3,0,0]=3 62 B4R0.2 NC=CC=O MCULE-4070918342 [0,0,0,0,0,0|3,0,0]=3 63 B4R0.2 O=BOB=O MCULE-4560541361 [0,0,0,0,0,0|4,0,0]=4 64 B4R0.2 O=CCCBr MCULE-4107157458 [0,0,0,0,0,0|3,0,1]=4 65 B4R0.2 O=CCCCl MCULE-5863929313 [0,0,0,0,0,0|3,0,1]=4 66 B4R0.2 O=CCCI MCULE-9771140462 [0,0,0,0,0,0|3,0,1]=4 67 B4R0.2 O=CCCO MCULE-1685289763 [0,0,0,0,0,0|3,0,1]=4 68 B4R0.2 O=CNC=O MCULE-3098379420 [0,0,0,0,0,0|3,0,0]=3 69 B4R0.2 O=COC=O MCULE-6311384332 [0,0,0,0,0,0|2,0,0]=2 70 B4R0.2 O=C[N-]C=O MCULE-4923470284 [0,0,0,0,0,0|3,0,0]=3 71 B4R0.2 O=[As]O[As]=O MCULE-6104708983 [0,0,0,0,0,0|4,0,0]=4 72 B4R0.2 OC=CCCl MCULE-4750991393 [0,0,0,0,0,0|3,0,1]=4 73 B4R0.2 OCC=CBr MCULE-4636104289 [0,0,0,0,0,0|3,0,1]=4 74 B4R0.2 OCC=CCl MCULE-2110127594 [0,0,0,0,0,0|3,0,1]=4 75 B3R0.1 Br/C=C/Br MCULE-6284547614 [1,0,0,0,0,0|2,0,0]=3 76 B3R0.1 BrC=CBr MCULE-4478409345 [1,0,0,0,0,0|2,0,0]=3 77 B3R0.1 C#CC=O MCULE-4187736819 [1,0,0,0,0,0|1,0,2]=4 78 B3R0.1 C/C=C/Br MCULE-4076369660 [1,0,0,0,0,0|1,0,1]=3 79 B3R0.1 C/C=N/O MCULE-2376410404 [1,0,0,0,0,0|2,0,1]=4 80 B3R0.1 C=CC#N MCULE-8176403366 [1,0,0,0,0,0|1,0,1]=3 81 B3R0.1 C=CC=C MCULE-4134157329 [1,0,0,0,0,0|0,0,0]=1 82 B3R0.1 C=CC=O MCULE-2104890669 [1,0,0,0,0,0|1,0,0]=2 83 B3R0.1 C=CCBr MCULE-9486454833 [1,0,0,0,0,0|1,0,1]=3 84 B3R0.1 C=CCC MCULE-8167907130 [1,0,0,0,0,0|0,0,2]=3 85 B3R0.1 C=CCCl MCULE-4067772785 [1,0,0,0,0,0|1,0,1]=3 86 B3R0.1 C=CCF MCULE-7783191980 [1,0,0,0,0,0|1,0,1]=3 87 B3R0.1 C=CCI MCULE-5037698873 [1,0,0,0,0,0|1,0,1]=3 88 B3R0.1 C=CCN MCULE-2424616806 [1,0,0,0,0,0|1,0,1]=3 89 B3R0.1 C=CCN MCULE-2473480946 [1,0,0,0,0,0|1,0,1]=3 90 B3R0.1 C=CCO MCULE-2145308838 [1,0,0,0,0,0|1,0,1]=3 91 B3R0.1 C=CCS MCULE-7270484838 [1,0,0,0,0,0|1,0,1]=3 92 B3R0.1 C=COC MCULE-4880746684 [1,0,0,0,0,0|0,0,1]=2 93 B3R0.1 CC=CBr MCULE-2098755460 [1,0,0,0,0,0|1,0,1]=3 94 B3R0.1 CC=CCl MCULE-9225887510 [1,0,0,0,0,0|1,0,1]=3 95 B3R0.1 CC=NO MCULE-9761317381 [1,0,0,0,0,0|2,0,1]=4 96 B3R0.1 CCC=O MCULE-4079744837 [1,0,0,0,0,0|1,0,2]=4 97 B3R0.1 CCON MCULE-5316082054 [1,0,0,0,0,0|1,0,2]=4 98 B3R0.1 CCON MCULE-6621418839 [1,0,0,0,0,0|1,0,2]=4 99 B3R0.1 CCO[NH3+] MCULE-7670481464 [1,0,0,0,0,0|1,0,2]=4 100 B3R0.1 CCO[NH3+] MCULE-7871083232 [1,0,0,0,0,0|1,0,2]=4 101 B3R0.1 CNC=O MCULE-4739122677 [1,0,0,0,0,0|2,0,1]=4 102 B3R0.1 CNC=S MCULE-1018523469 [1,0,0,0,0,0|2,0,1]=4 103 B3R0.1 CNOC MCULE-1706082503 [1,0,0,0,0,0|1,0,2]=4 104 B3R0.1 CNOC MCULE-6224540090 [1,0,0,0,0,0|1,0,2]=4 105 B3R0.1 COC=O MCULE-9122749354 [1,0,0,0,0,0|1,0,1]=3 106 B3R0.1 COCBr MCULE-2566721472 [1,0,0,0,0,0|1,0,2]=4 107 B3R0.1 COCCl MCULE-5928768006 [1,0,0,0,0,0|1,0,2]=4 108 B3R0.1 COCI MCULE-5215132549 [1,0,0,0,0,0|1,0,2]=4 109 B3R0.1 Cl/C=C/Cl MCULE-8326307647 [1,0,0,0,0,0|2,0,0]=3 110 B3R0.1 Cl/C=C\Cl MCULE-8638364223 [1,0,0,0,0,0|2,0,0]=3 111 B3R0.1 ClC=CCl MCULE-1709740532 [1,0,0,0,0,0|2,0,0]=3 112 B3R0.1 F/C=C/Cl MCULE-6748930384 [1,0,0,0,0,0|2,0,0]=3 113 B3R0.1 FC=CBr MCULE-3730796032 [1,0,0,0,0,0|2,0,0]=3 114 B3R0.1 FC=CCl MCULE-8668714110 [1,0,0,0,0,0|2,0,0]=3 115 B3R0.1 FC=CF MCULE-1668825245 [1,0,0,0,0,0|2,0,0]=3 116 B3R0.1 N/C=N/O MCULE-9567664507 [1,0,0,0,0,0|3,0,0]=4 117 B3R0.1 NNC=O MCULE-6986968107 [1,0,0,0,0,0|3,0,0]=4 118 B3R0.1 NOC=O MCULE-4489199776 [1,0,0,0,0,0|2,0,0]=3 119 B3R0.1 O=CC=O MCULE-3212938778 [1,0,0,0,0,0|2,0,0]=3 120 B3R0.1 O=CCBr MCULE-9076011270 [1,0,0,0,0,0|2,0,1]=4 121 B3R0.1 O=CCCl MCULE-7307216184 [1,0,0,0,0,0|2,0,1]=4 122 B3R0.1 O=CCI MCULE-1146810366 [1,0,0,0,0,0|2,0,1]=4 123 B5R0.1 C/C=C/C(=O)C MCULE-2109656516 [0,1,0,0,0,0|1,0,2]=4 124 B5R0.1 C/C=C/C(=O)Cl MCULE-8378824386 [0,1,0,0,0,0|2,0,1]=4 125 B5R0.1 C/C=C/C(=O)N MCULE-2532228624 [0,1,0,0,0,0|2,0,1]=4 126 B5R0.1 C/C=C/C(=O)O MCULE-6937494852 [0,1,0,0,0,0|2,0,1]=4 127 B5R0.1 C=C(Br)CCBr MCULE-7638627279 [0,1,0,0,0,0|2,0,1]=4 128 B5R0.1 C=C(Br)CCO MCULE-3743908958 [0,1,0,0,0,0|2,0,1]=4 129 B5R0.1 C=C(Br)COC MCULE-5349428431 [0,1,0,0,0,0|2,0,1]=4 130 B5R0.1 C=C(C)CCBr MCULE-3439794005 [0,1,0,0,0,0|2,0,1]=4 131 B5R0.1 C=C(C)CCC MCULE-8225129744 [0,1,0,0,0,0|1,0,2]=4 132 B5R0.1 C=C(C)CCCl MCULE-2816016781 [0,1,0,0,0,0|2,0,1]=4 133 B5R0.1 C=C(C)CCI MCULE-6317205481 [0,1,0,0,0,0|2,0,1]=4 134 B5R0.1 C=C(C)CCN MCULE-4037025602 [0,1,0,0,0,0|2,0,1]=4 135 B5R0.1 C=C(C)CCN MCULE-5001503744 [0,1,0,0,0,0|2,0,1]=4 136 B5R0.1 C=C(C)CCO MCULE-2689800711 [0,1,0,0,0,0|2,0,1]=4 137 B5R0.1 C=C(C)CNC MCULE-6783886553 [0,1,0,0,0,0|2,0,1]=4 138 B5R0.1 C=C(C)CNC MCULE-8292313282 [0,1,0,0,0,0|2,0,1]=4 139 B5R0.1 C=C(C)CNN MCULE-1117931770 [0,1,0,0,0,0|3,0,0]=4 140 B5R0.1 C=C(C)CON MCULE-2773974323 [0,1,0,0,0,0|3,0,0]=4 141 B5R0.1 C=C(C)CON MCULE-5978680243 [0,1,0,0,0,0|3,0,0]=4 142 B5R0.1 C=C(C)OCC MCULE-5303468686 [0,1,0,0,0,0|0,0,2]=3 143 B5R0.1 C=CC=C(C)C MCULE-7590870659 [0,1,0,0,0,0|1,0,1]=3 144 B5R0.1 C=CC=C(Cl)Cl MCULE-3787858961 [0,1,0,0,0,0|2,0,0]=3 145 B5R0.1 C=CCB(O)O MCULE-2306600658 [0,1,0,0,0,0|3,0,0]=4 146 B5R0.1 C=CCC(=C)C MCULE-6294070836 [0,1,0,0,0,0|1,0,0]=2 147 B5R0.1 C=CCC(=N)N MCULE-6305125234 [0,1,0,0,0,0|2,0,0]=3 148 B5R0.1 C=CCC(=O)Cl MCULE-6033189203 [0,1,0,0,0,0|2,0,0]=3 149 B5R0.1 C=CCC(=O)N MCULE-1205335257 [0,1,0,0,0,0|2,0,0]=3 150 B5R0.1 C=CCC(=O)O MCULE-6288979337 [0,1,0,0,0,0|2,0,0]=3 151 B5R0.1 C=CCC(C)Br MCULE-5638987302 [0,1,0,0,0,0|1,0,2]=4 152 B5R0.1 C=CCC(C)C MCULE-4586731422 [0,1,0,0,0,0|1,0,2]=4 153 B5R0.1 C=CCC(C)N MCULE-5354228552 [0,1,0,0,0,0|1,0,2]=4 154 B5R0.1 C=CCC(C)N MCULE-9454660067 [0,1,0,0,0,0|1,0,2]=4 155 B5R0.1 C=CCC(C)O MCULE-7724200334 [0,1,0,0,0,0|1,0,2]=4 156 B5R0.1 C=CCC(C)O MCULE-9910771503 [0,1,0,0,0,0|1,0,2]=4 157 B5R0.1 C=CCN(C)C MCULE-6958853335 [0,1,0,0,0,0|2,0,1]=4 158 B5R0.1 C=CC[C@@H](C)O MCULE-1663575568 [0,1,0,0,0,0|1,0,2]=4 159 B5R0.1 C=CC[C@@H](C)O MCULE-3971480179 [0,1,0,0,0,0|1,0,2]=4 160 B5R0.1 C=CC[C@H](C)N MCULE-2398654329 [0,1,0,0,0,0|1,0,2]=4 161 B5R0.1 C=CC[C@H](C)N MCULE-5817451810 [0,1,0,0,0,0|1,0,2]=4 