0 B5R0.2 BrCCCCBr MCULE-5088378536 [0,0,0,0,0,0|4,0,0]=4 1 B5R0.2 C#CCC#CC MCULE-1607912981 [0,0,0,0,0,0|2,0,2]=4 2 B5R0.2 C#CCCC#C MCULE-9901719987 [0,0,0,0,0,0|2,0,2]=4 3 B5R0.2 C#CCCC#N MCULE-9172928565 [0,0,0,0,0,0|3,0,1]=4 4 B5R0.2 C#CCCC=C MCULE-4858099861 [0,0,0,0,0,0|2,0,2]=4 5 B5R0.2 C#CCCC=O MCULE-9994552907 [0,0,0,0,0,0|3,0,1]=4 6 B5R0.2 C#CCCCBr MCULE-3834416844 [0,0,0,0,0,0|3,0,1]=4 7 B5R0.2 C#CCCCC MCULE-5706969297 [0,0,0,0,0,0|2,0,1]=3 8 B5R0.2 C#CCCCCl MCULE-3879115419 [0,0,0,0,0,0|3,0,1]=4 9 B5R0.2 C#CCCCI MCULE-4063232871 [0,0,0,0,0,0|3,0,1]=4 10 B5R0.2 C#CCCCN MCULE-3191305523 [0,0,0,0,0,0|3,0,1]=4 11 B5R0.2 C#CCCCN MCULE-3259677872 [0,0,0,0,0,0|3,0,1]=4 12 B5R0.2 C#CCCCO MCULE-6360852809 [0,0,0,0,0,0|3,0,1]=4 13 B5R0.2 C#CCCNC MCULE-1590490287 [0,0,0,0,0,0|2,0,1]=3 14 B5R0.2 C#CCCNC MCULE-4004733974 [0,0,0,0,0,0|2,0,1]=3 15 B5R0.2 C#CCCNC MCULE-7566671614 [0,0,0,0,0,0|2,0,1]=3 16 B5R0.2 C#CCCOC MCULE-7152168835 [0,0,0,0,0,0|1,0,1]=2 17 B5R0.2 C#CCNCC MCULE-1258696824 [0,0,0,0,0,0|3,0,1]=4 18 B5R0.2 C#CCNCC MCULE-3363103527 [0,0,0,0,0,0|3,0,1]=4 19 B5R0.2 C#CCNOC MCULE-3336529831 [0,0,0,0,0,0|2,0,1]=3 20 B5R0.2 C#CCNOC MCULE-7807129420 [0,0,0,0,0,0|2,0,1]=3 21 B5R0.2 C#CCOCC MCULE-1055202735 [0,0,0,0,0,0|3,0,1]=4 22 B5R0.2 C#CCSCC MCULE-5718021970 [0,0,0,0,0,0|3,0,1]=4 23 B5R0.2 C/C=C/C=C/C MCULE-9400628806 [0,0,0,0,0,0|2,0,2]=4 24 B5R0.2 C/C=C/CC#N MCULE-3707973146 [0,0,0,0,0,0|3,0,1]=4 25 B5R0.2 C/C=C/CCC MCULE-9851656818 [0,0,0,0,0,0|2,0,1]=3 26 B5R0.2 C/C=C/CCO MCULE-3952855392 [0,0,0,0,0,0|3,0,1]=4 27 B5R0.2 C/C=C/OCC MCULE-2891896400 [0,0,0,0,0,0|3,0,1]=4 28 B5R0.2 C/C=C\CCC MCULE-1013657748 [0,0,0,0,0,0|2,0,1]=3 29 B5R0.2 C=CC/C=C/C MCULE-8732875285 [0,0,0,0,0,0|2,0,2]=4 30 B5R0.2 C=CCC=CC MCULE-8643449832 [0,0,0,0,0,0|2,0,2]=4 31 B5R0.2 C=CCCC#N MCULE-8967750268 [0,0,0,0,0,0|3,0,1]=4 32 B5R0.2 C=CCCC=C MCULE-2599309974 [0,0,0,0,0,0|2,0,2]=4 33 B5R0.2 C=CCCC=O MCULE-7850336174 [0,0,0,0,0,0|3,0,1]=4 34 B5R0.2 C=CCCCBr MCULE-5027518679 [0,0,0,0,0,0|3,0,1]=4 35 B5R0.2 C=CCCCC MCULE-4750698031 [0,0,0,0,0,0|2,0,1]=3 36 B5R0.2 C=CCCCCl MCULE-3877430809 [0,0,0,0,0,0|3,0,1]=4 37 B5R0.2 C=CCCCI MCULE-8692831514 [0,0,0,0,0,0|3,0,1]=4 38 B5R0.2 C=CCCCN MCULE-5787926547 [0,0,0,0,0,0|3,0,1]=4 39 B5R0.2 C=CCCCN MCULE-7346989227 [0,0,0,0,0,0|3,0,1]=4 40 B5R0.2 C=CCCCO MCULE-5946342321 [0,0,0,0,0,0|3,0,1]=4 41 B5R0.2 C=CCCNC MCULE-2124263362 [0,0,0,0,0,0|2,0,1]=3 42 B5R0.2 C=CCCNC MCULE-5024925990 [0,0,0,0,0,0|2,0,1]=3 43 B5R0.2 C=CCCOC MCULE-4681354270 [0,0,0,0,0,0|1,0,1]=2 44 B5R0.2 C=CCCON MCULE-3476228435 [0,0,0,0,0,0|2,0,1]=3 45 B5R0.2 C=CCCON MCULE-9206052895 [0,0,0,0,0,0|2,0,1]=3 46 B5R0.2 C=CCNCC MCULE-6987567673 [0,0,0,0,0,0|3,0,1]=4 47 B5R0.2 C=CCNCC MCULE-8318544337 [0,0,0,0,0,0|3,0,1]=4 48 B5R0.2 C=CCOCC MCULE-4363356618 [0,0,0,0,0,0|3,0,1]=4 49 B5R0.2 C=CCONC MCULE-4537899476 [0,0,0,0,0,0|3,0,1]=4 50 B5R0.2 C=CCONC MCULE-9645204142 [0,0,0,0,0,0|3,0,1]=4 51 B5R0.2 C=CCSCC MCULE-3816911529 [0,0,0,0,0,0|3,0,1]=4 52 B5R0.2 C=CCSSC MCULE-8417830164 [0,0,0,0,0,0|2,1,1]=4 53 B5R0.2 C=COCCC MCULE-4423853666 [0,0,0,0,0,0|3,0,1]=4 54 B5R0.2 CC#CC#CC MCULE-8160676821 [0,0,0,0,0,0|2,0,2]=4 55 B5R0.2 CC#CCC=O MCULE-6071390808 [0,0,0,0,0,0|3,0,1]=4 56 B5R0.2 CC#CCCBr MCULE-5650557113 [0,0,0,0,0,0|3,0,1]=4 57 B5R0.2 CC#CCCC MCULE-8179328151 [0,0,0,0,0,0|2,0,1]=3 58 B5R0.2 CC#CCCN MCULE-2130545109 [0,0,0,0,0,0|3,0,1]=4 59 B5R0.2 CC#CCCN MCULE-7156357315 [0,0,0,0,0,0|3,0,1]=4 60 B5R0.2 CC#CCCO MCULE-9400138491 [0,0,0,0,0,0|3,0,1]=4 61 B5R0.2 CC#CCNC MCULE-3549759323 [0,0,0,0,0,0|2,0,1]=3 62 B5R0.2 CC#CCNC MCULE-7250319597 [0,0,0,0,0,0|2,0,1]=3 63 B5R0.2 CC#CCON MCULE-6251915377 [0,0,0,0,0,0|2,0,1]=3 64 B5R0.2 CC#CCON MCULE-7089104173 [0,0,0,0,0,0|2,0,1]=3 65 B5R0.2 CC/C=C/CC MCULE-6762040186 [0,0,0,0,0,0|2,0,2]=4 66 B5R0.2 CC/C=C\CC MCULE-9418110460 [0,0,0,0,0,0|2,0,2]=4 67 B5R0.2 CC=CC=CC MCULE-7702675183 [0,0,0,0,0,0|2,0,2]=4 68 B5R0.2 CC=CCC#N MCULE-6960681395 [0,0,0,0,0,0|3,0,1]=4 69 B5R0.2 CC=CCCBr MCULE-7329159278 [0,0,0,0,0,0|3,0,1]=4 70 B5R0.2 CC=CCCC MCULE-8736231124 [0,0,0,0,0,0|2,0,1]=3 71 B5R0.2 CC=CCCN MCULE-5129102475 [0,0,0,0,0,0|3,0,1]=4 72 B5R0.2 CC=CCCN MCULE-8500001929 [0,0,0,0,0,0|3,0,1]=4 73 B5R0.2 CC=CCCO MCULE-4302367089 [0,0,0,0,0,0|3,0,1]=4 74 B5R0.2 CC=COCC MCULE-1473170404 [0,0,0,0,0,0|3,0,1]=4 75 B5R0.2 CC=CSSC MCULE-2442770677 [0,0,0,0,0,0|2,1,1]=4 76 B5R0.2 CCC#CCC MCULE-2027962178 [0,0,0,0,0,0|2,0,2]=4 77 B5R0.2 CCC=CCC MCULE-5435957422 [0,0,0,0,0,0|2,0,2]=4 78 B5R0.2 CCCC#CI MCULE-5016901652 [0,0,0,0,0,0|3,0,1]=4 79 B5R0.2 CCCC=NO MCULE-7364375780 [0,0,0,0,0,0|3,0,1]=4 80 B5R0.2 CCCCC#N MCULE-4015236167 [0,0,0,0,0,0|3,0,0]=3 81 B5R0.2 CCCCC=O MCULE-4736782822 [0,0,0,0,0,0|3,0,0]=3 82 B5R0.2 CCCCCBr MCULE-8513521912 [0,0,0,0,0,0|3,0,0]=3 83 B5R0.2 CCCCCC MCULE-3465692202 [0,0,0,0,0,0|2,0,0]=2 84 B5R0.2 CCCCCCl MCULE-4412759460 [0,0,0,0,0,0|3,0,0]=3 85 B5R0.2 CCCCCF MCULE-6399883281 [0,0,0,0,0,0|3,0,0]=3 86 B5R0.2 CCCCCI MCULE-4590300793 [0,0,0,0,0,0|3,0,0]=3 87 B5R0.2 CCCCCN MCULE-3371742982 [0,0,0,0,0,0|3,0,0]=3 88 B5R0.2 CCCCCN MCULE-4371067300 [0,0,0,0,0,0|3,0,0]=3 89 B5R0.2 CCCCCN MCULE-6547961798 [0,0,0,0,0,0|3,0,0]=3 90 B5R0.2 CCCCCN MCULE-7483248760 [0,0,0,0,0,0|3,0,0]=3 91 B5R0.2 CCCCCO MCULE-8714292632 [0,0,0,0,0,0|3,0,0]=3 92 B5R0.2 CCCCCS MCULE-5476379340 [0,0,0,0,0,0|3,0,0]=3 93 B5R0.2 CCCCNC MCULE-9321610906 [0,0,0,0,0,0|2,0,0]=2 94 B5R0.2 CCCCNN MCULE-6681305566 [0,0,0,0,0,0|3,0,0]=3 95 B5R0.2 CCCCNN MCULE-6890760890 [0,0,0,0,0,0|3,0,0]=3 96 B5R0.2 CCCCNN MCULE-7362497327 [0,0,0,0,0,0|3,0,0]=3 97 B5R0.2 CCCCNN MCULE-8463623644 [0,0,0,0,0,0|3,0,0]=3 98 B5R0.2 CCCCNO MCULE-1911206569 [0,0,0,0,0,0|3,0,0]=3 99 B5R0.2 CCCCNO MCULE-3820646216 [0,0,0,0,0,0|3,0,0]=3 100 B5R0.2 CCCCOC MCULE-9814272675 [0,0,0,0,0,0|1,0,0]=1 101 B5R0.2 CCCCON MCULE-7582349983 [0,0,0,0,0,0|2,0,0]=2 102 B5R0.2 CCCCON MCULE-8175627798 [0,0,0,0,0,0|2,0,0]=2 103 B5R0.2 CCCCSC MCULE-2799775567 [0,0,0,0,0,0|1,1,0]=2 104 B5R0.2 CCCN=C=O MCULE-9014468293 [0,0,0,0,0,0|4,0,0]=4 105 B5R0.2 CCCN=C=S MCULE-7947940355 [0,0,0,0,0,0|4,0,0]=4 106 B5R0.2 CCCNC=O MCULE-6344556391 [0,0,0,0,0,0|4,0,0]=4 107 B5R0.2 CCCNCC MCULE-7948828264 [0,0,0,0,0,0|3,0,0]=3 108 B5R0.2 CCCNCC MCULE-9107549207 [0,0,0,0,0,0|3,0,0]=3 109 B5R0.2 CCCOC=O MCULE-3133604529 [0,0,0,0,0,0|4,0,0]=4 110 B5R0.2 CCCOCBr MCULE-3585683043 [0,0,0,0,0,0|4,0,0]=4 111 B5R0.2 CCCOCC MCULE-9971916790 [0,0,0,0,0,0|3,0,0]=3 112 B5R0.2 CCCOCCl MCULE-1932627202 [0,0,0,0,0,0|4,0,0]=4 113 B5R0.2 CCCSC#N MCULE-9018157774 [0,0,0,0,0,0|4,0,0]=4 114 B5R0.2 CCCSCC MCULE-4547385568 [0,0,0,0,0,0|3,0,0]=3 115 B5R0.2 CCCSSC MCULE-3127072032 [0,0,0,0,0,0|2,1,0]=3 116 B5R0.2 CCNCC#N MCULE-8279629720 [0,0,0,0,0,0|4,0,0]=4 117 B5R0.2 CCNCCCl MCULE-2589770119 [0,0,0,0,0,0|4,0,0]=4 118 B5R0.2 CCNCCCl MCULE-3098032672 [0,0,0,0,0,0|4,0,0]=4 119 B5R0.2 CCNCCN MCULE-7854769899 [0,0,0,0,0,0|4,0,0]=4 120 B5R0.2 CCNCCO MCULE-2537734730 [0,0,0,0,0,0|4,0,0]=4 121 B5R0.2 CCNCCO MCULE-3738714907 [0,0,0,0,0,0|4,0,0]=4 122 B5R0.2 CCNNCC MCULE-4789314801 [0,0,0,0,0,0|4,0,0]=4 123 B5R0.2 CCNNCC MCULE-9060220585 [0,0,0,0,0,0|4,0,0]=4 124 B5R0.2 CCOCC#N MCULE-6709940440 [0,0,0,0,0,0|4,0,0]=4 125 B5R0.2 CCOCCBr MCULE-4818900555 [0,0,0,0,0,0|4,0,0]=4 126 B5R0.2 CCOCCCl MCULE-1290576729 [0,0,0,0,0,0|4,0,0]=4 127 B5R0.2 CCOCCI MCULE-1833092968 [0,0,0,0,0,0|4,0,0]=4 128 B5R0.2 CCOCCN MCULE-1254431240 [0,0,0,0,0,0|4,0,0]=4 129 B5R0.2 CCOCCN MCULE-4039110889 [0,0,0,0,0,0|4,0,0]=4 130 B5R0.2 CCOCCN MCULE-4400456933 [0,0,0,0,0,0|4,0,0]=4 131 B5R0.2 CCOCCO MCULE-4311513289 [0,0,0,0,0,0|4,0,0]=4 132 B5R0.2 CCOCCS MCULE-3968740645 [0,0,0,0,0,0|4,0,0]=4 133 B5R0.2 CCSCC#N MCULE-4093791055 [0,0,0,0,0,0|4,0,0]=4 134 B5R0.2 CCSCC=O MCULE-8069035019 [0,0,0,0,0,0|4,0,0]=4 135 B5R0.2 CCSCCBr MCULE-9449933342 [0,0,0,0,0,0|4,0,0]=4 136 B5R0.2 CCSCCCl MCULE-4057847237 [0,0,0,0,0,0|4,0,0]=4 137 B5R0.2 CCSCCN MCULE-3375644872 [0,0,0,0,0,0|4,0,0]=4 138 B5R0.2 CCSCCN MCULE-4466279976 [0,0,0,0,0,0|4,0,0]=4 139 B5R0.2 CCSCCO MCULE-3557086162 [0,0,0,0,0,0|4,0,0]=4 140 B5R0.2 CCSCCS MCULE-4583054157 [0,0,0,0,0,0|4,0,0]=4 141 B5R0.2 CCSSCC MCULE-7989926475 [0,0,0,0,0,0|4,0,0]=4 142 B5R0.2 CC[Se][Se]CC MCULE-2725282576 [0,0,0,0,0,0|4,0,0]=4 143 B5R0.2 CNCCC#N MCULE-6686234290 [0,0,0,0,0,0|3,0,0]=3 144 B5R0.2 CNCCCBr MCULE-3376600253 [0,0,0,0,0,0|3,0,0]=3 145 B5R0.2 CNCCCBr MCULE-6212326106 [0,0,0,0,0,0|3,0,0]=3 146 B5R0.2 CNCCCCl MCULE-1007719210 [0,0,0,0,0,0|3,0,0]=3 147 B5R0.2 CNCCCCl MCULE-6146901643 [0,0,0,0,0,0|3,0,0]=3 148 B5R0.2 CNCCCF MCULE-7647417887 [0,0,0,0,0,0|3,0,0]=3 149 B5R0.2 CNCCCN MCULE-1736081896 [0,0,0,0,0,0|3,0,0]=3 150 B5R0.2 CNCCCO MCULE-9530478547 [0,0,0,0,0,0|3,0,0]=3 151 B5R0.2 CNCCNC MCULE-1378979868 [0,0,0,0,0,0|2,0,0]=2 152 B5R0.2 CNCCNC MCULE-3281508478 [0,0,0,0,0,0|2,0,0]=2 153 B5R0.2 CNCCOC MCULE-2857904484 [0,0,0,0,0,0|1,0,0]=1 154 B5R0.2 CNCCOC MCULE-5342712496 [0,0,0,0,0,0|1,0,0]=1 155 B5R0.2 CNCCSC MCULE-2812984399 [0,0,0,0,0,0|1,1,0]=2 156 B5R0.2 CNCCSC MCULE-2942435951 [0,0,0,0,0,0|1,1,0]=2 157 B5R0.2 CNOCCN MCULE-3163962093 [0,0,0,0,0,0|4,0,0]=4 158 B5R0.2 CNOCCN MCULE-7379538500 [0,0,0,0,0,0|4,0,0]=4 159 B5R0.2 COC=CC#N MCULE-4212629233 [0,0,0,0,0,0|2,0,2]=4 160 B5R0.2 COCCC#N MCULE-3009737584 [0,0,0,0,0,0|2,0,0]=2 161 B5R0.2 COCCC=O MCULE-2812117208 [0,0,0,0,0,0|2,0,0]=2 162 B5R0.2 COCCCBr MCULE-6489536401 [0,0,0,0,0,0|2,0,0]=2 163 B5R0.2 COCCCCl MCULE-9192274624 [0,0,0,0,0,0|2,0,0]=2 164 B5R0.2 COCCCF MCULE-5055725246 [0,0,0,0,0,0|2,0,0]=2 165 B5R0.2 COCCCI MCULE-9111605439 [0,0,0,0,0,0|2,0,0]=2 166 B5R0.2 COCCCN MCULE-1421362990 [0,0,0,0,0,0|2,0,0]=2 167 B5R0.2 COCCCN MCULE-4783132205 [0,0,0,0,0,0|2,0,0]=2 168 B5R0.2 COCCCO MCULE-4041418048 [0,0,0,0,0,0|2,0,0]=2 169 B5R0.2 COCCCS MCULE-2371333731 [0,0,0,0,0,0|2,0,0]=2 170 B5R0.2 COCCNN MCULE-2086510453 [0,0,0,0,0,0|2,0,0]=2 171 B5R0.2 COCCNN MCULE-4830987822 [0,0,0,0,0,0|2,0,0]=2 172 B5R0.2 COCCNN MCULE-8361975855 [0,0,0,0,0,0|2,0,0]=2 173 B5R0.2 COCCOC MCULE-7572196731 [0,0,0,0,0,0|0,0,0]=0 174 B5R0.2 COCCON MCULE-3507489398 [0,0,0,0,0,0|1,0,0]=1 175 B5R0.2 COCCON MCULE-8506879697 [0,0,0,0,0,0|1,0,0]=1 176 B5R0.2 COCCSC MCULE-5362054021 [0,0,0,0,0,0|0,1,0]=1 177 B5R0.2 COCN=C=O MCULE-6951734265 [0,0,0,0,0,0|3,0,0]=3 178 B5R0.2 COCN=C=S MCULE-8646619442 [0,0,0,0,0,0|3,0,0]=3 179 B5R0.2 CONCCN MCULE-3332727097 [0,0,0,0,0,0|3,0,0]=3 180 B5R0.2 CONCCN MCULE-5066538639 [0,0,0,0,0,0|3,0,0]=3 181 B5R0.2 CONCCO MCULE-9787830121 [0,0,0,0,0,0|3,0,0]=3 182 B5R0.2 CSCCC#N MCULE-5755086116 [0,0,0,0,0,0|2,1,0]=3 183 B5R0.2 CSCCC=O MCULE-6273241704 [0,0,0,0,0,0|2,1,0]=3 184 B5R0.2 CSCCCBr MCULE-8399851816 [0,0,0,0,0,0|2,1,0]=3 185 B5R0.2 CSCCCCl MCULE-1829120476 [0,0,0,0,0,0|2,1,0]=3 186 B5R0.2 CSCCCN MCULE-1030938424 [0,0,0,0,0,0|2,1,0]=3 187 B5R0.2 CSCCCN MCULE-4664984921 [0,0,0,0,0,0|2,1,0]=3 188 B5R0.2 CSCCCO MCULE-9232413185 [0,0,0,0,0,0|2,1,0]=3 189 B5R0.2 CSCCCS MCULE-8405766359 [0,0,0,0,0,0|2,1,0]=3 190 B5R0.2 CSCCON MCULE-9125601960 [0,0,0,0,0,0|1,1,0]=2 191 B5R0.2 CSSCCN MCULE-7065189564 [0,0,0,0,0,0|3,1,0]=4 192 B5R0.2 CSSCCN MCULE-8654200268 [0,0,0,0,0,0|3,1,0]=4 193 B5R0.2 ClCCCCBr MCULE-7973194927 [0,0,0,0,0,0|4,0,0]=4 194 B5R0.2 ClCCCCCl MCULE-4863501782 [0,0,0,0,0,0|4,0,0]=4 195 B5R0.2 ClCCCCI MCULE-4303507089 [0,0,0,0,0,0|4,0,0]=4 196 B5R0.2 FCCCCBr MCULE-8408956872 [0,0,0,0,0,0|4,0,0]=4 197 B5R0.2 FCCCCF MCULE-1347438150 [0,0,0,0,0,0|4,0,0]=4 198 B5R0.2 ICCCCI MCULE-1390457250 [0,0,0,0,0,0|4,0,0]=4 199 B5R0.2 N#CCCC#N MCULE-5570794181 [0,0,0,0,0,0|4,0,0]=4 200 B5R0.2 N#CCCC=O MCULE-9521735106 [0,0,0,0,0,0|4,0,0]=4 201 B5R0.2 N#CCCCBr MCULE-2664469446 [0,0,0,0,0,0|4,0,0]=4 202 B5R0.2 N#CCCCCl MCULE-3310172135 [0,0,0,0,0,0|4,0,0]=4 203 B5R0.2 N#CCCCF MCULE-3514322336 [0,0,0,0,0,0|4,0,0]=4 204 B5R0.2 N#CCCCI MCULE-7661529037 [0,0,0,0,0,0|4,0,0]=4 205 B5R0.2 N#CCCCN MCULE-7159177087 [0,0,0,0,0,0|4,0,0]=4 206 B5R0.2 N#CCCCN MCULE-8406710235 [0,0,0,0,0,0|4,0,0]=4 207 B5R0.2 N#CCCCO MCULE-2108386837 [0,0,0,0,0,0|4,0,0]=4 208 B5R0.2 N#CCCNN MCULE-2873114425 [0,0,0,0,0,0|4,0,0]=4 209 B5R0.2 N#CCCON MCULE-4242787851 [0,0,0,0,0,0|3,0,0]=3 210 B5R0.2 N#CCCON MCULE-9943219810 [0,0,0,0,0,0|3,0,0]=3 211 B5R0.2 NCCCCBr MCULE-7095299053 [0,0,0,0,0,0|4,0,0]=4 212 B5R0.2 NCCCCBr MCULE-7716027825 [0,0,0,0,0,0|4,0,0]=4 213 B5R0.2 NCCCCCl MCULE-8484381726 [0,0,0,0,0,0|4,0,0]=4 214 B5R0.2 NCCCCCl MCULE-9917306082 [0,0,0,0,0,0|4,0,0]=4 215 B5R0.2 NCCCCF MCULE-4260727945 [0,0,0,0,0,0|4,0,0]=4 216 B5R0.2 NCCCCF MCULE-7716720921 [0,0,0,0,0,0|4,0,0]=4 217 B5R0.2 NCCCCN MCULE-3098044935 [0,0,0,0,0,0|4,0,0]=4 218 B5R0.2 NCCCCN MCULE-7898833229 [0,0,0,0,0,0|4,0,0]=4 219 B5R0.2 NCCCCN MCULE-8029479697 [0,0,0,0,0,0|4,0,0]=4 220 B5R0.2 NCCCCN MCULE-8509656776 [0,0,0,0,0,0|4,0,0]=4 221 B5R0.2 NCCCCO MCULE-7395674091 [0,0,0,0,0,0|4,0,0]=4 222 B5R0.2 NCCCCS MCULE-4353910418 [0,0,0,0,0,0|4,0,0]=4 223 B5R0.2 NCCCCS MCULE-9812416858 [0,0,0,0,0,0|4,0,0]=4 224 B5R0.2 NCCCNN MCULE-7657257572 [0,0,0,0,0,0|4,0,0]=4 225 B5R0.2 NCCCON MCULE-1071170242 [0,0,0,0,0,0|3,0,0]=3 226 B5R0.2 NCCCON MCULE-7767315563 [0,0,0,0,0,0|3,0,0]=3 227 B5R0.2 NNCCCO MCULE-5557482626 [0,0,0,0,0,0|4,0,0]=4 228 B5R0.2 NNCCCO MCULE-7351853032 [0,0,0,0,0,0|4,0,0]=4 229 B5R0.2 NNCCCO MCULE-7919314403 [0,0,0,0,0,0|4,0,0]=4 230 B5R0.2 NOC/C=C/Cl MCULE-3781481075 [0,0,0,0,0,0|3,0,1]=4 231 B5R0.2 NOC/C=C/Cl MCULE-8874475488 [0,0,0,0,0,0|3,0,1]=4 232 B5R0.2 NOCC=CCl MCULE-5233830243 [0,0,0,0,0,0|3,0,1]=4 233 B5R0.2 NOCC=CCl MCULE-7677577759 [0,0,0,0,0,0|3,0,1]=4 234 B5R0.2 NOCCCO MCULE-1072312935 [0,0,0,0,0,0|3,0,0]=3 235 B5R0.2 NOCCCO MCULE-3715520109 [0,0,0,0,0,0|3,0,0]=3 236 B5R0.2 NOCCCS MCULE-2063976508 [0,0,0,0,0,0|3,0,0]=3 237 B5R0.2 NOCCCS MCULE-3464018652 [0,0,0,0,0,0|3,0,0]=3 238 B5R0.2 NOCCON MCULE-2027662613 [0,0,0,0,0,0|2,0,0]=2 239 B5R0.2 NOCCON MCULE-3458073239 [0,0,0,0,0,0|2,0,0]=2 240 B5R0.2 O=CCCC=O MCULE-3362810468 [0,0,0,0,0,0|4,0,0]=4 241 B5R0.2 O=CCCC=O MCULE-3813951568 [0,0,0,0,0,0|4,0,0]=4 242 B5R0.2 O=CCCCBr MCULE-7239613396 [0,0,0,0,0,0|4,0,0]=4 243 B5R0.2 O=CCCCCl MCULE-3011225716 [0,0,0,0,0,0|4,0,0]=4 244 B5R0.2 O=CCCCI MCULE-3153720790 [0,0,0,0,0,0|4,0,0]=4 245 B5R0.2 O=CCCCO MCULE-8728420992 [0,0,0,0,0,0|4,0,0]=4 246 B5R0.2 OCCCCBr MCULE-9231591925 [0,0,0,0,0,0|4,0,0]=4 247 B5R0.2 OCCCCCl MCULE-3507644812 [0,0,0,0,0,0|4,0,0]=4 248 B5R0.2 OCCCCF MCULE-9242285588 [0,0,0,0,0,0|4,0,0]=4 249 B5R0.2 OCCCCI MCULE-8723720522 [0,0,0,0,0,0|4,0,0]=4 250 B5R0.2 OCCCCO MCULE-2010022287 [0,0,0,0,0,0|4,0,0]=4 251 B5R0.2 OCCCCO MCULE-6551106098 [0,0,0,0,0,0|4,0,0]=4 252 B5R0.2 OCCCCS MCULE-8169490949 [0,0,0,0,0,0|4,0,0]=4 253 B5R0.2 SCCCCS MCULE-6695609899 [0,0,0,0,0,0|4,0,0]=4 254 B4R0.2 BrCCCBr MCULE-6500110480 [1,0,0,0,0,0|3,0,0]=4 255 B4R0.2 BrCCCI MCULE-6470610840 [1,0,0,0,0,0|3,0,0]=4 256 B4R0.2 C#CCCBr MCULE-1495603480 [1,0,0,0,0,0|2,0,1]=4 257 B4R0.2 C#CCCC MCULE-1233806896 [1,0,0,0,0,0|1,0,1]=3 258 B4R0.2 C#CCCCl MCULE-5602517887 [1,0,0,0,0,0|2,0,1]=4 259 B4R0.2 C#CCCI MCULE-2832310719 [1,0,0,0,0,0|2,0,1]=4 260 B4R0.2 C#CCCN MCULE-1223656854 [1,0,0,0,0,0|2,0,1]=4 261 B4R0.2 C#CCCN MCULE-6408469965 [1,0,0,0,0,0|2,0,1]=4 262 B4R0.2 C#CCCO MCULE-1797559276 [1,0,0,0,0,0|1,0,1]=3 263 B4R0.2 C#CCCO MCULE-8743964065 [1,0,0,0,0,0|1,0,1]=3 264 B4R0.2 C#CCNC MCULE-9758975590 [1,0,0,0,0,0|1,0,2]=4 265 B4R0.2 C#CCNO MCULE-7210831528 [1,0,0,0,0,0|2,0,1]=4 266 B4R0.2 C#CCNO MCULE-8082854360 [1,0,0,0,0,0|2,0,1]=4 267 B4R0.2 C#CCOC MCULE-9172422462 [1,0,0,0,0,0|0,0,2]=3 268 B4R0.2 C#CCON MCULE-1220634713 [1,0,0,0,0,0|1,0,2]=4 269 B4R0.2 C#CCON MCULE-5781631200 [1,0,0,0,0,0|1,0,2]=4 270 B4R0.2 C#CCSC MCULE-6808040899 [1,0,0,0,0,0|0,1,2]=4 271 B4R0.2 C#COCC MCULE-1522528824 [1,0,0,0,0,0|2,0,1]=4 272 B4R0.2 C/C=C/CCl MCULE-9977493525 [1,0,0,0,0,0|2,0,1]=4 273 B4R0.2 C/C=C/CO MCULE-2383161163 [1,0,0,0,0,0|1,0,1]=3 274 B4R0.2 C/C=C/OC MCULE-3906920304 [1,0,0,0,0,0|0,0,2]=3 275 B4R0.2 C/C=C\CO MCULE-5924662327 [1,0,0,0,0,0|1,0,1]=3 276 B4R0.2 C=C=CCC MCULE-6123315571 [1,0,0,0,0,0|1,0,2]=4 277 B4R0.2 C=C=CCO MCULE-5424851896 [1,0,0,0,0,0|1,0,2]=4 278 B4R0.2 C=CCCBr MCULE-2890129103 [1,0,0,0,0,0|2,0,1]=4 279 B4R0.2 C=CCCC MCULE-8386546337 [1,0,0,0,0,0|1,0,1]=3 280 B4R0.2 C=CCCCl MCULE-5903789900 [1,0,0,0,0,0|2,0,1]=4 281 B4R0.2 C=CCCI MCULE-1055671394 [1,0,0,0,0,0|2,0,1]=4 282 B4R0.2 C=CCCN MCULE-2471716627 [1,0,0,0,0,0|2,0,1]=4 283 B4R0.2 C=CCCN MCULE-2881108697 [1,0,0,0,0,0|2,0,1]=4 284 B4R0.2 C=CCCO MCULE-4582400839 [1,0,0,0,0,0|1,0,1]=3 285 B4R0.2 C=CCNC MCULE-3335720336 [1,0,0,0,0,0|1,0,2]=4 286 B4R0.2 C=CCOC MCULE-3321225771 [1,0,0,0,0,0|0,0,2]=3 287 B4R0.2 C=CCON MCULE-2094787759 [1,0,0,0,0,0|1,0,2]=4 288 B4R0.2 C=CCON MCULE-6222602533 [1,0,0,0,0,0|1,0,2]=4 289 B4R0.2 C=CCSC MCULE-4452023915 [1,0,0,0,0,0|0,1,2]=4 290 B4R0.2 C=COCC MCULE-2569047033 [1,0,0,0,0,0|2,0,1]=4 291 B4R0.2 C=CSCC MCULE-8927374165 [1,0,0,0,0,0|2,0,1]=4 292 B4R0.2 CC#CCBr MCULE-3596191560 [1,0,0,0,0,0|2,0,1]=4 293 B4R0.2 CC#CCC MCULE-8848779220 [1,0,0,0,0,0|1,0,1]=3 294 B4R0.2 CC#CCI MCULE-3596701582 [1,0,0,0,0,0|2,0,1]=4 295 B4R0.2 CC#CCN MCULE-7027146471 [1,0,0,0,0,0|2,0,1]=4 296 B4R0.2 CC#CCN MCULE-9570644542 [1,0,0,0,0,0|2,0,1]=4 297 B4R0.2 CC#CCO MCULE-5096552076 [1,0,0,0,0,0|1,0,1]=3 298 B4R0.2 CC=CCBr MCULE-7855581866 [1,0,0,0,0,0|2,0,1]=4 299 B4R0.2 CC=CCC MCULE-5931905453 [1,0,0,0,0,0|1,0,1]=3 300 B4R0.2 CC=CCCl MCULE-3941962217 [1,0,0,0,0,0|2,0,1]=4 301 B4R0.2 CC=CCO MCULE-7490725844 [1,0,0,0,0,0|1,0,1]=3 302 B4R0.2 CC=COC MCULE-6712403535 [1,0,0,0,0,0|0,0,2]=3 303 B4R0.2 CC=CSC MCULE-5921906156 [1,0,0,0,0,0|0,1,2]=4 304 B4R0.2 CCC#CI MCULE-6466997582 [1,0,0,0,0,0|2,0,1]=4 305 B4R0.2 CCC=CBr MCULE-4471551501 [1,0,0,0,0,0|2,0,1]=4 306 B4R0.2 CCC=NO MCULE-9457280654 [1,0,0,0,0,0|2,0,1]=4 307 B4R0.2 CCCC#N MCULE-8571076087 [1,0,0,0,0,0|2,0,0]=3 308 B4R0.2 CCCC=O MCULE-8530391347 [1,0,0,0,0,0|2,0,0]=3 309 B4R0.2 CCCCBr MCULE-3390217131 [1,0,0,0,0,0|2,0,0]=3 310 B4R0.2 CCCCC MCULE-4643148765 [1,0,0,0,0,0|1,0,0]=2 311 B4R0.2 CCCCCl MCULE-5329900290 [1,0,0,0,0,0|2,0,0]=3 312 B4R0.2 CCCCF MCULE-7225760858 [1,0,0,0,0,0|2,0,0]=3 313 B4R0.2 CCCCI MCULE-1160974720 [1,0,0,0,0,0|2,0,0]=3 314 B4R0.2 CCCCN MCULE-1731874934 [1,0,0,0,0,0|2,0,0]=3 315 B4R0.2 CCCCN MCULE-4233278050 [1,0,0,0,0,0|2,0,0]=3 316 B4R0.2 CCCCN MCULE-5242069370 [1,0,0,0,0,0|2,0,0]=3 317 B4R0.2 CCCCN MCULE-7343835253 [1,0,0,0,0,0|2,0,0]=3 318 B4R0.2 CCCCO MCULE-1571156443 [1,0,0,0,0,0|1,0,0]=2 319 B4R0.2 CCCCS MCULE-9441213933 [1,0,0,0,0,0|1,1,0]=3 320 B4R0.2 CCCNC MCULE-2266616259 [1,0,0,0,0,0|1,0,0]=2 321 B4R0.2 CCCNC MCULE-7722796872 [1,0,0,0,0,0|1,0,0]=2 322 B4R0.2 CCCNN MCULE-4121438775 [1,0,0,0,0,0|2,0,0]=3 323 B4R0.2 CCCNN MCULE-5875592228 [1,0,0,0,0,0|2,0,0]=3 324 B4R0.2 CCCNN MCULE-9585694661 [1,0,0,0,0,0|2,0,0]=3 325 B4R0.2 CCCOC MCULE-5854067718 [1,0,0,0,0,0|0,0,0]=1 326 B4R0.2 CCCON MCULE-4800172637 [1,0,0,0,0,0|1,0,0]=2 327 B4R0.2 CCCON MCULE-7988781002 [1,0,0,0,0,0|1,0,0]=2 328 B4R0.2 CCCSC MCULE-8387041737 [1,0,0,0,0,0|0,1,0]=2 329 B4R0.2 CCN=C=O MCULE-6522145601 [1,0,0,0,0,0|3,0,0]=4 330 B4R0.2 CCN=C=S MCULE-9838756606 [1,0,0,0,0,0|3,0,0]=4 331 B4R0.2 CCNC=O MCULE-9309926274 [1,0,0,0,0,0|3,0,0]=4 332 B4R0.2 CCNCC MCULE-3395060353 [1,0,0,0,0,0|2,0,0]=3 333 B4R0.2 CCNCC MCULE-4374609736 [1,0,0,0,0,0|2,0,0]=3 334 B4R0.2 CCNCC MCULE-4555901025 [1,0,0,0,0,0|2,0,0]=3 335 B4R0.2 CCNCC MCULE-6895602113 [1,0,0,0,0,0|2,0,0]=3 336 B4R0.2 CCNOC MCULE-4797714235 [1,0,0,0,0,0|1,0,0]=2 337 B4R0.2 CCNOC MCULE-6486167423 [1,0,0,0,0,0|1,0,0]=2 338 B4R0.2 CCOC=N MCULE-5321655909 [1,0,0,0,0,0|3,0,0]=4 339 B4R0.2 CCOC=N MCULE-8158357614 [1,0,0,0,0,0|3,0,0]=4 340 B4R0.2 CCOC=O MCULE-6245072161 [1,0,0,0,0,0|3,0,0]=4 341 B4R0.2 CCOCBr MCULE-6644755987 [1,0,0,0,0,0|3,0,0]=4 342 B4R0.2 CCOCC MCULE-5665709021 [1,0,0,0,0,0|2,0,0]=3 343 B4R0.2 CCOCCl MCULE-5087992840 [1,0,0,0,0,0|3,0,0]=4 344 B4R0.2 CCONC MCULE-5446312516 [1,0,0,0,0,0|2,0,0]=3 345 B4R0.2 CCONC MCULE-7976027802 [1,0,0,0,0,0|2,0,0]=3 346 B4R0.2 CCSC#N MCULE-1270730084 [1,0,0,0,0,0|3,0,0]=4 347 B4R0.2 CCSCC MCULE-6480710239 [1,0,0,0,0,0|2,0,0]=3 348 B4R0.2 CCSCCl MCULE-3890542152 [1,0,0,0,0,0|3,0,0]=4 349 B4R0.2 CCSSC MCULE-9430585714 [1,0,0,0,0,0|1,1,0]=3 350 B4R0.2 CC[NH2+]CC MCULE-9899430356 [1,0,0,0,0,0|2,0,0]=3 351 B4R0.2 CNCC#N MCULE-1233170363 [1,0,0,0,0,0|2,0,1]=4 352 B4R0.2 CNCC#N MCULE-4334159739 [1,0,0,0,0,0|2,0,1]=4 353 B4R0.2 CNCC#N MCULE-8267124503 [1,0,0,0,0,0|2,0,1]=4 354 B4R0.2 CNCCBr MCULE-3708780806 [1,0,0,0,0,0|2,0,0]=3 355 B4R0.2 CNCCBr MCULE-6840755559 [1,0,0,0,0,0|2,0,0]=3 356 B4R0.2 CNCCCl MCULE-1666345560 [1,0,0,0,0,0|2,0,0]=3 357 B4R0.2 CNCCCl MCULE-8215813413 [1,0,0,0,0,0|2,0,0]=3 358 B4R0.2 CNCCF MCULE-3719880423 [1,0,0,0,0,0|2,0,0]=3 359 B4R0.2 CNCCF MCULE-3751701745 [1,0,0,0,0,0|2,0,0]=3 360 B4R0.2 CNCCI MCULE-7026781832 [1,0,0,0,0,0|2,0,0]=3 361 B4R0.2 CNCCI MCULE-8892686580 [1,0,0,0,0,0|2,0,0]=3 362 B4R0.2 CNCCN MCULE-2881688448 [1,0,0,0,0,0|2,0,0]=3 363 B4R0.2 CNCCN MCULE-7199403269 [1,0,0,0,0,0|2,0,0]=3 364 B4R0.2 CNCCO MCULE-7051900771 [1,0,0,0,0,0|1,0,0]=2 365 B4R0.2 CNCCO MCULE-7934732981 [1,0,0,0,0,0|1,0,0]=2 366 B4R0.2 CNCCS MCULE-6430516369 [1,0,0,0,0,0|1,1,0]=3 367 B4R0.2 COCC#N MCULE-9178522865 [1,0,0,0,0,0|1,0,1]=3 368 B4R0.2 COCC=O MCULE-9427361019 [1,0,0,0,0,0|0,0,2]=3 369 B4R0.2 COCCBr MCULE-8316331262 [1,0,0,0,0,0|1,0,0]=2 370 B4R0.2 COCCCl MCULE-8886627413 [1,0,0,0,0,0|1,0,0]=2 371 B4R0.2 COCCI MCULE-9391124374 [1,0,0,0,0,0|1,0,0]=2 372 B4R0.2 COCCN MCULE-5051556646 [1,0,0,0,0,0|1,0,0]=2 373 B4R0.2 COCCN MCULE-7519068386 [1,0,0,0,0,0|1,0,0]=2 374 B4R0.2 COCCO MCULE-4751927883 [1,0,0,0,0,0|0,0,0]=1 375 B4R0.2 COCCS MCULE-7803276094 [1,0,0,0,0,0|0,1,0]=2 376 B4R0.2 COCOC MCULE-8559076702 [1,0,0,0,0,0|0,0,0]=1 377 B4R0.2 COCON MCULE-6032854331 [1,0,0,0,0,0|1,0,0]=2 378 B4R0.2 CSCC#N MCULE-3607261611 [1,0,0,0,0,0|1,1,1]=4 379 B4R0.2 CSCCBr MCULE-1684461541 [1,0,0,0,0,0|1,1,0]=3 380 B4R0.2 CSCCCl MCULE-8593103756 [1,0,0,0,0,0|1,1,0]=3 381 B4R0.2 CSCCN MCULE-5168245255 [1,0,0,0,0,0|1,1,0]=3 382 B4R0.2 CSCCN MCULE-6275285732 [1,0,0,0,0,0|1,1,0]=3 383 B4R0.2 CSCCO MCULE-9706874325 [1,0,0,0,0,0|0,1,0]=2 384 B4R0.2 CSCSC MCULE-5603964020 [1,0,0,0,0,0|0,2,0]=3 385 B4R0.2 CSSSC MCULE-4175573612 [1,0,0,0,0,0|1,2,0]=4 386 B4R0.2 ClCCCBr MCULE-7937580875 [1,0,0,0,0,0|3,0,0]=4 387 B4R0.2 ClCCCCl MCULE-6693270397 [1,0,0,0,0,0|3,0,0]=4 388 B4R0.2 ClCCCI MCULE-1521526833 [1,0,0,0,0,0|3,0,0]=4 389 B4R0.2 FCCCBr MCULE-5674735753 [1,0,0,0,0,0|3,0,0]=4 390 B4R0.2 FCCCF MCULE-1803511350 [1,0,0,0,0,0|3,0,0]=4 391 B4R0.2 FCCCI MCULE-9287814857 [1,0,0,0,0,0|3,0,0]=4 392 B4R0.2 ICCCI MCULE-9849754168 [1,0,0,0,0,0|3,0,0]=4 393 B4R0.2 N#CCCBr MCULE-1744180602 [1,0,0,0,0,0|3,0,0]=4 394 B4R0.2 N#CCCCl MCULE-3511379481 [1,0,0,0,0,0|3,0,0]=4 395 B4R0.2 N#CCCI MCULE-1591942951 [1,0,0,0,0,0|3,0,0]=4 396 B4R0.2 N#CCCN MCULE-8482296338 [1,0,0,0,0,0|3,0,0]=4 397 B4R0.2 N#CCCN MCULE-9518086954 [1,0,0,0,0,0|3,0,0]=4 398 B4R0.2 N#CCCO MCULE-5098987368 [1,0,0,0,0,0|2,0,0]=3 399 B4R0.2 N#CCCS MCULE-7199964466 [1,0,0,0,0,0|2,1,0]=4 400 B4R0.2 N#CCNO MCULE-6808474875 [1,0,0,0,0,0|3,0,0]=4 401 B4R0.2 N#CCON MCULE-1849571406 [1,0,0,0,0,0|2,0,1]=4 402 B4R0.2 N#CCON MCULE-2156159928 [1,0,0,0,0,0|2,0,1]=4 403 B4R0.2 NCCCBr MCULE-5485748003 [1,0,0,0,0,0|3,0,0]=4 404 B4R0.2 NCCCBr MCULE-7072709972 [1,0,0,0,0,0|3,0,0]=4 405 B4R0.2 NCCCCl MCULE-1324157004 [1,0,0,0,0,0|3,0,0]=4 406 B4R0.2 NCCCCl MCULE-3667248190 [1,0,0,0,0,0|3,0,0]=4 407 B4R0.2 NCCCF MCULE-5215746973 [1,0,0,0,0,0|3,0,0]=4 408 B4R0.2 NCCCF MCULE-8077133369 [1,0,0,0,0,0|3,0,0]=4 409 B4R0.2 NCCCI MCULE-3534892097 [1,0,0,0,0,0|3,0,0]=4 410 B4R0.2 NCCCI MCULE-8010453546 [1,0,0,0,0,0|3,0,0]=4 411 B4R0.2 NCCCN MCULE-4293255820 [1,0,0,0,0,0|3,0,0]=4 412 B4R0.2 NCCCN MCULE-5041378433 [1,0,0,0,0,0|3,0,0]=4 413 B4R0.2 NCCCN MCULE-6944452060 [1,0,0,0,0,0|3,0,0]=4 414 B4R0.2 NCCCN MCULE-7375662153 [1,0,0,0,0,0|3,0,0]=4 415 B4R0.2 NCCCN MCULE-8277465929 [1,0,0,0,0,0|3,0,0]=4 416 B4R0.2 NCCCN MCULE-9929373126 [1,0,0,0,0,0|3,0,0]=4 417 B4R0.2 NCCCO MCULE-2851278356 [1,0,0,0,0,0|2,0,0]=3 418 B4R0.2 NCCCO MCULE-9698089092 [1,0,0,0,0,0|2,0,0]=3 419 B4R0.2 NCCCS MCULE-3994478020 [1,0,0,0,0,0|2,1,0]=4 420 B4R0.2 NCCCS MCULE-7730973866 [1,0,0,0,0,0|2,1,0]=4 421 B4R0.2 NCCON MCULE-3613980902 [1,0,0,0,0,0|2,0,0]=3 422 B4R0.2 NCCON MCULE-7030217952 [1,0,0,0,0,0|2,0,0]=3 423 B4R0.2 NCCON MCULE-8959912781 [1,0,0,0,0,0|2,0,0]=3 424 B4R0.2 NNCCF MCULE-2712460031 [1,0,0,0,0,0|3,0,0]=4 425 B4R0.2 NNCCF MCULE-8505927457 [1,0,0,0,0,0|3,0,0]=4 426 B4R0.2 NNCCO MCULE-1290652744 [1,0,0,0,0,0|2,0,0]=3 427 B4R0.2 NOCCBr MCULE-2796346082 [1,0,0,0,0,0|2,0,0]=3 428 B4R0.2 NOCCBr MCULE-5636354898 [1,0,0,0,0,0|2,0,0]=3 429 B4R0.2 NOCCCl MCULE-5981688956 [1,0,0,0,0,0|2,0,0]=3 430 B4R0.2 NOCCF MCULE-1813481600 [1,0,0,0,0,0|2,0,0]=3 431 B4R0.2 NOCCF MCULE-2993254805 [1,0,0,0,0,0|2,0,0]=3 432 B4R0.2 NOCCO MCULE-2545004367 [1,0,0,0,0,0|1,0,0]=2 433 B4R0.2 O=CCCBr MCULE-4107157458 [1,0,0,0,0,0|3,0,0]=4 434 B4R0.2 O=CCCCl MCULE-5863929313 [1,0,0,0,0,0|3,0,0]=4 435 B4R0.2 O=CCCI MCULE-9771140462 [1,0,0,0,0,0|3,0,0]=4 436 B4R0.2 O=CCCO MCULE-1685289763 [1,0,0,0,0,0|2,0,0]=3 437 B4R0.2 OCC#CBr MCULE-2495653455 [1,0,0,0,0,0|2,0,1]=4 438 B4R0.2 OCC#CI MCULE-1101149708 [1,0,0,0,0,0|2,0,1]=4 439 B4R0.2 OCC=CBr MCULE-4636104289 [1,0,0,0,0,0|2,0,1]=4 440 B4R0.2 OCC=CCl MCULE-2110127594 [1,0,0,0,0,0|2,0,1]=4 441 B4R0.2 OCCCBr MCULE-3450011527 [1,0,0,0,0,0|2,0,0]=3 442 B4R0.2 OCCCCl MCULE-2319230957 [1,0,0,0,0,0|2,0,0]=3 443 B4R0.2 OCCCF MCULE-2347934403 [1,0,0,0,0,0|2,0,0]=3 444 B4R0.2 OCCCI MCULE-5200713967 [1,0,0,0,0,0|2,0,0]=3 445 B4R0.2 OCCCO MCULE-5166824786 [1,0,0,0,0,0|2,0,0]=3 446 B4R0.2 OCCCS MCULE-7930164048 [1,0,0,0,0,0|2,0,0]=3 447 B4R0.2 PCCCP MCULE-6048146071 [1,0,0,0,0,0|3,0,0]=4 448 B4R0.2 SCCCBr MCULE-4627341228 [1,0,0,0,0,0|2,1,0]=4 449 B4R0.2 SCCCCl MCULE-6410389127 [1,0,0,0,0,0|2,1,0]=4 450 B4R0.2 SCCCS MCULE-8220630729 [1,0,0,0,0,0|2,1,0]=4 451 B4R0.2 [NH2+](CC)CC MCULE-1192179232 [1,0,0,0,0,0|2,0,0]=3 452 B4R0.2 [NH3+]OCO[NH3+] MCULE-1014646507 [1,0,0,0,0,0|2,0,0]=3 453 B4R0.2 [NH3+]OCO[NH3+] MCULE-2130820760 [1,0,0,0,0,0|2,0,0]=3 454 B6R0.1 C#CC(N)CCC MCULE-1649795667 [0,1,0,0,0,0|2,0,1]=4 455 B6R0.1 C#CC(N)CCC MCULE-4074347601 [0,1,0,0,0,0|2,0,1]=4 456 B6R0.1 C#CC(N)COC MCULE-7083913188 [0,1,0,0,0,0|1,0,1]=3 457 B6R0.1 C#CC(O)CCC MCULE-6152066005 [0,1,0,0,0,0|2,0,1]=4 458 B6R0.1 C#CCC(=O)OC MCULE-8097491486 [0,1,0,0,0,0|1,0,2]=4 459 B6R0.1 C#CCC(C)NC MCULE-1501548827 [0,1,0,0,0,0|2,0,1]=4 460 B6R0.1 C#CCC(C)NC MCULE-4715321546 [0,1,0,0,0,0|2,0,1]=4 461 B6R0.1 C#CCC(N)CC MCULE-4259544439 [0,1,0,0,0,0|2,0,1]=4 462 B6R0.1 C#CCC(O)CC MCULE-8783941008 [0,1,0,0,0,0|2,0,1]=4 463 B6R0.1 C/C=C/C(=O)OC MCULE-8935178488 [0,1,0,0,0,0|1,0,2]=4 464 B6R0.1 C=CC(=O)COC MCULE-1933195578 [0,1,0,0,0,0|1,0,2]=4 465 B6R0.1 C=CC(C)CCC MCULE-2692803387 [0,1,0,0,0,0|2,0,1]=4 466 B6R0.1 C=CC(N)COC MCULE-3217346081 [0,1,0,0,0,0|1,0,1]=3 467 B6R0.1 C=CC(O)CCC MCULE-3664453040 [0,1,0,0,0,0|2,0,1]=4 468 B6R0.1 C=CCC(=O)OC MCULE-5546680906 [0,1,0,0,0,0|1,0,2]=4 469 B6R0.1 C=CCC(C)CC MCULE-8680856865 [0,1,0,0,0,0|2,0,1]=4 470 B6R0.1 C=CCC(N)CC MCULE-2309097248 [0,1,0,0,0,0|2,0,1]=4 471 B6R0.1 C=CCC(N)CC MCULE-8356954197 [0,1,0,0,0,0|2,0,1]=4 472 B6R0.1 C=CCC(O)CC MCULE-1497539816 [0,1,0,0,0,0|2,0,1]=4 473 B6R0.1 C=CC[C@@H](O)CC MCULE-3259102701 [0,1,0,0,0,0|2,0,1]=4 474 B6R0.1 C=CC[C@H](O)CC MCULE-6527977219 [0,1,0,0,0,0|2,0,1]=4 475 B6R0.1 CC#CC(=O)OC MCULE-6108678475 [0,1,0,0,0,0|1,0,2]=4 476 B6R0.1 CC#CC(O)CC MCULE-9870271888 [0,1,0,0,0,0|2,0,1]=4 477 B6R0.1 CC=CC(=O)OC MCULE-1093700917 [0,1,0,0,0,0|1,0,2]=4 478 B6R0.1 CCC(=O)CNC MCULE-3030105640 [0,1,0,0,0,0|2,0,1]=4 479 B6R0.1 CCC(=O)CNC MCULE-6945295017 [0,1,0,0,0,0|2,0,1]=4 480 B6R0.1 CCC(=O)COC MCULE-1087802011 [0,1,0,0,0,0|1,0,1]=3 481 B6R0.1 CCC(=O)CSC MCULE-3230433182 [0,1,0,0,0,0|1,1,1]=4 482 B6R0.1 CCC(=O)NOC MCULE-4440074406 [0,1,0,0,0,0|2,0,1]=4 483 B6R0.1 CCC(Br)COC MCULE-7942540965 [0,1,0,0,0,0|1,0,0]=2 484 B6R0.1 CCC(C)CC#N MCULE-8784266918 [0,1,0,0,0,0|3,0,0]=4 485 B6R0.1 CCC(C)CC=O MCULE-9143756592 [0,1,0,0,0,0|3,0,0]=4 486 B6R0.1 CCC(C)CCBr MCULE-6033010731 [0,1,0,0,0,0|3,0,0]=4 487 B6R0.1 CCC(C)CCCl MCULE-2069721626 [0,1,0,0,0,0|3,0,0]=4 488 B6R0.1 CCC(C)CCN MCULE-4140800594 [0,1,0,0,0,0|3,0,0]=4 489 B6R0.1 CCC(C)CCN MCULE-5509248218 [0,1,0,0,0,0|3,0,0]=4 490 B6R0.1 CCC(C)CCO MCULE-6482427735 [0,1,0,0,0,0|3,0,0]=4 491 B6R0.1 CCC(C)CNC MCULE-1998406301 [0,1,0,0,0,0|2,0,0]=3 492 B6R0.1 CCC(C)CNC MCULE-5957910094 [0,1,0,0,0,0|2,0,0]=3 493 B6R0.1 CCC(C)CON MCULE-7033012303 [0,1,0,0,0,0|2,0,0]=3 494 B6R0.1 CCC(N)CC#N MCULE-9550652690 [0,1,0,0,0,0|3,0,0]=4 495 B6R0.1 CCC(N)CCN MCULE-8956610037 [0,1,0,0,0,0|3,0,0]=4 496 B6R0.1 CCC(N)CCO MCULE-1511155206 [0,1,0,0,0,0|3,0,0]=4 497 B6R0.1 CCC(N)CCO MCULE-5525302643 [0,1,0,0,0,0|3,0,0]=4 498 B6R0.1 CCC(N)COC MCULE-2103613859 [0,1,0,0,0,0|1,0,0]=2 499 B6R0.1 CCC(N)COC MCULE-5835446359 [0,1,0,0,0,0|1,0,0]=2 500 B6R0.1 CCC(N)CSC MCULE-9145513729 [0,1,0,0,0,0|1,1,0]=3 501 B6R0.1 CCC(O)CC#N MCULE-2542710031 [0,1,0,0,0,0|3,0,0]=4 502 B6R0.1 CCC(O)CCN MCULE-5387303971 [0,1,0,0,0,0|3,0,0]=4 503 B6R0.1 CCC(O)CCO MCULE-5156075792 [0,1,0,0,0,0|3,0,0]=4 504 B6R0.1 CCC(O)CNC MCULE-2490431367 [0,1,0,0,0,0|2,0,0]=3 505 B6R0.1 CCC(O)CNN MCULE-1038166714 [0,1,0,0,0,0|3,0,0]=4 506 B6R0.1 CCC(O)CNN MCULE-6391104058 [0,1,0,0,0,0|3,0,0]=4 507 B6R0.1 CCC(O)COC MCULE-6751000060 [0,1,0,0,0,0|1,0,0]=2 508 B6R0.1 CCC(O)CSC MCULE-3582683720 [0,1,0,0,0,0|1,1,0]=3 509 B6R0.1 CCC(S)CCO MCULE-4193788852 [0,1,0,0,0,0|3,0,0]=4 510 B6R0.1 CCCC(=O)CC MCULE-7121523805 [0,1,0,0,0,0|2,0,1]=4 511 B6R0.1 CCCC(=O)NC MCULE-5770149071 [0,1,0,0,0,0|2,0,1]=4 512 B6R0.1 CCCC(=O)OC MCULE-1092030267 [0,1,0,0,0,0|1,0,1]=3 513 B6R0.1 CCCC(=O)SC MCULE-1490654381 [0,1,0,0,0,0|1,1,1]=4 514 B6R0.1 CCCC(=S)OC MCULE-8125476093 [0,1,0,0,0,0|1,0,1]=3 515 B6R0.1 CCCC(Br)CC MCULE-9116433502 [0,1,0,0,0,0|2,0,0]=3 516 B6R0.1 CCCC(C)C#N MCULE-2492294131 [0,1,0,0,0,0|3,0,0]=4 517 B6R0.1 CCCC(C)C=O MCULE-9756444218 [0,1,0,0,0,0|3,0,0]=4 518 B6R0.1 CCCC(C)CBr MCULE-3437352091 [0,1,0,0,0,0|3,0,0]=4 519 B6R0.1 CCCC(C)CC MCULE-7082933967 [0,1,0,0,0,0|2,0,0]=3 520 B6R0.1 CCCC(C)CCl MCULE-2381010454 [0,1,0,0,0,0|3,0,0]=4 521 B6R0.1 CCCC(C)CN MCULE-9552289739 [0,1,0,0,0,0|3,0,0]=4 522 B6R0.1 CCCC(C)CO MCULE-9777250826 [0,1,0,0,0,0|3,0,0]=4 523 B6R0.1 CCCC(C)NC MCULE-1560121168 [0,1,0,0,0,0|2,0,0]=3 524 B6R0.1 CCCC(C)NC MCULE-2169396338 [0,1,0,0,0,0|2,0,0]=3 525 B6R0.1 CCCC(Cl)CC MCULE-1581617529 [0,1,0,0,0,0|2,0,0]=3 526 B6R0.1 CCCC(Cl)CCl MCULE-9464139069 [0,1,0,0,0,0|3,0,0]=4 527 B6R0.1 CCCC(N)C#N MCULE-6830545935 [0,1,0,0,0,0|3,0,0]=4 528 B6R0.1 CCCC(N)C#N MCULE-9818121096 [0,1,0,0,0,0|3,0,0]=4 529 B6R0.1 CCCC(N)CC MCULE-5349906741 [0,1,0,0,0,0|2,0,0]=3 530 B6R0.1 CCCC(N)CC MCULE-7172418373 [0,1,0,0,0,0|2,0,0]=3 531 B6R0.1 CCCC(N)CN MCULE-8606218569 [0,1,0,0,0,0|3,0,0]=4 532 B6R0.1 CCCC(N)CO MCULE-3404967504 [0,1,0,0,0,0|3,0,0]=4 533 B6R0.1 CCCC(N)CO MCULE-3802448518 [0,1,0,0,0,0|3,0,0]=4 534 B6R0.1 CCCC(N)CO MCULE-4259078445 [0,1,0,0,0,0|3,0,0]=4 535 B6R0.1 CCCC(N)CO MCULE-6425025734 [0,1,0,0,0,0|3,0,0]=4 536 B6R0.1 CCCC(O)C#N MCULE-7017059503 [0,1,0,0,0,0|3,0,0]=4 537 B6R0.1 CCCC(O)CBr MCULE-5186252424 [0,1,0,0,0,0|3,0,0]=4 538 B6R0.1 CCCC(O)CC MCULE-9504041935 [0,1,0,0,0,0|2,0,0]=3 539 B6R0.1 CCCC(O)CCl MCULE-4737360217 [0,1,0,0,0,0|3,0,0]=4 540 B6R0.1 CCCC(O)CN MCULE-9402934997 [0,1,0,0,0,0|3,0,0]=4 541 B6R0.1 CCCC(O)CO MCULE-5124107719 [0,1,0,0,0,0|3,0,0]=4 542 B6R0.1 CCCC(S)CC MCULE-1322481338 [0,1,0,0,0,0|2,0,0]=3 543 B6R0.1 CCC[C@@H](N)CF MCULE-4702552251 [0,1,0,0,0,0|3,0,0]=4 544 B6R0.1 CCC[C@@H](N)CF MCULE-8118043624 [0,1,0,0,0,0|3,0,0]=4 545 B6R0.1 CCC[C@@H](N)CO MCULE-3684308356 [0,1,0,0,0,0|3,0,0]=4 546 B6R0.1 CCC[C@@H](N)CO MCULE-4573401915 [0,1,0,0,0,0|3,0,0]=4 547 B6R0.1 CCC[C@@H](N)CO MCULE-5502830670 [0,1,0,0,0,0|3,0,0]=4 548 B6R0.1 CCC[C@@H](O)CC MCULE-7377135785 [0,1,0,0,0,0|2,0,0]=3 549 B6R0.1 CCC[C@H](N)CF MCULE-7192744944 [0,1,0,0,0,0|3,0,0]=4 550 B6R0.1 CCC[C@H](N)CF MCULE-7441387613 [0,1,0,0,0,0|3,0,0]=4 551 B6R0.1 CCC[C@H](N)CO MCULE-4293730307 [0,1,0,0,0,0|3,0,0]=4 552 B6R0.1 CCC[C@H](N)CO MCULE-5185063577 [0,1,0,0,0,0|3,0,0]=4 553 B6R0.1 CCC[C@H](N)CO MCULE-5836622975 [0,1,0,0,0,0|3,0,0]=4 554 B6R0.1 CCC[C@H](N)CO MCULE-7340014196 [0,1,0,0,0,0|3,0,0]=4 555 B6R0.1 CCC[C@H](O)CC MCULE-2229025348 [0,1,0,0,0,0|2,0,0]=3 556 B6R0.1 CCNC(=O)OC MCULE-7110705188 [0,1,0,0,0,0|2,0,1]=4 557 B6R0.1 CCNC(C)CC MCULE-1017617081 [0,1,0,0,0,0|3,0,0]=4 558 B6R0.1 CCNC(C)CC MCULE-2691229640 [0,1,0,0,0,0|3,0,0]=4 559 B6R0.1 CCOC(=O)OC MCULE-1185162684 [0,1,0,0,0,0|2,0,1]=4 560 B6R0.1 CCOC(C)CC MCULE-5049998907 [0,1,0,0,0,0|3,0,0]=4 561 B6R0.1 CC[C@@H](N)CC#N MCULE-3694594576 [0,1,0,0,0,0|3,0,0]=4 562 B6R0.1 CC[C@@H](N)CC#N MCULE-9083117229 [0,1,0,0,0,0|3,0,0]=4 563 B6R0.1 CC[C@@H](N)COC MCULE-2231338404 [0,1,0,0,0,0|1,0,0]=2 564 B6R0.1 CC[C@@H](N)COC MCULE-2931188781 [0,1,0,0,0,0|1,0,0]=2 565 B6R0.1 CC[C@@H](N)COC MCULE-5773677141 [0,1,0,0,0,0|1,0,0]=2 566 B6R0.1 CC[C@@H](N)COC MCULE-5939905142 [0,1,0,0,0,0|1,0,0]=2 567 B6R0.1 CC[C@@H](O)CC#N MCULE-5921416613 [0,1,0,0,0,0|3,0,0]=4 568 B6R0.1 CC[C@@H](O)CC#N MCULE-8527710778 [0,1,0,0,0,0|3,0,0]=4 569 B6R0.1 CC[C@H](C)CCO MCULE-1190203828 [0,1,0,0,0,0|3,0,0]=4 570 B6R0.1 CC[C@H](C)CCO MCULE-8460710173 [0,1,0,0,0,0|3,0,0]=4 571 B6R0.1 CC[C@H](N)CC#N MCULE-9692545503 [0,1,0,0,0,0|3,0,0]=4 572 B6R0.1 CC[C@H](N)COC MCULE-1115072226 [0,1,0,0,0,0|1,0,0]=2 573 B6R0.1 CC[C@H](N)COC MCULE-3917835289 [0,1,0,0,0,0|1,0,0]=2 574 B6R0.1 CC[C@H](N)COC MCULE-8706423122 [0,1,0,0,0,0|1,0,0]=2 575 B6R0.1 CC[C@H](N)COC MCULE-9406311547 [0,1,0,0,0,0|1,0,0]=2 576 B6R0.1 CNC(=O)CON MCULE-6451598359 [0,1,0,0,0,0|2,0,1]=4 577 B6R0.1 CNC(=O)CON MCULE-8743298594 [0,1,0,0,0,0|2,0,1]=4 578 B6R0.1 CNC(C)CC#N MCULE-3748387165 [0,1,0,0,0,0|3,0,0]=4 579 B6R0.1 CNC(C)CCO MCULE-4722422254 [0,1,0,0,0,0|3,0,0]=4 580 B6R0.1 CNC(C)COC MCULE-6864731576 [0,1,0,0,0,0|1,0,0]=2 581 B6R0.1 CNC(C)COC MCULE-9135013355 [0,1,0,0,0,0|1,0,0]=2 582 B6R0.1 CNC(C)CSC MCULE-8293407208 [0,1,0,0,0,0|1,1,0]=3 583 B6R0.1 CNCC(=O)NC MCULE-4579550577 [0,1,0,0,0,0|2,0,1]=4 584 B6R0.1 CNCC(=O)NC MCULE-7833395637 [0,1,0,0,0,0|2,0,1]=4 585 B6R0.1 CNCC(=O)OC MCULE-1667683926 [0,1,0,0,0,0|1,0,1]=3 586 B6R0.1 CNCC(=O)OC MCULE-5530863658 [0,1,0,0,0,0|1,0,1]=3 587 B6R0.1 CNCC(C)C#N MCULE-1673067512 [0,1,0,0,0,0|3,0,0]=4 588 B6R0.1 CNCC(C)CN MCULE-1889673811 [0,1,0,0,0,0|3,0,0]=4 589 B6R0.1 CNCC(C)CO MCULE-6329429747 [0,1,0,0,0,0|3,0,0]=4 590 B6R0.1 CNCC(C)OC MCULE-6977139114 [0,1,0,0,0,0|1,0,0]=2 591 B6R0.1 CNCC(C)OC MCULE-8216810034 [0,1,0,0,0,0|1,0,0]=2 592 B6R0.1 CNCC(O)CF MCULE-3368370486 [0,1,0,0,0,0|3,0,0]=4 593 B6R0.1 CNCC(O)CN MCULE-1077260629 [0,1,0,0,0,0|3,0,0]=4 594 B6R0.1 CNCC(O)CO MCULE-4566952448 [0,1,0,0,0,0|3,0,0]=4 595 B6R0.1 CNC[C@H](O)CO MCULE-3410453252 [0,1,0,0,0,0|3,0,0]=4 596 B6R0.1 CNNC(=O)OC MCULE-4763095719 [0,1,0,0,0,0|2,0,1]=4 597 B6R0.1 COC(=N)CC#N MCULE-1828487034 [0,1,0,0,0,0|2,0,1]=4 598 B6R0.1 COC(=N)CC#N MCULE-5000327296 [0,1,0,0,0,0|2,0,1]=4 599 B6R0.1 COC(=N)CCCl MCULE-1997539408 [0,1,0,0,0,0|2,0,1]=4 600 B6R0.1 COC(=N)CCCl MCULE-2235564076 [0,1,0,0,0,0|2,0,1]=4 601 B6R0.1 COC(=N)CCO MCULE-1904978557 [0,1,0,0,0,0|2,0,1]=4 602 B6R0.1 COC(=N)CCO MCULE-8146089973 [0,1,0,0,0,0|2,0,1]=4 603 B6R0.1 COC(=O)CC#N MCULE-2699345092 [0,1,0,0,0,0|2,0,1]=4 604 B6R0.1 COC(=O)CC=O MCULE-6624474559 [0,1,0,0,0,0|2,0,1]=4 605 B6R0.1 COC(=O)CCBr MCULE-3565567444 [0,1,0,0,0,0|2,0,1]=4 606 B6R0.1 COC(=O)CCCl MCULE-5034007224 [0,1,0,0,0,0|2,0,1]=4 607 B6R0.1 COC(=O)CCI MCULE-5984806612 [0,1,0,0,0,0|2,0,1]=4 608 B6R0.1 COC(=O)CCN MCULE-2306060188 [0,1,0,0,0,0|2,0,1]=4 609 B6R0.1 COC(=O)CCN MCULE-8245275833 [0,1,0,0,0,0|2,0,1]=4 610 B6R0.1 COC(=O)CCO MCULE-8538834260 [0,1,0,0,0,0|2,0,1]=4 611 B6R0.1 COC(=O)CCS MCULE-1695345183 [0,1,0,0,0,0|2,0,1]=4 612 B6R0.1 COC(=O)CNN MCULE-3287579794 [0,1,0,0,0,0|2,0,1]=4 613 B6R0.1 COC(=O)CNN MCULE-3838874166 [0,1,0,0,0,0|2,0,1]=4 614 B6R0.1 COC(=O)CON MCULE-4799038238 [0,1,0,0,0,0|1,0,1]=3 615 B6R0.1 COC(=O)CSC MCULE-6735536033 [0,1,0,0,0,0|0,1,1]=3 616 B6R0.1 COC(C)CC=O MCULE-7243333697 [0,1,0,0,0,0|2,0,0]=3 617 B6R0.1 COC(C)CCN MCULE-8081876282 [0,1,0,0,0,0|2,0,0]=3 618 B6R0.1 COC(C)CCN MCULE-8892057529 [0,1,0,0,0,0|2,0,0]=3 619 B6R0.1 COC(C)CCO MCULE-7396381165 [0,1,0,0,0,0|2,0,0]=3 620 B6R0.1 COC/C(=N/O)/N MCULE-8214035702 [0,1,0,0,0,0|2,0,1]=4 621 B6R0.1 COCC(=N)OC MCULE-2350779439 [0,1,0,0,0,0|0,0,1]=2 622 B6R0.1 COCC(=N)OC MCULE-7810421458 [0,1,0,0,0,0|0,0,1]=2 623 B6R0.1 COCC(=O)CCl MCULE-7542636020 [0,1,0,0,0,0|2,0,1]=4 624 B6R0.1 COCC(=O)NN MCULE-4127487886 [0,1,0,0,0,0|2,0,1]=4 625 B6R0.1 COCC(=O)OC MCULE-8337685268 [0,1,0,0,0,0|0,0,1]=2 626 B6R0.1 COCC(C)C#N MCULE-2978497753 [0,1,0,0,0,0|2,0,0]=3 627 B6R0.1 COCC(C)C=O MCULE-7679332713 [0,1,0,0,0,0|2,0,0]=3 628 B6R0.1 COCC(C)CN MCULE-3223901774 [0,1,0,0,0,0|2,0,0]=3 629 B6R0.1 COCC(C)CO MCULE-7663064542 [0,1,0,0,0,0|2,0,0]=3 630 B6R0.1 COCC(C)OC MCULE-1583498700 [0,1,0,0,0,0|0,0,0]=1 631 B6R0.1 COCC(Cl)C#N MCULE-3128136686 [0,1,0,0,0,0|2,0,0]=3 632 B6R0.1 COCC(F)CN MCULE-2821685967 [0,1,0,0,0,0|2,0,0]=3 633 B6R0.1 COCC(F)CN MCULE-9691951401 [0,1,0,0,0,0|2,0,0]=3 634 B6R0.1 COCC(N)C#N MCULE-4816557518 [0,1,0,0,0,0|2,0,0]=3 635 B6R0.1 COCC(N)CN MCULE-1244199319 [0,1,0,0,0,0|2,0,0]=3 636 B6R0.1 COCC(N)CO MCULE-2141613120 [0,1,0,0,0,0|2,0,0]=3 637 B6R0.1 COCC(N)CO MCULE-3194232042 [0,1,0,0,0,0|2,0,0]=3 638 B6R0.1 COCC(N)CO MCULE-6545937769 [0,1,0,0,0,0|2,0,0]=3 639 B6R0.1 COCC(N)CO MCULE-7989665777 [0,1,0,0,0,0|2,0,0]=3 640 B6R0.1 COCC(O)C#N MCULE-2148015888 [0,1,0,0,0,0|2,0,0]=3 641 B6R0.1 COCC(O)CBr MCULE-6900294714 [0,1,0,0,0,0|2,0,0]=3 642 B6R0.1 COCC(O)CCl MCULE-9314630227 [0,1,0,0,0,0|2,0,0]=3 643 B6R0.1 COCC(O)CF MCULE-1938415887 [0,1,0,0,0,0|2,0,0]=3 644 B6R0.1 COCC(O)CN MCULE-2044547388 [0,1,0,0,0,0|2,0,0]=3 645 B6R0.1 COCC(O)CN MCULE-2145726384 [0,1,0,0,0,0|2,0,0]=3 646 B6R0.1 COCC(O)CN MCULE-3637597204 [0,1,0,0,0,0|2,0,0]=3 647 B6R0.1 COCC(O)CO MCULE-1154104224 [0,1,0,0,0,0|2,0,0]=3 648 B6R0.1 COC[C@@H](N)CO MCULE-2792470078 [0,1,0,0,0,0|2,0,0]=3 649 B6R0.1 COC[C@@H](N)CO MCULE-3805343572 [0,1,0,0,0,0|2,0,0]=3 650 B6R0.1 COC[C@@H](N)CO MCULE-7953239910 [0,1,0,0,0,0|2,0,0]=3 651 B6R0.1 COC[C@@H](N)CO MCULE-9178553914 [0,1,0,0,0,0|2,0,0]=3 652 B6R0.1 COC[C@@H](O)CN MCULE-2116679841 [0,1,0,0,0,0|2,0,0]=3 653 B6R0.1 COC[C@@H](O)CN MCULE-4198842123 [0,1,0,0,0,0|2,0,0]=3 654 B6R0.1 COC[C@@H](O)CN MCULE-6330998296 [0,1,0,0,0,0|2,0,0]=3 655 B6R0.1 COC[C@H](C)CO MCULE-3120475252 [0,1,0,0,0,0|2,0,0]=3 656 B6R0.1 COC[C@H](F)CN MCULE-2663238018 [0,1,0,0,0,0|2,0,0]=3 657 B6R0.1 COC[C@H](N)CO MCULE-1678153673 [0,1,0,0,0,0|2,0,0]=3 658 B6R0.1 COC[C@H](N)CO MCULE-2304967280 [0,1,0,0,0,0|2,0,0]=3 659 B6R0.1 COC[C@H](N)CO MCULE-6509090198 [0,1,0,0,0,0|2,0,0]=3 660 B6R0.1 COC[C@H](N)CO MCULE-9806530206 [0,1,0,0,0,0|2,0,0]=3 661 B6R0.1 COC[C@H](O)CN MCULE-1962346446 [0,1,0,0,0,0|2,0,0]=3 662 B6R0.1 COC[C@H](O)CN MCULE-6290984425 [0,1,0,0,0,0|2,0,0]=3 663 B6R0.1 CON(C)CCN MCULE-9318319159 [0,1,0,0,0,0|3,0,0]=4 664 B6R0.1 CONC(=O)OC MCULE-9304532248 [0,1,0,0,0,0|1,0,1]=3 665 B6R0.1 CSC(C)CC=O MCULE-9433914892 [0,1,0,0,0,0|2,1,0]=4 666 B6R0.1 CSC(C)CCN MCULE-5474458753 [0,1,0,0,0,0|2,1,0]=4 667 B6R0.1 CSC(C)CCO MCULE-4317600086 [0,1,0,0,0,0|2,1,0]=4 668 B6R0.1 CSCC(C)CN MCULE-4493405290 [0,1,0,0,0,0|2,1,0]=4 669 B6R0.1 CSCC(C)CO MCULE-3842820579 [0,1,0,0,0,0|2,1,0]=4 670 B6R0.1 CSCC(O)CO MCULE-6573013078 [0,1,0,0,0,0|2,1,0]=4 671 B6R0.1 [C@@H](N)(CC)CC#N MCULE-3832898190 [0,1,0,0,0,0|3,0,0]=4 672 B6R0.1 [C@H](N)(CC)CC#N MCULE-3962570164 [0,1,0,0,0,0|3,0,0]=4 673 B6R0.4 C#CCCC(=O)C MCULE-8723638688 [0,1,0,0,0,0|2,0,1]=4 674 B6R0.4 C#CCCC(C)C MCULE-9613694830 [0,1,0,0,0,0|2,0,1]=4 675 B6R0.4 C#CCCC(C)O MCULE-1476308263 [0,1,0,0,0,0|2,0,1]=4 676 B6R0.4 C#CCCN(C)C MCULE-9558095172 [0,1,0,0,0,0|2,0,1]=4 677 B6R0.4 C=C(C)CCC#N MCULE-9953519474 [0,1,0,0,0,0|3,0,0]=4 678 B6R0.4 C=C(C)CCCBr MCULE-5063918467 [0,1,0,0,0,0|3,0,0]=4 679 B6R0.4 C=C(C)CCCC MCULE-1010177756 [0,1,0,0,0,0|2,0,0]=3 680 B6R0.4 C=C(C)CCCO MCULE-4629274490 [0,1,0,0,0,0|3,0,0]=4 681 B6R0.4 C=C(C)CNCC MCULE-2237759977 [0,1,0,0,0,0|3,0,0]=4 682 B6R0.4 C=CCCC(=C)C MCULE-2323382963 [0,1,0,0,0,0|2,0,1]=4 683 B6R0.4 C=CCCC(=O)C MCULE-9598399930 [0,1,0,0,0,0|2,0,1]=4 684 B6R0.4 C=CCCC(C)Br MCULE-5841356762 [0,1,0,0,0,0|2,0,1]=4 685 B6R0.4 C=CCCC(C)C MCULE-7128249655 [0,1,0,0,0,0|2,0,1]=4 686 B6R0.4 C=CCCC(C)O MCULE-3388106789 [0,1,0,0,0,0|2,0,1]=4 687 B6R0.4 C=CCC[C@@H](C)O MCULE-1272820385 [0,1,0,0,0,0|2,0,1]=4 688 B6R0.4 C=CCC[C@@H](C)O MCULE-8509867177 [0,1,0,0,0,0|2,0,1]=4 689 B6R0.4 C=CCC[C@H](C)O MCULE-4371391667 [0,1,0,0,0,0|2,0,1]=4 690 B6R0.4 CC(=O)CCC#N MCULE-6810756363 [0,1,0,0,0,0|3,0,0]=4 691 B6R0.4 CC(=O)CCC=O MCULE-4767690464 [0,1,0,0,0,0|3,0,0]=4 692 B6R0.4 CC(=O)CCCBr MCULE-7143092097 [0,1,0,0,0,0|3,0,0]=4 693 B6R0.4 CC(=O)CCCCl MCULE-7158553745 [0,1,0,0,0,0|3,0,0]=4 694 B6R0.4 CC(=O)CCCO MCULE-1335342150 [0,1,0,0,0,0|3,0,0]=4 695 B6R0.4 CC(Br)CCC#N MCULE-7424967519 [0,1,0,0,0,0|3,0,0]=4 696 B6R0.4 CC(Br)CCCBr MCULE-8808667049 [0,1,0,0,0,0|3,0,0]=4 697 B6R0.4 CC(C)CCC#N MCULE-5503038837 [0,1,0,0,0,0|3,0,0]=4 698 B6R0.4 CC(C)CCC=O MCULE-9664145623 [0,1,0,0,0,0|3,0,0]=4 699 B6R0.4 CC(C)CCCBr MCULE-2045625937 [0,1,0,0,0,0|3,0,0]=4 700 B6R0.4 CC(C)CCCCl MCULE-4841628592 [0,1,0,0,0,0|3,0,0]=4 701 B6R0.4 CC(C)CCCI MCULE-4035616717 [0,1,0,0,0,0|3,0,0]=4 702 B6R0.4 CC(C)CCCN MCULE-2232715676 [0,1,0,0,0,0|3,0,0]=4 703 B6R0.4 CC(C)CCCN MCULE-7121372197 [0,1,0,0,0,0|3,0,0]=4 704 B6R0.4 CC(C)CCCO MCULE-5797993948 [0,1,0,0,0,0|3,0,0]=4 705 B6R0.4 CC(C)CCCS MCULE-8417191578 [0,1,0,0,0,0|3,0,0]=4 706 B6R0.4 CC(C)CCNN MCULE-1163630283 [0,1,0,0,0,0|3,0,0]=4 707 B6R0.4 CC(C)CCNN MCULE-2023326468 [0,1,0,0,0,0|3,0,0]=4 708 B6R0.4 CC(C)CCNN MCULE-4572239737 [0,1,0,0,0,0|3,0,0]=4 709 B6R0.4 CC(C)CCON MCULE-2653553816 [0,1,0,0,0,0|2,0,0]=3 710 B6R0.4 CC(C)CCON MCULE-6468395078 [0,1,0,0,0,0|2,0,0]=3 711 B6R0.4 CC(Cl)CCC#N MCULE-2064174419 [0,1,0,0,0,0|3,0,0]=4 712 B6R0.4 CC(Cl)CCCCl MCULE-9382073752 [0,1,0,0,0,0|3,0,0]=4 713 B6R0.4 CC(Cl)CCCO MCULE-2554250532 [0,1,0,0,0,0|3,0,0]=4 714 B6R0.4 CC(N)CCCN MCULE-4857113826 [0,1,0,0,0,0|3,0,0]=4 715 B6R0.4 CC(N)CCCN MCULE-4899798325 [0,1,0,0,0,0|3,0,0]=4 716 B6R0.4 CC(N)CCCO MCULE-6629535696 [0,1,0,0,0,0|3,0,0]=4 717 B6R0.4 CC(O)CCC#N MCULE-6350143710 [0,1,0,0,0,0|3,0,0]=4 718 B6R0.4 CC(O)CCCBr MCULE-5477662754 [0,1,0,0,0,0|3,0,0]=4 719 B6R0.4 CC(O)CCCCl MCULE-6993728810 [0,1,0,0,0,0|3,0,0]=4 720 B6R0.4 CC(O)CCCN MCULE-3754805134 [0,1,0,0,0,0|3,0,0]=4 721 B6R0.4 CC(O)CCCO MCULE-6580326052 [0,1,0,0,0,0|3,0,0]=4 722 B6R0.4 CC=CCC(C)C MCULE-7145682250 [0,1,0,0,0,0|2,0,1]=4 723 B6R0.4 CCCC=C(C)C MCULE-2110588796 [0,1,0,0,0,0|2,0,1]=4 724 B6R0.4 CCCCB(O)O MCULE-9002672645 [0,1,0,0,0,0|3,0,0]=4 725 B6R0.4 CCCCC(=N)N MCULE-3271993509 [0,1,0,0,0,0|3,0,0]=4 726 B6R0.4 CCCCC(=N)N MCULE-3935017760 [0,1,0,0,0,0|3,0,0]=4 727 B6R0.4 CCCCC(=O)Br MCULE-2980405081 [0,1,0,0,0,0|3,0,0]=4 728 B6R0.4 CCCCC(=O)C MCULE-3554390184 [0,1,0,0,0,0|2,0,0]=3 729 B6R0.4 CCCCC(=O)Cl MCULE-3875407102 [0,1,0,0,0,0|3,0,0]=4 730 B6R0.4 CCCCC(=O)N MCULE-6419483436 [0,1,0,0,0,0|3,0,0]=4 731 B6R0.4 CCCCC(=O)O MCULE-2333640078 [0,1,0,0,0,0|3,0,0]=4 732 B6R0.4 CCCCC(=O)[O-] MCULE-4817107962 [0,1,0,0,0,0|3,0,0]=4 733 B6R0.4 CCCCC(=S)N MCULE-8236760762 [0,1,0,0,0,0|3,0,0]=4 734 B6R0.4 CCCCC(C)Br MCULE-3252474574 [0,1,0,0,0,0|2,0,0]=3 735 B6R0.4 CCCCC(C)C MCULE-7568461039 [0,1,0,0,0,0|2,0,0]=3 736 B6R0.4 CCCCC(C)Cl MCULE-4825682003 [0,1,0,0,0,0|2,0,0]=3 737 B6R0.4 CCCCC(C)N MCULE-5349371506 [0,1,0,0,0,0|2,0,0]=3 738 B6R0.4 CCCCC(C)N MCULE-6696490028 [0,1,0,0,0,0|2,0,0]=3 739 B6R0.4 CCCCC(C)O MCULE-6558228722 [0,1,0,0,0,0|2,0,0]=3 740 B6R0.4 CCCCC(C)S MCULE-4791681848 [0,1,0,0,0,0|2,0,0]=3 741 B6R0.4 CCCCN(=O)=O MCULE-7679767771 [0,1,0,0,0,0|3,0,0]=4 742 B6R0.4 CCCCN(C)C MCULE-7202077639 [0,1,0,0,0,0|2,0,0]=3 743 B6R0.4 CCCCN(C)N MCULE-7927159797 [0,1,0,0,0,0|2,0,0]=3 744 B6R0.4 CCCCS(=O)[O-] MCULE-4347348762 [0,1,0,0,0,0|2,1,0]=4 745 B6R0.4 CCCCS(=O)[O-] MCULE-8153578421 [0,1,0,0,0,0|2,1,0]=4 746 B6R0.4 CCCC[C@@H](C)N MCULE-2673058676 [0,1,0,0,0,0|2,0,0]=3 747 B6R0.4 CCCC[C@@H](C)N MCULE-7666196055 [0,1,0,0,0,0|2,0,0]=3 748 B6R0.4 CCCC[C@@H](C)O MCULE-3149375333 [0,1,0,0,0,0|2,0,0]=3 749 B6R0.4 CCCC[C@@H](C)O MCULE-5463481348 [0,1,0,0,0,0|2,0,0]=3 750 B6R0.4 CCCC[C@H](C)N MCULE-6212068145 [0,1,0,0,0,0|2,0,0]=3 751 B6R0.4 CCCC[C@H](C)N MCULE-7818513999 [0,1,0,0,0,0|2,0,0]=3 752 B6R0.4 CCCC[C@H](C)O MCULE-1658952902 [0,1,0,0,0,0|2,0,0]=3 753 B6R0.4 CCCC[C@H](C)O MCULE-7987243522 [0,1,0,0,0,0|2,0,0]=3 754 B6R0.4 CCCNC(=O)C MCULE-5899703886 [0,1,0,0,0,0|3,0,0]=4 755 B6R0.4 CCCNC(C)C MCULE-7475023734 [0,1,0,0,0,0|3,0,0]=4 756 B6R0.4 CCCOC(=O)C MCULE-7327042566 [0,1,0,0,0,0|3,0,0]=4 757 B6R0.4 CCCSC(=O)C MCULE-4329646671 [0,1,0,0,0,0|3,0,0]=4 758 B6R0.4 CCCSC(C)C MCULE-2233656285 [0,1,0,0,0,0|3,0,0]=4 759 B6R0.4 CCNCC(=O)C MCULE-5799315547 [0,1,0,0,0,0|3,0,0]=4 760 B6R0.4 CCNCC(=O)C MCULE-9258294157 [0,1,0,0,0,0|3,0,0]=4 761 B6R0.4 CCNCC(C)C MCULE-1625905125 [0,1,0,0,0,0|3,0,0]=4 762 B6R0.4 CCNCC(C)C MCULE-3527739859 [0,1,0,0,0,0|3,0,0]=4 763 B6R0.4 CCNCC(C)O MCULE-5078068369 [0,1,0,0,0,0|3,0,0]=4 764 B6R0.4 CCNC[C@@H](C)O MCULE-4291219061 [0,1,0,0,0,0|3,0,0]=4 765 B6R0.4 CCNC[C@@H](C)O MCULE-8603386701 [0,1,0,0,0,0|3,0,0]=4 766 B6R0.4 CCNC[C@H](C)O MCULE-7173470231 [0,1,0,0,0,0|3,0,0]=4 767 B6R0.4 CCNC[C@H](C)O MCULE-9651301254 [0,1,0,0,0,0|3,0,0]=4 768 B6R0.4 CCOCC(=O)C MCULE-2825677443 [0,1,0,0,0,0|3,0,0]=4 769 B6R0.4 CCOCC(C)C MCULE-7986128672 [0,1,0,0,0,0|3,0,0]=4 770 B6R0.4 CCOCC(C)N MCULE-8540668261 [0,1,0,0,0,0|3,0,0]=4 771 B6R0.4 CCOCC(C)N MCULE-8720228996 [0,1,0,0,0,0|3,0,0]=4 772 B6R0.4 CCOCC(C)O MCULE-6224339526 [0,1,0,0,0,0|3,0,0]=4 773 B6R0.4 CCOC[C@@H](C)N MCULE-7053460047 [0,1,0,0,0,0|3,0,0]=4 774 B6R0.4 CCOC[C@@H](C)N MCULE-9865800502 [0,1,0,0,0,0|3,0,0]=4 775 B6R0.4 CCOC[C@@H](C)O MCULE-9075407512 [0,1,0,0,0,0|3,0,0]=4 776 B6R0.4 CCOC[C@H](C)N MCULE-2897416804 [0,1,0,0,0,0|3,0,0]=4 777 B6R0.4 CCOC[C@H](C)N MCULE-6799267946 [0,1,0,0,0,0|3,0,0]=4 778 B6R0.4 CCSCC(=O)C MCULE-9872082780 [0,1,0,0,0,0|3,0,0]=4 779 B6R0.4 CCSCC(C)N MCULE-3399255190 [0,1,0,0,0,0|3,0,0]=4 780 B6R0.4 CN(C)CCC#N MCULE-8979604677 [0,1,0,0,0,0|3,0,0]=4 781 B6R0.4 CN(C)CCC=O MCULE-6830649526 [0,1,0,0,0,0|3,0,0]=4 782 B6R0.4 CN(C)CCCBr MCULE-2862944726 [0,1,0,0,0,0|3,0,0]=4 783 B6R0.4 CN(C)CCCBr MCULE-4596026048 [0,1,0,0,0,0|3,0,0]=4 784 B6R0.4 CN(C)CCCBr MCULE-7515880350 [0,1,0,0,0,0|3,0,0]=4 785 B6R0.4 CN(C)CCCCl MCULE-1347366200 [0,1,0,0,0,0|3,0,0]=4 786 B6R0.4 CN(C)CCCCl MCULE-3767329555 [0,1,0,0,0,0|3,0,0]=4 787 B6R0.4 CN(C)CCCI MCULE-2134226049 [0,1,0,0,0,0|3,0,0]=4 788 B6R0.4 CN(C)CCCI MCULE-2999516061 [0,1,0,0,0,0|3,0,0]=4 789 B6R0.4 CN(C)CCCN MCULE-3882436382 [0,1,0,0,0,0|3,0,0]=4 790 B6R0.4 CN(C)CCCN MCULE-4415270662 [0,1,0,0,0,0|3,0,0]=4 791 B6R0.4 CN(C)CCCN MCULE-4624916051 [0,1,0,0,0,0|3,0,0]=4 792 B6R0.4 CN(C)CCCN MCULE-4749435878 [0,1,0,0,0,0|3,0,0]=4 793 B6R0.4 CN(C)CCCN MCULE-9301668058 [0,1,0,0,0,0|3,0,0]=4 794 B6R0.4 CN(C)CCCO MCULE-7408728427 [0,1,0,0,0,0|3,0,0]=4 795 B6R0.4 CN(C)CCCS MCULE-7945161812 [0,1,0,0,0,0|3,0,0]=4 796 B6R0.4 CN(C)CCNN MCULE-5321668174 [0,1,0,0,0,0|3,0,0]=4 797 B6R0.4 CN(C)CCNN MCULE-6578987911 [0,1,0,0,0,0|3,0,0]=4 798 B6R0.4 CN(C)CCON MCULE-1981169712 [0,1,0,0,0,0|2,0,0]=3 799 B6R0.4 CN(C)CCON MCULE-6706970282 [0,1,0,0,0,0|2,0,0]=3 800 B6R0.4 CNCCC(=O)N MCULE-1118876220 [0,1,0,0,0,0|3,0,0]=4 801 B6R0.4 CNCCC(=O)N MCULE-6679713144 [0,1,0,0,0,0|3,0,0]=4 802 B6R0.4 CNCCC(=O)O MCULE-3627988097 [0,1,0,0,0,0|3,0,0]=4 803 B6R0.4 CNCCC(=O)O MCULE-9858204248 [0,1,0,0,0,0|3,0,0]=4 804 B6R0.4 CNCCC(C)C MCULE-3679914556 [0,1,0,0,0,0|2,0,0]=3 805 B6R0.4 CNCCC(C)C MCULE-9679972004 [0,1,0,0,0,0|2,0,0]=3 806 B6R0.4 CNCCC(C)N MCULE-5955505029 [0,1,0,0,0,0|2,0,0]=3 807 B6R0.4 CNCCC(C)N MCULE-8933967952 [0,1,0,0,0,0|2,0,0]=3 808 B6R0.4 CNCCC(C)O MCULE-1615526002 [0,1,0,0,0,0|2,0,0]=3 809 B6R0.4 CNCCN(C)C MCULE-3324857553 [0,1,0,0,0,0|2,0,0]=3 810 B6R0.4 CNCCN(C)C MCULE-8014008412 [0,1,0,0,0,0|2,0,0]=3 811 B6R0.4 CNCCN(C)C MCULE-9954339750 [0,1,0,0,0,0|2,0,0]=3 812 B6R0.4 CNCC[C@@H](C)N MCULE-6024494304 [0,1,0,0,0,0|2,0,0]=3 813 B6R0.4 CNCC[C@H](C)N MCULE-5449372796 [0,1,0,0,0,0|2,0,0]=3 814 B6R0.4 CNCC[C@H](C)N MCULE-8157402351 [0,1,0,0,0,0|2,0,0]=3 815 B6R0.4 CNOCC(C)C MCULE-4779196887 [0,1,0,0,0,0|3,0,0]=4 816 B6R0.4 CNOCC(C)C MCULE-7320343096 [0,1,0,0,0,0|3,0,0]=4 817 B6R0.4 CO/C=C/C(=O)C MCULE-1215649803 [0,1,0,0,0,0|1,0,2]=4 818 B6R0.4 COC=CC(=O)C MCULE-4868833764 [0,1,0,0,0,0|1,0,2]=4 819 B6R0.4 COCCC(=N)N MCULE-8118559492 [0,1,0,0,0,0|2,0,0]=3 820 B6R0.4 COCCC(=N)N MCULE-9000138086 [0,1,0,0,0,0|2,0,0]=3 821 B6R0.4 COCCC(=O)C MCULE-5939812376 [0,1,0,0,0,0|1,0,0]=2 822 B6R0.4 COCCC(=O)Cl MCULE-9454266286 [0,1,0,0,0,0|2,0,0]=3 823 B6R0.4 COCCC(=O)N MCULE-7556483675 [0,1,0,0,0,0|2,0,0]=3 824 B6R0.4 COCCC(=O)O MCULE-3436347115 [0,1,0,0,0,0|2,0,0]=3 825 B6R0.4 COCCC(C)Br MCULE-6529807745 [0,1,0,0,0,0|1,0,0]=2 826 B6R0.4 COCCC(C)C MCULE-8727768886 [0,1,0,0,0,0|1,0,0]=2 827 B6R0.4 COCCC(C)N MCULE-6183216923 [0,1,0,0,0,0|1,0,0]=2 828 B6R0.4 COCCC(C)O MCULE-6536001437 [0,1,0,0,0,0|1,0,0]=2 829 B6R0.4 COCCN(C)C MCULE-5323166567 [0,1,0,0,0,0|1,0,0]=2 830 B6R0.4 COCCN(C)N MCULE-9480733049 [0,1,0,0,0,0|1,0,0]=2 831 B6R0.4 COCC[C@H](C)N MCULE-6163336851 [0,1,0,0,0,0|1,0,0]=2 832 B6R0.4 COCC[C@H](C)N MCULE-6363449253 [0,1,0,0,0,0|1,0,0]=2 833 B6R0.4 COCNC(=O)N MCULE-8367032240 [0,1,0,0,0,0|3,0,0]=4 834 B6R0.4 COCOC(=O)C MCULE-8876091916 [0,1,0,0,0,0|2,0,0]=3 835 B6R0.4 CON=CC(C)C MCULE-1606683545 [0,1,0,0,0,0|2,0,1]=4 836 B6R0.4 CS(=O)CCCN MCULE-1124989526 [0,1,0,0,0,0|2,1,0]=4 837 B6R0.4 CS(=O)CCCN MCULE-8758903495 [0,1,0,0,0,0|2,1,0]=4 838 B6R0.4 CSCCC(=N)N MCULE-3926353306 [0,1,0,0,0,0|2,1,0]=4 839 B6R0.4 CSCCC(=N)N MCULE-4451485733 [0,1,0,0,0,0|2,1,0]=4 840 B6R0.4 CSCCC(=O)C MCULE-6178663156 [0,1,0,0,0,0|1,1,0]=3 841 B6R0.4 CSCCC(=O)Cl MCULE-9732512141 [0,1,0,0,0,0|2,1,0]=4 842 B6R0.4 CSCCC(=O)N MCULE-7105035733 [0,1,0,0,0,0|2,1,0]=4 843 B6R0.4 CSCCC(=O)O MCULE-9550032941 [0,1,0,0,0,0|2,1,0]=4 844 B6R0.4 CSCCC(C)N MCULE-3925048385 [0,1,0,0,0,0|1,1,0]=3 845 B6R0.4 CSCCC(C)O MCULE-5934844952 [0,1,0,0,0,0|1,1,0]=3 846 B6R0.4 CSCCN(C)C MCULE-2148124964 [0,1,0,0,0,0|1,1,0]=3 847 B6R0.4 CSCCN(C)C MCULE-5176242697 [0,1,0,0,0,0|1,1,0]=3 848 B6R0.4 CSCOC(=O)C MCULE-1498769347 [0,1,0,0,0,0|2,1,0]=4 849 B6R0.4 C[C@@H](N)CCCO MCULE-8313291415 [0,1,0,0,0,0|3,0,0]=4 850 B6R0.4 C[C@@H](O)CCCO MCULE-1658231016 [0,1,0,0,0,0|3,0,0]=4 851 B6R0.4 NOCCC(=O)O MCULE-1529492904 [0,1,0,0,0,0|3,0,0]=4 852 B6R0.4 NOCCC(=O)O MCULE-6297331357 [0,1,0,0,0,0|3,0,0]=4 853 B6R0.6 BrCCCCCBr MCULE-7929769310 [0,1,0,0,0,0|3,0,0]=4 854 B6R0.6 C#CCCCCBr MCULE-9086746106 [0,1,0,0,0,0|2,0,1]=4 855 B6R0.6 C#CCCCCC MCULE-7776756434 [0,1,0,0,0,0|2,0,1]=4 856 B6R0.6 C#CCCCCCl MCULE-3718113550 [0,1,0,0,0,0|2,0,1]=4 857 B6R0.6 C#CCCCCI MCULE-6799128140 [0,1,0,0,0,0|2,0,1]=4 858 B6R0.6 C#CCCCCN MCULE-1313888655 [0,1,0,0,0,0|2,0,1]=4 859 B6R0.6 C#CCCCCN MCULE-5521830994 [0,1,0,0,0,0|2,0,1]=4 860 B6R0.6 C#CCCCCO MCULE-2977997146 [0,1,0,0,0,0|2,0,1]=4 861 B6R0.6 C#CCCCNC MCULE-4472877921 [0,1,0,0,0,0|2,0,1]=4 862 B6R0.6 C#CCCCNC MCULE-9185657315 [0,1,0,0,0,0|2,0,1]=4 863 B6R0.6 C#CCCCOC MCULE-3174650949 [0,1,0,0,0,0|1,0,1]=3 864 B6R0.6 C#CCCCON MCULE-5269610423 [0,1,0,0,0,0|2,0,1]=4 865 B6R0.6 C#CCCSCC MCULE-1094584940 [0,1,0,0,0,0|1,1,1]=4 866 B6R0.6 C#CCNCCC MCULE-7880884278 [0,1,0,0,0,0|2,0,1]=4 867 B6R0.6 C#CCNCCC MCULE-8975069665 [0,1,0,0,0,0|2,0,1]=4 868 B6R0.6 C(=C/CCC)\CO MCULE-6491762150 [0,1,0,0,0,0|2,0,1]=4 869 B6R0.6 C/C=C/CCCC MCULE-6900331316 [0,1,0,0,0,0|2,0,0]=3 870 B6R0.6 C/C=C/CCCO MCULE-9865436125 [0,1,0,0,0,0|2,0,1]=4 871 B6R0.6 C/C=C\CCCC MCULE-8426867799 [0,1,0,0,0,0|2,0,0]=3 872 B6R0.6 C/C=C\CCCO MCULE-3169839661 [0,1,0,0,0,0|2,0,1]=4 873 B6R0.6 C=CCC/C=C/C MCULE-3936427871 [0,1,0,0,0,0|2,0,1]=4 874 B6R0.6 C=CCCC=CC MCULE-6481809840 [0,1,0,0,0,0|2,0,1]=4 875 