162 B5R0.1 C=CC[C@H](C)O MCULE-5783959808 [0,1,0,0,0,0|1,0,2]=4 163 B5R0.1 C=CC[C@H](C)O MCULE-6146696600 [0,1,0,0,0,0|1,0,2]=4 164 B5R0.1 C=CNC(=O)C MCULE-1260296806 [0,1,0,0,0,0|1,0,1]=3 165 B5R0.1 C=CNC(=O)N MCULE-4235216182 [0,1,0,0,0,0|2,0,0]=3 166 B5R0.1 C=COC(=O)C MCULE-7626795765 [0,1,0,0,0,0|0,0,1]=2 167 B5R0.1 C=COC(=O)Cl MCULE-9915729615 [0,1,0,0,0,0|1,0,0]=2 168 B5R0.1 C=COC(C)C MCULE-6339383821 [0,1,0,0,0,0|0,0,2]=3 169 B5R0.1 C=C[CH+]C(=O)[O-] MCULE-7935071431 [0,1,0,0,0,0|2,0,0]=3 170 B5R0.1 C=NCC(=O)N MCULE-7609497329 [0,1,0,0,0,0|3,0,0]=4 171 B5R0.1 C=NCC(=S)N MCULE-6261527142 [0,1,0,0,0,0|3,0,0]=4 172 B5R0.1 CC(=CC=O)C MCULE-7002222435 [0,1,0,0,0,0|2,0,1]=4 173 B5R0.1 CC(=CC=O)Cl MCULE-2279693190 [0,1,0,0,0,0|2,0,1]=4 174 B5R0.1 CC(=CC=O)N MCULE-2659507627 [0,1,0,0,0,0|2,0,1]=4 175 B5R0.1 CC(=O)OCBr MCULE-9842804945 [0,1,0,0,0,0|1,0,2]=4 176 B5R0.1 CC(=O)OCCl MCULE-6822222026 [0,1,0,0,0,0|1,0,2]=4 177 B5R0.1 CC(C)OC=O MCULE-8263698122 [0,1,0,0,0,0|1,0,2]=4 178 B5R0.1 CC=CC(=O)C MCULE-4826977340 [0,1,0,0,0,0|1,0,2]=4 179 B5R0.1 CC=CC(=O)Cl MCULE-2747622237 [0,1,0,0,0,0|2,0,1]=4 180 B5R0.1 CC=CC(=O)N MCULE-9693879476 [0,1,0,0,0,0|2,0,1]=4 181 B5R0.1 CC=CC(=O)O MCULE-7970410217 [0,1,0,0,0,0|2,0,1]=4 182 B5R0.1 CCOC(=N)C MCULE-3060267072 [0,1,0,0,0,0|0,0,3]=4 183 B5R0.1 CCOC(=N)C MCULE-3943786182 [0,1,0,0,0,0|0,0,3]=4 184 B5R0.1 CCOC(=N)N MCULE-3570858508 [0,1,0,0,0,0|1,0,2]=4 185 B5R0.1 CCOC(=N)N MCULE-6061063856 [0,1,0,0,0,0|1,0,2]=4 186 B5R0.1 CCOC(=O)C MCULE-6628539781 [0,1,0,0,0,0|0,0,3]=4 187 B5R0.1 CCOC(=O)Cl MCULE-4167904934 [0,1,0,0,0,0|1,0,2]=4 188 B5R0.1 CCOC(=O)N MCULE-1776877276 [0,1,0,0,0,0|1,0,2]=4 189 B5R0.1 CCOC(=S)C MCULE-3358897597 [0,1,0,0,0,0|0,0,3]=4 190 B5R0.1 CCOC(=S)N MCULE-4649285010 [0,1,0,0,0,0|1,0,2]=4 191 B5R0.1 CCOC(=S)[S-] MCULE-6247969567 [0,1,0,0,0,0|1,0,2]=4 192 B5R0.1 CCOC(=S)[S-] MCULE-6902289618 [0,1,0,0,0,0|1,0,2]=4 193 B5R0.1 CCOC(=S)[S-] MCULE-9105300958 [0,1,0,0,0,0|1,0,2]=4 194 B5R0.1 CNOC(=O)C MCULE-1464426541 [0,1,0,0,0,0|1,0,2]=4 195 B5R0.1 CNOC(=O)C MCULE-2976282666 [0,1,0,0,0,0|1,0,2]=4 196 B5R0.1 N=C(N)NC=O MCULE-2702198735 [0,1,0,0,0,0|3,0,0]=4 197 B5R0.1 NC(=O)C=CCl MCULE-3595468874 [0,1,0,0,0,0|3,0,0]=4 198 B5R0.1 O=C(Cl)C=CCl MCULE-7984379237 [0,1,0,0,0,0|3,0,0]=4 199 B5R0.1 O=C(Cl)OCCl MCULE-2130588147 [0,1,0,0,0,0|2,0,1]=4 200 B5R0.1 O=C(O)/C=C/Br MCULE-7284519266 [0,1,0,0,0,0|3,0,0]=4 201 B5R0.1 O=C(O)/C=C/Cl MCULE-1625781671 [0,1,0,0,0,0|3,0,0]=4 202 B5R0.1 O=C(O)/C=C/I MCULE-3339607379 [0,1,0,0,0,0|3,0,0]=4 203 B5R0.1 O=C(O)/C=C\Br MCULE-6149049313 [0,1,0,0,0,0|3,0,0]=4 204 B5R0.1 O=C(O)/C=C\Cl MCULE-1221996674 [0,1,0,0,0,0|3,0,0]=4 205 B5R0.1 O=C(O)/C=C\I MCULE-3065405012 [0,1,0,0,0,0|3,0,0]=4 206 B5R0.1 O=C(O)C=CBr MCULE-2956464856 [0,1,0,0,0,0|3,0,0]=4 207 B5R0.1 O=C(O)C=CCl MCULE-6369812151 [0,1,0,0,0,0|3,0,0]=4 208 B5R0.1 O=C(O)C=CI MCULE-7162332129 [0,1,0,0,0,0|3,0,0]=4 209 B5R0.1 O=C([O-])C=CCl MCULE-4750072789 [0,1,0,0,0,0|3,0,0]=4 210 B5R0.2 C#CCCC=C MCULE-4858099861 [0,1,0,0,0,0|1,0,2]=4 211 B5R0.2 C/C=C/C=C/C MCULE-9400628806 [0,1,0,0,0,0|1,0,1]=3 212 B5R0.2 C/C=C/CC#N MCULE-3707973146 [0,1,0,0,0,0|2,0,1]=4 213 B5R0.2 C/C=C/CCC MCULE-9851656818 [0,1,0,0,0,0|1,0,2]=4 214 B5R0.2 C/C=C/CCO MCULE-3952855392 [0,1,0,0,0,0|2,0,1]=4 215 B5R0.2 C/C=C/OCC MCULE-2891896400 [0,1,0,0,0,0|0,0,2]=3 216 B5R0.2 C/C=C\CCC MCULE-1013657748 [0,1,0,0,0,0|1,0,2]=4 217 B5R0.2 C=C/C=C/C=C MCULE-2938938774 [0,1,0,0,0,0|1,0,0]=2 218 B5R0.2 C=C/C=C/CC MCULE-5996202716 [0,1,0,0,0,0|1,0,1]=3 219 B5R0.2 C=C=CCCBr MCULE-5561919067 [0,1,0,0,0,0|2,0,1]=4 220 B5R0.2 C=C=CCCI MCULE-7583015374 [0,1,0,0,0,0|2,0,1]=4 221 B5R0.2 C=C=CCCN MCULE-5814175873 [0,1,0,0,0,0|2,0,1]=4 222 B5R0.2 C=C=CCCN MCULE-8177198091 [0,1,0,0,0,0|2,0,1]=4 223 B5R0.2 C=C=CCCO MCULE-1054355649 [0,1,0,0,0,0|2,0,1]=4 224 B5R0.2 C=C=COC=C MCULE-3691748324 [0,1,0,0,0,0|0,0,0]=1 225 B5R0.2 C=CC#CCO MCULE-5199716906 [0,1,0,0,0,0|1,0,2]=4 226 B5R0.2 C=CC/C=C/C MCULE-8732875285 [0,1,0,0,0,0|1,0,0]=2 227 B5R0.2 C=CCC=CC MCULE-8643449832 [0,1,0,0,0,0|1,0,0]=2 228 B5R0.2 C=CCCC#N MCULE-8967750268 [0,1,0,0,0,0|1,0,2]=4 229 B5R0.2 C=CCCC=C MCULE-2599309974 [0,1,0,0,0,0|1,0,0]=2 230 B5R0.2 C=CCCC=O MCULE-7850336174 [0,1,0,0,0,0|1,0,1]=3 231 B5R0.2 C=CCCCBr MCULE-5027518679 [0,1,0,0,0,0|1,0,2]=4 232 B5R0.2 C=CCCCC MCULE-4750698031 [0,1,0,0,0,0|1,0,2]=4 233 B5R0.2 C=CCCCCl MCULE-3877430809 [0,1,0,0,0,0|1,0,2]=4 234 B5R0.2 C=CCCCI MCULE-8692831514 [0,1,0,0,0,0|1,0,2]=4 235 B5R0.2 C=CCCCN MCULE-5787926547 [0,1,0,0,0,0|1,0,2]=4 236 B5R0.2 C=CCCCN MCULE-7346989227 [0,1,0,0,0,0|1,0,2]=4 237 B5R0.2 C=CCCCO MCULE-5946342321 [0,1,0,0,0,0|1,0,2]=4 238 B5R0.2 C=CCCNC MCULE-2124263362 [0,1,0,0,0,0|1,0,2]=4 239 B5R0.2 C=CCCNC MCULE-5024925990 [0,1,0,0,0,0|1,0,2]=4 240 B5R0.2 C=CCCOC MCULE-4681354270 [0,1,0,0,0,0|1,0,2]=4 241 B5R0.2 C=CCCON MCULE-3476228435 [0,1,0,0,0,0|2,0,1]=4 242 B5R0.2 C=CCCON MCULE-9206052895 [0,1,0,0,0,0|2,0,1]=4 243 B5R0.2 C=CCN=C=O MCULE-3142552406 [0,1,0,0,0,0|2,0,1]=4 244 B5R0.2 C=CCN=C=S MCULE-3404572895 [0,1,0,0,0,0|2,0,1]=4 245 B5R0.2 C=CCN=N#N MCULE-5243443585 [0,1,0,0,0,0|3,0,0]=4 246 B5R0.2 C=CCNC=O MCULE-1911798514 [0,1,0,0,0,0|2,0,0]=3 247 B5R0.2 C=CCNCC MCULE-6987567673 [0,1,0,0,0,0|1,0,2]=4 248 B5R0.2 C=CCNCC MCULE-8318544337 [0,1,0,0,0,0|1,0,2]=4 249 B5R0.2 C=CCOC=C MCULE-7085070702 [0,1,0,0,0,0|0,0,0]=1 250 B5R0.2 C=CCOC=O MCULE-4161785970 [0,1,0,0,0,0|1,0,0]=2 251 B5R0.2 C=CCOCC MCULE-4363356618 [0,1,0,0,0,0|0,0,2]=3 252 B5R0.2 C=CCOCCl MCULE-6656252526 [0,1,0,0,0,0|1,0,1]=3 253 B5R0.2 C=CCONC MCULE-4537899476 [0,1,0,0,0,0|1,0,1]=3 254 B5R0.2 C=CCONC MCULE-9645204142 [0,1,0,0,0,0|1,0,1]=3 255 B5R0.2 C=CCSC#N MCULE-9515980614 [0,1,0,0,0,0|1,1,1]=4 256 B5R0.2 C=CCSCC MCULE-3816911529 [0,1,0,0,0,0|0,1,2]=4 257 B5R0.2 C=CCSSC MCULE-8417830164 [0,1,0,0,0,0|1,1,1]=4 258 B5R0.2 C=COCCC MCULE-4423853666 [0,1,0,0,0,0|0,0,2]=3 259 B5R0.2 C=COCCCl MCULE-7782311030 [0,1,0,0,0,0|0,0,2]=3 260 B5R0.2 C=COCCN MCULE-8052872924 [0,1,0,0,0,0|0,0,2]=3 261 B5R0.2 C=COCCN MCULE-8496820259 [0,1,0,0,0,0|0,0,2]=3 262 B5R0.2 C=COCCO MCULE-9383372818 [0,1,0,0,0,0|0,0,2]=3 263 B5R0.2 CC/C=C/C=O MCULE-5102906061 [0,1,0,0,0,0|1,0,2]=4 264 B5R0.2 CC=CC=CC MCULE-7702675183 [0,1,0,0,0,0|1,0,1]=3 265 B5R0.2 CC=CCC#N MCULE-6960681395 [0,1,0,0,0,0|2,0,1]=4 266 B5R0.2 CC=CCCBr MCULE-7329159278 [0,1,0,0,0,0|2,0,1]=4 267 B5R0.2 CC=CCCC MCULE-8736231124 [0,1,0,0,0,0|1,0,2]=4 268 B5R0.2 CC=CCCN MCULE-5129102475 [0,1,0,0,0,0|2,0,1]=4 269 B5R0.2 CC=CCCN MCULE-8500001929 [0,1,0,0,0,0|2,0,1]=4 270 B5R0.2 CC=CCCO MCULE-4302367089 [0,1,0,0,0,0|2,0,1]=4 271 B5R0.2 CC=COCC MCULE-1473170404 [0,1,0,0,0,0|0,0,2]=3 272 B5R0.2 CC=CSSC MCULE-2442770677 [0,1,0,0,0,0|1,1,1]=4 273 B5R0.2 CCC=CC=O MCULE-1318250395 [0,1,0,0,0,0|1,0,2]=4 274 B5R0.2 CCCOC=O MCULE-3133604529 [0,1,0,0,0,0|1,0,2]=4 275 B5R0.2 CCO/C=C\Br MCULE-7396084973 [0,1,0,0,0,0|0,0,2]=3 276 B5R0.2 CCOC=CBr MCULE-5241125671 [0,1,0,0,0,0|0,0,2]=3 277 B5R0.2 N#CCOC=O MCULE-4453241991 [0,1,0,0,0,0|1,0,2]=4 278 B5R0.2 NOC/C=C/Cl MCULE-3781481075 [0,1,0,0,0,0|3,0,0]=4 279 B5R0.2 NOC/C=C/Cl MCULE-8874475488 [0,1,0,0,0,0|3,0,0]=4 280 B5R0.2 NOCC=CCl MCULE-5233830243 [0,1,0,0,0,0|3,0,0]=4 281 B5R0.2 NOCC=CCl MCULE-7677577759 [0,1,0,0,0,0|3,0,0]=4 282 B5R0.2 O=CCCC=O MCULE-3362810468 [0,1,0,0,0,0|2,0,1]=4 283 B5R0.2 O=CCCC=O MCULE-3813951568 [0,1,0,0,0,0|2,0,1]=4 284 B5R0.2 O=CNNC=O MCULE-7634212643 [0,1,0,0,0,0|3,0,0]=4 285 B5R0.2 O=COCCO MCULE-1922672843 [0,1,0,0,0,0|1,0,2]=4 286 B5R0.2 OC=CCCBr MCULE-3964604828 [0,1,0,0,0,0|2,0,1]=4 287 B5R0.2 OC=CCCBr MCULE-5728835735 [0,1,0,0,0,0|2,0,1]=4 288 B5R0.3 C#CC(O)C=C MCULE-5849420618 [0,1,0,0,0,0|1,0,2]=4 289 B5R0.3 C/C(=C\N)/C=O MCULE-4713460468 [0,1,0,0,0,0|3,0,0]=4 290 B5R0.3 C/C=C(\C)/C=O MCULE-2818872726 [0,1,0,0,0,0|2,0,1]=4 291 B5R0.3 C=C/C(=C/C)/C MCULE-6445909882 [0,1,0,0,0,0|1,0,1]=3 292 B5R0.3 C=CC(=CC)C MCULE-8585683674 [0,1,0,0,0,0|1,0,1]=3 293 B5R0.3 C=CC(=O)C=C MCULE-8555160354 [0,1,0,0,0,0|1,0,0]=2 294 B5R0.3 C=CC(=O)CC MCULE-7277696617 [0,1,0,0,0,0|1,0,2]=4 295 B5R0.3 C=CC(=O)NC MCULE-5619481947 [0,1,0,0,0,0|2,0,1]=4 296 B5R0.3 C=CC(=O)NN MCULE-4327484127 [0,1,0,0,0,0|3,0,0]=4 297 B5R0.3 C=CC(=O)NN MCULE-4961696321 [0,1,0,0,0,0|3,0,0]=4 298 B5R0.3 C=CC(=O)NO MCULE-9528737042 [0,1,0,0,0,0|3,0,0]=4 299 B5R0.3 C=CC(=O)OC MCULE-6010665978 [0,1,0,0,0,0|2,0,1]=4 300 B5R0.3 C=CC(C)C#N MCULE-7507500865 [0,1,0,0,0,0|2,0,1]=4 301 B5R0.3 C=CC(C)CC MCULE-8112547661 [0,1,0,0,0,0|1,0,2]=4 302 B5R0.3 C=CC(C)NC MCULE-1929679074 [0,1,0,0,0,0|2,0,1]=4 303 B5R0.3 C=CC(C)NC MCULE-6382339452 [0,1,0,0,0,0|2,0,1]=4 304 B5R0.3 C=CC(C)ON MCULE-2385478473 [0,1,0,0,0,0|3,0,0]=4 305 B5R0.3 C=CC(C)ON MCULE-3428023923 [0,1,0,0,0,0|3,0,0]=4 306 B5R0.3 C=CC(Cl)CCl MCULE-8000466907 [0,1,0,0,0,0|2,0,1]=4 307 B5R0.3 C=CC(N)CC MCULE-6270835453 [0,1,0,0,0,0|1,0,2]=4 308 B5R0.3 C=CC(N)CC MCULE-7920121163 [0,1,0,0,0,0|1,0,2]=4 309 B5R0.3 C=CC(N)CO MCULE-2457433196 [0,1,0,0,0,0|2,0,1]=4 310 B5R0.3 C=CC(N)CO MCULE-6697949182 [0,1,0,0,0,0|2,0,1]=4 311 B5R0.3 C=CC(N)CO MCULE-7137123222 [0,1,0,0,0,0|2,0,1]=4 312 B5R0.3 C=CC(N)CO MCULE-8388687355 [0,1,0,0,0,0|2,0,1]=4 313 B5R0.3 C=CC(O)C#N MCULE-2341615846 [0,1,0,0,0,0|2,0,1]=4 314 B5R0.3 C=CC(O)C=C MCULE-7283842025 [0,1,0,0,0,0|1,0,0]=2 315 B5R0.3 C=CC(O)CBr MCULE-3538023814 [0,1,0,0,0,0|2,0,1]=4 316 B5R0.3 C=CC(O)CC MCULE-2794806228 [0,1,0,0,0,0|1,0,2]=4 317 B5R0.3 C=CC(O)CN MCULE-3472823475 [0,1,0,0,0,0|2,0,1]=4 318 B5R0.3 C=CC(O)CO MCULE-6172654550 [0,1,0,0,0,0|2,0,1]=4 319 B5R0.3 C=CS(=O)C=C MCULE-5650907653 [0,1,0,0,0,0|0,1,0]=2 320 B5R0.3 C=C[C@@H](N)CO MCULE-1000343618 [0,1,0,0,0,0|2,0,1]=4 321 B5R0.3 C=C[C@@H](N)CO MCULE-1074988940 [0,1,0,0,0,0|2,0,1]=4 322 B5R0.3 C=C[C@@H](N)CO MCULE-3685491078 [0,1,0,0,0,0|2,0,1]=4 323 B5R0.3 C=C[C@@H](N)CO MCULE-4969611575 [0,1,0,0,0,0|2,0,1]=4 324 B5R0.3 C=C[C@@H](O)CO MCULE-5957455616 [0,1,0,0,0,0|2,0,1]=4 325 B5R0.3 C=C[C@H](N)CO MCULE-2834725512 [0,1,0,0,0,0|2,0,1]=4 326 B5R0.3 C=C[C@H](N)CO MCULE-3281738311 [0,1,0,0,0,0|2,0,1]=4 327 B5R0.3 C=C[C@H](N)CO MCULE-3551585090 [0,1,0,0,0,0|2,0,1]=4 328 B5R0.3 C=C[C@H](N)CO MCULE-9055556349 [0,1,0,0,0,0|2,0,1]=4 329 B5R0.3 C=C[C@H](O)CO MCULE-6068203844 [0,1,0,0,0,0|2,0,1]=4 330 B5R0.3 C=C[C@H](O)CO MCULE-9367072182 [0,1,0,0,0,0|2,0,1]=4 331 B5R0.3 CC(=CN)C=O MCULE-5507488903 [0,1,0,0,0,0|3,0,0]=4 332 B5R0.3 CC=C(Br)C=O MCULE-4703333701 [0,1,0,0,0,0|2,0,1]=4 333 B5R0.3 CC=C(C)C=O MCULE-9453566957 [0,1,0,0,0,0|2,0,1]=4 334 B5R0.3 CN(C=O)C=O MCULE-7774435044 [0,1,0,0,0,0|3,0,0]=4 335 B5R0.3 O=CC(=CO)Br MCULE-8777401868 [0,1,0,0,0,0|3,0,0]=4 336 B5R0.3 O=CC(=C[O-])F MCULE-8068241665 [0,1,0,0,0,0|3,0,0]=4 337 B5R0.3 O=CC(=C[O-])F MCULE-9099292239 [0,1,0,0,0,0|3,0,0]=4 338 B5R0.3 O=CC(Br)C=O MCULE-4387864308 [0,1,0,0,0,0|3,0,0]=4 339 B5R0.3 O=CC(Cl)C=O MCULE-4927811862 [0,1,0,0,0,0|3,0,0]=4 340 B5R1.1 C1=CCC=C1 MCULE-1776679581 [0,0,0,1,0,0|1,0,0]=2 341 B5R1.1 C1=CCCC1 MCULE-8785635218 [0,0,0,1,0,0|1,0,2]=4 342 B5R1.1 C1=CCNC1 MCULE-4645888757 [0,0,0,1,0,0|1,0,2]=4 343 B5R1.1 C1=CCNC1 MCULE-7386427096 [0,0,0,1,0,0|1,0,2]=4 344 B5R1.1 C1=CCOC1 MCULE-1252378718 [0,0,0,1,0,0|0,0,2]=3 345 B5R1.1 C1=CCSC1 MCULE-7848219599 [0,0,0,1,0,0|0,1,2]=4 346 B5R1.1 C1=CNC=C1 MCULE-7417495535 [0,0,0,1,0,0|1,0,0]=2 347 B5R1.1 C1=CNC=N1 MCULE-1256901064 [0,0,0,1,0,0|2,0,0]=3 348 B5R1.1 C1=CNC=N1 MCULE-1410806694 [0,0,0,1,0,0|2,0,0]=3 349 B5R1.1 C1=CNC=N1 MCULE-5649243123 [0,0,0,1,0,0|2,0,0]=3 350 B5R1.1 C1=CNC=N1 MCULE-6335507586 [0,0,0,1,0,0|2,0,0]=3 351 B5R1.1 C1=CNN=C1 MCULE-9342475145 [0,0,0,1,0,0|2,0,0]=3 352 B5R1.1 C1=CNN=N1 MCULE-9027372824 [0,0,0,1,0,0|3,0,0]=4 353 B5R1.1 C1=COC=C1 MCULE-6076190179 [0,0,0,1,0,0|0,0,0]=1 354 B5R1.1 C1=COC=N1 MCULE-4239266587 [0,0,0,1,0,0|1,0,0]=2 355 B5R1.1 