B6R0.6 C=CCCCCBr MCULE-4313298656 [0,1,0,0,0,0|2,0,1]=4 876 B6R0.6 C=CCCCCC MCULE-5868303078 [0,1,0,0,0,0|2,0,1]=4 877 B6R0.6 C=CCCCCCl MCULE-7600727876 [0,1,0,0,0,0|2,0,1]=4 878 B6R0.6 C=CCCCCI MCULE-5694143061 [0,1,0,0,0,0|2,0,1]=4 879 B6R0.6 C=CCCCCN MCULE-1489231988 [0,1,0,0,0,0|2,0,1]=4 880 B6R0.6 C=CCCCCN MCULE-4288584778 [0,1,0,0,0,0|2,0,1]=4 881 B6R0.6 C=CCCCCO MCULE-3631432277 [0,1,0,0,0,0|2,0,1]=4 882 B6R0.6 C=CCCCNC MCULE-6696525157 [0,1,0,0,0,0|2,0,1]=4 883 B6R0.6 C=CCCCNC MCULE-7417274044 [0,1,0,0,0,0|2,0,1]=4 884 B6R0.6 C=CCCCON MCULE-6496647420 [0,1,0,0,0,0|2,0,1]=4 885 B6R0.6 C=CCCCON MCULE-7055713530 [0,1,0,0,0,0|2,0,1]=4 886 B6R0.6 C=CCNCCC MCULE-4239068147 [0,1,0,0,0,0|2,0,1]=4 887 B6R0.6 C=CCNCCC MCULE-9778489216 [0,1,0,0,0,0|2,0,1]=4 888 B6R0.6 C=CCOCOC MCULE-6553342654 [0,1,0,0,0,0|1,0,1]=3 889 B6R0.6 C=CCSCCC MCULE-3855352363 [0,1,0,0,0,0|2,0,1]=4 890 B6R0.6 C=COCCCC MCULE-2025922328 [0,1,0,0,0,0|1,0,1]=3 891 B6R0.6 C=COCCCN MCULE-1669664157 [0,1,0,0,0,0|2,0,1]=4 892 B6R0.6 C=COCCCO MCULE-8325617945 [0,1,0,0,0,0|2,0,1]=4 893 B6R0.6 C=COCCOC MCULE-6845218696 [0,1,0,0,0,0|0,0,1]=2 894 B6R0.6 C=COCCON MCULE-8247202981 [0,1,0,0,0,0|1,0,1]=3 895 B6R0.6 CC#CCCCBr MCULE-8545908172 [0,1,0,0,0,0|2,0,1]=4 896 B6R0.6 CC#CCCCC MCULE-1899332515 [0,1,0,0,0,0|2,0,0]=3 897 B6R0.6 CC#CCCCO MCULE-6502564684 [0,1,0,0,0,0|2,0,1]=4 898 B6R0.6 CC/C=C/CCC MCULE-5222700461 [0,1,0,0,0,0|2,0,1]=4 899 B6R0.6 CC=CCCCBr MCULE-1109208969 [0,1,0,0,0,0|2,0,1]=4 900 B6R0.6 CC=CCCCC MCULE-7277981733 [0,1,0,0,0,0|2,0,0]=3 901 B6R0.6 CC=CCCCCl MCULE-7487798637 [0,1,0,0,0,0|2,0,1]=4 902 B6R0.6 CC=CCCCO MCULE-1401303632 [0,1,0,0,0,0|2,0,1]=4 903 B6R0.6 CC=CSCCC MCULE-3534082442 [0,1,0,0,0,0|2,0,1]=4 904 B6R0.6 CCC#CCCC MCULE-9615607532 [0,1,0,0,0,0|2,0,1]=4 905 B6R0.6 CCC=CCCC MCULE-3739501724 [0,1,0,0,0,0|2,0,1]=4 906 B6R0.6 CCC=COCC MCULE-1991976030 [0,1,0,0,0,0|1,0,2]=4 907 B6R0.6 CCCC#CCO MCULE-8352024607 [0,1,0,0,0,0|2,0,1]=4 908 B6R0.6 CCCC=CCBr MCULE-2474104566 [0,1,0,0,0,0|2,0,1]=4 909 B6R0.6 CCCC=CCO MCULE-3204738641 [0,1,0,0,0,0|2,0,1]=4 910 B6R0.6 CCCCCC#N MCULE-7596791521 [0,1,0,0,0,0|2,0,1]=4 911 B6R0.6 CCCCCC=O MCULE-6770578514 [0,1,0,0,0,0|2,0,1]=4 912 B6R0.6 CCCCCCBr MCULE-6022503394 [0,1,0,0,0,0|2,0,0]=3 913 B6R0.6 CCCCCCC MCULE-5817084747 [0,1,0,0,0,0|2,0,0]=3 914 B6R0.6 CCCCCCCl MCULE-3706149525 [0,1,0,0,0,0|2,0,0]=3 915 B6R0.6 CCCCCCF MCULE-4320903575 [0,1,0,0,0,0|2,0,0]=3 916 B6R0.6 CCCCCCI MCULE-1021236615 [0,1,0,0,0,0|2,0,0]=3 917 B6R0.6 CCCCCCN MCULE-2944455155 [0,1,0,0,0,0|2,0,0]=3 918 B6R0.6 CCCCCCN MCULE-6014217174 [0,1,0,0,0,0|2,0,0]=3 919 B6R0.6 CCCCCCN MCULE-6021451227 [0,1,0,0,0,0|2,0,0]=3 920 B6R0.6 CCCCCCO MCULE-4299150163 [0,1,0,0,0,0|2,0,0]=3 921 B6R0.6 CCCCCCS MCULE-5962964855 [0,1,0,0,0,0|2,0,0]=3 922 B6R0.6 CCCCCNC MCULE-8082703734 [0,1,0,0,0,0|2,0,0]=3 923 B6R0.6 CCCCCNN MCULE-5089668540 [0,1,0,0,0,0|3,0,0]=4 924 B6R0.6 CCCCCNN MCULE-7265120524 [0,1,0,0,0,0|3,0,0]=4 925 B6R0.6 CCCCCOC MCULE-3370181741 [0,1,0,0,0,0|1,0,0]=2 926 B6R0.6 CCCCCON MCULE-5372426564 [0,1,0,0,0,0|2,0,0]=3 927 B6R0.6 CCCCCON MCULE-8557641459 [0,1,0,0,0,0|2,0,0]=3 928 B6R0.6 CCCCCSC MCULE-6566108868 [0,1,0,0,0,0|1,1,0]=3 929 B6R0.6 CCCCN=C=O MCULE-3381327717 [0,1,0,0,0,0|2,0,1]=4 930 B6R0.6 CCCCN=C=S MCULE-3952129182 [0,1,0,0,0,0|2,0,1]=4 931 B6R0.6 CCCCN=N#N MCULE-4207638779 [0,1,0,0,0,0|3,0,0]=4 932 B6R0.6 CCCCNC=O MCULE-8821792924 [0,1,0,0,0,0|2,0,1]=4 933 B6R0.6 CCCCNCC MCULE-8816750429 [0,1,0,0,0,0|2,0,0]=3 934 B6R0.6 CCCCNOC MCULE-4265481432 [0,1,0,0,0,0|1,0,0]=2 935 B6R0.6 CCCCOC=O MCULE-4633421026 [0,1,0,0,0,0|1,0,1]=3 936 B6R0.6 CCCCOCC MCULE-5662731951 [0,1,0,0,0,0|1,0,0]=2 937 B6R0.6 CCCCOCCl MCULE-5282964693 [0,1,0,0,0,0|1,0,0]=2 938 B6R0.6 CCCCON=O MCULE-9992790020 [0,1,0,0,0,0|2,0,0]=3 939 B6R0.6 CCCCSC#N MCULE-4585387956 [0,1,0,0,0,0|1,1,1]=4 940 B6R0.6 CCCCSCC MCULE-4832924468 [0,1,0,0,0,0|1,1,0]=3 941 B6R0.6 CCCCSCCl MCULE-4907770015 [0,1,0,0,0,0|1,1,0]=3 942 B6R0.6 CCCNCC#N MCULE-3452380054 [0,1,0,0,0,0|3,0,0]=4 943 B6R0.6 CCCNCCC MCULE-1452672638 [0,1,0,0,0,0|2,0,0]=3 944 B6R0.6 CCCNCCC MCULE-6223802621 [0,1,0,0,0,0|2,0,0]=3 945 B6R0.6 CCCNCCC MCULE-6789654118 [0,1,0,0,0,0|2,0,0]=3 946 B6R0.6 CCCNCCN MCULE-2288945868 [0,1,0,0,0,0|3,0,0]=4 947 B6R0.6 CCCNCCO MCULE-4813687741 [0,1,0,0,0,0|3,0,0]=4 948 B6R0.6 CCCNOCC MCULE-1349462426 [0,1,0,0,0,0|2,0,0]=3 949 B6R0.6 CCCNOCC MCULE-7159087335 [0,1,0,0,0,0|2,0,0]=3 950 B6R0.6 CCCOCC#N MCULE-7011471802 [0,1,0,0,0,0|3,0,0]=4 951 B6R0.6 CCCOCCC MCULE-1390130917 [0,1,0,0,0,0|2,0,0]=3 952 B6R0.6 CCCOCCCl MCULE-6561613708 [0,1,0,0,0,0|3,0,0]=4 953 B6R0.6 CCCOCCI MCULE-5330098176 [0,1,0,0,0,0|3,0,0]=4 954 B6R0.6 CCCOCCN MCULE-1987261931 [0,1,0,0,0,0|3,0,0]=4 955 B6R0.6 CCCOCCN MCULE-9033871038 [0,1,0,0,0,0|3,0,0]=4 956 B6R0.6 CCCOCCO MCULE-3263526264 [0,1,0,0,0,0|3,0,0]=4 957 B6R0.6 CCCSCCC MCULE-5531652471 [0,1,0,0,0,0|2,0,0]=3 958 B6R0.6 CCCSCCN MCULE-3934428121 [0,1,0,0,0,0|3,0,0]=4 959 B6R0.6 CCCSCCN MCULE-5705755172 [0,1,0,0,0,0|3,0,0]=4 960 B6R0.6 CCCSCCO MCULE-8371796663 [0,1,0,0,0,0|3,0,0]=4 961 B6R0.6 CCCSSCC MCULE-7192921435 [0,1,0,0,0,0|2,1,0]=4 962 B6R0.6 CCNCCC#N MCULE-8589229962 [0,1,0,0,0,0|3,0,0]=4 963 B6R0.6 CCNCCCN MCULE-5811169148 [0,1,0,0,0,0|3,0,0]=4 964 B6R0.6 CCNCCCO MCULE-3251610052 [0,1,0,0,0,0|3,0,0]=4 965 B6R0.6 CCNCCNC MCULE-9372339393 [0,1,0,0,0,0|2,0,0]=3 966 B6R0.6 CCNCCOC MCULE-1476772953 [0,1,0,0,0,0|1,0,0]=2 967 B6R0.6 CCNCCOC MCULE-6652489795 [0,1,0,0,0,0|1,0,0]=2 968 B6R0.6 CCNCCSC MCULE-1736157320 [0,1,0,0,0,0|1,1,0]=3 969 B6R0.6 CCNCCSC MCULE-9369049891 [0,1,0,0,0,0|1,1,0]=3 970 B6R0.6 CCOCCC#N MCULE-4907543374 [0,1,0,0,0,0|2,0,0]=3 971 B6R0.6 CCOCCC=O MCULE-1664130148 [0,1,0,0,0,0|2,0,0]=3 972 B6R0.6 CCOCCCBr MCULE-6544747281 [0,1,0,0,0,0|2,0,0]=3 973 B6R0.6 CCOCCCCl MCULE-8523618681 [0,1,0,0,0,0|2,0,0]=3 974 B6R0.6 CCOCCCI MCULE-6640732668 [0,1,0,0,0,0|2,0,0]=3 975 B6R0.6 CCOCCCN MCULE-3491529722 [0,1,0,0,0,0|2,0,0]=3 976 B6R0.6 CCOCCCO MCULE-3077567484 [0,1,0,0,0,0|2,0,0]=3 977 B6R0.6 CCOCCNC MCULE-5244682559 [0,1,0,0,0,0|1,0,0]=2 978 B6R0.6 CCOCCNC MCULE-9344296133 [0,1,0,0,0,0|1,0,0]=2 979 B6R0.6 CCOCCNN MCULE-2995792378 [0,1,0,0,0,0|2,0,0]=3 980 B6R0.6 CCOCCNN MCULE-7756116612 [0,1,0,0,0,0|2,0,0]=3 981 B6R0.6 CCOCCOC MCULE-2753000412 [0,1,0,0,0,0|0,0,0]=1 982 B6R0.6 CCOCCON MCULE-6072859154 [0,1,0,0,0,0|1,0,0]=2 983 B6R0.6 CCOCCON MCULE-7716477934 [0,1,0,0,0,0|1,0,0]=2 984 B6R0.6 CCOCOCC MCULE-3885854108 [0,1,0,0,0,0|2,0,0]=3 985 B6R0.6 CCSCCC=O MCULE-2493452950 [0,1,0,0,0,0|2,1,0]=4 986 B6R0.6 CCSCCCBr MCULE-5143634954 [0,1,0,0,0,0|2,1,0]=4 987 B6R0.6 CCSCCCN MCULE-4566450606 [0,1,0,0,0,0|2,1,0]=4 988 B6R0.6 CCSCCCO MCULE-6719011943 [0,1,0,0,0,0|2,1,0]=4 989 B6R0.6 CCSCCNC MCULE-6159594076 [0,1,0,0,0,0|1,1,0]=3 990 B6R0.6 CCSCCNC MCULE-6696154047 [0,1,0,0,0,0|1,1,0]=3 991 B6R0.6 CCSCSCC MCULE-6005869091 [0,1,0,0,0,0|2,1,0]=4 992 B6R0.6 CNCC#CCO MCULE-4900527922 [0,1,0,0,0,0|2,0,1]=4 993 B6R0.6 CNCCCC#N MCULE-2995077554 [0,1,0,0,0,0|2,0,1]=4 994 B6R0.6 CNCCCC#N MCULE-4831210709 [0,1,0,0,0,0|2,0,1]=4 995 B6R0.6 CNCCCCBr MCULE-4148452640 [0,1,0,0,0,0|2,0,0]=3 996 B6R0.6 CNCCCCBr MCULE-8686440557 [0,1,0,0,0,0|2,0,0]=3 997 B6R0.6 CNCCCCCl MCULE-1170786568 [0,1,0,0,0,0|2,0,0]=3 998 B6R0.6 CNCCCCCl MCULE-1726466829 [0,1,0,0,0,0|2,0,0]=3 999 B6R0.6 CNCCCCN MCULE-2542685963 [0,1,0,0,0,0|2,0,0]=3 1000 B6R0.6 CNCCCCN MCULE-7925344560 [0,1,0,0,0,0|2,0,0]=3 1001 B6R0.6 CNCCCCO MCULE-9264393637 [0,1,0,0,0,0|2,0,0]=3 1002 B6R0.6 CNCCCNC MCULE-3840224541 [0,1,0,0,0,0|2,0,0]=3 1003 B6R0.6 CNCCCOC MCULE-4057126907 [0,1,0,0,0,0|1,0,0]=2 1004 B6R0.6 CNCCCOC MCULE-8552551858 [0,1,0,0,0,0|1,0,0]=2 1005 B6R0.6 CNCCCSC MCULE-6553998750 [0,1,0,0,0,0|1,1,0]=3 1006 B6R0.6 CNOCCOC MCULE-2652662364 [0,1,0,0,0,0|0,0,0]=1 1007 B6R0.6 CNOCCOC MCULE-3394597000 [0,1,0,0,0,0|0,0,0]=1 1008 B6R0.6 CO/N=C/NOC MCULE-8041255040 [0,1,0,0,0,0|1,0,1]=3 1009 B6R0.6 COC=CCC#N MCULE-8939260341 [0,1,0,0,0,0|2,0,1]=4 1010 B6R0.6 COCC#CCCl MCULE-2143739767 [0,1,0,0,0,0|1,0,1]=3 1011 B6R0.6 COCCCC#N MCULE-8739581354 [0,1,0,0,0,0|1,0,1]=3 1012 B6R0.6 COCCCC=O MCULE-2055914202 [0,1,0,0,0,0|1,0,1]=3 1013 B6R0.6 COCCCCBr MCULE-7500019583 [0,1,0,0,0,0|1,0,0]=2 1014 B6R0.6 COCCCCCl MCULE-3863170338 [0,1,0,0,0,0|1,0,0]=2 1015 B6R0.6 COCCCCN MCULE-9584631056 [0,1,0,0,0,0|1,0,0]=2 1016 B6R0.6 COCCCCO MCULE-2543196930 [0,1,0,0,0,0|1,0,0]=2 1017 B6R0.6 COCCCCO MCULE-8659106280 [0,1,0,0,0,0|1,0,0]=2 1018 B6R0.6 COCCCNN MCULE-5097653856 [0,1,0,0,0,0|2,0,0]=3 1019 B6R0.6 COCCCNN MCULE-7758841774 [0,1,0,0,0,0|2,0,0]=3 1020 B6R0.6 COCCCOC MCULE-5003816236 [0,1,0,0,0,0|0,0,0]=1 1021 B6R0.6 COCCCON MCULE-3859091617 [0,1,0,0,0,0|1,0,0]=2 1022 B6R0.6 COCCCON MCULE-4419390097 [0,1,0,0,0,0|1,0,0]=2 1023 B6R0.6 COCCN=C=O MCULE-7139432642 [0,1,0,0,0,0|1,0,1]=3 1024 B6R0.6 COCCN=C=S MCULE-4661994491 [0,1,0,0,0,0|1,0,1]=3 1025 B6R0.6 COCCN=N#N MCULE-2613703286 [0,1,0,0,0,0|2,0,0]=3 1026 B6R0.6 COCCNC=O MCULE-9003279073 [0,1,0,0,0,0|1,0,1]=3 1027 B6R0.6 COCCOCCl MCULE-6701095927 [0,1,0,0,0,0|0,0,0]=1 1028 B6R0.6 COCOCCBr MCULE-8856323357 [0,1,0,0,0,0|2,0,0]=3 1029 B6R0.6 COCOCCI MCULE-4444019738 [0,1,0,0,0,0|2,0,0]=3 1030 B6R0.6 COCOCCN MCULE-7974740048 [0,1,0,0,0,0|2,0,0]=3 1031 B6R0.6 COCOCCO MCULE-8093241209 [0,1,0,0,0,0|2,0,0]=3 1032 B6R0.6 COCOCOC MCULE-9183615159 [0,1,0,0,0,0|0,0,0]=1 1033 B6R0.6 CONCCCN MCULE-4780444103 [0,1,0,0,0,0|2,0,0]=3 1034 B6R0.6 CONCCCN MCULE-6095720673 [0,1,0,0,0,0|2,0,0]=3 1035 B6R0.6 CONCCCN MCULE-9121351484 [0,1,0,0,0,0|2,0,0]=3 1036 B6R0.6 CSCCCC=O MCULE-6353729217 [0,1,0,0,0,0|1,1,1]=4 1037 B6R0.6 CSCCCCN MCULE-2391033479 [0,1,0,0,0,0|1,1,0]=3 1038 B6R0.6 CSCCCCO MCULE-1045422424 [0,1,0,0,0,0|1,1,0]=3 1039 B6R0.6 CSCCCON MCULE-2543326517 [0,1,0,0,0,0|1,1,0]=3 1040 B6R0.6 CSCCCSC MCULE-6993538101 [0,1,0,0,0,0|0,2,0]=3 1041 B6R0.6 CSCCN=C=O MCULE-4217751051 [0,1,0,0,0,0|1,1,1]=4 1042 B6R0.6 CSCCN=C=S MCULE-4977130724 [0,1,0,0,0,0|1,1,1]=4 1043 B6R0.6 CSCCN=N#N MCULE-6952720817 [0,1,0,0,0,0|2,1,0]=4 1044 B6R0.6 ClCCCCCBr MCULE-6767883252 [0,1,0,0,0,0|3,0,0]=4 1045 B6R0.6 ClCCCCCCl MCULE-9302388009 [0,1,0,0,0,0|3,0,0]=4 1046 B6R0.6 ClCCCCCI MCULE-2173931817 [0,1,0,0,0,0|3,0,0]=4 1047 B6R0.6 FCCCCCBr MCULE-1314383985 [0,1,0,0,0,0|3,0,0]=4 1048 B6R0.6 ICCCCCI MCULE-2889089700 [0,1,0,0,0,0|3,0,0]=4 1049 B6R0.6 N#CCCCCBr MCULE-7152608116 [0,1,0,0,0,0|3,0,0]=4 1050 B6R0.6 N#CCCCCCl MCULE-9317036806 [0,1,0,0,0,0|3,0,0]=4 1051 B6R0.6 N#CCCCCF MCULE-1200512715 [0,1,0,0,0,0|3,0,0]=4 1052 B6R0.6 N#CCCCCI MCULE-8000340428 [0,1,0,0,0,0|3,0,0]=4 1053 B6R0.6 N#CCCCCN MCULE-4183048720 [0,1,0,0,0,0|3,0,0]=4 1054 B6R0.6 N#CCCCCN MCULE-4775375165 [0,1,0,0,0,0|3,0,0]=4 1055 B6R0.6 N#CCCCCO MCULE-4289736283 [0,1,0,0,0,0|3,0,0]=4 1056 B6R0.6 N#CCCCCS MCULE-6284171080 [0,1,0,0,0,0|3,0,0]=4 1057 B6R0.6 NCCCCCBr MCULE-3577483607 [0,1,0,0,0,0|3,0,0]=4 1058 B6R0.6 NCCCCCBr MCULE-7572691537 [0,1,0,0,0,0|3,0,0]=4 1059 B6R0.6 NCCCCCF MCULE-1057270243 [0,1,0,0,0,0|3,0,0]=4 1060 B6R0.6 NCCCCCN MCULE-3785554987 [0,1,0,0,0,0|3,0,0]=4 1061 B6R0.6 NCCCCCN MCULE-5173983982 [0,1,0,0,0,0|3,0,0]=4 1062 B6R0.6 NCCCCCO MCULE-8877250712 [0,1,0,0,0,0|3,0,0]=4 1063 B6R0.6 NCCCCCS MCULE-1813104379 [0,1,0,0,0,0|3,0,0]=4 1064 B6R0.6 NCCCCCS MCULE-6081835870 [0,1,0,0,0,0|3,0,0]=4 1065 B6R0.6 NCCCCNO MCULE-6478748569 [0,1,0,0,0,0|3,0,0]=4 1066 B6R0.6 NNCCCCO MCULE-3928748589 [0,1,0,0,0,0|3,0,0]=4 1067 B6R0.6 NOCCCON MCULE-1133530094 [0,1,0,0,0,0|2,0,0]=3 1068 B6R0.6 NOCCCON MCULE-5394799847 [0,1,0,0,0,0|2,0,0]=3 1069 B6R0.6 O=CCCCCCl MCULE-1257670284 [0,1,0,0,0,0|3,0,0]=4 1070 B6R0.6 O=CCCCCO MCULE-7959082228 [0,1,0,0,0,0|3,0,0]=4 1071 B6R0.6 OCCCCCBr MCULE-1444733196 [0,1,0,0,0,0|3,0,0]=4 1072 B6R0.6 OCCCCCCl MCULE-5666058059 [0,1,0,0,0,0|3,0,0]=4 1073 B6R0.6 OCCCCCF MCULE-9253204275 [0,1,0,0,0,0|3,0,0]=4 1074 B6R0.6 OCCCCCI MCULE-8707758496 [0,1,0,0,0,0|3,0,0]=4 1075 B6R0.6 OCCCCCO MCULE-1044076048 [0,1,0,0,0,0|3,0,0]=4 1076 B6R0.6 SCCCCCS MCULE-4899719552 [0,1,0,0,0,0|3,0,0]=4 1077 B6R1.1 C1=CCCCC1 MCULE-3564016252 [0,0,0,1,0,0|2,0,1]=4 1078 B6R1.1 C1=CCNCC1 MCULE-4850984502 [0,0,0,1,0,0|2,0,1]=4 1079 B6R1.1 C1=CCNCC1 MCULE-9744767398 [0,0,0,1,0,0|2,0,1]=4 1080 B6R1.1 C1=CCOCC1 MCULE-7723901693 [0,0,0,1,0,0|1,0,1]=3 1081 B6R1.1 C1=CCONC1 MCULE-7264346127 [0,0,0,1,0,0|2,0,1]=4 1082 B6R1.1 C1=CCONC1 MCULE-7621269131 [0,0,0,1,0,0|2,0,1]=4 1083 B6R1.1 C1=COCCC1 MCULE-1260841717 [0,0,0,1,0,0|1,0,2]=4 1084 B6R1.1 C1=COCCO1 MCULE-2562788031 [0,0,0,1,0,0|0,0,2]=3 1085 B6R1.1 C1=COCOC1 MCULE-9916358884 [0,0,0,1,0,0|2,0,1]=4 1086 B6R1.1 C1=NCCCC1 MCULE-7101012273 [0,0,0,1,0,0|2,0,1]=4 1087 B6R1.1 C1CCCCC1 MCULE-3136361765 [0,0,0,1,0,0|2,0,0]=3 1088 B6R1.1 C1CCNCC1 MCULE-4094049864 [0,0,0,1,0,0|2,0,0]=3 1089 B6R1.1 C1CCNNC1 MCULE-6440414301 [0,0,0,1,0,0|3,0,0]=4 1090 B6R1.1 C1CCNNC1 MCULE-6764314654 [0,0,0,1,0,0|3,0,0]=4 1091 B6R1.1 C1CCOCC1 MCULE-6904583049 [0,0,0,1,0,0|1,0,0]=2 1092 B6R1.1 C1CCONC1 MCULE-4106728300 [0,0,0,1,0,0|2,0,0]=3 1093 B6R1.1 C1CCONC1 MCULE-7653057344 [0,0,0,1,0,0|2,0,0]=3 1094 B6R1.1 C1CCSCC1 MCULE-5775966946 [0,0,0,1,0,0|1,1,0]=3 1095 B6R1.1 C1CNCCN1 MCULE-1581360805 [0,0,0,1,0,0|2,0,0]=3 1096 B6R1.1 C1CNCCN1 MCULE-3262369531 [0,0,0,1,0,0|2,0,0]=3 1097 B6R1.1 C1CNCCN1 MCULE-4322783360 [0,0,0,1,0,0|2,0,0]=3 1098 B6R1.1 C1CNCCN1 MCULE-5522245554 [0,0,0,1,0,0|2,0,0]=3 1099 B6R1.1 C1CNCCN1 MCULE-6779430492 [0,0,0,1,0,0|2,0,0]=3 1100 B6R1.1 C1CNCCN1 MCULE-9358926351 [0,0,0,1,0,0|2,0,0]=3 1101 B6R1.1 C1CNCCN1 MCULE-9768146432 [0,0,0,1,0,0|2,0,0]=3 1102 B6R1.1 C1CNCOC1 MCULE-7862832103 [0,0,0,1,0,0|2,0,0]=3 1103 B6R1.1 C1CNCSC1 MCULE-2728084068 [0,0,0,1,0,0|2,1,0]=4 1104 B6R1.1 C1CNCSC1 MCULE-3301332730 [0,0,0,1,0,0|2,1,0]=4 1105 B6R1.1 C1COCCN1 MCULE-2533030492 [0,0,0,1,0,0|1,0,0]=2 1106 B6R1.1 C1COCCN1 MCULE-4684386765 [0,0,0,1,0,0|1,0,0]=2 1107 B6R1.1 C1COCCN1 MCULE-8040983584 [0,0,0,1,0,0|1,0,0]=2 1108 B6R1.1 C1COCCO1 MCULE-5088019198 [0,0,0,1,0,0|0,0,0]=1 1109 B6R1.1 C1COCC[NH2+]1 MCULE-5238323153 [0,0,0,1,0,0|1,0,0]=2 1110 B6R1.1 C1COCOC1 MCULE-3698539550 [0,0,0,1,0,0|2,0,0]=3 1111 B6R1.1 C1CSCCN1 MCULE-6420970424 [0,0,0,1,0,0|1,1,0]=3 1112 B6R1.1 C1CSCCN1 MCULE-8670233998 [0,0,0,1,0,0|1,1,0]=3 1113 B6R1.1 C1CSCCO1 MCULE-5803800470 [0,0,0,1,0,0|0,1,0]=2 1114 B6R1.1 C1CSCCS1 MCULE-6198913745 [0,0,0,1,0,0|0,2,0]=3 1115 B6R1.1 C1CSCSC1 MCULE-5626011651 [0,0,0,1,0,0|2,1,0]=4 1116 B6R1.1 C1C[Se]CCN1 MCULE-6480197745 [0,0,0,1,0,0|1,1,0]=3 1117 B6R1.1 C1OCOCO1 MCULE-9548551067 [0,0,0,1,0,0|3,0,0]=4 1118 B6R1.2 BrC1=COCC1 MCULE-8057569313 [0,0,0,1,0,0|2,0,1]=4 1119 B6R1.2 BrC1CCCC1 MCULE-9383923023 [0,0,0,1,0,0|3,0,0]=4 1120 B6R1.2 BrC1CCNC1 MCULE-4841543716 [0,0,0,1,0,0|3,0,0]=4 1121 B6R1.2 BrC1CCNC1 MCULE-4954951045 [0,0,0,1,0,0|3,0,0]=4 1122 B6R1.2 BrC1CCNC1 MCULE-7176123276 [0,0,0,1,0,0|3,0,0]=4 1123 B6R1.2 BrC1CCOC1 MCULE-7037144528 [0,0,0,1,0,0|2,0,0]=3 1124 B6R1.2 BrC1CCSC1 MCULE-6663716947 [0,0,0,1,0,0|2,1,0]=4 1125 B6R1.2 Br[C@@H]1CCNC1 MCULE-1681494552 [0,0,0,1,0,0|3,0,0]=4 1126 B6R1.2 Br[C@@H]1CCNC1 MCULE-1764777534 [0,0,0,1,0,0|3,0,0]=4 1127 B6R1.2 Br[C@@H]1CCNC1 MCULE-2455801012 [0,0,0,1,0,0|3,0,0]=4 1128 B6R1.2 Br[C@@H]1CCNC1 MCULE-8945784733 [0,0,0,1,0,0|3,0,0]=4 1129 B6R1.2 Br[C@H]1CCNC1 MCULE-5014033994 [0,0,0,1,0,0|3,0,0]=4 1130 B6R1.2 Br[C@H]1CCNC1 MCULE-5217617272 [0,0,0,1,0,0|3,0,0]=4 1131 B6R1.2 Br[C@H]1CCNC1 MCULE-8899453530 [0,0,0,1,0,0|3,0,0]=4 1132 B6R1.2 Br[C@H]1CCNC1 MCULE-9461718131 [0,0,0,1,0,0|3,0,0]=4 1133 B6R1.2 Br[C@H]1CCOC1 MCULE-7554969036 [0,0,0,1,0,0|2,0,0]=3 1134 B6R1.2 C1(CCNC1)C MCULE-2542646403 [0,0,0,1,0,0|2,0,0]=3 1135 B6R1.2 C1(CCNC1)C MCULE-4538835016 [0,0,0,1,0,0|2,0,0]=3 1136 B6R1.2 C1(CCNC1)F MCULE-2259566125 [0,0,0,1,0,0|3,0,0]=4 1137 B6R1.2 C1(CCNC1)F MCULE-3325393466 [0,0,0,1,0,0|3,0,0]=4 1138 B6R1.2 C1(CCNC1)O MCULE-2676539647 [0,0,0,1,0,0|3,0,0]=4 1139 B6R1.2 C1(CCNC1)O MCULE-4228466615 [0,0,0,1,0,0|3,0,0]=4 1140 B6R1.2 C1(CCOC1)I MCULE-4877322062 [0,0,0,1,0,0|2,0,0]=3 1141 B6R1.2 C1(CCOC1)N MCULE-2221007915 [0,0,0,1,0,0|2,0,0]=3 1142 B6R1.2 C1(CCOC1)N MCULE-3972931474 [0,0,0,1,0,0|2,0,0]=3 1143 B6R1.2 C1(CCOC1)O MCULE-3631749536 [0,0,0,1,0,0|2,0,0]=3 1144 B6R1.2 C=C1CCCC1 MCULE-4115373196 [0,0,0,1,0,0|2,0,1]=4 1145 B6R1.2 C=C1CCNC1 MCULE-7982953073 [0,0,0,1,0,0|2,0,1]=4 1146 B6R1.2 C=C1CCNC1 MCULE-8428731599 [0,0,0,1,0,0|2,0,1]=4 1147 B6R1.2 C=C1CCSC1 MCULE-7042571473 [0,0,0,1,0,0|1,1,1]=4 1148 B6R1.2 CC1=CCCC1 MCULE-8508688474 [0,0,0,1,0,0|2,0,1]=4 1149 B6R1.2 CC1=CCNC1 MCULE-5892113847 [0,0,0,1,0,0|2,0,1]=4 1150 B6R1.2 CC1=CCNC1 MCULE-9225220351 [0,0,0,1,0,0|2,0,1]=4 1151 B6R1.2 CC1=NCCC1 MCULE-5009170423 [0,0,0,1,0,0|3,0,0]=4 1152 B6R1.2 CC1=NNCC1 MCULE-1758510182 [0,0,0,1,0,0|3,0,0]=4 1153 B6R1.2 CC1C=CCC1 MCULE-1638534048 [0,0,0,1,0,0|2,0,1]=4 1154 B6R1.2 CC1CCCC1 MCULE-4702116068 [0,0,0,1,0,0|2,0,0]=3 1155 B6R1.2 CC1CCCN1 MCULE-4853624560 [0,0,0,1,0,0|3,0,0]=4 1156 B6R1.2 CC1CCCN1 MCULE-5939948024 [0,0,0,1,0,0|3,0,0]=4 1157 B6R1.2 CC1CCCN1 MCULE-6020011445 [0,0,0,1,0,0|3,0,0]=4 1158 B6R1.2 CC1CCCN1 MCULE-7855346849 [0,0,0,1,0,0|3,0,0]=4 1159 B6R1.2 CC1CCCO1 MCULE-2526138687 [0,0,0,1,0,0|3,0,0]=4 1160 B6R1.2 CC1CCCS1 MCULE-8372499972 [0,0,0,1,0,0|3,0,0]=4 1161 B6R1.2 CC1CCNC1 MCULE-6494098173 [0,0,0,1,0,0|2,0,0]=3 1162 B6R1.2 CC1CCNC1 MCULE-8260364514 [0,0,0,1,0,0|2,0,0]=3 1163 B6R1.2 CC1CCOC1 MCULE-6424683416 [0,0,0,1,0,0|1,0,0]=2 1164 B6R1.2 CC1CCSC1 MCULE-7445511318 [0,0,0,1,0,0|1,1,0]=3 1165 B6R1.2 CC1CNOC1 MCULE-1071803164 [0,0,0,1,0,0|2,0,0]=3 1166 B6R1.2 CC1CNOC1 MCULE-9455391174 [0,0,0,1,0,0|2,0,0]=3 1167 B6R1.2 CC1COCO1 MCULE-9332316279 [0,0,0,1,0,0|2,0,0]=3 1168 B6R1.2 CN1CC=CC1 MCULE-2586884916 [0,0,0,1,0,0|2,0,1]=4 1169 B6R1.2 CN1CCCC1 MCULE-5387702231 [0,0,0,1,0,0|2,0,0]=3 1170 B6R1.2 CN1CCNC1 MCULE-8059197564 [0,0,0,1,0,0|2,0,0]=3 1171 B6R1.2 CN1CCNC1 MCULE-9818601515 [0,0,0,1,0,0|2,0,0]=3 1172 B6R1.2 CN1CCOC1 MCULE-5504672404 [0,0,0,1,0,0|1,0,0]=2 1173 B6R1.2 C[C@@H]1CCCN1 MCULE-1038329474 [0,0,0,1,0,0|3,0,0]=4 1174 B6R1.2 C[C@@H]1CCCN1 MCULE-1829999308 [0,0,0,1,0,0|3,0,0]=4 1175 B6R1.2 C[C@@H]1CCCN1 MCULE-8644278041 [0,0,0,1,0,0|3,0,0]=4 1176 B6R1.2 C[C@@H]1CCCN1 MCULE-9243990647 [0,0,0,1,0,0|3,0,0]=4 1177 B6R1.2 C[C@@H]1CCNC1 MCULE-5345577321 [0,0,0,1,0,0|2,0,0]=3 1178 B6R1.2 C[C@@H]1CCNC1 MCULE-5749945455 [0,0,0,1,0,0|2,0,0]=3 1179 B6R1.2 C[C@@H]1CCNC1 MCULE-8967606188 [0,0,0,1,0,0|2,0,0]=3 1180 B6R1.2 C[C@@H]1CCNC1 MCULE-8996756392 [0,0,0,1,0,0|2,0,0]=3 1181 B6R1.2 C[C@H]1CCCN1 MCULE-2078024663 [0,0,0,1,0,0|3,0,0]=4 1182 B6R1.2 C[C@H]1CCCN1 MCULE-3113877345 [0,0,0,1,0,0|3,0,0]=4 1183 B6R1.2 C[C@H]1CCCN1 MCULE-3426869473 [0,0,0,1,0,0|3,0,0]=4 1184 B6R1.2 C[C@H]1CCCN1 MCULE-5093266679 [0,0,0,1,0,0|3,0,0]=4 1185 B6R1.2 C[C@H]1CCNC1 MCULE-1866792897 [0,0,0,1,0,0|2,0,0]=3 1186 B6R1.2 C[C@H]1CCNC1 MCULE-3817248567 [0,0,0,1,0,0|2,0,0]=3 1187 B6R1.2 C[C@H]1CCNC1 MCULE-7938243226 [0,0,0,1,0,0|2,0,0]=3 1188 B6R1.2 C[C@H]1CCNC1 MCULE-8895875203 [0,0,0,1,0,0|2,0,0]=3 1189 B6R1.2 C[S+]1CCCC1 MCULE-6294888335 [0,0,0,1,0,0|1,1,0]=3 1190 B6R1.2 C[S+]1CCCC1 MCULE-8432227262 [0,0,0,1,0,0|1,1,0]=3 1191 B6R1.2 ClC1CCCC1 MCULE-3285928655 [0,0,0,1,0,0|3,0,0]=4 1192 B6R1.2 ClC1CCNC1 MCULE-5659561118 [0,0,0,1,0,0|3,0,0]=4 1193 B6R1.2 ClC1CCNC1 MCULE-6180477494 [0,0,0,1,0,0|3,0,0]=4 1194 B6R1.2 ClC1CCNC1 MCULE-6964859207 [0,0,0,1,0,0|3,0,0]=4 1195 B6R1.2 ClC1CCNC1 MCULE-8389509440 [0,0,0,1,0,0|3,0,0]=4 1196 B6R1.2 ClC1CCOC1 MCULE-6903762147 [0,0,0,1,0,0|2,0,0]=3 1197 B6R1.2 Cl[C@@H]1CCNC1 MCULE-3218152098 [0,0,0,1,0,0|3,0,0]=4 1198 B6R1.2 Cl[C@@H]1CCNC1 MCULE-6728755007 [0,0,0,1,0,0|3,0,0]=4 1199 B6R1.2 Cl[C@@H]1CCNC1 MCULE-7223308304 [0,0,0,1,0,0|3,0,0]=4 1200 B6R1.2 Cl[C@@H]1CCNC1 MCULE-9699335522 [0,0,0,1,0,0|3,0,0]=4 1201 B6R1.2 Cl[C@H]1CCNC1 MCULE-1696981588 [0,0,0,1,0,0|3,0,0]=4 1202 B6R1.2 Cl[C@H]1CCNC1 MCULE-4535592624 [0,0,0,1,0,0|3,0,0]=4 1203 B6R1.2 Cl[C@H]1CCNC1 MCULE-4850151938 [0,0,0,1,0,0|3,0,0]=4 1204 B6R1.2 Cl[C@H]1CCNC1 MCULE-8947782807 [0,0,0,1,0,0|3,0,0]=4 1205 B6R1.2 FC1CCCC1 MCULE-1416016970 [0,0,0,1,0,0|3,0,0]=4 1206 B6R1.2 FC1CCNC1 MCULE-3601135445 [0,0,0,1,0,0|3,0,0]=4 1207 B6R1.2 FC1CCNC1 MCULE-8578750940 [0,0,0,1,0,0|3,0,0]=4 1208 B6R1.2 FC1CNOC1 MCULE-4837734523 [0,0,0,1,0,0|3,0,0]=4 1209 B6R1.2 FC1CNOC1 MCULE-6176254900 [0,0,0,1,0,0|3,0,0]=4 1210 B6R1.2 F[C@@H]1CCNC1 MCULE-4408739710 [0,0,0,1,0,0|3,0,0]=4 1211 B6R1.2 F[C@@H]1CCNC1 MCULE-5678498844 [0,0,0,1,0,0|3,0,0]=4 1212 B6R1.2 F[C@@H]1CCNC1 MCULE-5679054116 [0,0,0,1,0,0|3,0,0]=4 1213 B6R1.2 F[C@@H]1CCNC1 MCULE-7029204180 [0,0,0,1,0,0|3,0,0]=4 1214 B6R1.2 F[C@H]1CCNC1 MCULE-2854402872 [0,0,0,1,0,0|3,0,0]=4 1215 B6R1.2 F[C@H]1CCNC1 MCULE-4493640982 [0,0,0,1,0,0|3,0,0]=4 1216 B6R1.2 F[C@H]1CCNC1 MCULE-7441383471 [0,0,0,1,0,0|3,0,0]=4 1217 B6R1.2 F[C@H]1CCNC1 MCULE-7946601643 [0,0,0,1,0,0|3,0,0]=4 1218 B6R1.2 IC1=COCC1 MCULE-3076361502 [0,0,0,1,0,0|2,0,1]=4 1219 B6R1.2 IC1CCCC1 MCULE-2705379744 [0,0,0,1,0,0|3,0,0]=4 1220 B6R1.2 IC1CCNC1 MCULE-3058541551 [0,0,0,1,0,0|3,0,0]=4 1221 B6R1.2 IC1CCNC1 MCULE-5326267139 [0,0,0,1,0,0|3,0,0]=4 1222 B6R1.2 IC1CCOC1 MCULE-1379775972 [0,0,0,1,0,0|2,0,0]=3 1223 B6R1.2 I[C@@H]1CCNC1 MCULE-3800433724 [0,0,0,1,0,0|3,0,0]=4 1224 B6R1.2 I[C@@H]1CCNC1 MCULE-3857825133 [0,0,0,1,0,0|3,0,0]=4 1225 B6R1.2 I[C@@H]1CCNC1 MCULE-7781267462 [0,0,0,1,0,0|3,0,0]=4 1226 B6R1.2 I[C@@H]1CCNC1 MCULE-7979843810 [0,0,0,1,0,0|3,0,0]=4 1227 B6R1.2 I[C@@H]1CCOC1 MCULE-2036157502 [0,0,0,1,0,0|2,0,0]=3 1228 B6R1.2 I[C@@H]1CCOC1 MCULE-4800752659 [0,0,0,1,0,0|2,0,0]=3 1229 B6R1.2 I[C@H]1CCNC1 MCULE-1218289403 [0,0,0,1,0,0|3,0,0]=4 1230 B6R1.2 I[C@H]1CCNC1 MCULE-7469922084 [0,0,0,1,0,0|3,0,0]=4 1231 B6R1.2 I[C@H]1CCOC1 MCULE-4242860607 [0,0,0,1,0,0|2,0,0]=3 1232 B6R1.2 I[C@H]1CCOC1 MCULE-7095404975 [0,0,0,1,0,0|2,0,0]=3 1233 B6R1.2 NC1=NOCC1 MCULE-4971355735 [0,0,0,1,0,0|3,0,0]=4 1234 B6R1.2 NC1CCCC1 MCULE-2292038009 [0,0,0,1,0,0|3,0,0]=4 1235 B6R1.2 NC1CCNC1 MCULE-2237528072 [0,0,0,1,0,0|3,0,0]=4 1236 B6R1.2 NC1CCNC1 MCULE-5167920547 [0,0,0,1,0,0|3,0,0]=4 1237 B6R1.2 NC1CCNC1 MCULE-5837785719 [0,0,0,1,0,0|3,0,0]=4 1238 B6R1.2 NC1CCOC1 MCULE-1276945018 [0,0,0,1,0,0|2,0,0]=3 1239 B6R1.2 NC1CCOC1 MCULE-8146259495 [0,0,0,1,0,0|2,0,0]=3 1240 B6R1.2 NC1CCSC1 MCULE-8972229387 [0,0,0,1,0,0|2,1,0]=4 1241 B6R1.2 NC1CCSC1 MCULE-9186640582 [0,0,0,1,0,0|2,1,0]=4 1242 B6R1.2 NN1CCCC1 MCULE-1562593919 [0,0,0,1,0,0|3,0,0]=4 1243 B6R1.2 NN1CCCC1 MCULE-2311855036 [0,0,0,1,0,0|3,0,0]=4 1244 B6R1.2 NN1CCCC1 MCULE-5484008222 [0,0,0,1,0,0|3,0,0]=4 1245 B6R1.2 N[C@@H]1CCNC1 MCULE-6043697974 [0,0,0,1,0,0|3,0,0]=4 1246 B6R1.2 N[C@@H]1CCNC1 MCULE-8912264932 [0,0,0,1,0,0|3,0,0]=4 1247 B6R1.2 N[C@@H]1CCNC1 MCULE-9183647019 [0,0,0,1,0,0|3,0,0]=4 1248 B6R1.2 N[C@@H]1CCNC1 MCULE-9608760183 [0,0,0,1,0,0|3,0,0]=4 1249 B6R1.2 N[C@@H]1CCOC1 MCULE-1100136080 [0,0,0,1,0,0|2,0,0]=3 1250 B6R1.2 N[C@@H]1CCOC1 MCULE-4493278911 [0,0,0,1,0,0|2,0,0]=3 1251 B6R1.2 N[C@@H]1CCOC1 MCULE-5574536510 [0,0,0,1,0,0|2,0,0]=3 1252 B6R1.2 N[C@@H]1CCOC1 MCULE-7204677203 [0,0,0,1,0,0|2,0,0]=3 1253 B6R1.2 N[C@H]1CCNC1 MCULE-3573455998 [0,0,0,1,0,0|3,0,0]=4 1254 B6R1.2 N[C@H]1CCNC1 MCULE-3988158945 [0,0,0,1,0,0|3,0,0]=4 1255 B6R1.2 N[C@H]1CCNC1 MCULE-4526890579 [0,0,0,1,0,0|3,0,0]=4 1256 B6R1.2 N[C@H]1CCNC1 MCULE-8548728927 [0,0,0,1,0,0|3,0,0]=4 1257 B6R1.2 N[C@H]1CCOC1 MCULE-2273771439 [0,0,0,1,0,0|2,0,0]=3 1258 B6R1.2 N[C@H]1CCOC1 MCULE-3567904137 [0,0,0,1,0,0|2,0,0]=3 1259 B6R1.2 N[C@H]1CCOC1 MCULE-5268616156 [0,0,0,1,0,0|2,0,0]=3 1260 B6R1.2 N[C@H]1CCOC1 MCULE-7351975857 [0,0,0,1,0,0|2,0,0]=3 1261 B6R1.2 O=C1CCCC1 MCULE-9455227735 [0,0,0,1,0,0|3,0,0]=4 1262 B6R1.2 O=C1CCNC1 MCULE-2947789259 [0,0,0,1,0,0|3,0,0]=4 1263 B6R1.2 O=C1CCNC1 MCULE-7192595052 [0,0,0,1,0,0|3,0,0]=4 1264 B6R1.2 O=C1CCOC1 MCULE-2031733910 [0,0,0,1,0,0|2,0,0]=3 1265 B6R1.2 O=C1CCON1 MCULE-6799359324 [0,0,0,1,0,0|3,0,0]=4 1266 B6R1.2 O=C1CCSC1 MCULE-2059655624 [0,0,0,1,0,0|2,1,0]=4 1267 B6R1.2 O=S1CCCC1 MCULE-2442126780 [0,0,0,1,0,0|2,1,0]=4 1268 B6R1.2 OC1CCCC1 MCULE-1758440264 [0,0,0,1,0,0|3,0,0]=4 1269 B6R1.2 OC1CCNC1 MCULE-4307402606 [0,0,0,1,0,0|3,0,0]=4 1270 B6R1.2 OC1CCNC1 MCULE-6745480350 [0,0,0,1,0,0|3,0,0]=4 1271 B6R1.2 OC1CCOC1 MCULE-4469581028 [0,0,0,1,0,0|2,0,0]=3 1272 B6R1.2 OC1CCSC1 MCULE-9796808599 [0,0,0,1,0,0|2,1,0]=4 1273 B6R1.2 OC1CNOC1 MCULE-3414700581 [0,0,0,1,0,0|3,0,0]=4 1274 B6R1.2 OC1CNOC1 MCULE-8163403090 [0,0,0,1,0,0|3,0,0]=4 1275 B6R1.2 OC1CNOC1 MCULE-8644852072 [0,0,0,1,0,0|3,0,0]=4 1276 B6R1.2 OC1C[NH2+]OC1 MCULE-7865131527 [0,0,0,1,0,0|3,0,0]=4 1277 B6R1.2 O[C@@H]1CCNC1 MCULE-8116497337 [0,0,0,1,0,0|3,0,0]=4 1278 B6R1.2 O[C@@H]1CCNC1 MCULE-8578068948 [0,0,0,1,0,0|3,0,0]=4 1279 B6R1.2 O[C@@H]1CCNC1 MCULE-9094582248 [0,0,0,1,0,0|3,0,0]=4 1280 B6R1.2 O[C@@H]1CCNC1 MCULE-9933593352 [0,0,0,1,0,0|3,0,0]=4 1281 B6R1.2 O[C@@H]1CCOC1 MCULE-7739141732 [0,0,0,1,0,0|2,0,0]=3 1282 B6R1.2 O[C@@H]1CCOC1 MCULE-8344812226 [0,0,0,1,0,0|2,0,0]=3 1283 B6R1.2 O[C@@H]1CCOC1 MCULE-9098074990 [0,0,0,1,0,0|2,0,0]=3 1284 B6R1.2 O[C@@H]1CCSC1 MCULE-3532754705 [0,0,0,1,0,0|2,1,0]=4 1285 B6R1.2 O[C@@H]1CCSC1 MCULE-5800407146 [0,0,0,1,0,0|2,1,0]=4 1286 B6R1.2 O[C@@H]1CNOC1 MCULE-1481945185 [0,0,0,1,0,0|3,0,0]=4 1287 B6R1.2 O[C@@H]1CNOC1 MCULE-4156521353 [0,0,0,1,0,0|3,0,0]=4 1288 B6R1.2 O[C@@H]1CNOC1 MCULE-5692816168 [0,0,0,1,0,0|3,0,0]=4 1289 B6R1.2 O[C@@H]1CNOC1 MCULE-6838604903 [0,0,0,1,0,0|3,0,0]=4 1290 B6R1.2 O[C@H]1CCNC1 MCULE-1100098088 [0,0,0,1,0,0|3,0,0]=4 1291 B6R1.2 O[C@H]1CCNC1 MCULE-3493644065 [0,0,0,1,0,0|3,0,0]=4 1292 B6R1.2 O[C@H]1CCNC1 MCULE-3778918259 [0,0,0,1,0,0|3,0,0]=4 1293 B6R1.2 O[C@H]1CCNC1 MCULE-4680162054 [0,0,0,1,0,0|3,0,0]=4 1294 B6R1.2 O[C@H]1CCOC1 MCULE-8518846297 [0,0,0,1,0,0|2,0,0]=3 1295 B6R1.2 O[C@H]1CCOC1 MCULE-9544747995 [0,0,0,1,0,0|2,0,0]=3 1296 B6R1.2 O[C@H]1CNOC1 MCULE-1746817114 [0,0,0,1,0,0|3,0,0]=4 1297 B6R1.2 O[C@H]1CNOC1 MCULE-4469396812 [0,0,0,1,0,0|3,0,0]=4 1298 B6R1.2 O[C@H]1CNOC1 MCULE-7167785164 [0,0,0,1,0,0|3,0,0]=4 1299 B6R1.2 O[C@H]1CNOC1 MCULE-8409877332 [0,0,0,1,0,0|3,0,0]=4 1300 B6R1.2 SC1CCCC1 MCULE-5932400506 [0,0,0,1,0,0|3,0,0]=4 1301 B6R1.2 SC1CCOC1 MCULE-9247906418 [0,0,0,1,0,0|2,0,0]=3 1302 B6R1.2 SC1CCSC1 MCULE-5955380477 [0,0,0,1,0,0|2,1,0]=4 1303 B6R1.2 [NH3+]C1CC[NH2+]C1 MCULE-3374468196 [0,0,0,1,0,0|3,0,0]=4 1304 B6R1.3 BrCCC1CC1 MCULE-3454213225 [0,0,0,1,0,0|3,0,0]=4 1305 B6R1.3 BrCCC1CO1 MCULE-9889314000 [0,0,0,1,0,0|2,0,0]=3 1306 B6R1.3 BrCC[C@@H]1CO1 MCULE-7015242723 [0,0,0,1,0,0|2,0,0]=3 1307 B6R1.3 BrCC[C@H]1CO1 MCULE-3286755305 [0,0,0,1,0,0|2,0,0]=3 1308 B6R1.3 BrCC[C@H]1CO1 MCULE-3512143037 [0,0,0,1,0,0|2,0,0]=3 1309 B6R1.3 C#CCC1CC1 MCULE-4980990503 [0,0,0,1,0,0|2,0,1]=4 1310 B6R1.3 CC#CC1CC1 MCULE-8441018700 [0,0,0,1,0,0|2,0,1]=4 1311 B6R1.3 CCCC1CO1 MCULE-5080039224 [0,0,0,1,0,0|1,0,0]=2 1312 B6R1.3 CCC[C@@H]1CO1 MCULE-1815222100 [0,0,0,1,0,0|1,0,0]=2 1313 B6R1.3 CCC[C@H]1CO1 MCULE-9952368131 [0,0,0,1,0,0|1,0,0]=2 1314 B6R1.3 CCNC1CC1 MCULE-6542327880 [0,0,0,1,0,0|3,0,0]=4 1315 B6R1.3 CCNC1CC1 MCULE-6804557809 [0,0,0,1,0,0|3,0,0]=4 1316 B6R1.3 CCNC1CC1 MCULE-7846800898 [0,0,0,1,0,0|3,0,0]=4 1317 B6R1.3 CNCC1CC1 MCULE-4410938050 [0,0,0,1,0,0|2,0,0]=3 1318 B6R1.3 CNCC1CC1 MCULE-6365201280 [0,0,0,1,0,0|2,0,0]=3 1319 B6R1.3 COCC1CO1 MCULE-3193889854 [0,0,0,1,0,0|0,0,0]=1 1320 B6R1.3 COC[C@@H]1CO1 MCULE-8086795507 [0,0,0,1,0,0|0,0,0]=1 1321 B6R1.3 COC[C@@H]1CO1 MCULE-8921875584 [0,0,0,1,0,0|0,0,0]=1 1322 B6R1.3 COC[C@H]1CO1 MCULE-7210190703 [0,0,0,1,0,0|0,0,0]=1 1323 B6R1.3 COC[C@H]1CO1 MCULE-8979404390 [0,0,0,1,0,0|0,0,0]=1 1324 B6R1.3 CONC1CC1 MCULE-3903074552 [0,0,0,1,0,0|2,0,0]=3 1325 B6R1.3 CONC1CC1 MCULE-6248549552 [0,0,0,1,0,0|2,0,0]=3 1326 B6R1.3 CSCC1CO1 MCULE-9014850650 [0,0,0,1,0,0|0,1,0]=2 1327 B6R1.3 ClCCC1CC1 MCULE-5665496795 [0,0,0,1,0,0|3,0,0]=4 1328 B6R1.3 ClCCC1CO1 MCULE-2772510260 [0,0,0,1,0,0|2,0,0]=3 1329 B6R1.3 ICCC1CC1 MCULE-5518738700 [0,0,0,1,0,0|3,0,0]=4 1330 B6R1.3 N#CCC1CC1 MCULE-4951047709 [0,0,0,1,0,0|3,0,0]=4 1331 B6R1.3 NCCC1CC1 MCULE-8459735325 [0,0,0,1,0,0|3,0,0]=4 1332 B6R1.3 NCCC1CC1 MCULE-9646218986 [0,0,0,1,0,0|3,0,0]=4 1333 B6R1.3 NNCC1CC1 MCULE-4020404918 [0,0,0,1,0,0|3,0,0]=4 1334 B6R1.3 NNCC1CC1 MCULE-7742306770 [0,0,0,1,0,0|3,0,0]=4 1335 B6R1.3 NNCC1CC1 MCULE-8978618772 [0,0,0,1,0,0|3,0,0]=4 1336 B6R1.3 NOCC1CC1 MCULE-3594146552 [0,0,0,1,0,0|2,0,0]=3 1337 B6R1.3 NOCC1CC1 MCULE-7376211865 [0,0,0,1,0,0|2,0,0]=3 1338 B6R1.3 O=CCC1CC1 MCULE-3319649937 [0,0,0,1,0,0|3,0,0]=4 1339 B6R1.3 OCCC1CC1 MCULE-1360348684 [0,0,0,1,0,0|3,0,0]=4 1340 B6R1.3 OCCC1CO1 MCULE-6523000607 [0,0,0,1,0,0|2,0,0]=3 1341 B6R1.3 OCC[C@@H]1CO1 MCULE-4797533590 [0,0,0,1,0,0|2,0,0]=3 1342 B6R1.3 OCC[C@@H]1CO1 MCULE-6833850805 [0,0,0,1,0,0|2,0,0]=3 1343 B6R1.3 OCC[C@H]1CO1 MCULE-3560802495 [0,0,0,1,0,0|2,0,0]=3 1344 B6R1.3 OCC[C@H]1CO1 MCULE-8738926598 [0,0,0,1,0,0|2,0,0]=3 1345 B6R1.4 CC1CCC1=O MCULE-4548181715 [0,0,0,1,0,0|3,0,0]=4 1346 B6R1.4 CC1CCC1N MCULE-9634057678 [0,0,0,1,0,0|3,0,0]=4 1347 B6R1.4 CC1CCC1N MCULE-9849489304 [0,0,0,1,0,0|3,0,0]=4 1348 B6R1.4 CC1CCC1O MCULE-3852133104 [0,0,0,1,0,0|3,0,0]=4 1349 B6R1.4 CC1CNC1C MCULE-6217110869 [0,0,0,1,0,0|3,0,0]=4 1350 B6R1.4 CC1CNC1C MCULE-8966220604 [0,0,0,1,0,0|3,0,0]=4 1351 B6R1.4 C[C@@H]1CC[C@@H]1N MCULE-9803413081 [0,0,0,1,0,0|3,0,0]=4 1352 B6R1.4 C[C@@H]1CC[C@H]1N MCULE-3888655890 [0,0,0,1,0,0|3,0,0]=4 1353 B6R1.4 C[C@@H]1CN[C@@H]1C MCULE-5099590573 [0,0,0,1,0,0|3,0,0]=4 1354 B6R1.4 C[C@@H]1CN[C@@H]1C MCULE-6754257002 [0,0,0,1,0,0|3,0,0]=4 1355 B6R1.4 C[C@@H]1CN[C@@H]1C MCULE-7084262632 [0,0,0,1,0,0|3,0,0]=4 1356 B6R1.4 C[C@@H]1CN[C@@H]1C MCULE-9147724667 [0,0,0,1,0,0|3,0,0]=4 1357 B6R1.4 C[C@H]1CC[C@@H]1N MCULE-1445146965 [0,0,0,1,0,0|3,0,0]=4 1358 B6R1.4 C[C@H]1CC[C@H]1N MCULE-3329522369 [0,0,0,1,0,0|3,0,0]=4 1359 B6R1.6 BrCC1CCC1 MCULE-6307620219 [0,0,0,1,0,0|3,0,0]=4 1360 B6R1.6 BrCC1CNC1 MCULE-5889797727 [0,0,0,1,0,0|3,0,0]=4 1361 B6R1.6 BrCC1CNC1 MCULE-7668948015 [0,0,0,1,0,0|3,0,0]=4 1362 B6R1.6 BrCC1COC1 MCULE-3267235863 [0,0,0,1,0,0|2,0,0]=3 1363 B6R1.6 C#CC1CCC1 MCULE-3076610847 [0,0,0,1,0,0|2,0,1]=4 1364 B6R1.6 C#CC1CNC1 MCULE-4651971465 [0,0,0,1,0,0|2,0,1]=4 1365 B6R1.6 C#CC1CNC1 MCULE-9377887865 [0,0,0,1,0,0|2,0,1]=4 1366 B6R1.6 C#CC1COC1 MCULE-8724712442 [0,0,0,1,0,0|1,0,1]=3 1367 B6R1.6 C=CC1CNC1 MCULE-9929515921 [0,0,0,1,0,0|2,0,1]=4 1368 B6R1.6 CCC1CCN1 MCULE-2791335818 [0,0,0,1,0,0|3,0,0]=4 1369 B6R1.6 CCC1CCN1 MCULE-3929810240 [0,0,0,1,0,0|3,0,0]=4 1370 B6R1.6 CCC1CNC1 MCULE-5314495230 [0,0,0,1,0,0|2,0,0]=3 1371 B6R1.6 CCC1CNC1 MCULE-6675770601 [0,0,0,1,0,0|2,0,0]=3 1372 B6R1.6 CNC1CCC1 MCULE-1364608179 [0,0,0,1,0,0|2,0,0]=3 1373 B6R1.6 CNC1CCC1 MCULE-2951993315 [0,0,0,1,0,0|2,0,0]=3 1374 B6R1.6 CNC1CCN1 MCULE-7769870554 [0,0,0,1,0,0|3,0,0]=4 1375 B6R1.6 CNC1CCN1 MCULE-9764026934 [0,0,0,1,0,0|3,0,0]=4 1376 B6R1.6 CNC1CNC1 MCULE-1099597328 [0,0,0,1,0,0|2,0,0]=3 1377 B6R1.6 CNC1CNC1 MCULE-1308867000 [0,0,0,1,0,0|2,0,0]=3 1378 B6R1.6 CNC1COC1 MCULE-2040978636 [0,0,0,1,0,0|1,0,0]=2 1379 B6R1.6 CNC1COC1 MCULE-3130259264 [0,0,0,1,0,0|1,0,0]=2 1380 B6R1.6 CNC1COC1 MCULE-4618612030 [0,0,0,1,0,0|1,0,0]=2 1381 B6R1.6 CNC1CSC1 MCULE-6729829548 [0,0,0,1,0,0|1,1,0]=3 1382 B6R1.6 CNC1CSC1 MCULE-7173779891 [0,0,0,1,0,0|1,1,0]=3 1383 B6R1.6 COC1CNC1 MCULE-1522685592 [0,0,0,1,0,0|1,0,0]=2 1384 B6R1.6 COC1CNC1 MCULE-4835486151 [0,0,0,1,0,0|1,0,0]=2 1385 B6R1.6 CSC1CNC1 MCULE-2006549414 [0,0,0,1,0,0|1,1,0]=3 1386 B6R1.6 CSC1CNC1 MCULE-6024405532 [0,0,0,1,0,0|1,1,0]=3 1387 B6R1.6 ClCC1CCC1 MCULE-2464596839 [0,0,0,1,0,0|3,0,0]=4 1388 B6R1.6 ClCC1CNC1 MCULE-2451543932 [0,0,0,1,0,0|3,0,0]=4 1389 B6R1.6 ClCC1CNC1 MCULE-9626195989 [0,0,0,1,0,0|3,0,0]=4 1390 B6R1.6 ClCC1COC1 MCULE-1144637548 [0,0,0,1,0,0|2,0,0]=3 1391 B6R1.6 FCC1CNC1 MCULE-4813599184 [0,0,0,1,0,0|3,0,0]=4 1392 B6R1.6 FCC1CNC1 MCULE-5694626686 [0,0,0,1,0,0|3,0,0]=4 1393 B6R1.6 ICC1CCC1 MCULE-7767711699 [0,0,0,1,0,0|3,0,0]=4 1394 B6R1.6 ICC1COC1 MCULE-6325029437 [0,0,0,1,0,0|2,0,0]=3 1395 B6R1.6 N#CC1CCC1 MCULE-3335810526 [0,0,0,1,0,0|3,0,0]=4 1396 B6R1.6 N#CC1CNC1 MCULE-2385981463 [0,0,0,1,0,0|3,0,0]=4 1397 B6R1.6 N#CC1CNC1 MCULE-6516721657 [0,0,0,1,0,0|3,0,0]=4 1398 B6R1.6 N#CC1COC1 MCULE-8173442458 [0,0,0,1,0,0|2,0,0]=3 1399 B6R1.6 N#CC1CSC1 MCULE-8903032109 [0,0,0,1,0,0|2,1,0]=4 1400 B6R1.6 NCC1CCC1 MCULE-4977602211 [0,0,0,1,0,0|3,0,0]=4 1401 B6R1.6 NCC1CCC1 MCULE-8434128112 [0,0,0,1,0,0|3,0,0]=4 1402 B6R1.6 NCC1CNC1 MCULE-7601725567 [0,0,0,1,0,0|3,0,0]=4 1403 B6R1.6 NCC1CNC1 MCULE-7948891652 [0,0,0,1,0,0|3,0,0]=4 1404 B6R1.6 NCC1COC1 MCULE-4685637013 [0,0,0,1,0,0|2,0,0]=3 1405 B6R1.6 NCC1COC1 MCULE-6896653344 [0,0,0,1,0,0|2,0,0]=3 1406 B6R1.6 NCC1CSC1 MCULE-2317140221 [0,0,0,1,0,0|2,1,0]=4 1407 B6R1.6 NCC1CSC1 MCULE-2885312159 [0,0,0,1,0,0|2,1,0]=4 1408 B6R1.6 NNC1CCC1 MCULE-2058855063 [0,0,0,1,0,0|3,0,0]=4 1409 B6R1.6 NNC1CCC1 MCULE-2355527907 [0,0,0,1,0,0|3,0,0]=4 1410 B6R1.6 NNC1CCC1 MCULE-7674249555 [0,0,0,1,0,0|3,0,0]=4 1411 B6R1.6 NNC1CNC1 MCULE-1383746939 [0,0,0,1,0,0|3,0,0]=4 1412 B6R1.6 NNC1CNC1 MCULE-8167393861 [0,0,0,1,0,0|3,0,0]=4 1413 B6R1.6 NNC1COC1 MCULE-2986078946 [0,0,0,1,0,0|2,0,0]=3 1414 B6R1.6 NNC1COC1 MCULE-4662390820 [0,0,0,1,0,0|2,0,0]=3 1415 B6R1.6 NNC1COC1 MCULE-7804737341 [0,0,0,1,0,0|2,0,0]=3 1416 B6R1.6 NNC1CSC1 MCULE-2341298971 [0,0,0,1,0,0|2,1,0]=4 1417 B6R1.6 NNC1CSC1 MCULE-6513117263 [0,0,0,1,0,0|2,1,0]=4 1418 B6R1.6 NNC1CSC1 MCULE-9957779440 [0,0,0,1,0,0|2,1,0]=4 1419 B6R1.6 NOC1CCC1 MCULE-2140396646 [0,0,0,1,0,0|2,0,0]=3 1420 B6R1.6 NOC1CCC1 MCULE-9347173321 [0,0,0,1,0,0|2,0,0]=3 1421 B6R1.6 NOC1COC1 MCULE-1949996102 [0,0,0,1,0,0|1,0,0]=2 1422 B6R1.6 O=CC1CCC1 MCULE-8678026416 [0,0,0,1,0,0|3,0,0]=4 1423 B6R1.6 O=CC1COC1 MCULE-3773699476 [0,0,0,1,0,0|2,0,0]=3 1424 B6R1.6 O=CC1CSC1 MCULE-2648443908 [0,0,0,1,0,0|2,1,0]=4 1425 B6R1.6 OCC1CCC1 MCULE-3046613150 [0,0,0,1,0,0|3,0,0]=4 1426 B6R1.6 OCC1CNC1 MCULE-1537874886 [0,0,0,1,0,0|3,0,0]=4 1427 B6R1.6 OCC1CNC1 MCULE-8316085177 [0,0,0,1,0,0|3,0,0]=4 1428 B6R1.6 OCC1COC1 MCULE-5031415478 [0,0,0,1,0,0|2,0,0]=3 1429 B6R1.6 OCC1CSC1 MCULE-9388221183 [0,0,0,1,0,0|2,1,0]=4 1430 B6R1.6 SCC1CCC1 MCULE-4083757063 [0,0,0,1,0,0|3,0,0]=4 1431 B6R1.6 SCC1COC1 MCULE-7193197469 [0,0,0,1,0,0|2,0,0]=3 1432 B6R1.8 CC1CC1C#N MCULE-4373618430 [0,0,0,1,0,0|3,0,0]=4 1433 B6R1.8 CC1CC1C=O MCULE-2600627355 [0,0,0,1,0,0|3,0,0]=4 1434 B6R1.8 CC1CC1CN MCULE-2810102174 [0,0,0,1,0,0|3,0,0]=4 1435 B6R1.8 CC1CC1CN MCULE-7518062300 [0,0,0,1,0,0|3,0,0]=4 1436 B6R1.8 CC1CC1CO MCULE-5196594569 [0,0,0,1,0,0|3,0,0]=4 1437 B6R1.8 CCC1CC1N MCULE-6304873051 [0,0,0,1,0,0|3,0,0]=4 1438 B6R1.8 CC[C@@H]1C[C@@H]1N MCULE-9218626187 [0,0,0,1,0,0|3,0,0]=4 1439 B6R1.8 CC[C@@H]1C[C@H]1N MCULE-5365117215 [0,0,0,1,0,0|3,0,0]=4 1440 B6R1.8 CC[C@@H]1C[C@H]1N MCULE-9993971387 [0,0,0,1,0,0|3,0,0]=4 1441 B6R1.8 CC[C@H]1C[C@@H]1N MCULE-5971477946 [0,0,0,1,0,0|3,0,0]=4 1442 B6R1.8 