C1=COCC1 MCULE-7714726225 [0,0,0,1,0,0|0,0,2]=3 356 B5R1.1 C1=CON=C1 MCULE-4177650025 [0,0,0,1,0,0|1,0,0]=2 357 B5R1.1 C1=CSC=C1 MCULE-5759025979 [0,0,0,1,0,0|0,1,0]=2 358 B5R1.1 C1=CSC=N1 MCULE-2839580990 [0,0,0,1,0,0|1,1,0]=3 359 B5R1.1 C1=CSN=C1 MCULE-7711497319 [0,0,0,1,0,0|1,1,0]=3 360 B5R1.1 C1=C[N-]C=N1 MCULE-2590868668 [0,0,0,1,0,0|2,0,0]=3 361 B5R1.1 C1=C[N-]C=N1 MCULE-7665637014 [0,0,0,1,0,0|2,0,0]=3 362 B5R1.1 C1=C[Se]C=C1 MCULE-2438977476 [0,0,0,1,0,0|0,1,0]=2 363 B5R1.1 C1=NC=NN1 MCULE-3522189420 [0,0,0,1,0,0|3,0,0]=4 364 B5R1.1 C1=NC=N[N-]1 MCULE-4858966495 [0,0,0,1,0,0|3,0,0]=4 365 B5R1.1 C1=NC=N[N-]1 MCULE-9511234084 [0,0,0,1,0,0|3,0,0]=4 366 B5R1.1 C1=NN=CO1 MCULE-2512252204 [0,0,0,1,0,0|2,0,0]=3 367 B5R1.1 C1=NN=CS1 MCULE-1697345730 [0,0,0,1,0,0|2,1,0]=4 368 B5R1.2 BrC1=CCC1 MCULE-7839710306 [0,0,0,1,0,0|2,0,1]=4 369 B5R1.2 C=C1CCC1 MCULE-8318650413 [0,0,0,1,0,0|1,0,2]=4 370 B5R1.2 C=C1CNC1 MCULE-1391021267 [0,0,0,1,0,0|2,0,1]=4 371 B5R1.2 C=C1CNC1 MCULE-7957953185 [0,0,0,1,0,0|2,0,1]=4 372 B5R1.2 C=C1COC1 MCULE-1822645869 [0,0,0,1,0,0|2,0,1]=4 373 B5R1.2 O=C1CCO1 MCULE-1277069147 [0,0,0,1,0,0|1,0,2]=4 374 B5R1.3 C=CC1CC1 MCULE-4323158851 [0,0,0,1,0,0|1,0,2]=4 375 B5R1.3 C=CC1CO1 MCULE-1428696186 [0,0,0,1,0,0|2,0,1]=4 376 B5R1.3 [C@@H]1(CO1)C=C MCULE-9776744095 [0,0,0,1,0,0|2,0,1]=4 377 B5R1.3 [C@H]1(CO1)C=C MCULE-7934901088 [0,0,0,1,0,0|2,0,1]=4 378 B2R0.1 C=C=C MCULE-2040872097 [2,0,0,0,0,0|0,0,1]=3 379 B2R0.1 C=CBr MCULE-1481946455 [2,0,0,0,0,0|1,0,0]=3 380 B2R0.1 C=CC MCULE-5223715076 [2,0,0,0,0,0|0,0,1]=3 381 B2R0.1 C=CCl MCULE-9678046268 [2,0,0,0,0,0|1,0,0]=3 382 B2R0.1 C=CI MCULE-2939062322 [2,0,0,0,0,0|1,0,0]=3 383 B2R0.1 C=CO MCULE-8167566239 [2,0,0,0,0,0|0,0,0]=2 384 B2R0.1 C=NN MCULE-4427606079 [2,0,0,0,0,0|2,0,0]=4 385 B2R0.1 C=NO MCULE-1312312591 [2,0,0,0,0,0|1,0,0]=3 386 B2R0.1 C=NO MCULE-7599902650 [2,0,0,0,0,0|1,0,0]=3 387 B2R0.1 CC=O MCULE-6002254510 [2,0,0,0,0,0|0,0,2]=4 388 B2R0.1 CC=O MCULE-6800925955 [2,0,0,0,0,0|0,0,2]=4 389 B2R0.1 CCO MCULE-8818474596 [2,0,0,0,0,0|0,0,2]=4 390 B2R0.1 CNO MCULE-5310203084 [2,0,0,0,0,0|1,0,1]=4 391 B2R0.1 CNO MCULE-7072005453 [2,0,0,0,0,0|1,0,1]=4 392 B2R0.1 COC MCULE-4385003255 [2,0,0,0,0,0|0,0,2]=4 393 B2R0.1 CON MCULE-1068458971 [2,0,0,0,0,0|1,0,1]=4 394 B2R0.1 CON MCULE-8687558307 [2,0,0,0,0,0|1,0,1]=4 395 B2R0.1 CO[NH3+] MCULE-6631452734 [2,0,0,0,0,0|1,0,1]=4 396 B2R0.1 CO[NH3+] MCULE-9975010969 [2,0,0,0,0,0|1,0,1]=4 397 B2R0.1 N#CO MCULE-7459250889 [2,0,0,0,0,0|1,0,1]=4 398 B2R0.1 N=CN MCULE-3312866825 [2,0,0,0,0,0|2,0,0]=4 399 B2R0.1 N=CN MCULE-4184922761 [2,0,0,0,0,0|2,0,0]=4 400 B2R0.1 N=CN MCULE-8637660949 [2,0,0,0,0,0|2,0,0]=4 401 B2R0.1 NC=O MCULE-1633954643 [2,0,0,0,0,0|1,0,1]=4 402 B2R0.1 NC=O MCULE-4202420620 [2,0,0,0,0,0|1,0,1]=4 403 B2R0.1 NC=S MCULE-9004645073 [2,0,0,0,0,0|1,1,0]=4 404 B2R0.1 NC=[NH2+] MCULE-1491590547 [2,0,0,0,0,0|2,0,0]=4 405 B2R0.1 O=BO MCULE-1752281859 [2,0,0,0,0,0|2,0,0]=4 406 B2R0.1 O=CO MCULE-7175589186 [2,0,0,0,0,0|1,0,0]=3 407 B2R0.1 O=C[O-] MCULE-2970986504 [2,0,0,0,0,0|1,0,1]=4 408 B2R0.1 O=C[O-] MCULE-3867870864 [2,0,0,0,0,0|1,0,1]=4 409 B2R0.1 O=C[O-] MCULE-4029930501 [2,0,0,0,0,0|1,0,1]=4 410 B2R0.1 O=NO MCULE-6927518919 [2,0,0,0,0,0|2,0,0]=4 411 B2R0.1 O=PO MCULE-5287418544 [2,0,0,0,0,0|2,0,0]=4 412 B2R0.1 OBO MCULE-8455181481 [2,0,0,0,0,0|2,0,0]=4 413 B2R0.1 OPO MCULE-1346196691 [2,0,0,0,0,0|2,0,0]=4 414 B2R0.1 OPO MCULE-5673098193 [2,0,0,0,0,0|2,0,0]=4 415 B2R0.1 [O-]PO MCULE-2811495269 [2,0,0,0,0,0|2,0,0]=4 416 B2R0.1 [O-]PO MCULE-6918966731 [2,0,0,0,0,0|2,0,0]=4 417 B4R0.1 BrC=C(Br)Br MCULE-9536958233 [1,1,0,0,0,0|2,0,0]=4 418 B4R0.1 C#CC(=C)C MCULE-6826835331 [1,1,0,0,0,0|0,0,2]=4 419 B4R0.1 C/C=C(/C)\Cl MCULE-6841426098 [1,1,0,0,0,0|0,0,2]=4 420 B4R0.1 C/C=C(\C)/Br MCULE-3045523462 [1,1,0,0,0,0|0,0,2]=4 421 B4R0.1 C/C=C(\C)/Cl MCULE-4683862502 [1,1,0,0,0,0|0,0,2]=4 422 B4R0.1 C=C(Br)C#N MCULE-6077746884 [1,1,0,0,0,0|1,0,1]=4 423 B4R0.1 C=C(Br)C=O MCULE-9500973388 [1,1,0,0,0,0|1,0,0]=3 424 B4R0.1 C=C(Br)CBr MCULE-1222617820 [1,1,0,0,0,0|1,0,1]=4 425 B4R0.1 C=C(Br)CC MCULE-6271946451 [1,1,0,0,0,0|0,0,2]=4 426 B4R0.1 C=C(Br)CN MCULE-1170417597 [1,1,0,0,0,0|1,0,1]=4 427 B4R0.1 C=C(Br)CN MCULE-9190049156 [1,1,0,0,0,0|1,0,1]=4 428 B4R0.1 C=C(Br)CO MCULE-7763893047 [1,1,0,0,0,0|1,0,1]=4 429 B4R0.1 C=C(C)C#N MCULE-9177849910 [1,1,0,0,0,0|1,0,1]=4 430 B4R0.1 C=C(C)C=O MCULE-3758355501 [1,1,0,0,0,0|1,0,0]=3 431 B4R0.1 C=C(C)CBr MCULE-1361893863 [1,1,0,0,0,0|1,0,1]=4 432 B4R0.1 C=C(C)CCl MCULE-5586406339 [1,1,0,0,0,0|1,0,1]=4 433 B4R0.1 C=C(C)CI MCULE-3678124406 [1,1,0,0,0,0|1,0,1]=4 434 B4R0.1 C=C(C)CN MCULE-1033495975 [1,1,0,0,0,0|1,0,1]=4 435 B4R0.1 C=C(C)CN MCULE-8730181300 [1,1,0,0,0,0|1,0,1]=4 436 B4R0.1 C=C(C)CO MCULE-8641288398 [1,1,0,0,0,0|1,0,1]=4 437 B4R0.1 C=C(C)CS MCULE-5174170431 [1,1,0,0,0,0|1,0,1]=4 438 B4R0.1 C=C(C)OC MCULE-7344104255 [1,1,0,0,0,0|0,0,1]=3 439 B4R0.1 C=C(Cl)C#N MCULE-8612604639 [1,1,0,0,0,0|1,0,1]=4 440 B4R0.1 C=C(Cl)CBr MCULE-9398157024 [1,1,0,0,0,0|1,0,1]=4 441 B4R0.1 C=C(Cl)CCl MCULE-4210429118 [1,1,0,0,0,0|1,0,1]=4 442 B4R0.1 C=C(Cl)CI MCULE-1908004565 [1,1,0,0,0,0|1,0,1]=4 443 B4R0.1 C=C(Cl)CN MCULE-2159410121 [1,1,0,0,0,0|1,0,1]=4 444 B4R0.1 C=C(Cl)CN MCULE-3454023553 [1,1,0,0,0,0|1,0,1]=4 445 B4R0.1 C=C(Cl)CO MCULE-8813337564 [1,1,0,0,0,0|1,0,1]=4 446 B4R0.1 C=C(F)CBr MCULE-6528430141 [1,1,0,0,0,0|1,0,1]=4 447 B4R0.1 C=C(F)CCl MCULE-4499400030 [1,1,0,0,0,0|1,0,1]=4 448 B4R0.1 C=C(F)CN MCULE-1603171858 [1,1,0,0,0,0|1,0,1]=4 449 B4R0.1 C=C(F)CN MCULE-3878727292 [1,1,0,0,0,0|1,0,1]=4 450 B4R0.1 C=C(F)CO MCULE-2779963696 [1,1,0,0,0,0|1,0,1]=4 451 B4R0.1 C=C(I)CO MCULE-2533897125 [1,1,0,0,0,0|1,0,1]=4 452 B4R0.1 C=C=C(C)C MCULE-8705186354 [1,1,0,0,0,0|0,0,2]=4 453 B4R0.1 C=CB(O)O MCULE-2531600001 [1,1,0,0,0,0|2,0,0]=4 454 B4R0.1 C=CC(=C)C MCULE-1668999564 [1,1,0,0,0,0|0,0,0]=2 455 B4R0.1 