CC[C@H]1C[C@H]1N MCULE-4387456908 [0,0,0,1,0,0|3,0,0]=4 1443 B6R1.8 COC1CC1N MCULE-6836691149 [0,0,0,1,0,0|2,0,0]=3 1444 B6R1.8 COC1CC1N MCULE-9062056960 [0,0,0,1,0,0|2,0,0]=3 1445 B6R1.8 CO[C@@H]1C[C@@H]1N MCULE-6456572695 [0,0,0,1,0,0|2,0,0]=3 1446 B6R1.8 CO[C@@H]1C[C@@H]1N MCULE-9755300484 [0,0,0,1,0,0|2,0,0]=3 1447 B6R1.8 CO[C@@H]1C[C@H]1N MCULE-3862342520 [0,0,0,1,0,0|2,0,0]=3 1448 B6R1.8 CO[C@@H]1C[C@H]1N MCULE-4120361377 [0,0,0,1,0,0|2,0,0]=3 1449 B6R1.8 CO[C@H]1C[C@@H]1N MCULE-6295001950 [0,0,0,1,0,0|2,0,0]=3 1450 B6R1.8 CO[C@H]1C[C@@H]1N MCULE-7524472312 [0,0,0,1,0,0|2,0,0]=3 1451 B6R1.8 CO[C@H]1C[C@H]1N MCULE-3000810470 [0,0,0,1,0,0|2,0,0]=3 1452 B6R1.8 CO[C@H]1C[C@H]1N MCULE-6255571706 [0,0,0,1,0,0|2,0,0]=3 1453 B6R1.8 C[C@@H]1C[C@@H]1CN MCULE-5971817939 [0,0,0,1,0,0|3,0,0]=4 1454 B6R1.8 C[C@@H]1C[C@@H]1CO MCULE-7143685612 [0,0,0,1,0,0|3,0,0]=4 1455 B6R1.8 C[C@@H]1C[C@H]1CN MCULE-3418148363 [0,0,0,1,0,0|3,0,0]=4 1456 B6R1.8 C[C@@H]1C[C@H]1CN MCULE-3519756910 [0,0,0,1,0,0|3,0,0]=4 1457 B6R1.8 C[C@@H]1C[C@H]1CN MCULE-3649923384 [0,0,0,1,0,0|3,0,0]=4 1458 B6R1.8 C[C@@H]1C[C@H]1CN MCULE-8330237030 [0,0,0,1,0,0|3,0,0]=4 1459 B6R1.8 C[C@@H]1C[C@H]1CO MCULE-3741611930 [0,0,0,1,0,0|3,0,0]=4 1460 B6R1.8 C[C@H]1C[C@@H]1CN MCULE-9856477951 [0,0,0,1,0,0|3,0,0]=4 1461 B6R1.8 C[C@H]1C[C@@H]1CO MCULE-2846304871 [0,0,0,1,0,0|3,0,0]=4 1462 B6R1.8 C[C@H]1C[C@@H]1CO MCULE-9275931471 [0,0,0,1,0,0|3,0,0]=4 1463 B6R1.8 C[C@H]1C[C@H]1CN MCULE-4949172422 [0,0,0,1,0,0|3,0,0]=4 1464 B6R1.8 C[C@H]1C[C@H]1CO MCULE-3828120088 [0,0,0,1,0,0|3,0,0]=4 1465 B6R1.8 C[C@H]1C[C@H]1CO MCULE-8442952820 [0,0,0,1,0,0|3,0,0]=4 1466 B3R0.1 BrCCBr MCULE-7586462642 [2,0,0,0,0,0|2,0,0]=4 1467 B3R0.1 BrCCI MCULE-8691237057 [2,0,0,0,0,0|2,0,0]=4 1468 B3R0.1 C#CCC MCULE-8090253856 [2,0,0,0,0,0|0,0,2]=4 1469 B3R0.1 C#CCO MCULE-3909200923 [2,0,0,0,0,0|0,0,2]=4 1470 B3R0.1 C/B=N/O MCULE-5227399299 [2,0,0,0,0,0|2,0,0]=4 1471 B3R0.1 C/C=N/O MCULE-2376410404 [2,0,0,0,0,0|1,0,1]=4 1472 B3R0.1 C=CCC MCULE-8167907130 [2,0,0,0,0,0|0,0,2]=4 1473 B3R0.1 C=CCO MCULE-2145308838 [2,0,0,0,0,0|0,0,2]=4 1474 B3R0.1 C=COC MCULE-4880746684 [2,0,0,0,0,0|0,0,2]=4 1475 B3R0.1 CC#CC MCULE-3721942346 [2,0,0,0,0,0|0,0,2]=4 1476 B3R0.1 CC=NO MCULE-9761317381 [2,0,0,0,0,0|1,0,1]=4 1477 B3R0.1 CCC#N MCULE-9484970536 [2,0,0,0,0,0|1,0,1]=4 1478 B3R0.1 CCC=O MCULE-4079744837 [2,0,0,0,0,0|0,0,2]=4 1479 B3R0.1 CCCBr MCULE-2393970713 [2,0,0,0,0,0|1,0,0]=3 1480 B3R0.1 CCCC MCULE-9760497805 [2,0,0,0,0,0|0,0,0]=2 1481 B3R0.1 CCCCl MCULE-3496412829 [2,0,0,0,0,0|1,0,0]=3 1482 B3R0.1 CCCF MCULE-8540338768 [2,0,0,0,0,0|1,0,0]=3 1483 B3R0.1 CCCI MCULE-1721488805 [2,0,0,0,0,0|1,0,0]=3 1484 B3R0.1 CCCN MCULE-2885523792 [2,0,0,0,0,0|1,0,0]=3 1485 B3R0.1 CCCN MCULE-4318907091 [2,0,0,0,0,0|1,0,0]=3 1486 B3R0.1 CCCN MCULE-6330457870 [2,0,0,0,0,0|1,0,0]=3 1487 B3R0.1 CCCN MCULE-7146820007 [2,0,0,0,0,0|1,0,0]=3 1488 B3R0.1 CCCO MCULE-6252105126 [2,0,0,0,0,0|0,0,0]=2 1489 B3R0.1 CCCS MCULE-8267649092 [2,0,0,0,0,0|0,1,0]=3 1490 B3R0.1 CCNC MCULE-7215376398 [2,0,0,0,0,0|1,0,0]=3 1491 B3R0.1 CCNC MCULE-9811899205 [2,0,0,0,0,0|1,0,0]=3 1492 B3R0.1 CCNN MCULE-4753127904 [2,0,0,0,0,0|2,0,0]=4 1493 B3R0.1 CCNN MCULE-7630363192 [2,0,0,0,0,0|2,0,0]=4 1494 B3R0.1 CCNN MCULE-8402230944 [2,0,0,0,0,0|2,0,0]=4 1495 B3R0.1 CCNO MCULE-1215586669 [2,0,0,0,0,0|1,0,0]=3 1496 B3R0.1 CCNO MCULE-7075818857 [2,0,0,0,0,0|1,0,0]=3 1497 B3R0.1 CCON MCULE-5316082054 [2,0,0,0,0,0|1,0,0]=3 1498 B3R0.1 CCON MCULE-6621418839 [2,0,0,0,0,0|1,0,0]=3 1499 B3R0.1 CCO[NH3+] MCULE-7670481464 [2,0,0,0,0,0|1,0,0]=3 1500 B3R0.1 CCO[NH3+] MCULE-7871083232 [2,0,0,0,0,0|1,0,0]=3 1501 B3R0.1 CCSC MCULE-6944750263 [2,0,0,0,0,0|0,1,0]=3 1502 B3R0.1 CNNC MCULE-5932476941 [2,0,0,0,0,0|2,0,0]=4 1503 B3R0.1 CNNC MCULE-6419598860 [2,0,0,0,0,0|2,0,0]=4 1504 B3R0.1 CNOC MCULE-1706082503 [2,0,0,0,0,0|1,0,0]=3 1505 B3R0.1 CNOC MCULE-6224540090 [2,0,0,0,0,0|1,0,0]=3 1506 B3R0.1 COC=O MCULE-9122749354 [2,0,0,0,0,0|0,0,2]=4 1507 B3R0.1 COCBr MCULE-2566721472 [2,0,0,0,0,0|1,0,0]=3 1508 B3R0.1 COCCl MCULE-5928768006 [2,0,0,0,0,0|1,0,0]=3 1509 B3R0.1 COCI MCULE-5215132549 [2,0,0,0,0,0|1,0,0]=3 1510 B3R0.1 CSCCl MCULE-1281800596 [2,0,0,0,0,0|1,1,0]=4 1511 B3R0.1 CSSC MCULE-7451882535 [2,0,0,0,0,0|0,2,0]=4 1512 B3R0.1 C[Se][Se]C MCULE-1189700302 [2,0,0,0,0,0|0,2,0]=4 1513 B3R0.1 ClCCBr MCULE-3933774075 [2,0,0,0,0,0|2,0,0]=4 1514 B3R0.1 ClCCCl MCULE-3493741440 [2,0,0,0,0,0|2,0,0]=4 1515 B3R0.1 ClCCI MCULE-7847880962 [2,0,0,0,0,0|2,0,0]=4 1516 B3R0.1 FCCBr MCULE-3117974140 [2,0,0,0,0,0|2,0,0]=4 1517 B3R0.1 FCCCl MCULE-1862981403 [2,0,0,0,0,0|2,0,0]=4 1518 B3R0.1 FCCF MCULE-1975194621 [2,0,0,0,0,0|2,0,0]=4 1519 B3R0.1 FCCI MCULE-3689313503 [2,0,0,0,0,0|2,0,0]=4 1520 B3R0.1 ICCI MCULE-8025471988 [2,0,0,0,0,0|2,0,0]=4 1521 B3R0.1 NCCBr MCULE-3401124597 [2,0,0,0,0,0|2,0,0]=4 1522 B3R0.1 NCCBr MCULE-6215378497 [2,0,0,0,0,0|2,0,0]=4 1523 B3R0.1 NCCCl MCULE-1458699843 [2,0,0,0,0,0|2,0,0]=4 1524 B3R0.1 NCCCl MCULE-6944306112 [2,0,0,0,0,0|2,0,0]=4 1525 B3R0.1 NCCF MCULE-1670520169 [2,0,0,0,0,0|2,0,0]=4 1526 B3R0.1 NCCF MCULE-4963351029 [2,0,0,0,0,0|2,0,0]=4 1527 B3R0.1 NCCI MCULE-6905308399 [2,0,0,0,0,0|2,0,0]=4 1528 B3R0.1 NCCI MCULE-7487764362 [2,0,0,0,0,0|2,0,0]=4 1529 B3R0.1 NCCN MCULE-4740333723 [2,0,0,0,0,0|2,0,0]=4 1530 B3R0.1 NCCN MCULE-6795272853 [2,0,0,0,0,0|2,0,0]=4 1531 B3R0.1 NCCN MCULE-8304126024 [2,0,0,0,0,0|2,0,0]=4 1532 B3R0.1 NCCN MCULE-8325612144 [2,0,0,0,0,0|2,0,0]=4 1533 B3R0.1 NCCO MCULE-5175116598 [2,0,0,0,0,0|1,0,0]=3 1534 B3R0.1 NCCO MCULE-8624730373 [2,0,0,0,0,0|1,0,0]=3 1535 B3R0.1 NCCS MCULE-1838427828 [2,0,0,0,0,0|1,1,0]=4 1536 B3R0.1 NCCS MCULE-2418938683 [2,0,0,0,0,0|1,1,0]=4 1537 B3R0.1 OCCBr MCULE-5097256006 [2,0,0,0,0,0|1,0,0]=3 1538 B3R0.1 OCCCl MCULE-5139580173 [2,0,0,0,0,0|1,0,0]=3 1539 B3R0.1 OCCF MCULE-7590677201 [2,0,0,0,0,0|1,0,0]=3 1540 B3R0.1 OCCI MCULE-8359750387 [2,0,0,0,0,0|1,0,0]=3 1541 B3R0.1 OCCO MCULE-6366313128 [2,0,0,0,0,0|0,0,0]=2 1542 B3R0.1 OCCS MCULE-2252943288 [2,0,0,0,0,0|0,1,0]=3 1543 B3R0.1 PCCP MCULE-2159678577 [2,0,0,0,0,0|2,0,0]=4 1544 B3R0.1 SCCBr MCULE-5899941299 [2,0,0,0,0,0|1,1,0]=4 1545 B3R0.1 SCCS MCULE-8277435664 [2,0,0,0,0,0|0,2,0]=4 1546 B3R0.1 [NH3+]CCS MCULE-6407472407 [2,0,0,0,0,0|1,1,0]=4 1547 B3R0.1 [NH3+]CC[NH3+] MCULE-5313549416 [2,0,0,0,0,0|2,0,0]=4 1548 B5R0.1 C#CCC(C)C MCULE-2506063278 [1,1,0,0,0,0|1,0,1]=4 1549 B5R0.1 C#CCC(C)N MCULE-1523044787 [1,1,0,0,0,0|1,0,1]=4 1550 B5R0.1 C#CCC(C)N MCULE-3399522488 [1,1,0,0,0,0|1,0,1]=4 1551 B5R0.1 C#CCC(C)O MCULE-2487589857 [1,1,0,0,0,0|1,0,1]=4 1552 B5R0.1 C(C)(N)CCC MCULE-4800297905 [1,1,0,0,0,0|1,0,0]=3 1553 B5R0.1 C(C)(N)CCC MCULE-7674864567 [1,1,0,0,0,0|1,0,0]=3 1554 B5R0.1 C(C)(N)CCO MCULE-5545469271 [1,1,0,0,0,0|1,0,0]=3 1555 B5R0.1 C/C=C/C(C)C MCULE-8705863155 [1,1,0,0,0,0|1,0,1]=4 1556 B5R0.1 C/C=C/C(C)O MCULE-3191147789 [1,1,0,0,0,0|1,0,1]=4 1557 B5R0.1 C=C(Br)CCO MCULE-3743908958 [1,1,0,0,0,0|1,0,1]=4 1558 B5R0.1 C=C(Br)COC MCULE-5349428431 [1,1,0,0,0,0|0,0,2]=4 1559 B5R0.1 C=C(C)CCBr MCULE-3439794005 [1,1,0,0,0,0|2,0,0]=4 1560 B5R0.1 C=C(C)CCC MCULE-8225129744 [1,1,0,0,0,0|1,0,0]=3 1561 B5R0.1 C=C(C)CCCl MCULE-2816016781 [1,1,0,0,0,0|2,0,0]=4 1562 B5R0.1 C=C(C)CCI MCULE-6317205481 [1,1,0,0,0,0|2,0,0]=4 1563 B5R0.1 C=C(C)CCN MCULE-4037025602 [1,1,0,0,0,0|2,0,0]=4 1564 B5R0.1 C=C(C)CCN MCULE-5001503744 [1,1,0,0,0,0|2,0,0]=4 1565 B5R0.1 C=C(C)CCO MCULE-2689800711 [1,1,0,0,0,0|1,0,0]=3 1566 B5R0.1 C=C(C)CNC MCULE-6783886553 [1,1,0,0,0,0|1,0,1]=4 1567 B5R0.1 C=C(C)CNC MCULE-8292313282 [1,1,0,0,0,0|1,0,1]=4 1568 B5R0.1 C=C(C)CON MCULE-2773974323 [1,1,0,0,0,0|1,0,1]=4 1569 B5R0.1 C=C(C)CON MCULE-5978680243 [1,1,0,0,0,0|1,0,1]=4 1570 B5R0.1 C=C(C)OCC MCULE-5303468686 [1,1,0,0,0,0|2,0,0]=4 1571 B5R0.1 C=CCC(C)Br MCULE-5638987302 [1,1,0,0,0,0|1,0,1]=4 1572 B5R0.1 C=CCC(C)C MCULE-4586731422 [1,1,0,0,0,0|1,0,1]=4 1573 B5R0.1 C=CCC(C)N MCULE-5354228552 [1,1,0,0,0,0|1,0,1]=4 1574 B5R0.1 C=CCC(C)N MCULE-9454660067 [1,1,0,0,0,0|1,0,1]=4 1575 B5R0.1 C=CCC(C)O MCULE-7724200334 [1,1,0,0,0,0|1,0,1]=4 1576 B5R0.1 C=CCC(C)O MCULE-9910771503 [1,1,0,0,0,0|1,0,1]=4 1577 B5R0.1 C=CC[C@@H](C)O MCULE-1663575568 [1,1,0,0,0,0|1,0,1]=4 1578 B5R0.1 C=CC[C@@H](C)O MCULE-3971480179 [1,1,0,0,0,0|1,0,1]=4 1579 B5R0.1 C=CC[C@H](C)N MCULE-2398654329 [1,1,0,0,0,0|1,0,1]=4 1580 B5R0.1 C=CC[C@H](C)N MCULE-5817451810 [1,1,0,0,0,0|1,0,1]=4 1581 B5R0.1 C=CC[C@H](C)O MCULE-5783959808 [1,1,0,0,0,0|1,0,1]=4 1582 B5R0.1 C=CC[C@H](C)O MCULE-6146696600 [1,1,0,0,0,0|1,0,1]=4 1583 B5R0.1 CC#CC(C)C MCULE-9841369985 [1,1,0,0,0,0|1,0,1]=4 1584 B5R0.1 CC#CC(C)O MCULE-5523814936 [1,1,0,0,0,0|1,0,1]=4 1585 B5R0.1 CC(=CCO)C MCULE-3984123588 [1,1,0,0,0,0|1,0,1]=4 1586 B5R0.1 CC(=CCO)Cl MCULE-6459066496 [1,1,0,0,0,0|1,0,1]=4 1587 B5R0.1 CC(=CCO)I MCULE-4600854759 [1,1,0,0,0,0|1,0,1]=4 1588 B5R0.1 CC(=O)CCBr MCULE-2615300206 [1,1,0,0,0,0|2,0,0]=4 1589 B5R0.1 CC(=O)CCCl MCULE-8019748964 [1,1,0,0,0,0|2,0,0]=4 1590 B5R0.1 CC(=O)CCN MCULE-7550348751 [1,1,0,0,0,0|2,0,0]=4 1591 B5R0.1 CC(=O)CCN MCULE-9519063810 [1,1,0,0,0,0|2,0,0]=4 1592 B5R0.1 CC(=O)CCO MCULE-6328537335 [1,1,0,0,0,0|1,0,0]=3 1593 B5R0.1 CC(=O)NCO MCULE-4563335540 [1,1,0,0,0,0|2,0,0]=4 1594 B5R0.1 CC(Br)CC#N MCULE-6321379216 [1,1,0,0,0,0|2,0,0]=4 1595 B5R0.1 CC(Br)CCBr MCULE-1045475402 [1,1,0,0,0,0|2,0,0]=4 1596 B5R0.1 CC(C)CC#N MCULE-4346986727 [1,1,0,0,0,0|2,0,0]=4 1597 B5R0.1 CC(C)CC=O MCULE-2939497534 [1,1,0,0,0,0|2,0,0]=4 1598 B5R0.1 CC(C)CCBr MCULE-7163010428 [1,1,0,0,0,0|2,0,0]=4 1599 B5R0.1 CC(C)CCCl MCULE-8360122696 [1,1,0,0,0,0|2,0,0]=4 1600 B5R0.1 CC(C)CCCl MCULE-9017922949 [1,1,0,0,0,0|2,0,0]=4 1601 B5R0.1 CC(C)CCI MCULE-4934529500 [1,1,0,0,0,0|2,0,0]=4 1602 B5R0.1 CC(C)CCN MCULE-3081003576 [1,1,0,0,0,0|2,0,0]=4 1603 B5R0.1 CC(C)CCN MCULE-5118782389 [1,1,0,0,0,0|2,0,0]=4 1604 B5R0.1 CC(C)CCN MCULE-5217981670 [1,1,0,0,0,0|2,0,0]=4 1605 B5R0.1 CC(C)CCN MCULE-6280940933 [1,1,0,0,0,0|2,0,0]=4 1606 B5R0.1 CC(C)CCO MCULE-7411270401 [1,1,0,0,0,0|1,0,0]=3 1607 B5R0.1 CC(C)CCS MCULE-7115473363 [1,1,0,0,0,0|1,1,0]=4 1608 B5R0.1 CC(C)CNN MCULE-6797887001 [1,1,0,0,0,0|2,0,0]=4 1609 B5R0.1 CC(C)CNN MCULE-9592971233 [1,1,0,0,0,0|2,0,0]=4 1610 B5R0.1 CC(C)CNN MCULE-9725792452 [1,1,0,0,0,0|2,0,0]=4 1611 B5R0.1 CC(C)CON MCULE-3476786246 [1,1,0,0,0,0|1,0,0]=3 1612 B5R0.1 CC(C)CON MCULE-4450654727 [1,1,0,0,0,0|1,0,0]=3 1613 B5R0.1 CC(Cl)CCCl MCULE-3656498608 [1,1,0,0,0,0|2,0,0]=4 1614 B5R0.1 CC(Cl)CCO MCULE-1955496242 [1,1,0,0,0,0|1,0,0]=3 1615 B5R0.1 CC(F)CCBr MCULE-3035340901 [1,1,0,0,0,0|2,0,0]=4 1616 B5R0.1 CC(F)CCI MCULE-6469250150 [1,1,0,0,0,0|2,0,0]=4 1617 B5R0.1 CC(F)CCN MCULE-2805813131 [1,1,0,0,0,0|2,0,0]=4 1618 B5R0.1 CC(F)CCN MCULE-5849913362 [1,1,0,0,0,0|2,0,0]=4 1619 B5R0.1 CC(N)CC#N MCULE-2350352782 [1,1,0,0,0,0|2,0,0]=4 1620 B5R0.1 CC(N)CC#N MCULE-7269201059 [1,1,0,0,0,0|2,0,0]=4 1621 B5R0.1 CC(N)CCN MCULE-5308134596 [1,1,0,0,0,0|2,0,0]=4 1622 B5R0.1 CC(N)CCN MCULE-5880045507 [1,1,0,0,0,0|2,0,0]=4 1623 B5R0.1 CC(N)CCN MCULE-7827515430 [1,1,0,0,0,0|2,0,0]=4 1624 B5R0.1 CC(N)CCO MCULE-1771399942 [1,1,0,0,0,0|1,0,0]=3 1625 B5R0.1 CC(N)CCO MCULE-7239872808 [1,1,0,0,0,0|1,0,0]=3 1626 B5R0.1 CC(O)CC#N MCULE-7172428142 [1,1,0,0,0,0|2,0,0]=4 1627 B5R0.1 CC(O)CCBr MCULE-7983169885 [1,1,0,0,0,0|2,0,0]=4 1628 B5R0.1 CC(O)CCCl MCULE-2952545606 [1,1,0,0,0,0|2,0,0]=4 1629 B5R0.1 CC(O)CCN MCULE-6836791276 [1,1,0,0,0,0|2,0,0]=4 1630 B5R0.1 CC(O)CCN MCULE-7186260925 [1,1,0,0,0,0|2,0,0]=4 1631 B5R0.1 CC(O)CCO MCULE-1694239851 [1,1,0,0,0,0|1,0,0]=3 1632 B5R0.1 CC(O)CCO MCULE-7784884948 [1,1,0,0,0,0|1,0,0]=3 1633 B5R0.1 CC(O)CNN MCULE-4956670781 [1,1,0,0,0,0|2,0,0]=4 1634 B5R0.1 CC(O)CNN MCULE-7917439573 [1,1,0,0,0,0|2,0,0]=4 1635 B5R0.1 CC(O)CON MCULE-1051091134 [1,1,0,0,0,0|1,0,0]=3 1636 B5R0.1 CC(O)CON MCULE-6722092589 [1,1,0,0,0,0|1,0,0]=3 1637 B5R0.1 CC(S)CCO MCULE-5702212503 [1,1,0,0,0,0|1,0,0]=3 1638 B5R0.1 CC=CC(C)C MCULE-9898453837 [1,1,0,0,0,0|1,0,1]=4 1639 B5R0.1 CC=CC(C)O MCULE-4806592836 [1,1,0,0,0,0|1,0,1]=4 1640 B5R0.1 CCC=C(C)C MCULE-2405063894 [1,1,0,0,0,0|1,0,1]=4 1641 B5R0.1 CCCB(O)O MCULE-4994980798 [1,1,0,0,0,0|2,0,0]=4 1642 B5R0.1 CCCC(=N)N MCULE-5974105638 [1,1,0,0,0,0|2,0,0]=4 1643 B5R0.1 CCCC(=N)N MCULE-9230704591 [1,1,0,0,0,0|2,0,0]=4 1644 B5R0.1 CCCC(=O)C MCULE-7174095676 [1,1,0,0,0,0|1,0,0]=3 1645 B5R0.1 CCCC(=O)Cl MCULE-3288175193 [1,1,0,0,0,0|2,0,0]=4 1646 B5R0.1 CCCC(=O)N MCULE-2712067671 [1,1,0,0,0,0|2,0,0]=4 1647 B5R0.1 CCCC(=O)O MCULE-4116382006 [1,1,0,0,0,0|1,0,1]=4 1648 B5R0.1 CCCC(=O)[O-] MCULE-8706538802 [1,1,0,0,0,0|2,0,0]=4 1649 B5R0.1 CCCC(=O)[O-] MCULE-9764702574 [1,1,0,0,0,0|2,0,0]=4 1650 B5R0.1 CCCC(=S)N MCULE-3529335988 [1,1,0,0,0,0|2,0,0]=4 1651 B5R0.1 CCCC(=S)O MCULE-3382199964 [1,1,0,0,0,0|1,0,1]=4 1652 B5R0.1 CCCC(C)Br MCULE-3178073667 [1,1,0,0,0,0|1,0,0]=3 1653 B5R0.1 CCCC(C)C MCULE-9604552974 [1,1,0,0,0,0|1,0,0]=3 1654 B5R0.1 CCCC(C)N MCULE-2640298430 [1,1,0,0,0,0|1,0,0]=3 1655 B5R0.1 CCCC(C)N MCULE-7225905167 [1,1,0,0,0,0|1,0,0]=3 1656 B5R0.1 CCCC(C)O MCULE-8205906299 [1,1,0,0,0,0|1,0,0]=3 1657 B5R0.1 CCCC(C)S MCULE-1649095713 [1,1,0,0,0,0|1,0,0]=3 1658 B5R0.1 CCCC(O)Cl MCULE-3188577082 [1,1,0,0,0,0|1,0,0]=3 1659 B5R0.1 CCCN(=O)=O MCULE-5615753372 [1,1,0,0,0,0|2,0,0]=4 1660 B5R0.1 CCCN(C)C MCULE-8702643596 [1,1,0,0,0,0|1,0,0]=3 1661 B5R0.1 CCCS(=O)[O-] MCULE-4306915022 [1,1,0,0,0,0|1,1,0]=4 1662 B5R0.1 CCCS(=O)[O-] MCULE-9775151913 [1,1,0,0,0,0|1,1,0]=4 1663 B5R0.1 CCC[C@@H](C)N MCULE-2394536966 [1,1,0,0,0,0|1,0,0]=3 1664 B5R0.1 CCC[C@@H](C)N MCULE-3008898216 [1,1,0,0,0,0|1,0,0]=3 1665 B5R0.1 CCC[C@@H](C)N MCULE-5656861143 [1,1,0,0,0,0|1,0,0]=3 1666 B5R0.1 CCC[C@@H](C)N MCULE-8113159645 [1,1,0,0,0,0|1,0,0]=3 1667 B5R0.1 CCC[C@@H](C)O MCULE-1540573875 [1,1,0,0,0,0|1,0,0]=3 1668 B5R0.1 CCC[C@H](C)N MCULE-2068574015 [1,1,0,0,0,0|1,0,0]=3 1669 B5R0.1 CCC[C@H](C)N MCULE-3439133019 [1,1,0,0,0,0|1,0,0]=3 1670 B5R0.1 CCC[C@H](C)N MCULE-5495177657 [1,1,0,0,0,0|1,0,0]=3 1671 B5R0.1 CCC[C@H](C)N MCULE-7962028651 [1,1,0,0,0,0|1,0,0]=3 1672 B5R0.1 CCC[C@H](C)O MCULE-6976816276 [1,1,0,0,0,0|1,0,0]=3 1673 B5R0.1 CCNC(=O)C MCULE-7543656350 [1,1,0,0,0,0|2,0,0]=4 1674 B5R0.1 CCNC(C)C MCULE-8064118469 [1,1,0,0,0,0|2,0,0]=4 1675 B5R0.1 CCOC(=N)C MCULE-3060267072 [1,1,0,0,0,0|2,0,0]=4 1676 B5R0.1 CCOC(=N)C MCULE-3943786182 [1,1,0,0,0,0|2,0,0]=4 1677 B5R0.1 CCOC(=O)C MCULE-6628539781 [1,1,0,0,0,0|2,0,0]=4 1678 B5R0.1 CCOC(=S)C MCULE-3358897597 [1,1,0,0,0,0|2,0,0]=4 1679 B5R0.1 CCOC(C)C MCULE-1934548340 [1,1,0,0,0,0|2,0,0]=4 1680 B5R0.1 CCOC(C)Cl MCULE-8486994638 [1,1,0,0,0,0|2,0,0]=4 1681 B5R0.1 CCSC(=O)C MCULE-8015440229 [1,1,0,0,0,0|2,0,0]=4 1682 B5R0.1 CCSC(=S)C MCULE-1502137460 [1,1,0,0,0,0|2,0,0]=4 1683 B5R0.1 CCSC(C)C MCULE-3738251898 [1,1,0,0,0,0|2,0,0]=4 1684 B5R0.1 CN(C)CCBr MCULE-4844398053 [1,1,0,0,0,0|2,0,0]=4 1685 B5R0.1 CN(C)CCCl MCULE-4297554717 [1,1,0,0,0,0|2,0,0]=4 1686 B5R0.1 CN(C)CCCl MCULE-4465544992 [1,1,0,0,0,0|2,0,0]=4 1687 B5R0.1 CN(C)CCI MCULE-4687894526 [1,1,0,0,0,0|2,0,0]=4 1688 B5R0.1 CN(C)CCI MCULE-7464680246 [1,1,0,0,0,0|2,0,0]=4 1689 B5R0.1 CN(C)CCI MCULE-9051868668 [1,1,0,0,0,0|2,0,0]=4 1690 B5R0.1 CN(C)CCN MCULE-6693759372 [1,1,0,0,0,0|2,0,0]=4 1691 B5R0.1 CN(C)CCN MCULE-6929925748 [1,1,0,0,0,0|2,0,0]=4 1692 B5R0.1 CN(C)CCN MCULE-7881547574 [1,1,0,0,0,0|2,0,0]=4 1693 B5R0.1 CN(C)CCO MCULE-5715813465 [1,1,0,0,0,0|1,0,0]=3 1694 B5R0.1 CN(C)CCO MCULE-7567469160 [1,1,0,0,0,0|1,0,0]=3 1695 B5R0.1 CN(C)CCO MCULE-9024108074 [1,1,0,0,0,0|1,0,0]=3 1696 B5R0.1 CN(C)CCS MCULE-4356815596 [1,1,0,0,0,0|1,1,0]=4 1697 B5R0.1 CN(C)CCS MCULE-4611688723 [1,1,0,0,0,0|1,1,0]=4 1698 B5R0.1 CN(C)CCS MCULE-6259585517 [1,1,0,0,0,0|1,1,0]=4 1699 B5R0.1 CN(N)CCN MCULE-2782966878 [1,1,0,0,0,0|2,0,0]=4 1700 B5R0.1 CNCC(=O)C MCULE-3695443024 [1,1,0,0,0,0|1,0,1]=4 1701 B5R0.1 CNCC(=O)C MCULE-7402723072 [1,1,0,0,0,0|1,0,1]=4 1702 B5R0.1 CNCC(=O)O MCULE-3448356048 [1,1,0,0,0,0|1,0,1]=4 1703 B5R0.1 CNCC(=O)O MCULE-4484444573 [1,1,0,0,0,0|1,0,1]=4 1704 B5R0.1 CNCC(C)C MCULE-6582386339 [1,1,0,0,0,0|1,0,0]=3 1705 B5R0.1 CNCC(C)C MCULE-6856717783 [1,1,0,0,0,0|1,0,0]=3 1706 B5R0.1 CNCC(C)F MCULE-4381138647 [1,1,0,0,0,0|1,0,0]=3 1707 B5R0.1 CNCC(C)F MCULE-9018181183 [1,1,0,0,0,0|1,0,0]=3 1708 B5R0.1 CNCC(C)O MCULE-3671071529 [1,1,0,0,0,0|1,0,0]=3 1709 B5R0.1 CNCC(C)O MCULE-4171705304 [1,1,0,0,0,0|1,0,0]=3 1710 B5R0.1 CNCC(Cl)Cl MCULE-1176483469 [1,1,0,0,0,0|2,0,0]=4 1711 B5R0.1 CNCC(Cl)Cl MCULE-8474434261 [1,1,0,0,0,0|2,0,0]=4 1712 B5R0.1 CNCC(F)F MCULE-3004221847 [1,1,0,0,0,0|2,0,0]=4 1713 B5R0.1 CNCC(F)F MCULE-5997956111 [1,1,0,0,0,0|2,0,0]=4 1714 B5R0.1 CNC[C@@H](C)O MCULE-2953164520 [1,1,0,0,0,0|1,0,0]=3 1715 B5R0.1 CNC[C@@H](C)O MCULE-3161721140 [1,1,0,0,0,0|1,0,0]=3 1716 B5R0.1 CNC[C@@H](C)O MCULE-6218150837 [1,1,0,0,0,0|1,0,0]=3 1717 B5R0.1 CNC[C@@H](C)O MCULE-8245274547 [1,1,0,0,0,0|1,0,0]=3 1718 B5R0.1 CNC[C@H](C)O MCULE-2655303492 [1,1,0,0,0,0|1,0,0]=3 1719 B5R0.1 CNC[C@H](C)O MCULE-7346940457 [1,1,0,0,0,0|1,0,0]=3 1720 B5R0.1 COC=C(C)C MCULE-6348538911 [1,1,0,0,0,0|0,0,2]=4 1721 B5R0.1 COCC(=N)N MCULE-4711728356 [1,1,0,0,0,0|1,0,1]=4 1722 B5R0.1 COCC(=N)N MCULE-7163250467 [1,1,0,0,0,0|1,0,1]=4 1723 B5R0.1 COCC(=O)C MCULE-7262197587 [1,1,0,0,0,0|0,0,1]=3 1724 B5R0.1 COCC(=O)Cl MCULE-5449267495 [1,1,0,0,0,0|0,0,2]=4 1725 B5R0.1 COCC(=O)N MCULE-6674958132 [1,1,0,0,0,0|0,0,2]=4 1726 B5R0.1 COCC(=O)O MCULE-3945589151 [1,1,0,0,0,0|0,0,1]=3 1727 B5R0.1 