C=CC(=O)C MCULE-4924646293 [1,1,0,0,0,0|0,0,1]=3 456 B4R0.1 C=CC(=O)Cl MCULE-3579233798 [1,1,0,0,0,0|1,0,0]=3 457 B4R0.1 C=CC(=O)N MCULE-4309430654 [1,1,0,0,0,0|1,0,0]=3 458 B4R0.1 C=CC(=O)O MCULE-9352227082 [1,1,0,0,0,0|1,0,0]=3 459 B4R0.1 C=CC(=O)[O-] MCULE-3928960314 [1,1,0,0,0,0|1,0,0]=3 460 B4R0.1 C=CC(=O)[O-] MCULE-4331301308 [1,1,0,0,0,0|1,0,0]=3 461 B4R0.1 C=CC(=O)[O-] MCULE-5516854555 [1,1,0,0,0,0|1,0,0]=3 462 B4R0.1 C=CC(C)Cl MCULE-1756172983 [1,1,0,0,0,0|0,0,2]=4 463 B4R0.1 C=CC(C)N MCULE-5748048106 [1,1,0,0,0,0|0,0,2]=4 464 B4R0.1 C=CC(C)N MCULE-6786590923 [1,1,0,0,0,0|0,0,2]=4 465 B4R0.1 C=CC(C)O MCULE-4525368256 [1,1,0,0,0,0|0,0,2]=4 466 B4R0.1 C=CN(=O)=O MCULE-1988475489 [1,1,0,0,0,0|2,0,0]=4 467 B4R0.1 C=C[C@@H](C)N MCULE-4388444035 [1,1,0,0,0,0|0,0,2]=4 468 B4R0.1 C=C[C@@H](C)N MCULE-6107415849 [1,1,0,0,0,0|0,0,2]=4 469 B4R0.1 C=C[C@@H](C)N MCULE-6707490046 [1,1,0,0,0,0|0,0,2]=4 470 B4R0.1 C=C[C@@H](C)N MCULE-9654995108 [1,1,0,0,0,0|0,0,2]=4 471 B4R0.1 C=C[C@H](C)N MCULE-1396113041 [1,1,0,0,0,0|0,0,2]=4 472 B4R0.1 C=C[C@H](C)N MCULE-2197513722 [1,1,0,0,0,0|0,0,2]=4 473 B4R0.1 C=C[C@H](C)N MCULE-4698235480 [1,1,0,0,0,0|0,0,2]=4 474 B4R0.1 C=C[C@H](C)N MCULE-8745929233 [1,1,0,0,0,0|0,0,2]=4 475 B4R0.1 C=C[C@H](C)O MCULE-2251589245 [1,1,0,0,0,0|0,0,2]=4 476 B4R0.1 CC(=CBr)C MCULE-9508381610 [1,1,0,0,0,0|1,0,1]=4 477 B4R0.1 CC(=CCl)C MCULE-4321554138 [1,1,0,0,0,0|1,0,1]=4 478 B4R0.1 CC(=CCl)Cl MCULE-3528888685 [1,1,0,0,0,0|1,0,1]=4 479 B4R0.1 CC(=O)C=O MCULE-2718961814 [1,1,0,0,0,0|1,0,1]=4 480 B4R0.1 CC(=O)OO MCULE-6028338742 [1,1,0,0,0,0|1,0,1]=4 481 B4R0.1 CC=C(C)Br MCULE-1371905211 [1,1,0,0,0,0|0,0,2]=4 482 B4R0.1 CC=C(C)C MCULE-4230157245 [1,1,0,0,0,0|0,0,2]=4 483 B4R0.1 CC=C(C)Cl MCULE-3844314543 [1,1,0,0,0,0|0,0,2]=4 484 B4R0.1 CC=C(Cl)Cl MCULE-3741261135 [1,1,0,0,0,0|1,0,1]=4 485 B4R0.1 CC=C(F)F MCULE-5544510852 [1,1,0,0,0,0|1,0,1]=4 486 B4R0.1 COC(=N)C MCULE-2752794913 [1,1,0,0,0,0|0,0,2]=4 487 B4R0.1 COC(=N)C MCULE-2904991083 [1,1,0,0,0,0|0,0,2]=4 488 B4R0.1 COC(=N)N MCULE-1611076737 [1,1,0,0,0,0|1,0,1]=4 489 B4R0.1 COC(=N)N MCULE-4923904579 [1,1,0,0,0,0|1,0,1]=4 490 B4R0.1 COC(=N)N MCULE-6696789855 [1,1,0,0,0,0|1,0,1]=4 491 B4R0.1 COC(=N)N MCULE-9171600210 [1,1,0,0,0,0|1,0,1]=4 492 B4R0.1 COC(=O)C MCULE-7368066093 [1,1,0,0,0,0|0,0,2]=4 493 B4R0.1 COC(=O)Cl MCULE-8022274771 [1,1,0,0,0,0|1,0,1]=4 494 B4R0.1 COC(=O)N MCULE-4070607369 [1,1,0,0,0,0|1,0,1]=4 495 B4R0.1 COC(=S)N MCULE-9414558443 [1,1,0,0,0,0|1,0,1]=4 496 B4R0.1 COC(=S)[S-] MCULE-4829872223 [1,1,0,0,0,0|1,0,1]=4 497 B4R0.1 COC(=S)[S-] MCULE-6509496630 [1,1,0,0,0,0|1,0,1]=4 498 B4R0.1 ClC=C(Cl)Cl MCULE-3945953656 [1,1,0,0,0,0|2,0,0]=4 499 B4R0.1 FC(=CBr)F MCULE-5114290777 [1,1,0,0,0,0|2,0,0]=4 500 B4R0.1 FC=C(Br)Br MCULE-3150710627 [1,1,0,0,0,0|2,0,0]=4 501 B4R0.1 FC=C(F)F MCULE-2449532887 [1,1,0,0,0,0|2,0,0]=4 502 B4R0.1 O=CC(=O)O MCULE-5307898766 [1,1,0,0,0,0|2,0,0]=4 503 B6R0.1 C=CC(=O)OCC MCULE-9281713240 [0,2,0,0,0,0|0,0,2]=4 504 B6R0.1 C=CC/C(=N/O)/N MCULE-6681864760 [0,2,0,0,0,0|2,0,0]=4 505 B6R0.1 C=CCC(=O)CN MCULE-3960819679 [0,2,0,0,0,0|1,0,1]=4 506 B6R0.1 C=CCC(=O)CN MCULE-8089375331 [0,2,0,0,0,0|1,0,1]=4 507 B6R0.1 C=CCC(=O)NC MCULE-4823208577 [0,2,0,0,0,0|1,0,1]=4 508 B6R0.1 C=CCC(=O)OC MCULE-5546680906 [0,2,0,0,0,0|1,0,1]=4 509 B6R0.1 C=CCC(C)C=O MCULE-3981206051 [0,2,0,0,0,0|1,0,1]=4 510 B6R0.1 C=CCC(O)C=C MCULE-3803883413 [0,2,0,0,0,0|1,0,0]=3 511 B6R0.1 C=CC[C@H](C)C=O MCULE-6968117309 [0,2,0,0,0,0|1,0,1]=4 512 B6R0.1 C=COC(=O)CC MCULE-7662621547 [0,2,0,0,0,0|0,0,1]=3 513 B6R0.1 C=COC(=O)CCl MCULE-7675766105 [0,2,0,0,0,0|0,0,1]=3 514 B6R0.1 CCOC(=O)C=O MCULE-3433596669 [0,2,0,0,0,0|0,0,2]=4 515 B6R0.2 C=C(C)C=C(C)C MCULE-1842732141 [0,2,0,0,0,0|1,0,1]=4 516 B6R0.2 C=C(C)CC(=O)C MCULE-3534735279 [0,2,0,0,0,0|1,0,1]=4 517 B6R0.2 C=C(C)CC(=O)O MCULE-5404023928 [0,2,0,0,0,0|2,0,0]=4 518 B6R0.2 C=C(C)OC(=O)C MCULE-9345377025 [0,2,0,0,0,0|0,0,1]=3 519 B6R0.2 C=C(I)CC(=O)O MCULE-3849925169 [0,2,0,0,0,0|2,0,0]=4 520 B6R0.2 CC(=O)OC(=O)C MCULE-9184217748 [0,2,0,0,0,0|0,0,2]=4 521 B6R0.2 N=C(N)OC(=[NH2+])N MCULE-1040352274 [0,2,0,0,0,0|2,0,0]=4 522 B6R0.2 N=C(N)OC(=[NH2+])N MCULE-7233867485 [0,2,0,0,0,0|2,0,0]=4 523 B6R0.3 C=CC(=O)C(=O)O MCULE-9816982424 [0,2,0,0,0,0|2,0,0]=4 524 B6R0.3 C=CC(C)C(=O)O MCULE-7280145889 [0,2,0,0,0,0|2,0,0]=4 525 B6R0.3 C=CC(N)C(=O)O MCULE-2000511750 [0,2,0,0,0,0|2,0,0]=4 526 B6R0.3 C=CC(N)C(=O)O MCULE-7504415267 [0,2,0,0,0,0|2,0,0]=4 527 B6R0.3 C=CC(N)C(=O)O MCULE-9012490000 [0,2,0,0,0,0|2,0,0]=4 528 B6R0.3 C=CC(N)C(=O)O MCULE-9978294266 [0,2,0,0,0,0|2,0,0]=4 529 B6R0.3 C=CC(O)C(=O)O MCULE-3847595710 [0,2,0,0,0,0|2,0,0]=4 530 B6R0.3 C=CN(C)C(=O)C MCULE-2418332000 [0,2,0,0,0,0|1,0,1]=4 531 B6R0.3 C=C[C@@H](C)C(=O)O MCULE-9719548038 [0,2,0,0,0,0|2,0,0]=4 532 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-3678761806 [0,2,0,0,0,0|2,0,0]=4 533 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-6682447306 [0,2,0,0,0,0|2,0,0]=4 534 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-6779191781 [0,2,0,0,0,0|2,0,0]=4 535 B6R0.3 C=C[C@H](C)C(=O)O MCULE-1694697840 [0,2,0,0,0,0|2,0,0]=4 536 B6R0.3 C=C[C@H](C)C(=O)O MCULE-2601438258 [0,2,0,0,0,0|2,0,0]=4 537 B6R0.3 C=C[C@H](C)C(=O)O MCULE-6098133430 [0,2,0,0,0,0|2,0,0]=4 538 B6R0.3 C=C[C@H](N)C(=O)O MCULE-2657488498 [0,2,0,0,0,0|2,0,0]=4 539 B6R0.3 C=C[C@H](N)C(=O)O MCULE-5103456570 [0,2,0,0,0,0|2,0,0]=4 540 B6R0.3 C=C[C@H](N)C(=O)O MCULE-5936124947 [0,2,0,0,0,0|2,0,0]=4 541 B6R0.3 C=C[C@H](N)C(=O)O MCULE-9631686254 [0,2,0,0,0,0|2,0,0]=4 542 B6R0.3 [C@@H](N)(C=C)C(=O)O MCULE-9406839633 [0,2,0,0,0,0|2,0,0]=4 543 B6R0.4 C/C=C/CC(=O)Cl MCULE-5377125313 [0,2,0,0,0,0|2,0,0]=4 544 B6R0.4 C/C=C/CC(=O)N MCULE-1942934157 [0,2,0,0,0,0|2,0,0]=4 545 B6R0.4 C/C=C/CC(=O)O MCULE-4626577048 [0,2,0,0,0,0|2,0,0]=4 546 B6R0.4 C=C/C=C/C(=O)O MCULE-7975593411 [0,2,0,0,0,0|1,0,0]=3 547 B6R0.4 C=C=CCC(=O)O MCULE-2611659307 [0,2,0,0,0,0|2,0,0]=4 548 B6R0.4 C=CC=CC(=O)Cl MCULE-6383997047 [0,2,0,0,0,0|1,0,0]=3 549 B6R0.4 C=CC=CC(=O)O MCULE-5189540617 [0,2,0,0,0,0|1,0,0]=3 550 B6R0.4 C=CCCC(=C)C MCULE-2323382963 [0,2,0,0,0,0|1,0,0]=3 551 B6R0.4 C=CCCC(=N)N MCULE-6900789687 [0,2,0,0,0,0|1,0,1]=4 552 B6R0.4 C=CCCC(=N)N MCULE-8560021860 [0,2,0,0,0,0|1,0,1]=4 553 B6R0.4 C=CCCC(=O)C MCULE-9598399930 [0,2,0,0,0,0|1,0,1]=4 554 B6R0.4 C=CCCC(=O)Cl MCULE-7378353157 [0,2,0,0,0,0|1,0,1]=4 555 B6R0.4 C=CCCC(=O)N MCULE-7202462484 [0,2,0,0,0,0|1,0,1]=4 556 B6R0.4 C=CCCC(=O)O MCULE-6221951425 [0,2,0,0,0,0|1,0,1]=4 557 B6R0.4 C=CCNC(=O)C MCULE-7903624915 [0,2,0,0,0,0|1,0,1]=4 558 B6R0.4 C=CCNC(=O)N MCULE-1210131291 [0,2,0,0,0,0|2,0,0]=4 559 B6R0.4 C=CCNC(=S)N MCULE-4099442157 [0,2,0,0,0,0|2,0,0]=4 560 B6R0.4 C=CCOC(=O)C MCULE-9991130828 [0,2,0,0,0,0|0,0,1]=3 561 B6R0.4 C=CCOC(=O)Cl MCULE-3513251417 [0,2,0,0,0,0|1,0,0]=3 562 B6R0.4 C=CCOC(=O)N MCULE-4119124558 [0,2,0,0,0,0|1,0,0]=3 563 B6R0.4 C=CCSC(=N)N MCULE-8236628420 [0,2,0,0,0,0|1,1,0]=4 564 B6R0.4 C=CCSC(=[NH2+])N MCULE-7174450469 [0,2,0,0,0,0|1,1,0]=4 565 B6R0.4 C=CNCC(=O)O MCULE-5142273921 [0,2,0,0,0,0|1,0,1]=4 566 B6R0.4 C=COCC(C)C MCULE-7268141053 [0,2,0,0,0,0|0,0,2]=4 567 B6R0.4 C=CON=C(C)C MCULE-5340817509 [0,2,0,0,0,0|0,0,1]=3 568 B6R0.4 CC=CCC(=O)O MCULE-9174714653 [0,2,0,0,0,0|2,0,0]=4 569 B6R0.5 C=COC(C)(C)C MCULE-5049432761 [0,2,0,0,0,0|0,0,2]=4 570 B6R0.5 C=CO[Si](C)(C)C MCULE-8953873865 [0,2,0,0,0,0|0,1,1]=4 571 B6R0.6 C/C=C/C=C/C#N MCULE-3461215979 [0,2,0,0,0,0|1,0,1]=4 572 B6R0.6 C/C=C/C=C/C=O MCULE-9837225903 [0,2,0,0,0,0|1,0,0]=3 573 B6R0.6 C/C=C/C=C/CO MCULE-3717958585 [0,2,0,0,0,0|1,0,1]=4 574 B6R0.6 C=CC=CCCBr MCULE-8528821525 [0,2,0,0,0,0|1,0,1]=4 575 B6R0.6 C=CC=CCCN MCULE-8129949310 [0,2,0,0,0,0|1,0,1]=4 576 B6R0.6 C=CC=CCCO MCULE-5956097722 [0,2,0,0,0,0|1,0,1]=4 577 B6R0.6 C=CCC/C=C/C MCULE-3936427871 [0,2,0,0,0,0|1,0,0]=3 578 B6R0.6 C=CCCC=CC MCULE-6481809840 [0,2,0,0,0,0|1,0,0]=3 579 B6R0.6 C=CCCCC=O MCULE-8676840281 [0,2,0,0,0,0|1,0,1]=4 580 B6R0.6 C=CCNCC=C MCULE-1595235262 [0,2,0,0,0,0|1,0,0]=3 581 B6R0.6 C=CCNCC=C MCULE-3284076720 [0,2,0,0,0,0|1,0,0]=3 582 B6R0.6 C=CCOCC=C MCULE-1121686176 [0,2,0,0,0,0|0,0,0]=2 583 B6R0.6 C=CCOCC=O MCULE-8507800253 [0,2,0,0,0,0|0,0,1]=3 584 B6R0.6 C=CCOCCBr MCULE-7565992230 [0,2,0,0,0,0|0,0,2]=4 585 B6R0.6 C=CCOCCCl MCULE-1353236332 [0,2,0,0,0,0|0,0,2]=4 586 B6R0.6 C=CCOCCI MCULE-8468439129 [0,2,0,0,0,0|0,0,2]=4 587 B6R0.6 C=CCOCCN MCULE-5411259412 [0,2,0,0,0,0|0,0,2]=4 588 B6R0.6 C=CCOCCN MCULE-9798285838 [0,2,0,0,0,0|0,0,2]=4 589 B6R0.6 C=CCOCCO MCULE-5718868633 [0,2,0,0,0,0|0,0,2]=4 590 B6R0.6 C=CCOCOC MCULE-6553342654 [0,2,0,0,0,0|0,0,2]=4 591 B6R0.6 C=CCSCC=C MCULE-7417537491 [0,2,0,0,0,0|0,1,0]=3 592 B6R0.6 C=COCCCC MCULE-2025922328 [0,2,0,0,0,0|0,0,2]=4 593 B6R0.6 C=COCCCN MCULE-1669664157 [0,2,0,0,0,0|0,0,2]=4 594 B6R0.6 C=COCCCO MCULE-8325617945 [0,2,0,0,0,0|0,0,2]=4 595 B6R0.6 C=COCCOC MCULE-6845218696 [0,2,0,0,0,0|0,0,2]=4 596 B6R0.6 C=COCCON MCULE-8247202981 [0,2,0,0,0,0|0,0,2]=4 597 B6R0.6 CC/C=C\CC=O MCULE-1715953159 [0,2,0,0,0,0|2,0,0]=4 598 B6R0.6 CC=CC=CC#N MCULE-2944741082 [0,2,0,0,0,0|1,0,1]=4 599 B6R0.6 CC=CC=CC=O MCULE-7370101773 [0,2,0,0,0,0|1,0,0]=3 600 B6R0.6 CC=CC=CCN MCULE-9780064235 [0,2,0,0,0,0|1,0,1]=4 601 B6R0.6 CC=CC=CCO MCULE-1802738822 [0,2,0,0,0,0|1,0,1]=4 602 B6R0.6 CCC=CCC=O MCULE-5764198290 [0,2,0,0,0,0|2,0,0]=4 603 B6R0.6 CCC=COCC MCULE-1991976030 [0,2,0,0,0,0|0,0,2]=4 604 B6R0.6 CCO/C=C/C#N MCULE-4278586794 [0,2,0,0,0,0|0,0,2]=4 605 B6R0.6 CCOC=CC#N MCULE-5002780993 [0,2,0,0,0,0|0,0,2]=4 606 B6R0.6 O=CC=CC=C[O-] MCULE-1735082795 [0,2,0,0,0,0|1,0,0]=3 607 B6R0.6 O=CC=CC=C[O-] MCULE-1943976542 [0,2,0,0,0,0|1,0,0]=3 608 B6R0.8 C=CP(=O)(C)C=C MCULE-6499826339 [0,2,0,0,0,0|1,0,0]=3 609 B6R0.8 C=CS(=O)(=O)C=C MCULE-3404825535 [0,2,0,0,0,0|0,1,0]=3 610 B6R0.8 C=C[Si](C)(C)C=C MCULE-9536837452 [0,2,0,0,0,0|1,0,0]=3 611 B6R0.9 C=C[Te+](C=C)CC MCULE-1463602090 [0,2,0,0,0,0|0,1,0]=3 612 B6R0.9 C=C[Te+](C=C)CC MCULE-4459353516 [0,2,0,0,0,0|0,1,0]=3 613 B6R1.2 BrC1=CC=CN1 MCULE-5264580992 [0,1,0,1,0,0|1,0,0]=3 614 B6R1.2 BrC1=CC=CO1 MCULE-5734064318 [0,1,0,1,0,0|0,0,0]=2 615 B6R1.2 BrC1=CC=CS1 MCULE-1364150691 [0,1,0,1,0,0|0,1,0]=3 616 B6R1.2 BrC1=CC=C[Se]1 MCULE-9011330064 [0,1,0,1,0,0|0,1,0]=3 617 B6R1.2 BrC1=CC=NN1 MCULE-9341716246 [0,1,0,1,0,0|2,0,0]=4 618 B6R1.2 BrC1=CC=NO1 MCULE-9219362534 [0,1,0,1,0,0|1,0,0]=3 619 B6R1.2 BrC1=CC=NS1 MCULE-2346915540 [0,1,0,1,0,0|1,1,0]=4 620 B6R1.2 BrC1=CN=CO1 MCULE-5651145478 [0,1,0,1,0,0|1,0,0]=3 621 B6R1.2 BrC1=CN=CO1 MCULE-8656599411 [0,1,0,1,0,0|1,0,0]=3 622 B6R1.2 BrC1=CN=CS1 MCULE-2394006568 [0,1,0,1,0,0|1,1,0]=4 623 B6R1.2 BrC1=CNC=C1 MCULE-2704154564 [0,1,0,1,0,0|1,0,0]=3 624 B6R1.2 BrC1=CNC=N1 MCULE-7584078883 [0,1,0,1,0,0|2,0,0]=4 625 B6R1.2 BrC1=CNN=C1 MCULE-2600716492 [0,1,0,1,0,0|2,0,0]=4 626 B6R1.2 BrC1=COC=C1 MCULE-7282301463 [0,1,0,1,0,0|0,0,0]=2 627 B6R1.2 BrC1=COC=N1 MCULE-3389578396 [0,1,0,1,0,0|1,0,0]=3 628 B6R1.2 BrC1=COC=N1 MCULE-5006735396 [0,1,0,1,0,0|1,0,0]=3 629 B6R1.2 BrC1=COCC1 MCULE-8057569313 [0,1,0,1,0,0|0,0,2]=4 630 B6R1.2 BrC1=CON=C1 MCULE-7025802564 [0,1,0,1,0,0|1,0,0]=3 631 B6R1.2 BrC1=CSC=C1 MCULE-6680927224 [0,1,0,1,0,0|0,1,0]=3 632 B6R1.2 BrC1=CSC=N1 MCULE-6952917931 [0,1,0,1,0,0|1,1,0]=4 633 B6R1.2 BrC1=CSN=C1 MCULE-2285235944 [0,1,0,1,0,0|1,1,0]=4 634 B6R1.2 BrC1=NC=CN1 MCULE-6985395799 [0,1,0,1,0,0|2,0,0]=4 635 B6R1.2 BrC1=NC=CN1 MCULE-8632789036 [0,1,0,1,0,0|2,0,0]=4 636 B6R1.2 BrC1=NC=CO1 MCULE-2104886923 [0,1,0,1,0,0|1,0,0]=3 637 B6R1.2 BrC1=NC=CO1 MCULE-2745860961 [0,1,0,1,0,0|1,0,0]=3 638 B6R1.2 BrC1=NC=CS1 MCULE-9214561330 [0,1,0,1,0,0|1,1,0]=4 639 B6R1.2 BrC1=NN=CO1 MCULE-9908278798 [0,1,0,1,0,0|2,0,0]=4 640 B6R1.2 BrC1=NOC=C1 MCULE-1786338778 [0,1,0,1,0,0|1,0,0]=3 641 B6R1.2 BrC1=NSC=C1 MCULE-5948625316 [0,1,0,1,0,0|1,1,0]=4 642 B6R1.2 CC1=CC=CC1 MCULE-3765599626 [0,1,0,1,0,0|1,0,0]=3 643 B6R1.2 CC1=CC=CN1 MCULE-7608248575 [0,1,0,1,0,0|1,0,0]=3 644 B6R1.2 CC1=CC=CO1 MCULE-3620289319 [0,1,0,1,0,0|0,0,0]=2 645 B6R1.2 CC1=CC=CS1 MCULE-7297776024 [0,1,0,1,0,0|0,1,0]=3 646 B6R1.2 CC1=CC=NN1 MCULE-1457877312 [0,1,0,1,0,0|1,0,1]=4 647 B6R1.2 CC1=CC=NN1 MCULE-3441401586 [0,1,0,1,0,0|1,0,1]=4 648 B6R1.2 CC1=CC=NO1 MCULE-3188314923 [0,1,0,1,0,0|0,0,1]=3 649 B6R1.2 CC1=CC=NS1 MCULE-4163670775 [0,1,0,1,0,0|0,1,1]=4 650 B6R1.2 CC1=CCCO1 MCULE-7276659214 [0,1,0,1,0,0|0,0,2]=4 651 B6R1.2 CC1=CN=CO1 MCULE-4609626879 [0,1,0,1,0,0|0,0,1]=3 652 B6R1.2 CC1=CN=CS1 MCULE-8510377651 [0,1,0,1,0,0|0,1,1]=4 653 B6R1.2 CC1=CNC=C1 MCULE-9114555776 [0,1,0,1,0,0|1,0,0]=3 654 B6R1.2 CC1=CNC=N1 MCULE-9375719449 [0,1,0,1,0,0|1,0,1]=4 655 B6R1.2 CC1=CNN=C1 MCULE-2732751720 [0,1,0,1,0,0|2,0,0]=4 656 B6R1.2 CC1=CNN=C1 MCULE-3538959589 [0,1,0,1,0,0|2,0,0]=4 657 B6R1.2 CC1=COC=C1 MCULE-1597223627 [0,1,0,1,0,0|0,0,0]=2 658 B6R1.2 CC1=COC=N1 MCULE-3497089982 [0,1,0,1,0,0|1,0,0]=3 659 B6R1.2 CC1=CON=C1 MCULE-4312100714 [0,1,0,1,0,0|1,0,0]=3 660 B6R1.2 CC1=CSC=C1 MCULE-1408158529 [0,1,0,1,0,0|0,1,0]=3 661 B6R1.2 CC1=CSC=N1 MCULE-3711308900 [0,1,0,1,0,0|1,0,1]=4 662 B6R1.2 CC1=CSN=C1 MCULE-2603580928 [0,1,0,1,0,0|1,1,0]=4 663 B6R1.2 CC1=NC=CN1 MCULE-4484196639 [0,1,0,1,0,0|1,0,1]=4 664 B6R1.2 CC1=NC=CO1 MCULE-7894525701 [0,1,0,1,0,0|0,0,1]=3 665 B6R1.2 CC1=NC=CS1 MCULE-6863408892 [0,1,0,1,0,0|0,1,1]=4 666 B6R1.2 CC1=NN=CO1 MCULE-5138394000 [0,1,0,1,0,0|1,0,1]=4 667 B6R1.2 CC1=NOC=C1 MCULE-1572732397 [0,1,0,1,0,0|0,0,1]=3 668 B6R1.2 CC1=NOC=N1 MCULE-5841548711 [0,1,0,1,0,0|1,0,1]=4 669 B6R1.2 CC1=NON=C1 MCULE-7563934145 [0,1,0,1,0,0|1,0,1]=4 670 B6R1.2 CC1=NSC=C1 MCULE-6941128185 [0,1,0,1,0,0|0,1,1]=4 671 B6R1.2 CN1C=CC=C1 MCULE-4929965979 [0,1,0,1,0,0|1,0,0]=3 672 B6R1.2 CN1C=CC=N1 MCULE-9409141633 [0,1,0,1,0,0|2,0,0]=4 673 B6R1.2 CN1C=CN=C1 MCULE-1468573178 [0,1,0,1,0,0|1,0,1]=4 674 B6R1.2 CN1C=CN=C1 MCULE-1857627459 [0,1,0,1,0,0|1,0,1]=4 675 B6R1.2 CN1C=CN=C1 MCULE-3087755909 [0,1,0,1,0,0|1,0,1]=4 676 B6R1.2 CN1C=CN=C1 MCULE-7326970566 [0,1,0,1,0,0|1,0,1]=4 677 B6R1.2 CN1C=CN=C1 MCULE-7347723440 [0,1,0,1,0,0|1,0,1]=4 678 B6R1.2 CN1C=C[NH+]=C1 MCULE-1511454799 [0,1,0,1,0,0|1,0,1]=4 679 B6R1.2 ClC1=CC=CO1 MCULE-3538307465 [0,1,0,1,0,0|0,0,0]=2 680 B6R1.2 ClC1=CC=CS1 MCULE-2640438050 [0,1,0,1,0,0|0,1,0]=3 681 B6R1.2 ClC1=CC=NN1 MCULE-3560728451 [0,1,0,1,0,0|2,0,0]=4 682 B6R1.2 ClC1=CN=CS1 MCULE-6088272612 [0,1,0,1,0,0|1,1,0]=4 683 B6R1.2 ClC1=CNC=N1 MCULE-3072422179 [0,1,0,1,0,0|2,0,0]=4 684 B6R1.2 ClC1=CNC=N1 MCULE-8453567278 [0,1,0,1,0,0|2,0,0]=4 685 B6R1.2 ClC1=CNN=C1 MCULE-2092045123 [0,1,0,1,0,0|2,0,0]=4 686 B6R1.2 ClC1=CSC=C1 MCULE-1998275400 [0,1,0,1,0,0|0,1,0]=3 687 B6R1.2 ClC1=CSC=N1 MCULE-9647338017 [0,1,0,1,0,0|1,1,0]=4 688 B6R1.2 ClC1=CSN=C1 MCULE-6113180722 [0,1,0,1,0,0|1,1,0]=4 689 B6R1.2 ClC1=NC=CN1 MCULE-6072122645 [0,1,0,1,0,0|2,0,0]=4 690 B6R1.2 ClC1=NC=CO1 MCULE-1860416745 [0,1,0,1,0,0|1,0,0]=3 691 B6R1.2 ClC1=NC=CO1 MCULE-4765528658 [0,1,0,1,0,0|1,0,0]=3 692 B6R1.2 ClC1=NC=CS1 MCULE-6673458969 [0,1,0,1,0,0|1,1,0]=4 693 B6R1.2 ClC1=NNC=C1 MCULE-6678816051 [0,1,0,1,0,0|2,0,0]=4 694 B6R1.2 ClC1=NSC=C1 MCULE-5743382341 [0,1,0,1,0,0|1,1,0]=4 695 B6R1.2 FC1=CC=CS1 MCULE-5362233873 [0,1,0,1,0,0|0,1,0]=3 696 B6R1.2 FC1=CN=CN1 MCULE-9951835141 [0,1,0,1,0,0|2,0,0]=4 697 B6R1.2 FC1=CNN=C1 MCULE-7981107171 [0,1,0,1,0,0|2,0,0]=4 698 B6R1.2 FC1=CNN=C1 MCULE-9509914186 [0,1,0,1,0,0|2,0,0]=4 699 B6R1.2 FC1=CSC=C1 MCULE-3342972910 [0,1,0,1,0,0|0,1,0]=3 700 B6R1.2 FC1=NC=CN1 MCULE-1860701993 [0,1,0,1,0,0|2,0,0]=4 701 B6R1.2 FC1=NC=CN1 MCULE-5026249596 [0,1,0,1,0,0|2,0,0]=4 702 B6R1.2 FC1=NC=CS1 MCULE-3710058771 [0,1,0,1,0,0|1,1,0]=4 703 B6R1.2 FC1=NNC=C1 MCULE-3532126949 [0,1,0,1,0,0|2,0,0]=4 704 B6R1.2 IC1=CC=CO1 MCULE-6467830719 [0,1,0,1,0,0|0,0,0]=2 705 B6R1.2 IC1=CC=CS1 MCULE-6025659368 [0,1,0,1,0,0|0,1,0]=3 706 B6R1.2 IC1=CC=NN1 MCULE-9744954898 [0,1,0,1,0,0|2,0,0]=4 707 B6R1.2 IC1=CC=NS1 MCULE-7758361866 [0,1,0,1,0,0|1,1,0]=4 708 B6R1.2 IC1=CN=CS1 MCULE-1577269526 [0,1,0,1,0,0|1,1,0]=4 709 B6R1.2 IC1=CNC=C1 MCULE-4230351559 [0,1,0,1,0,0|1,0,0]=3 710 B6R1.2 IC1=CNC=N1 MCULE-9964164089 [0,1,0,1,0,0|2,0,0]=4 711 B6R1.2 IC1=CNN=C1 MCULE-4755201793 [0,1,0,1,0,0|2,0,0]=4 712 B6R1.2 IC1=COC=N1 MCULE-1363022741 [0,1,0,1,0,0|1,0,0]=3 713 B6R1.2 IC1=COC=N1 MCULE-8108166687 [0,1,0,1,0,0|1,0,0]=3 714 B6R1.2 IC1=COCC1 MCULE-3076361502 [0,1,0,1,0,0|0,0,2]=4 715 B6R1.2 IC1=CON=C1 MCULE-4450603437 [0,1,0,1,0,0|1,0,0]=3 716 B6R1.2 IC1=CSC=C1 MCULE-1100365117 [0,1,0,1,0,0|0,1,0]=3 717 B6R1.2 IC1=CSN=C1 MCULE-5646861702 [0,1,0,1,0,0|1,1,0]=4 718 B6R1.2 IC1=NC=CN1 MCULE-1690537323 [0,1,0,1,0,0|2,0,0]=4 719 B6R1.2 IC1=NC=CO1 MCULE-2254947090 [0,1,0,1,0,0|1,0,0]=3 720 B6R1.2 IC1=NC=CS1 MCULE-9500451238 [0,1,0,1,0,0|1,1,0]=4 721 B6R1.2 IC1=NNC=C1 MCULE-9771094813 [0,1,0,1,0,0|2,0,0]=4 722 B6R1.2 IN1C=CN=C1 MCULE-4410570789 [0,1,0,1,0,0|2,0,0]=4 723 B6R1.2 NC1=CC=CN1 MCULE-5653620818 [0,1,0,1,0,0|1,0,0]=3 724 B6R1.2 NC1=CC=CN1 MCULE-9753432085 [0,1,0,1,0,0|1,0,0]=3 725 B6R1.2 NC1=CC=CO1 MCULE-2421139965 [0,1,0,1,0,0|0,0,0]=2 726 B6R1.2 NC1=CC=CS1 MCULE-1649510352 [0,1,0,1,0,0|0,1,0]=3 727 B6R1.2 NC1=CC=CS1 MCULE-9501271303 [0,1,0,1,0,0|0,1,0]=3 728 B6R1.2 NC1=CC=NO1 MCULE-3638275568 [0,1,0,1,0,0|1,0,0]=3 729 B6R1.2 NC1=CC=NS1 MCULE-2159626770 [0,1,0,1,0,0|1,1,0]=4 730 B6R1.2 NC1=CC=NS1 MCULE-8733584582 [0,1,0,1,0,0|1,1,0]=4 731 B6R1.2 NC1=CN=CN1 MCULE-3029255616 [0,1,0,1,0,0|2,0,0]=4 732 B6R1.2 NC1=CN=CN1 MCULE-8873453977 [0,1,0,1,0,0|2,0,0]=4 733 B6R1.2 NC1=CN=CN1 MCULE-9206811415 [0,1,0,1,0,0|2,0,0]=4 734 B6R1.2 NC1=CN=CO1 MCULE-4492961257 [0,1,0,1,0,0|1,0,0]=3 735 B6R1.2 NC1=CN=CS1 MCULE-1239962681 [0,1,0,1,0,0|1,1,0]=4 736 B6R1.2 NC1=CN=CS1 MCULE-3685342495 [0,1,0,1,0,0|1,1,0]=4 737 B6R1.2 NC1=CN=CS1 MCULE-7122700564 [0,1,0,1,0,0|1,1,0]=4 738 B6R1.2 NC1=CNC=C1 MCULE-1411730985 [0,1,0,1,0,0|1,0,0]=3 739 B6R1.2 NC1=CNC=C1 MCULE-7701316156 [0,1,0,1,0,0|1,0,0]=3 740 B6R1.2 NC1=CNN=C1 MCULE-4119655375 [0,1,0,1,0,0|2,0,0]=4 741 B6R1.2 NC1=CNN=C1 MCULE-5097217370 [0,1,0,1,0,0|2,0,0]=4 742 B6R1.2 NC1=CNN=C1 MCULE-6287007700 [0,1,0,1,0,0|2,0,0]=4 743 B6R1.2 NC1=COC=C1 MCULE-1858324031 [0,1,0,1,0,0|0,0,0]=2 744 B6R1.2 NC1=COC=C1 MCULE-3985426542 [0,1,0,1,0,0|0,0,0]=2 745 B6R1.2 NC1=COC=N1 MCULE-2511021171 [0,1,0,1,0,0|1,0,0]=3 746 B6R1.2 NC1=COC=N1 MCULE-3099880728 [0,1,0,1,0,0|1,0,0]=3 747 B6R1.2 NC1=CON=C1 MCULE-2373604754 [0,1,0,1,0,0|1,0,0]=3 748 B6R1.2 NC1=CON=C1 MCULE-7932471087 [0,1,0,1,0,0|1,0,0]=3 749 B6R1.2 NC1=CSC=C1 MCULE-1673174137 [0,1,0,1,0,0|0,1,0]=3 750 B6R1.2 NC1=CSC=C1 MCULE-5461897385 [0,1,0,1,0,0|0,1,0]=3 751 B6R1.2 NC1=CSC=C1 MCULE-6200615331 [0,1,0,1,0,0|0,1,0]=3 752 B6R1.2 NC1=CSC=C1 MCULE-9439581665 [0,1,0,1,0,0|0,1,0]=3 753 B6R1.2 NC1=CSC=N1 MCULE-3316985941 [0,1,0,1,0,0|1,1,0]=4 754 B6R1.2 NC1=CSC=N1 MCULE-4767298680 [0,1,0,1,0,0|1,1,0]=4 755 B6R1.2 NC1=CSN=C1 MCULE-8555779572 [0,1,0,1,0,0|1,1,0]=4 756 B6R1.2 NC1=CSN=C1 MCULE-9110365089 [0,1,0,1,0,0|1,1,0]=4 757 B6R1.2 NC1=CSN=C1 MCULE-9229676240 [0,1,0,1,0,0|1,1,0]=4 758 B6R1.2 NC1=NC=CN1 MCULE-4937045321 [0,1,0,1,0,0|2,0,0]=4 759 B6R1.2 NC1=NC=CN1 MCULE-6371804569 [0,1,0,1,0,0|2,0,0]=4 760 B6R1.2 NC1=NC=CN1 MCULE-7485953374 [0,1,0,1,0,0|2,0,0]=4 761 B6R1.2 NC1=NC=CN1 MCULE-9607974759 [0,1,0,1,0,0|2,0,0]=4 762 B6R1.2 NC1=NC=CO1 MCULE-7316590930 [0,1,0,1,0,0|1,0,0]=3 763 B6R1.2 NC1=NC=CS1 MCULE-1506905792 [0,1,0,1,0,0|1,1,0]=4 764 B6R1.2 NC1=NC=CS1 MCULE-8550608343 [0,1,0,1,0,0|1,1,0]=4 765 B6R1.2 NC1=NN=CO1 MCULE-9653146681 [0,1,0,1,0,0|2,0,0]=4 766 B6R1.2 NC1=NNC=C1 MCULE-1507683823 [0,1,0,1,0,0|2,0,0]=4 767 B6R1.2 NC1=NNC=C1 MCULE-5117516307 [0,1,0,1,0,0|2,0,0]=4 768 B6R1.2 NC1=NNC=C1 MCULE-7091290697 [0,1,0,1,0,0|2,0,0]=4 769 B6R1.2 NC1=NOC=C1 MCULE-5363092492 [0,1,0,1,0,0|1,0,0]=3 770 B6R1.2 NC1=NOC=N1 MCULE-1140308393 [0,1,0,1,0,0|2,0,0]=4 771 B6R1.2 NC1=NON=C1 MCULE-1928445544 [0,1,0,1,0,0|2,0,0]=4 772 B6R1.2 NC1=NSC=C1 MCULE-2731864153 [0,1,0,1,0,0|1,1,0]=4 773 B6R1.2 NC1=NSC=C1 MCULE-4778941442 [0,1,0,1,0,0|1,1,0]=4 774 B6R1.2 NN1C=CC=C1 MCULE-9328309132 [0,1,0,1,0,0|1,0,0]=3 775 B6R1.2 NN1C=CC=N1 MCULE-1897324593 [0,1,0,1,0,0|2,0,0]=4 776 B6R1.2 NN1C=CN=C1 MCULE-6804632943 [0,1,0,1,0,0|2,0,0]=4 777 B6R1.2 NN1C=CN=C1 MCULE-9704502703 [0,1,0,1,0,0|2,0,0]=4 778 B6R1.2 O=C1C=CCC1 MCULE-1844779047 [0,1,0,1,0,0|1,0,1]=4 779 B6R1.2 O=C1C=CCN1 MCULE-4338701003 [0,1,0,1,0,0|1,0,1]=4 780 B6R1.2 O=C1C=CCO1 MCULE-4296503663 [0,1,0,1,0,0|0,0,1]=3 781 B6R1.2 O=C1C=CCS1 MCULE-5623095583 [0,1,0,1,0,0|0,1,1]=4 782 B6R1.2 O=C1C=CNN1 MCULE-8045056316 [0,1,0,1,0,0|2,0,0]=4 783 B6R1.2 O=C1C=CSC1 MCULE-6580304664 [0,1,0,1,0,0|0,1,1]=4 784 B6R1.2 O=C1C=CSN1 MCULE-6820517860 [0,1,0,1,0,0|1,1,0]=4 785 B6R1.2 O=C1CC=CC1 MCULE-7606670114 [0,1,0,1,0,0|1,0,1]=4 786 B6R1.2 O=C1NC=CN1 MCULE-6249170076 [0,1,0,1,0,0|2,0,0]=4 787 B6R1.2 O=C1NC=CO1 MCULE-4371023805 [0,1,0,1,0,0|1,0,0]=3 788 B6R1.2 O=C1NC=CS1 MCULE-2039347995 [0,1,0,1,0,0|1,1,0]=4 789 B6R1.2 O=C1OC=CO1 MCULE-1924277704 [0,1,0,1,0,0|1,0,0]=3 790 B6R1.2 OC1=CC=CO1 MCULE-7591676996 [0,1,0,1,0,0|0,0,0]=2 791 B6R1.2 OC1=CC=CS1 MCULE-8044830478 [0,1,0,1,0,0|0,1,0]=3 792 B6R1.2 OC1=CC=NN1 MCULE-9109008036 [0,1,0,1,0,0|2,0,0]=4 793 B6R1.2 OC1=CN=CS1 MCULE-4004908551 [0,1,0,1,0,0|1,1,0]=4 794 B6R1.2 OC1=CNC=C1 MCULE-3938204755 [0,1,0,1,0,0|1,0,0]=3 795 B6R1.2 OC1=CNC=N1 MCULE-1911765165 [0,1,0,1,0,0|2,0,0]=4 796 B6R1.2 OC1=CNN=C1 MCULE-5672706063 [0,1,0,1,0,0|2,0,0]=4 797 B6R1.2 OC1=CNN=C1 MCULE-5774317326 [0,1,0,1,0,0|2,0,0]=4 798 B6R1.2 OC1=CON=C1 MCULE-9622003135 [0,1,0,1,0,0|1,0,0]=3 799 B6R1.2 OC1=CSC=C1 MCULE-2226095386 [0,1,0,1,0,0|0,1,0]=3 800 B6R1.2 OC1=NN=CO1 MCULE-5444445027 [0,1,0,1,0,0|2,0,0]=4 801 B6R1.2 OC1=NOC=C1 MCULE-6441945551 [0,1,0,1,0,0|1,0,0]=3 802 B6R1.2 OC1C=CCO1 MCULE-4636930669 [0,1,0,1,0,0|0,0,2]=4 803 B6R1.2 ON1C=CC=N1 MCULE-8533909959 [0,1,0,1,0,0|2,0,0]=4 804 B6R1.2 S=C1NC=CO1 MCULE-6706918798 [0,1,0,1,0,0|1,0,0]=3 805 B6R1.2 S=C1SC=CS1 MCULE-7239273248 [0,1,0,1,0,0|1,1,0]=4 806 B6R1.2 SC1=CC=CS1 MCULE-8882266878 [0,1,0,1,0,0|0,1,0]=3 807 B6R1.2 SC1=CNN=C1 MCULE-7844673145 [0,1,0,1,0,0|2,0,0]=4 808 B6R1.2 SC1=CSC=C1 MCULE-8930005512 [0,1,0,1,0,0|0,1,0]=3 809 B6R1.2 SC1=NC=CN1 MCULE-1550904171 [0,1,0,1,0,0|2,0,0]=4 810 B6R1.2 SC1=NC=CS1 MCULE-4142949987 [0,1,0,1,0,0|1,1,0]=4 811 B6R1.2 SC1=NN=CO1 MCULE-5180923337 [0,1,0,1,0,0|2,0,0]=4 812 B6R1.2 [Li]C1C=CC=C1 MCULE-1100709751 [0,1,0,1,0,0|1,0,0]=3 813 B6R1.2 [TlH2]C1=CC=CC1 MCULE-7402896981 [0,1,0,1,0,0|1,0,0]=3 814 B6R1.5 C=C1CC(=O)O1 MCULE-7149487095 [0,1,0,1,0,0|0,0,1]=3 815 B6R1.1 C1=CC=CC=C1 MCULE-4899719484 [0,1,0,1,0,0|1,0,0]=3 816 B6R1.1 C1=CC=NC=C1 MCULE-4028120692 [0,1,0,1,0,0|1,0,0]=3 817 B6R1.1 C1=CC=NN=C1 MCULE-8903555610 [0,1,0,1,0,0|1,0,0]=3 818 B6R1.1 C1=CC=[O+]C=C1 MCULE-1614244243 [0,1,0,1,0,0|0,0,1]=3 819 B6R1.1 C1=CC=[O+]C=C1 MCULE-7104367772 [0,1,0,1,0,0|0,0,1]=3 820 B6R1.1 C1=CCC=CC1 MCULE-5587669746 [0,1,0,1,0,0|1,0,0]=3 821 B6R1.1 C1=CCCC=C1 MCULE-9111393952 [0,1,0,1,0,0|1,0,0]=3 822 B6R1.1 C1=CCOCC1 MCULE-7723901693 [0,1,0,1,0,0|0,0,2]=4 823 B6R1.1 C1=CCONC1 MCULE-7264346127 [0,1,0,1,0,0|0,0,2]=4 824 B6R1.1 C1=CCONC1 MCULE-7621269131 [0,1,0,1,0,0|0,0,2]=4 825 B6R1.1 C1=CN=CC=N1 MCULE-7343822850 [0,1,0,1,0,0|1,0,0]=3 826 B6R1.1 C1=CN=CN=C1 MCULE-4261708822 [0,1,0,1,0,0|1,0,0]=3 827 B6R1.1 C1=CN=NC=C1 MCULE-3487470460 [0,1,0,1,0,0|1,0,0]=3 828 B6R1.1 C1=CN=NC=N1 MCULE-1276893342 [0,1,0,1,0,0|2,0,0]=4 829 B6R1.1 C1=COCCC1 MCULE-1260841717 [0,1,0,1,0,0|0,0,2]=4 830 B6R1.1 C1=COCCO1 MCULE-2562788031 [0,1,0,1,0,0|0,0,2]=4 831 B6R1.1 C1=COCOC1 MCULE-9916358884 [0,1,0,1,0,0|0,0,2]=4 832 B6R1.1 C1=NC=NC=N1 MCULE-4420507646 [0,1,0,1,0,0|2,0,0]=4