COCC(=S)N MCULE-2046809269 [1,1,0,0,0,0|0,1,1]=4 1728 B5R0.1 COCC(C)Br MCULE-6850689931 [1,1,0,0,0,0|0,0,0]=2 1729 B5R0.1 COCC(C)I MCULE-8608265714 [1,1,0,0,0,0|0,0,0]=2 1730 B5R0.1 COCC(C)N MCULE-1896873634 [1,1,0,0,0,0|0,0,0]=2 1731 B5R0.1 COCC(C)N MCULE-2549420211 [1,1,0,0,0,0|0,0,0]=2 1732 B5R0.1 COCC(C)N MCULE-3490410444 [1,1,0,0,0,0|0,0,0]=2 1733 B5R0.1 COCC(C)N MCULE-7089888882 [1,1,0,0,0,0|0,0,0]=2 1734 B5R0.1 COCC(C)O MCULE-4022733014 [1,1,0,0,0,0|0,0,0]=2 1735 B5R0.1 COCC(C)O MCULE-7513310960 [1,1,0,0,0,0|0,0,0]=2 1736 B5R0.1 COCN(C)C MCULE-1963225930 [1,1,0,0,0,0|1,0,0]=3 1737 B5R0.1 COC[C@@H](C)N MCULE-1225912236 [1,1,0,0,0,0|0,0,0]=2 1738 B5R0.1 COC[C@@H](C)N MCULE-2754628271 [1,1,0,0,0,0|0,0,0]=2 1739 B5R0.1 COC[C@@H](C)N MCULE-4676764915 [1,1,0,0,0,0|0,0,0]=2 1740 B5R0.1 COC[C@@H](C)N MCULE-8891950737 [1,1,0,0,0,0|0,0,0]=2 1741 B5R0.1 COC[C@@H](C)O MCULE-6287552520 [1,1,0,0,0,0|0,0,0]=2 1742 B5R0.1 COC[C@@H](C)O MCULE-7942118801 [1,1,0,0,0,0|0,0,0]=2 1743 B5R0.1 COC[C@H](C)N MCULE-2465679418 [1,1,0,0,0,0|0,0,0]=2 1744 B5R0.1 COC[C@H](C)N MCULE-2998593539 [1,1,0,0,0,0|0,0,0]=2 1745 B5R0.1 COC[C@H](C)N MCULE-3161045661 [1,1,0,0,0,0|0,0,0]=2 1746 B5R0.1 COC[C@H](C)N MCULE-9550165578 [1,1,0,0,0,0|0,0,0]=2 1747 B5R0.1 COC[C@H](C)O MCULE-5908531683 [1,1,0,0,0,0|0,0,0]=2 1748 B5R0.1 COC[C@H](C)O MCULE-8619138238 [1,1,0,0,0,0|0,0,0]=2 1749 B5R0.1 CONC(=O)C MCULE-6601866630 [1,1,0,0,0,0|1,0,1]=4 1750 B5R0.1 CONC(=S)C MCULE-1876042939 [1,1,0,0,0,0|1,0,1]=4 1751 B5R0.1 CS(=O)CCBr MCULE-7846126230 [1,1,0,0,0,0|1,1,0]=4 1752 B5R0.1 CS(=O)CCCl MCULE-7012781505 [1,1,0,0,0,0|1,1,0]=4 1753 B5R0.1 CS(=O)CCN MCULE-6497874560 [1,1,0,0,0,0|1,1,0]=4 1754 B5R0.1 CS(=O)CCN MCULE-8275663766 [1,1,0,0,0,0|1,1,0]=4 1755 B5R0.1 CS(=O)CCN MCULE-8330490290 [1,1,0,0,0,0|1,1,0]=4 1756 B5R0.1 CS(=O)CCO MCULE-8331553582 [1,1,0,0,0,0|0,1,0]=3 1757 B5R0.1 CSCC(=O)C MCULE-4131794172 [1,1,0,0,0,0|0,1,1]=4 1758 B5R0.1 CSCC(=O)O MCULE-7003418159 [1,1,0,0,0,0|0,1,1]=4 1759 B5R0.1 CSCC(C)N MCULE-7985946030 [1,1,0,0,0,0|0,1,0]=3 1760 B5R0.1 CSCC(C)O MCULE-2227652351 [1,1,0,0,0,0|0,1,0]=3 1761 B5R0.1 CSCN(C)C MCULE-2931143051 [1,1,0,0,0,0|1,1,0]=4 1762 B5R0.1 CSCS(=O)C MCULE-3167702486 [1,1,0,0,0,0|0,2,0]=4 1763 B5R0.1 C[C@@H](N)CC#N MCULE-1923686728 [1,1,0,0,0,0|2,0,0]=4 1764 B5R0.1 C[C@@H](N)CC#N MCULE-5694530830 [1,1,0,0,0,0|2,0,0]=4 1765 B5R0.1 C[C@@H](N)CC#N MCULE-8880445785 [1,1,0,0,0,0|2,0,0]=4 1766 B5R0.1 C[C@@H](N)CC#N MCULE-9410509782 [1,1,0,0,0,0|2,0,0]=4 1767 B5R0.1 C[C@@H](N)CCO MCULE-4224878672 [1,1,0,0,0,0|1,0,0]=3 1768 B5R0.1 C[C@@H](N)CCO MCULE-5727539473 [1,1,0,0,0,0|1,0,0]=3 1769 B5R0.1 C[C@@H](O)CC#N MCULE-2879004464 [1,1,0,0,0,0|2,0,0]=4 1770 B5R0.1 C[C@@H](O)CCN MCULE-7588849994 [1,1,0,0,0,0|2,0,0]=4 1771 B5R0.1 C[C@@H](O)CCN MCULE-7895006310 [1,1,0,0,0,0|2,0,0]=4 1772 B5R0.1 C[C@@H](O)CCN MCULE-9071323255 [1,1,0,0,0,0|2,0,0]=4 1773 B5R0.1 C[C@@H](O)CCN MCULE-9627550610 [1,1,0,0,0,0|2,0,0]=4 1774 B5R0.1 C[C@@H](O)CCO MCULE-6277947442 [1,1,0,0,0,0|1,0,0]=3 1775 B5R0.1 C[C@@H](O)CCO MCULE-9742368348 [1,1,0,0,0,0|1,0,0]=3 1776 B5R0.1 C[C@@H](O)CON MCULE-3740397343 [1,1,0,0,0,0|1,0,0]=3 1777 B5R0.1 C[C@@H](O)CON MCULE-8274376872 [1,1,0,0,0,0|1,0,0]=3 1778 B5R0.1 C[C@H](N)CC#N MCULE-1876010727 [1,1,0,0,0,0|2,0,0]=4 1779 B5R0.1 C[C@H](N)CC#N MCULE-6927344020 [1,1,0,0,0,0|2,0,0]=4 1780 B5R0.1 C[C@H](N)CC#N MCULE-9082410813 [1,1,0,0,0,0|2,0,0]=4 1781 B5R0.1 C[C@H](N)CC#N MCULE-9498047771 [1,1,0,0,0,0|2,0,0]=4 1782 B5R0.1 C[C@H](N)CCO MCULE-1496375567 [1,1,0,0,0,0|1,0,0]=3 1783 B5R0.1 C[C@H](N)CCO MCULE-4744824708 [1,1,0,0,0,0|1,0,0]=3 1784 B5R0.1 C[C@H](N)CCO MCULE-7219173683 [1,1,0,0,0,0|1,0,0]=3 1785 B5R0.1 C[C@H](N)CCO MCULE-9164942837 [1,1,0,0,0,0|1,0,0]=3 1786 B5R0.1 C[C@H](O)CC#N MCULE-1968982761 [1,1,0,0,0,0|2,0,0]=4 1787 B5R0.1 C[C@H](O)CCN MCULE-7570743309 [1,1,0,0,0,0|2,0,0]=4 1788 B5R0.1 C[C@H](O)CCN MCULE-9428853702 [1,1,0,0,0,0|2,0,0]=4 1789 B5R0.1 C[C@H](O)CCO MCULE-2504912618 [1,1,0,0,0,0|1,0,0]=3 1790 B5R0.1 C[C@H](O)CCO MCULE-2958119786 [1,1,0,0,0,0|1,0,0]=3 1791 B5R0.1 C[C@H](O)CON MCULE-4216605221 [1,1,0,0,0,0|1,0,0]=3 1792 B5R0.1 C[C@H](O)CON MCULE-9863094719 [1,1,0,0,0,0|1,0,0]=3 1793 B5R0.1 C[NH+](C)CCBr MCULE-4990293495 [1,1,0,0,0,0|2,0,0]=4 1794 B5R0.1 C[S+](C)CCCl MCULE-1305595131 [1,1,0,0,0,0|1,1,0]=4 1795 B5R0.1 C[S+](C)CCCl MCULE-9761617787 [1,1,0,0,0,0|1,1,0]=4 1796 B5R0.1 C[S@@](=O)CCO MCULE-4485824334 [1,1,0,0,0,0|0,1,0]=3 1797 B5R0.1 N=C(N)CCO MCULE-4567824707 [1,1,0,0,0,0|2,0,0]=4 1798 B5R0.1 N=C(N)CCO MCULE-7139693715 [1,1,0,0,0,0|2,0,0]=4 1799 B5R0.1 NC(=O)CCO MCULE-4026170350 [1,1,0,0,0,0|2,0,0]=4 1800 B5R0.1 NOCC(=O)O MCULE-4566186819 [1,1,0,0,0,0|1,0,1]=4 1801 B5R0.1 NOCC(=O)O MCULE-4824237418 [1,1,0,0,0,0|1,0,1]=4 1802 B5R0.1 NOCC(=O)O MCULE-8132180423 [1,1,0,0,0,0|1,0,1]=4 1803 B5R0.1 NOCC(F)F MCULE-1860693804 [1,1,0,0,0,0|2,0,0]=4 1804 B5R0.1 NOCC(F)F MCULE-2698080780 [1,1,0,0,0,0|2,0,0]=4 1805 B5R0.1 O=C(O)CCO MCULE-3428604829 [1,1,0,0,0,0|2,0,0]=4 1806 B5R0.1 O=C([O-])CCO MCULE-4429611588 [1,1,0,0,0,0|2,0,0]=4 1807 B5R0.1 O=N(=O)CCO MCULE-2060841405 [1,1,0,0,0,0|2,0,0]=4 1808 B5R0.1 OCCC(F)F MCULE-9207688926 [1,1,0,0,0,0|2,0,0]=4 1809 B5R0.1 [C@@H](C)(O)CCC MCULE-9717120293 [1,1,0,0,0,0|1,0,0]=3 1810 B5R0.1 [C@@H](C)(O)CNC MCULE-2044067921 [1,1,0,0,0,0|1,0,0]=3 1811 B5R0.1 [C@H](C)(O)CC#N MCULE-6894178072 [1,1,0,0,0,0|2,0,0]=4 1812 B5R0.1 [C@H](C)(O)CCC MCULE-2689023898 [1,1,0,0,0,0|1,0,0]=3 1813 B5R0.3 C#CC(C)OC MCULE-3702592933 [1,1,0,0,0,0|0,0,2]=4 1814 B5R0.3 C#CC(C)OC MCULE-3806443816 [1,1,0,0,0,0|0,0,2]=4 1815 B5R0.3 C#CC(N)CC MCULE-2327605941 [1,1,0,0,0,0|1,0,1]=4 1816 B5R0.3 C#CC(N)CC MCULE-3572771620 [1,1,0,0,0,0|1,0,1]=4 1817 B5R0.3 C#CC(N)CO MCULE-2442851523 [1,1,0,0,0,0|1,0,1]=4 1818 B5R0.3 C#CC(N)CO MCULE-3866086926 [1,1,0,0,0,0|1,0,1]=4 1819 B5R0.3 C#CC(O)CC MCULE-9890863731 [1,1,0,0,0,0|1,0,1]=4 1820 B5R0.3 C#C[C@H](C)OC MCULE-9002531152 [1,1,0,0,0,0|0,0,2]=4 1821 B5R0.3 C#C[C@H](N)CO MCULE-2312982984 [1,1,0,0,0,0|1,0,1]=4 1822 B5R0.3 C#C[C@H](N)CO MCULE-8124038281 [1,1,0,0,0,0|1,0,1]=4 1823 B5R0.3 C#C[C@H](N)CO MCULE-8753140181 [1,1,0,0,0,0|1,0,1]=4 1824 B5R0.3 C#C[C@H](N)CO MCULE-9874393436 [1,1,0,0,0,0|1,0,1]=4 1825 B5R0.3 C/C=C(/C)\CC MCULE-9789907985 [1,1,0,0,0,0|1,0,1]=4 1826 B5R0.3 C/C=C(\C)/CC MCULE-7119786881 [1,1,0,0,0,0|1,0,1]=4 1827 B5R0.3 C=C(CC)CC MCULE-9174509622 [1,1,0,0,0,0|1,0,1]=4 1828 B5R0.3 C=C(CC)CO MCULE-8127766352 [1,1,0,0,0,0|1,0,1]=4 1829 B5R0.3 C=CC(C)CC MCULE-8112547661 [1,1,0,0,0,0|1,0,1]=4 1830 B5R0.3 C=CC(N)CC MCULE-6270835453 [1,1,0,0,0,0|1,0,1]=4 1831 B5R0.3 C=CC(N)CC MCULE-7920121163 [1,1,0,0,0,0|1,0,1]=4 1832 B5R0.3 C=CC(N)CO MCULE-2457433196 [1,1,0,0,0,0|1,0,1]=4 1833 B5R0.3 C=CC(N)CO MCULE-6697949182 [1,1,0,0,0,0|1,0,1]=4 1834 B5R0.3 C=CC(N)CO MCULE-7137123222 [1,1,0,0,0,0|1,0,1]=4 1835 B5R0.3 C=CC(N)CO MCULE-8388687355 [1,1,0,0,0,0|1,0,1]=4 1836 B5R0.3 C=CC(O)CC MCULE-2794806228 [1,1,0,0,0,0|1,0,1]=4 1837 B5R0.3 C=CC(O)CO MCULE-6172654550 [1,1,0,0,0,0|1,0,1]=4 1838 B5R0.3 C=C[C@@H](N)CO MCULE-1000343618 [1,1,0,0,0,0|1,0,1]=4 1839 B5R0.3 C=C[C@@H](N)CO MCULE-1074988940 [1,1,0,0,0,0|1,0,1]=4 1840 B5R0.3 C=C[C@@H](N)CO MCULE-3685491078 [1,1,0,0,0,0|1,0,1]=4 1841 B5R0.3 C=C[C@@H](N)CO MCULE-4969611575 [1,1,0,0,0,0|1,0,1]=4 1842 B5R0.3 C=C[C@@H](O)CO MCULE-5957455616 [1,1,0,0,0,0|1,0,1]=4 1843 B5R0.3 C=C[C@H](N)CO MCULE-2834725512 [1,1,0,0,0,0|1,0,1]=4 1844 B5R0.3 C=C[C@H](N)CO MCULE-3281738311 [1,1,0,0,0,0|1,0,1]=4 1845 B5R0.3 C=C[C@H](N)CO MCULE-3551585090 [1,1,0,0,0,0|1,0,1]=4 1846 B5R0.3 C=C[C@H](N)CO MCULE-9055556349 [1,1,0,0,0,0|1,0,1]=4 1847 B5R0.3 C=C[C@H](O)CO MCULE-6068203844 [1,1,0,0,0,0|1,0,1]=4 1848 B5R0.3 C=C[C@H](O)CO MCULE-9367072182 [1,1,0,0,0,0|1,0,1]=4 1849 B5R0.3 CC(C#N)CO MCULE-1644391554 [1,1,0,0,0,0|2,0,0]=4 1850 B5R0.3 CC(CN)CO MCULE-5880795484 [1,1,0,0,0,0|2,0,0]=4 1851 B5R0.3 CC(CN)CO MCULE-8083007887 [1,1,0,0,0,0|2,0,0]=4 1852 B5R0.3 CC(CO)CBr MCULE-3815333295 [1,1,0,0,0,0|2,0,0]=4 1853 B5R0.3 CC(CO)CBr MCULE-5695891877 [1,1,0,0,0,0|2,0,0]=4 1854 B5R0.3 CC(CO)CO MCULE-2340730326 [1,1,0,0,0,0|2,0,0]=4 1855 B5R0.3 CC(CO)CS MCULE-1990992504 [1,1,0,0,0,0|2,0,0]=4 1856 B5R0.3 CC(CO)NN MCULE-3362748538 [1,1,0,0,0,0|2,0,0]=4 1857 B5R0.3 CC(CO)NN MCULE-4440318216 [1,1,0,0,0,0|2,0,0]=4 1858 B5R0.3 CC=C(C)CC MCULE-5790494157 [1,1,0,0,0,0|1,0,1]=4 1859 B5R0.3 CCC(=N)OC MCULE-4123543795 [1,1,0,0,0,0|0,0,1]=3 1860 B5R0.3 CCC(=N)OC MCULE-5346320805 [1,1,0,0,0,0|0,0,1]=3 1861 B5R0.3 CCC(=O)CC MCULE-8236549739 [1,1,0,0,0,0|1,0,1]=4 1862 B5R0.3 CCC(=O)CO MCULE-8674894820 [1,1,0,0,0,0|1,0,1]=4 1863 B5R0.3 CCC(=O)NC MCULE-5612060170 [1,1,0,0,0,0|1,0,1]=4 1864 B5R0.3 CCC(=O)OC MCULE-7384824725 [1,1,0,0,0,0|0,0,1]=3 1865 B5R0.3 CCC(=O)SC MCULE-9712192191 [1,1,0,0,0,0|0,1,1]=4 1866 B5R0.3 CCC(Br)C#N MCULE-4015907163 [1,1,0,0,0,0|2,0,0]=4 1867 B5R0.3 CCC(Br)C=O MCULE-3064952987 [1,1,0,0,0,0|2,0,0]=4 1868 B5R0.3 CCC(Br)CBr MCULE-5254958560 [1,1,0,0,0,0|2,0,0]=4 1869 B5R0.3 CCC(Br)CC MCULE-7435628721 [1,1,0,0,0,0|1,0,0]=3 1870 B5R0.3 CCC(Br)CO MCULE-7211805716 [1,1,0,0,0,0|1,0,0]=3 1871 B5R0.3 CCC(C)C#N MCULE-6204122967 [1,1,0,0,0,0|2,0,0]=4 1872 B5R0.3 CCC(C)C=O MCULE-2523669899 [1,1,0,0,0,0|2,0,0]=4 1873 B5R0.3 CCC(C)CBr MCULE-5451416952 [1,1,0,0,0,0|2,0,0]=4 1874 B5R0.3 CCC(C)CC MCULE-2542807917 [1,1,0,0,0,0|1,0,0]=3 1875 B5R0.3 CCC(C)CCl MCULE-7450386476 [1,1,0,0,0,0|2,0,0]=4 1876 B5R0.3 CCC(C)CI MCULE-5444509280 [1,1,0,0,0,0|2,0,0]=4 1877 B5R0.3 CCC(C)CN MCULE-2777327284 [1,1,0,0,0,0|2,0,0]=4 1878 B5R0.3 CCC(C)CN MCULE-7014901600 [1,1,0,0,0,0|2,0,0]=4 1879 B5R0.3 CCC(C)CO MCULE-6521026296 [1,1,0,0,0,0|1,0,0]=3 1880 B5R0.3 CCC(C)CS MCULE-7795095685 [1,1,0,0,0,0|1,1,0]=4 1881 B5R0.3 CCC(C)NC MCULE-2676584804 [1,1,0,0,0,0|1,0,0]=3 1882 B5R0.3 CCC(C)NC MCULE-6158046887 [1,1,0,0,0,0|1,0,0]=3 1883 B5R0.3 CCC(C)NN MCULE-6074476998 [1,1,0,0,0,0|2,0,0]=4 1884 B5R0.3 CCC(C)NN MCULE-8130021960 [1,1,0,0,0,0|2,0,0]=4 1885 B5R0.3 CCC(C)NN MCULE-8519369369 [1,1,0,0,0,0|2,0,0]=4 1886 B5R0.3 CCC(C)NO MCULE-1247092627 [1,1,0,0,0,0|2,0,0]=4 1887 B5R0.3 CCC(C)NO MCULE-6169819668 [1,1,0,0,0,0|2,0,0]=4 1888 B5R0.3 CCC(C)OC MCULE-7354431606 [1,1,0,0,0,0|0,0,0]=2 1889 B5R0.3 CCC(C)ON MCULE-2907890438 [1,1,0,0,0,0|1,0,0]=3 1890 B5R0.3 CCC(C)ON MCULE-4364205813 [1,1,0,0,0,0|1,0,0]=3 1891 B5R0.3 CCC(Cl)C#N MCULE-7185233128 [1,1,0,0,0,0|2,0,0]=4 1892 B5R0.3 CCC(Cl)C=O MCULE-5238776091 [1,1,0,0,0,0|2,0,0]=4 1893 B5R0.3 CCC(Cl)CCl MCULE-5122022797 [1,1,0,0,0,0|2,0,0]=4 1894 B5R0.3 CCC(Cl)CO MCULE-1756262629 [1,1,0,0,0,0|1,0,0]=3 1895 B5R0.3 CCC(F)CBr MCULE-3226052264 [1,1,0,0,0,0|2,0,0]=4 1896 B5R0.3 CCC(F)CN MCULE-1291385596 [1,1,0,0,0,0|2,0,0]=4 1897 B5R0.3 CCC(F)CN MCULE-7421331323 [1,1,0,0,0,0|2,0,0]=4 1898 B5R0.3 CCC(I)CC MCULE-1119844552 [1,1,0,0,0,0|1,0,0]=3 1899 B5R0.3 CCC(N)C#N MCULE-1350483203 [1,1,0,0,0,0|2,0,0]=4 1900 B5R0.3 CCC(N)C#N MCULE-3867024162 [1,1,0,0,0,0|2,0,0]=4 1901 B5R0.3 CCC(N)CBr MCULE-3567691924 [1,1,0,0,0,0|2,0,0]=4 1902 B5R0.3 CCC(N)CC MCULE-4261937519 [1,1,0,0,0,0|1,0,0]=3 1903 B5R0.3 CCC(N)CC MCULE-5899128891 [1,1,0,0,0,0|1,0,0]=3 1904 B5R0.3 CCC(N)CN MCULE-6911484065 [1,1,0,0,0,0|2,0,0]=4 1905 B5R0.3 CCC(N)CN MCULE-8376506697 [1,1,0,0,0,0|2,0,0]=4 1906 B5R0.3 CCC(N)CO MCULE-1135809021 [1,1,0,0,0,0|1,0,0]=3 1907 B5R0.3 CCC(N)CO MCULE-7588854111 [1,1,0,0,0,0|1,0,0]=3 1908 B5R0.3 CCC(O)C#N MCULE-5389816542 [1,1,0,0,0,0|2,0,0]=4 1909 B5R0.3 CCC(O)CBr MCULE-4205031860 [1,1,0,0,0,0|2,0,0]=4 1910 B5R0.3 CCC(O)CC MCULE-5553645045 [1,1,0,0,0,0|1,0,0]=3 1911 B5R0.3 CCC(O)CCl MCULE-8359810208 [1,1,0,0,0,0|2,0,0]=4 1912 B5R0.3 CCC(O)CN MCULE-5197026448 [1,1,0,0,0,0|2,0,0]=4 1913 B5R0.3 CCC(O)CO MCULE-2488753438 [1,1,0,0,0,0|1,0,0]=3 1914 B5R0.3 CCC(O)CO MCULE-7297282094 [1,1,0,0,0,0|1,0,0]=3 1915 B5R0.3 CCC(S)CC MCULE-2556259434 [1,1,0,0,0,0|1,0,0]=3 1916 B5R0.3 CCC(S)CS MCULE-9332449950 [1,1,0,0,0,0|1,1,0]=4 1917 B5R0.3 CCC([NH3+])CBr MCULE-6971158198 [1,1,0,0,0,0|2,0,0]=4 1918 B5R0.3 CCN(C)CC MCULE-7207964917 [1,1,0,0,0,0|2,0,0]=4 1919 B5R0.3 CCN(N)CC MCULE-9853386945 [1,1,0,0,0,0|2,0,0]=4 1920 B5R0.3 CCN(N)CC MCULE-9962617398 [1,1,0,0,0,0|2,0,0]=4 1921 B5R0.3 CCN(O)CC MCULE-6022935768 [1,1,0,0,0,0|2,0,0]=4 1922 B5R0.3 CCP(=O)CC MCULE-2216184595 [1,1,0,0,0,0|2,0,0]=4 1923 B5R0.3 CCP(Cl)CC MCULE-4484529264 [1,1,0,0,0,0|2,0,0]=4 1924 B5R0.3 CCS(=O)CC MCULE-5102735179 [1,1,0,0,0,0|2,0,0]=4 1925 B5R0.3 CC[C@@H](C)CBr MCULE-5675886072 [1,1,0,0,0,0|2,0,0]=4 1926 B5R0.3 CC[C@@H](C)CN MCULE-7612408107 [1,1,0,0,0,0|2,0,0]=4 1927 B5R0.3 CC[C@@H](C)CO MCULE-6700783698 [1,1,0,0,0,0|1,0,0]=3 1928 B5R0.3 CC[C@@H](C)CO MCULE-8175790803 [1,1,0,0,0,0|1,0,0]=3 1929 B5R0.3 CC[C@@H](N)C#N MCULE-3696119254 [1,1,0,0,0,0|2,0,0]=4 1930 B5R0.3 CC[C@@H](N)C#N MCULE-5586041766 [1,1,0,0,0,0|2,0,0]=4 1931 B5R0.3 CC[C@@H](N)CO MCULE-3821348404 [1,1,0,0,0,0|1,0,0]=3 1932 B5R0.3 CC[C@@H](N)CO MCULE-7190248306 [1,1,0,0,0,0|1,0,0]=3 1933 B5R0.3 CC[C@@H](O)CN MCULE-2854535153 [1,1,0,0,0,0|2,0,0]=4 1934 B5R0.3 CC[C@@H](O)CN MCULE-8228547956 [1,1,0,0,0,0|2,0,0]=4 1935 B5R0.3 CC[C@@H](O)CO MCULE-3948477298 [1,1,0,0,0,0|1,0,0]=3 1936 B5R0.3 CC[C@@H](O)CO MCULE-5098109795 [1,1,0,0,0,0|1,0,0]=3 1937 B5R0.3 CC[C@H](C)C#N MCULE-9118306872 [1,1,0,0,0,0|2,0,0]=4 1938 B5R0.3 CC[C@H](C)CBr MCULE-3263714447 [1,1,0,0,0,0|2,0,0]=4 1939 B5R0.3 CC[C@H](C)CBr MCULE-3384648570 [1,1,0,0,0,0|2,0,0]=4 1940 B5R0.3 CC[C@H](C)CCl MCULE-6795758745 [1,1,0,0,0,0|2,0,0]=4 1941 B5R0.3 CC[C@H](C)CCl MCULE-8147276830 [1,1,0,0,0,0|2,0,0]=4 1942 B5R0.3 CC[C@H](C)CI MCULE-9690776923 [1,1,0,0,0,0|2,0,0]=4 1943 B5R0.3 CC[C@H](C)CN MCULE-1380819951 [1,1,0,0,0,0|2,0,0]=4 1944 B5R0.3 CC[C@H](C)CN MCULE-1396096112 [1,1,0,0,0,0|2,0,0]=4 1945 B5R0.3 CC[C@H](C)CN MCULE-2971933862 [1,1,0,0,0,0|2,0,0]=4 1946 B5R0.3 CC[C@H](C)CN MCULE-3698084674 [1,1,0,0,0,0|2,0,0]=4 1947 B5R0.3 CC[C@H](C)CO MCULE-1493424061 [1,1,0,0,0,0|1,0,0]=3 1948 B5R0.3 CC[C@H](C)CO MCULE-6879443668 [1,1,0,0,0,0|1,0,0]=3 1949 B5R0.3 CC[C@H](N)C#N MCULE-4431283179 [1,1,0,0,0,0|2,0,0]=4 1950 B5R0.3 CC[C@H](N)C#N MCULE-8842235277 [1,1,0,0,0,0|2,0,0]=4 1951 B5R0.3 CC[C@H](N)CF MCULE-3646304583 [1,1,0,0,0,0|2,0,0]=4 1952 B5R0.3 CC[C@H](N)CF MCULE-4493834638 [1,1,0,0,0,0|2,0,0]=4 1953 B5R0.3 CC[C@H](N)CO MCULE-5500083870 [1,1,0,0,0,0|1,0,0]=3 1954 B5R0.3 CC[C@H](N)CO MCULE-6312512384 [1,1,0,0,0,0|1,0,0]=3 1955 B5R0.3 CC[C@H](O)CN MCULE-4385930741 [1,1,0,0,0,0|2,0,0]=4 1956 B5R0.3 CC[C@H](O)CO MCULE-2194264642 [1,1,0,0,0,0|1,0,0]=3 1957 B5R0.3 CC[C@H](O)CO MCULE-5503575962 [1,1,0,0,0,0|1,0,0]=3 1958 B5R0.3 CNC(=N)CO MCULE-3239749882 [1,1,0,0,0,0|1,0,1]=4 1959 B5R0.3 CNC(=O)CO MCULE-5899226107 [1,1,0,0,0,0|1,0,1]=4 1960 B5R0.3 CNC(=O)OC MCULE-1162861376 [1,1,0,0,0,0|1,0,1]=4 1961 B5R0.3 CNC(C)CN MCULE-1599162912 [1,1,0,0,0,0|2,0,0]=4 1962 B5R0.3 CNC(C)CN MCULE-1637391260 [1,1,0,0,0,0|2,0,0]=4 1963 B5R0.3 CNC(C)CO MCULE-3841057780 [1,1,0,0,0,0|1,0,0]=3 1964 B5R0.3 CNC(C)CO MCULE-6474892275 [1,1,0,0,0,0|1,0,0]=3 1965 B5R0.3 CN[C@@H](C)CO MCULE-1633741835 [1,1,0,0,0,0|1,0,0]=3 1966 B5R0.3 CN[C@@H](C)CO MCULE-6736108875 [1,1,0,0,0,0|1,0,0]=3 1967 B5R0.3 CN[C@@H](C)CO MCULE-7554801630 [1,1,0,0,0,0|1,0,0]=3 1968 B5R0.3 CN[C@@H](C)CO MCULE-9312521497 [1,1,0,0,0,0|1,0,0]=3 1969 B5R0.3 CN[C@H](C)CO MCULE-2402322400 [1,1,0,0,0,0|1,0,0]=3 1970 B5R0.3 CN[C@H](C)CO MCULE-4362091386 [1,1,0,0,0,0|1,0,0]=3 1971 B5R0.3 CN[C@H](C)CO MCULE-5426855707 [1,1,0,0,0,0|1,0,0]=3 1972 B5R0.3 CN[C@H](C)CO MCULE-9777995604 [1,1,0,0,0,0|1,0,0]=3 1973 B5R0.3 COC(=N)CCl MCULE-2713131753 [1,1,0,0,0,0|1,0,1]=4 1974 B5R0.3 COC(=N)CCl MCULE-6471252676 [1,1,0,0,0,0|1,0,1]=4 1975 B5R0.3 COC(=O)CBr MCULE-2684954408 [1,1,0,0,0,0|1,0,1]=4 1976 B5R0.3 COC(=O)CCl MCULE-5886832940 [1,1,0,0,0,0|1,0,1]=4 1977 B5R0.3 COC(=O)CF MCULE-4367430175 [1,1,0,0,0,0|1,0,1]=4 1978 B5R0.3 COC(=O)CI MCULE-9545584156 [1,1,0,0,0,0|1,0,1]=4 1979 B5R0.3 COC(=O)CN MCULE-7462799100 [1,1,0,0,0,0|1,0,1]=4 1980 B5R0.3 COC(=O)CN MCULE-8887061469 [1,1,0,0,0,0|1,0,1]=4 1981 B5R0.3 COC(=O)CO MCULE-8734582763 [1,1,0,0,0,0|0,0,1]=3 1982 B5R0.3 COC(=O)CS MCULE-3020830180 [1,1,0,0,0,0|0,1,1]=4 1983 B5R0.3 COC(=O)OC MCULE-7488725621 [1,1,0,0,0,0|0,0,1]=3 1984 B5R0.3 COC(=S)SC MCULE-7665194168 [1,1,0,0,0,0|0,1,1]=4 1985 B5R0.3 COC(C)C#N MCULE-7716445717 [1,1,0,0,0,0|1,0,1]=4 1986 B5R0.3 COC(C)CBr MCULE-6831960550 [1,1,0,0,0,0|1,0,0]=3 1987 B5R0.3 COC(C)CCl MCULE-6614968111 [1,1,0,0,0,0|1,0,0]=3 1988 B5R0.3 COC(C)CI MCULE-9561627722 [1,1,0,0,0,0|1,0,0]=3 1989 B5R0.3 COC(C)CN MCULE-1378513525 [1,1,0,0,0,0|1,0,0]=3 1990 B5R0.3 COC(C)CN MCULE-6114730248 [1,1,0,0,0,0|1,0,0]=3 1991 B5R0.3 COC(C)CN MCULE-7516064224 [1,1,0,0,0,0|1,0,0]=3 1992 B5R0.3 COC(C)CN MCULE-8277408054 [1,1,0,0,0,0|1,0,0]=3 1993 B5R0.3 COC(C)CO MCULE-5269990702 [1,1,0,0,0,0|0,0,0]=2 1994 B5R0.3 COC(C)CO MCULE-7173093332 [1,1,0,0,0,0|0,0,0]=2 1995 B5R0.3 COC(C)OC MCULE-8241616143 [1,1,0,0,0,0|0,0,0]=2 1996 B5R0.3 COS(=O)OC MCULE-9352053920 [1,1,0,0,0,0|1,0,0]=3 1997 B5R0.3 CO[C@@H](C)C#N MCULE-1453263443 [1,1,0,0,0,0|1,0,1]=4 1998 B5R0.3 CO[C@@H](C)CN MCULE-1448950160 [1,1,0,0,0,0|1,0,0]=3 1999 B5R0.3 CO[C@@H](C)CN MCULE-3784073249 [1,1,0,0,0,0|1,0,0]=3 2000 B5R0.3 CO[C@@H](C)CN MCULE-6073633931 [1,1,0,0,0,0|1,0,0]=3 2001 B5R0.3 CO[C@@H](C)CN MCULE-9516756218 [1,1,0,0,0,0|1,0,0]=3 2002 B5R0.3 CO[C@@H](C)CO MCULE-5600457791 [1,1,0,0,0,0|0,0,0]=2 2003 B5R0.3 CO[C@@H](C)CO MCULE-7981152382 [1,1,0,0,0,0|0,0,0]=2 2004 B5R0.3 CO[C@H](C)CN MCULE-4143562009 [1,1,0,0,0,0|1,0,0]=3 2005 B5R0.3 CO[C@H](C)CN MCULE-4184510827 [1,1,0,0,0,0|1,0,0]=3 2006 B5R0.3 CO[C@H](C)CN MCULE-9625722424 [1,1,0,0,0,0|1,0,0]=3 2007 B5R0.3 CO[C@H](C)CN MCULE-9882567615 [1,1,0,0,0,0|1,0,0]=3 2008 B5R0.3 CO[C@H](C)CO MCULE-4211976708 [1,1,0,0,0,0|0,0,0]=2 2009 B5R0.3 CO[C@H](C)CO MCULE-7592020348 [1,1,0,0,0,0|0,0,0]=2 2010 B5R0.3 CSC(C)CN MCULE-8841622109 [1,1,0,0,0,0|1,1,0]=4 2011 B5R0.3 CSC(C)CO MCULE-4646435737 [1,1,0,0,0,0|0,1,0]=3 2012 B5R0.3 C[C@@H](CN)CO MCULE-4662215148 [1,1,0,0,0,0|2,0,0]=4 2013 B5R0.3 C[C@@H](CN)CO MCULE-7870198689 [1,1,0,0,0,0|2,0,0]=4 2014 B5R0.3 C[C@@H](CO)CBr MCULE-3691541800 [1,1,0,0,0,0|2,0,0]=4 2015 B5R0.3 C[C@@H](CO)CBr MCULE-4447849056 [1,1,0,0,0,0|2,0,0]=4 2016 B5R0.3 C[C@H](CO)CBr MCULE-4031825779 [1,1,0,0,0,0|2,0,0]=4 2017 B5R0.3 C[C@H](CO)CBr MCULE-6846167456 [1,1,0,0,0,0|2,0,0]=4 2018 B5R0.3 N#CC(N)CO MCULE-5918855868 [1,1,0,0,0,0|2,0,0]=4 2019 B5R0.3 N#CC(N)CO MCULE-8439000158 [1,1,0,0,0,0|2,0,0]=4 2020 B5R0.3 NC(CO)CF MCULE-3756808200 [1,1,0,0,0,0|2,0,0]=4 2021 B5R0.3 NC(CO)CF MCULE-9468719402 [1,1,0,0,0,0|2,0,0]=4 2022 B5R0.3 NC(CO)CO MCULE-1559988016 [1,1,0,0,0,0|2,0,0]=4 2023 B5R0.3 NC(CO)CO MCULE-4954119952 [1,1,0,0,0,0|2,0,0]=4 2024 B5R0.3 NCC(F)CO MCULE-6156319956 [1,1,0,0,0,0|2,0,0]=4 2025 B5R0.3 NCC(F)CO MCULE-7472307328 [1,1,0,0,0,0|2,0,0]=4 2026 B5R0.3 NCC(O)CO MCULE-2689763818 [1,1,0,0,0,0|2,0,0]=4 2027 B5R0.3 NCC(O)CO MCULE-6096620010 [1,1,0,0,0,0|2,0,0]=4 2028 B5R0.3 NCC(O)CO MCULE-7307777212 [1,1,0,0,0,0|2,0,0]=4 2029 B5R0.3 NC[C@@H](F)CO MCULE-3273711180 [1,1,0,0,0,0|2,0,0]=4 2030 B5R0.3 NC[C@@H](F)CO MCULE-6673969522 [1,1,0,0,0,0|2,0,0]=4 2031 B5R0.3 NC[C@@H](N)CO MCULE-7333007012 [1,1,0,0,0,0|2,0,0]=4 2032 B5R0.3 NC[C@@H](N)CO MCULE-9200386635 [1,1,0,0,0,0|2,0,0]=4 2033 B5R0.3 NC[C@@H](O)CO MCULE-7897503444 [1,1,0,0,0,0|2,0,0]=4 2034 B5R0.3 NC[C@@H](O)CO MCULE-8044821624 [1,1,0,0,0,0|2,0,0]=4 2035 B5R0.3 NC[C@@H](O)CO MCULE-9443333756 [1,1,0,0,0,0|2,0,0]=4 2036 B5R0.3 NC[C@H](F)CO MCULE-2595736378 [1,1,0,0,0,0|2,0,0]=4 2037 B5R0.3 NC[C@H](F)CO MCULE-7417074078 [1,1,0,0,0,0|2,0,0]=4 2038 B5R0.3 NC[C@H](F)CO MCULE-7938231499 [1,1,0,0,0,0|2,0,0]=4 2039 B5R0.3 NC[C@H](N)CO MCULE-1060049548 [1,1,0,0,0,0|2,0,0]=4 2040 B5R0.3 NC[C@H](N)CO MCULE-9942356112 [1,1,0,0,0,0|2,0,0]=4 2041 B5R0.3 NC[C@H](O)CO MCULE-5835551322 [1,1,0,0,0,0|2,0,0]=4 2042 B5R0.3 NC[C@H](O)CO MCULE-6021133883 [1,1,0,0,0,0|2,0,0]=4 2043 B5R0.3 NC[C@H](O)CO MCULE-7461568841 [1,1,0,0,0,0|2,0,0]=4 2044 B5R0.3 NC[C@H](O)CO MCULE-8112454132 [1,1,0,0,0,0|2,0,0]=4 2045 B5R0.3 N[C@@H](CO)CF MCULE-1103631898 [1,1,0,0,0,0|2,0,0]=4 2046 B5R0.3 N[C@@H](CO)CF MCULE-1137418239 [1,1,0,0,0,0|2,0,0]=4 2047 B5R0.3 N[C@@H](CO)CF MCULE-7452275160 [1,1,0,0,0,0|2,0,0]=4 2048 B5R0.3 N[C@@H](CO)CF MCULE-9154795583 [1,1,0,0,0,0|2,0,0]=4 2049 B5R0.3 N[C@H](CO)CF MCULE-1070351343 [1,1,0,0,0,0|2,0,0]=4 2050 B5R0.3 N[C@H](CO)CF MCULE-4715788718 [1,1,0,0,0,0|2,0,0]=4 2051 B5R0.3 N[C@H](CO)CF MCULE-8220585202 [1,1,0,0,0,0|2,0,0]=4 2052 B5R0.3 N[C@H](CO)CF MCULE-8991857376 [1,1,0,0,0,0|2,0,0]=4 2053 B5R0.3 O=CC(O)CO MCULE-9581740191 [1,1,0,0,0,0|2,0,0]=4 2054 B5R0.3 O=C[C@@H](O)CO MCULE-3883857491 [1,1,0,0,0,0|2,0,0]=4 2055 B5R0.3 O=C[C@@H](O)CO MCULE-7852783182 [1,1,0,0,0,0|2,0,0]=4 2056 B5R0.3 O=C[C@H](O)CO MCULE-4574984840 [1,1,0,0,0,0|2,0,0]=4 2057 B5R0.3 OCC(Br)CBr MCULE-9616107956 [1,1,0,0,0,0|2,0,0]=4 2058 B5R0.3 OCC(Br)CO MCULE-9272628834 [1,1,0,0,0,0|2,0,0]=4 2059 B5R0.3 OCC(Cl)CCl MCULE-2120585852 [1,1,0,0,0,0|2,0,0]=4 2060 B5R0.3 OCC(Cl)CO MCULE-7487945326 [1,1,0,0,0,0|2,0,0]=4 2061 B5R0.3 OCC(F)CBr MCULE-2889937576 [1,1,0,0,0,0|2,0,0]=4 2062 B5R0.3 OCC(F)CO MCULE-2970537690 [1,1,0,0,0,0|2,0,0]=4 2063 B5R0.3 OCC(O)CBr MCULE-9116190245 [1,1,0,0,0,0|2,0,0]=4 2064 B5R0.3 OCC(O)CCl MCULE-7895191088 [1,1,0,0,0,0|2,0,0]=4 2065 B5R0.3 OCC(O)CCl MCULE-8992242488 [1,1,0,0,0,0|2,0,0]=4 2066 B5R0.3 OCC(O)CF MCULE-3575952891 [1,1,0,0,0,0|2,0,0]=4 2067 B5R0.3 OCC(O)CF MCULE-8981430411 [1,1,0,0,0,0|2,0,0]=4 2068 B5R0.3 OCC(O)CI MCULE-6705992930 [1,1,0,0,0,0|2,0,0]=4 2069 B5R0.3 OCC(O)CO MCULE-6349111826 [1,1,0,0,0,0|2,0,0]=4 2070 B5R0.3 OCC(O)CS MCULE-6300188207 [1,1,0,0,0,0|2,0,0]=4 2071 B5R0.3 OCC(S)CS MCULE-9735516119 [1,1,0,0,0,0|2,0,0]=4 2072 B5R0.3 OC[C@@H](O)CCl MCULE-1311776512 [1,1,0,0,0,0|2,0,0]=4 2073 B5R0.3 OC[C@@H](O)CCl MCULE-2685107404 [1,1,0,0,0,0|2,0,0]=4 2074 B5R0.3 OC[C@@H](O)CF MCULE-3274443966 [1,1,0,0,0,0|2,0,0]=4 2075 B5R0.3 OC[C@@H](O)CF MCULE-5908395855 [1,1,0,0,0,0|2,0,0]=4 2076 B5R0.3 OC[C@H](O)CBr MCULE-5035020863 [1,1,0,0,0,0|2,0,0]=4 2077 B5R0.3 OC[C@H](O)CCl MCULE-2098232262 [1,1,0,0,0,0|2,0,0]=4 2078 B5R0.3 OC[C@H](O)CCl MCULE-5801605349 [1,1,0,0,0,0|2,0,0]=4 2079 B5R0.3 OC[C@H](O)CF MCULE-3309672397 [1,1,0,0,0,0|2,0,0]=4 2080 B5R0.3 OC[C@H](O)CF MCULE-7695783253 [1,1,0,0,0,0|2,0,0]=4 2081 B5R0.3 P(=O)(OC)OC MCULE-7918891029 [1,1,0,0,0,0|1,0,0]=3 2082 B7R0.2 C=C(C)CC(C)CC MCULE-1001667584 [0,2,0,0,0,0|2,0,0]=4 2083 B7R0.2 CCC(C)CC(=O)C MCULE-5801548800 [0,2,0,0,0,0|2,0,0]=4 2084 B7R0.2 CCC(C)CC(C)C MCULE-9492683095 [0,2,0,0,0,0|2,0,0]=4 2085 B7R0.2 CCC(C)CC(C)N MCULE-2633957870 [0,2,0,0,0,0|2,0,0]=4 2086 B7R0.2 CCC(C)CC(C)N MCULE-5740038174 [0,2,0,0,0,0|2,0,0]=4 2087 B7R0.2 CCC(N)CC(C)O MCULE-1447243469 [0,2,0,0,0,0|2,0,0]=4 2088 B7R0.2 CCC(N)CN(C)C MCULE-7794272438 [0,2,0,0,0,0|2,0,0]=4 2089 B7R0.2 CCC(O)CC(=O)C MCULE-1222748729 [0,2,0,0,0,0|2,0,0]=4 2090 B7R0.2 CCC(O)CC(C)O MCULE-3115543235 [0,2,0,0,0,0|2,0,0]=4 2091 B7R0.2 CCC(O)CN(C)C MCULE-5823673760 [0,2,0,0,0,0|2,0,0]=4 2092 B7R0.2 CC[C@@H](N)CN(C)C MCULE-4272885891 [0,2,0,0,0,0|2,0,0]=4 2093 B7R0.2 CC[C@@H](N)CN(C)C MCULE-8695009794 [0,2,0,0,0,0|2,0,0]=4 2094 B7R0.2 CC[C@H](N)CN(C)C MCULE-4335497059 [0,2,0,0,0,0|2,0,0]=4 2095 B7R0.2 CC[C@H](N)CN(C)C MCULE-5607250734 [0,2,0,0,0,0|2,0,0]=4 2096 B7R0.2 CNC(C)CC(C)C MCULE-4458579180 [0,2,0,0,0,0|2,0,0]=4 2097 B7R0.2 CNC(C)CC(C)C MCULE-9768203107 [0,2,0,0,0,0|2,0,0]=4 2098 B7R0.2 CNC(C)CS(=O)C MCULE-5598071425 [0,2,0,0,0,0|1,1,0]=4 2099 B7R0.2 COC(=N)CC(C)C MCULE-4603041381 [0,2,0,0,0,0|1,0,1]=4 2100 B7R0.2 COC(=N)CC(C)C MCULE-5838686710 [0,2,0,0,0,0|1,0,1]=4 2101 B7R0.2 COC(=O)CC(=O)C MCULE-1265364784 [0,2,0,0,0,0|1,0,1]=4 2102 B7R0.2 COC(=O)CC(C)Br MCULE-4193147778 [0,2,0,0,0,0|1,0,1]=4 2103 B7R0.2 COC(=O)CC(C)C MCULE-2808202854 [0,2,0,0,0,0|1,0,1]=4 2104 B7R0.2 COC(=O)CC(C)Cl MCULE-2734734940 [0,2,0,0,0,0|1,0,1]=4 2105 B7R0.2 COC(=O)CC(C)N MCULE-2402304310 [0,2,0,0,0,0|1,0,1]=4 2106 B7R0.2 COC(=O)CC(C)N MCULE-3520358398 [0,2,0,0,0,0|1,0,1]=4 2107 B7R0.2 COC(=O)CC(C)N MCULE-4044567169 [0,2,0,0,0,0|1,0,1]=4 2108 B7R0.2 COC(=O)CC(C)N MCULE-5962991844 [0,2,0,0,0,0|1,0,1]=4 2109 B7R0.2 COC(=O)CC(C)O MCULE-7542131760 [0,2,0,0,0,0|1,0,1]=4 2110 B7R0.2 COC(=O)CC(C)O MCULE-7559608260 [0,2,0,0,0,0|1,0,1]=4 2111 B7R0.2 COC(=O)CC(C)S MCULE-8423856471 [0,2,0,0,0,0|1,0,1]=4 2112 B7R0.2 COC(=O)CN(C)C MCULE-2035644817 [0,2,0,0,0,0|1,0,1]=4 2113 B7R0.2 COC(=O)CN(C)C MCULE-2356820620 [0,2,0,0,0,0|1,0,1]=4 2114 B7R0.2 COC(=O)CS(=O)C MCULE-6286293391 [0,2,0,0,0,0|0,1,1]=4 2115 B7R0.2 COC(=O)C[C@@H](C)N MCULE-1483636974 [0,2,0,0,0,0|1,0,1]=4 2116 B7R0.2 COC(=O)C[C@@H](C)N MCULE-4260923997 [0,2,0,0,0,0|1,0,1]=4 2117 B7R0.2 COC(=O)C[C@@H](C)N MCULE-6569883717 [0,2,0,0,0,0|1,0,1]=4 2118 B7R0.2 COC(=O)C[C@@H](C)N MCULE-9853158708 [0,2,0,0,0,0|1,0,1]=4 2119 B7R0.2 COC(=O)C[C@@H](C)O MCULE-1647366037 [0,2,0,0,0,0|1,0,1]=4 2120 B7R0.2 COC(=O)C[C@@H](C)O MCULE-7832771936 [0,2,0,0,0,0|1,0,1]=4 2121 B7R0.2 COC(=O)C[C@H](C)N MCULE-1385999778 [0,2,0,0,0,0|1,0,1]=4 2122 B7R0.2 COC(=O)C[C@H](C)N MCULE-1446150641 [0,2,0,0,0,0|1,0,1]=4 2123 B7R0.2 COC(=O)C[C@H](C)N MCULE-2979603570 [0,2,0,0,0,0|1,0,1]=4 2124 B7R0.2 COC(=O)C[C@H](C)N MCULE-7679126750 [0,2,0,0,0,0|1,0,1]=4 2125 B7R0.2 COC(=O)C[C@H](C)O MCULE-5154734951 [0,2,0,0,0,0|1,0,1]=4 2126 B7R0.2 COC(=O)C[C@H](C)O MCULE-7031738180 [0,2,0,0,0,0|1,0,1]=4 2127 B7R0.2 COC(C)CC(=O)O MCULE-7063015720 [0,2,0,0,0,0|2,0,0]=4 2128 B7R0.2 COC(C)CC(C)O MCULE-3635789827 [0,2,0,0,0,0|1,0,0]=3 2129 B7R0.3 C#CCCC(=O)OC MCULE-8778440511 [0,2,0,0,0,0|1,0,1]=4 2130 B7R0.3 C/C=C/CC(=O)OC MCULE-7204157194 [0,2,0,0,0,0|1,0,1]=4 2131 B7R0.3 C=C(CC)CCCC MCULE-5118701402 [0,2,0,0,0,0|2,0,0]=4 2132 B7R0.3 C=C(CCl)OCOC MCULE-3049043061 [0,2,0,0,0,0|2,0,0]=4 2133 B7R0.3 C=CCCC(=O)OC MCULE-8671478952 [0,2,0,0,0,0|1,0,1]=4 2134 B7R0.3 C=CCCC(=S)OC MCULE-4709907145 [0,2,0,0,0,0|1,0,1]=4 2135 B7R0.3 CC#CCC(=O)OC MCULE-4727663716 [0,2,0,0,0,0|1,0,1]=4 2136 B7R0.3 CC#CCC(O)CC MCULE-3474605709 [0,2,0,0,0,0|2,0,0]=4 2137 B7R0.3 CC=CCC(=O)OC MCULE-9658428283 [0,2,0,0,0,0|1,0,1]=4 2138 B7R0.3 CC=CCC(C)CC MCULE-4817855750 [0,2,0,0,0,0|2,0,0]=4 2139 B7R0.3 CCC(=O)OCOC MCULE-8101176829 [0,2,0,0,0,0|1,0,1]=4 2140 B7R0.3 CCC(C)CCCO MCULE-2323419626 [0,2,0,0,0,0|2,0,0]=4 2141 B7R0.3 CCC(Cl)CCCCl MCULE-6770226574 [0,2,0,0,0,0|2,0,0]=4 2142 B7R0.3 CCC(N)CCCO MCULE-3868205501 [0,2,0,0,0,0|2,0,0]=4 2143 B7R0.3 CCC(N)CCOC MCULE-8279767210 [0,2,0,0,0,0|1,0,0]=3 2144 B7R0.3 CCC(O)CCCN MCULE-1491163174 [0,2,0,0,0,0|2,0,0]=4 2145 B7R0.3 CCC(O)CCCN MCULE-5150508895 [0,2,0,0,0,0|2,0,0]=4 2146 B7R0.3 CCC(O)CCCO MCULE-1099760826 [0,2,0,0,0,0|2,0,0]=4 2147 B7R0.3 CCC(O)CCOC MCULE-1245099360 [0,2,0,0,0,0|1,0,0]=3 2148 B7R0.3 CCCCC(=N)OC MCULE-3917139857 [0,2,0,0,0,0|1,0,0]=3 2149 B7R0.3 CCCCC(=N)OC MCULE-8394549097 [0,2,0,0,0,0|1,0,0]=3 2150 B7R0.3 CCCCC(=NO)C MCULE-8239265636 [0,2,0,0,0,0|2,0,0]=4 2151 B7R0.3 CCCCC(=O)CBr MCULE-5866288227 [0,2,0,0,0,0|2,0,0]=4 2152 B7R0.3 CCCCC(=O)CC MCULE-7758340382 [0,2,0,0,0,0|2,0,0]=4 2153 B7R0.3 CCCCC(=O)CCl MCULE-9673190063 [0,2,0,0,0,0|2,0,0]=4 2154 B7R0.3 CCCCC(=O)NC MCULE-6810865419 [0,2,0,0,0,0|2,0,0]=4 2155 B7R0.3 CCCCC(=O)OC MCULE-8635651818 [0,2,0,0,0,0|1,0,0]=3 2156 B7R0.3 CCCCC(Br)CBr MCULE-9142273359 [0,2,0,0,0,0|2,0,0]=4 2157 B7R0.3 CCCCC(Br)CC MCULE-3813549657 [0,2,0,0,0,0|2,0,0]=4 2158 B7R0.3 CCCCC(C)CC MCULE-9471981954 [0,2,0,0,0,0|2,0,0]=4 2159 B7R0.3 CCCCC(C)NC MCULE-7492621121 [0,2,0,0,0,0|2,0,0]=4 2160 B7R0.3 CCCCC(Cl)CCl MCULE-6681580076 [0,2,0,0,0,0|2,0,0]=4 2161 B7R0.3 CCCCC(N)CC MCULE-1353863738 [0,2,0,0,0,0|2,0,0]=4 2162 B7R0.3 CCCCC(N)CC MCULE-9870475040 [0,2,0,0,0,0|2,0,0]=4 2163 B7R0.3 CCCCC(N)CN MCULE-2038464943 [0,2,0,0,0,0|2,0,0]=4 2164 B7R0.3 CCCCC(N)CO MCULE-1874423109 [0,2,0,0,0,0|2,0,0]=4 2165 B7R0.3 CCCCC(N)CO MCULE-2041767659 [0,2,0,0,0,0|2,0,0]=4 2166 B7R0.3 CCCCC(N)CO MCULE-4533575851 [0,2,0,0,0,0|2,0,0]=4 2167 B7R0.3 CCCCC(N)CO MCULE-7141990411 [0,2,0,0,0,0|2,0,0]=4 2168 B7R0.3 CCCCC(O)CBr MCULE-8416535559 [0,2,0,0,0,0|2,0,0]=4 2169 B7R0.3 CCCCC(O)CC MCULE-3912386534 [0,2,0,0,0,0|2,0,0]=4 2170 B7R0.3 CCCCC(O)CN MCULE-1383380728 [0,2,0,0,0,0|2,0,0]=4 2171 B7R0.3 CCCCC(O)CO MCULE-6903923961 [0,2,0,0,0,0|2,0,0]=4 2172 B7R0.3 CCCCN(C)CC MCULE-7723007145 [0,2,0,0,0,0|2,0,0]=4 2173 B7R0.3 CCCC[C@@H](N)CO MCULE-1379297850 [0,2,0,0,0,0|2,0,0]=4 2174 B7R0.3 CCCC[C@@H](N)CO MCULE-5016786633 [0,2,0,0,0,0|2,0,0]=4 2175 B7R0.3 CCCC[C@@H](N)CO MCULE-6669873658 [0,2,0,0,0,0|2,0,0]=4 2176 B7R0.3 CCCC[C@@H](N)CO MCULE-6809294141 [0,2,0,0,0,0|2,0,0]=4 2177 B7R0.3 CCCC[C@H](C)C=O MCULE-7821873587 [0,2,0,0,0,0|2,0,0]=4 2178 B7R0.3 CCCC[C@H](N)CO MCULE-3277509271 [0,2,0,0,0,0|2,0,0]=4 2179 B7R0.3 CCCC[C@H](N)CO MCULE-5867397890 [0,2,0,0,0,0|2,0,0]=4 2180 B7R0.3 CCCNC(C)CC MCULE-8533643430 [0,2,0,0,0,0|2,0,0]=4 2181 B7R0.3 CCCOC(=O)OC MCULE-7254829881 [0,2,0,0,0,0|1,0,1]=4 2182 B7R0.3 CCN(C)CCNC MCULE-3001815120 [0,2,0,0,0,0|2,0,0]=4 2183 B7R0.3 CCNCC(=O)OC MCULE-7988488004 [0,2,0,0,0,0|1,0,1]=4 2184 B7R0.3 CCNCC(=O)OC MCULE-9483901468 [0,2,0,0,0,0|1,0,1]=4 2185 B7R0.3 CCNCC(C)CC MCULE-8768620428 [0,2,0,0,0,0|2,0,0]=4 2186 B7R0.3 CCNCC(C)CC MCULE-9491990692 [0,2,0,0,0,0|2,0,0]=4 2187 B7R0.3 CCNCC(C)OC MCULE-9115511555 [0,2,0,0,0,0|1,0,0]=3 2188 B7R0.3 CCNCC(N)NC MCULE-1380874674 [0,2,0,0,0,0|2,0,0]=4 2189 B7R0.3 CCNCC(O)CC MCULE-9820144398 [0,2,0,0,0,0|2,0,0]=4 2190 B7R0.3 CCOCC(=O)OC MCULE-5158396979 [0,2,0,0,0,0|0,0,1]=3 2191 B7R0.3 CCOCC(C)CO MCULE-6831759423 [0,2,0,0,0,0|2,0,0]=4 2192 B7R0.3 CCOCC(N)CC MCULE-2793834769 [0,2,0,0,0,0|1,0,0]=3 2193 B7R0.3 CCOCC(N)CC MCULE-5142543434 [0,2,0,0,0,0|1,0,0]=3 2194 B7R0.3 CCOCC(N)CO MCULE-8546500751 [0,2,0,0,0,0|2,0,0]=4 2195 B7R0.3 CCOCC(O)CCl MCULE-5119359541 [0,2,0,0,0,0|2,0,0]=4 2196 B7R0.3 CCOCC(O)CN MCULE-2355759727 [0,2,0,0,0,0|2,0,0]=4 2197 B7R0.3 CCOCC(O)CO MCULE-2728952355 [0,2,0,0,0,0|2,0,0]=4 2198 B7R0.3 CCSCC(=O)OC MCULE-2538182357 [0,2,0,0,0,0|0,1,1]=4 2199 B7R0.3 CCSCC(C)NC MCULE-6245105657 [0,2,0,0,0,0|1,1,0]=4 2200 B7R0.3 CC[C@H](C)CCCO MCULE-1760153718 [0,2,0,0,0,0|2,0,0]=4 2201 B7R0.3 CC[C@H](C)CCCO MCULE-3488695651 [0,2,0,0,0,0|2,0,0]=4 2202 B7R0.3 CNC(=O)CCOC MCULE-1263122933 [0,2,0,0,0,0|1,0,0]=3 2203 B7R0.3 CNC(C)CCSC MCULE-2095620023 [0,2,0,0,0,0|1,1,0]=4 2204 B7R0.3 CNCCC(=O)NC MCULE-1793457920 [0,2,0,0,0,0|2,0,0]=4 2205 B7R0.3 CNCCC(=O)NC MCULE-7089073664 [0,2,0,0,0,0|2,0,0]=4 2206 B7R0.3 CNCCC(=O)OC MCULE-5657949377 [0,2,0,0,0,0|1,0,0]=3 2207 B7R0.3 CNCCC(=O)OC MCULE-9145127599 [0,2,0,0,0,0|1,0,0]=3 2208 B7R0.3 CNOCC(=O)OC MCULE-1491246414 [0,2,0,0,0,0|0,0,1]=3 2209 B7R0.3 CNOCC(=O)OC MCULE-2119135006 [0,2,0,0,0,0|0,0,1]=3 2210 B7R0.3 CO/C=C/C(=O)OC MCULE-8858181328 [0,2,0,0,0,0|0,0,2]=4 2211 B7R0.3 COC(=N)CCCCl MCULE-3704020642 [0,2,0,0,0,0|1,0,1]=4 2212 B7R0.3 COC(=N)CCCCl MCULE-6282500757 [0,2,0,0,0,0|1,0,1]=4 2213 B7R0.3 COC(=O)CCC#N MCULE-3476013569 [0,2,0,0,0,0|2,0,0]=4 2214 B7R0.3 COC(=O)CCC=O MCULE-2572188002 [0,2,0,0,0,0|2,0,0]=4 2215 B7R0.3 COC(=O)CCCBr MCULE-3856139347 [0,2,0,0,0,0|1,0,1]=4 2216 B7R0.3 COC(=O)CCCCl MCULE-9725150748 [0,2,0,0,0,0|1,0,1]=4 2217 B7R0.3 COC(=O)CCCI MCULE-6607823615 [0,2,0,0,0,0|1,0,1]=4 2218 B7R0.3 COC(=O)CCCN MCULE-2399653885 [0,2,0,0,0,0|1,0,1]=4 2219 B7R0.3 COC(=O)CCCN MCULE-7745643244 [0,2,0,0,0,0|1,0,1]=4 2220 B7R0.3 COC(=O)CCCO MCULE-6149839873 [0,2,0,0,0,0|1,0,1]=4 2221 B7R0.3 COC(=O)CCCS MCULE-6897052882 [0,2,0,0,0,0|1,0,1]=4 2222 B7R0.3 COC(=O)CCSC MCULE-8525618169 [0,2,0,0,0,0|0,1,0]=3 2223 B7R0.3 COC=CC(=O)OC MCULE-3167643214 [0,2,0,0,0,0|0,0,2]=4 2224 B7R0.3 COCC/C(=N\O)/N MCULE-3175892655 [0,2,0,0,0,0|2,0,0]=4 2225 B7R0.3 COCC/C(=N\O)/N MCULE-8002911611 [0,2,0,0,0,0|2,0,0]=4 2226 B7R0.3 COCCC(=O)CCl MCULE-2918704994 [0,2,0,0,0,0|1,0,0]=3 2227 B7R0.3 COCCC(=O)NN MCULE-6895114863 [0,2,0,0,0,0|2,0,0]=4 2228 B7R0.3 COCCC(=O)OC MCULE-5918489580 [0,2,0,0,0,0|0,0,0]=2 2229 B7R0.3 COCCC(C)CN MCULE-7288397543 [0,2,0,0,0,0|1,0,0]=3 2230 B7R0.3 COCCC(N)CO MCULE-9758817920 [0,2,0,0,0,0|1,0,0]=3 2231 B7R0.3 COCOC(C)CO MCULE-5033492685 [0,2,0,0,0,0|2,0,0]=4 2232 B7R0.3 COCO[C@@H](C)CO MCULE-2279257941 [0,2,0,0,0,0|2,0,0]=4 2233 B7R0.3 COCO[C@H](C)CO MCULE-6639618074 [0,2,0,0,0,0|2,0,0]=4 2234 B7R0.3 COCO[C@H](C)CO MCULE-9421136678 [0,2,0,0,0,0|2,0,0]=4 2235 B7R0.3 CSCCC(N)CO MCULE-1688371230 [0,2,0,0,0,0|1,1,0]=4 2236 B7R0.3 CSCCC(O)CN MCULE-3835830442 [0,2,0,0,0,0|1,1,0]=4 2237 B7R0.3 CSCC[C@@H](N)CO MCULE-2764794918 [0,2,0,0,0,0|1,1,0]=4 2238 B7R0.3 CSCC[C@@H](N)CO MCULE-7120101109 [0,2,0,0,0,0|1,1,0]=4 2239 B7R0.3 CSCC[C@H](N)CN MCULE-6460179286 [0,2,0,0,0,0|1,1,0]=4 2240 B7R0.3 CSCC[C@H](N)CO MCULE-6014525130 [0,2,0,0,0,0|1,1,0]=4 2241 B7R0.3 CSCC[C@H](N)CO MCULE-9216326176 [0,2,0,0,0,0|1,1,0]=4 2242 B7R0.5 CCCC(Br)C(=O)C MCULE-2062903416 [0,2,0,0,0,0|2,0,0]=4 2243 B7R0.5 CCCC(Br)C(C)Br MCULE-4740207556 [0,2,0,0,0,0|2,0,0]=4 2244 B7R0.5 CCCC(C)C(=O)C MCULE-5585795289 [0,2,0,0,0,0|2,0,0]=4 2245 B7R0.5 CCCC(C)C(C)C MCULE-1008931357 [0,2,0,0,0,0|2,0,0]=4 2246 B7R0.5 CCCC(C)C(C)N MCULE-3555650010 [0,2,0,0,0,0|2,0,0]=4 2247 B7R0.5 CCCC(C)C(C)N MCULE-8637319249 [0,2,0,0,0,0|2,0,0]=4 2248 B7R0.5 CCCC(C)C(C)O MCULE-3222709632 [0,2,0,0,0,0|2,0,0]=4 2249 B7R0.5 CCCC(O)C(C)C MCULE-8942406791 [0,2,0,0,0,0|2,0,0]=4 2250 B7R0.5 CNCC(N)C(C)C MCULE-6535124409 [0,2,0,0,0,0|2,0,0]=4 2251 B7R0.5 COCC(=O)C(C)C MCULE-8251961368 [0,2,0,0,0,0|1,0,1]=4 2252 B7R0.5 COCC(=O)N(C)C MCULE-4175778673 [0,2,0,0,0,0|1,0,1]=4 2253 B7R0.5 COCC(Br)C(=O)O MCULE-2977381282 [0,2,0,0,0,0|2,0,0]=4 2254 B7R0.5 COCC(C)C(=O)C MCULE-5328927786 [0,2,0,0,0,0|1,0,0]=3 2255 B7R0.5 COCC(C)C(=O)O MCULE-9776415948 [0,2,0,0,0,0|2,0,0]=4 2256 B7R0.5 COCC(C)C(=S)N MCULE-6392999047 [0,2,0,0,0,0|2,0,0]=4 2257 B7R0.5 COCC(C)C(C)N MCULE-6465669754 [0,2,0,0,0,0|1,0,0]=3 2258 B7R0.5 COCC(Cl)C(=O)O MCULE-1439107016 [0,2,0,0,0,0|2,0,0]=4 2259 B7R0.5 COCC(N)C(=O)N MCULE-2465830538 [0,2,0,0,0,0|2,0,0]=4 2260 B7R0.5 COCC(N)C(=O)N MCULE-6194410780 [0,2,0,0,0,0|2,0,0]=4 2261 B7R0.5 COCC(N)C(=O)O MCULE-4336440568 [0,2,0,0,0,0|2,0,0]=4 2262 B7R0.5 COCC(N)C(=O)O MCULE-4899043582 [0,2,0,0,0,0|2,0,0]=4 2263 B7R0.5 COCC(N)C(=O)O MCULE-6964823693 [0,2,0,0,0,0|2,0,0]=4 2264 B7R0.5 COCC(N)C(=O)O MCULE-7037870255 [0,2,0,0,0,0|2,0,0]=4 2265 B7R0.5 COCC(N)C(C)C MCULE-4185259512 [0,2,0,0,0,0|1,0,0]=3 2266 B7R0.5 COCC(N)C(C)C MCULE-6424539237 [0,2,0,0,0,0|1,0,0]=3 2267 B7R0.5 COCC(O)C(=O)O MCULE-3185498869 [0,2,0,0,0,0|2,0,0]=4 2268 B7R0.5 COCC(O)C(C)C MCULE-3818851772 [0,2,0,0,0,0|1,0,0]=3 2269 B7R0.5 COC[C@@H](N)C(=O)O MCULE-1827086666 [0,2,0,0,0,0|2,0,0]=4 2270 B7R0.5 COC[C@@H](N)C(=O)O MCULE-4868456769 [0,2,0,0,0,0|2,0,0]=4 2271 B7R0.5 COC[C@@H](N)C(=O)O MCULE-5275247485 [0,2,0,0,0,0|2,0,0]=4 2272 B7R0.5 COC[C@@H](N)C(=O)O MCULE-7339751251 [0,2,0,0,0,0|2,0,0]=4 2273 B7R0.5 COC[C@@H](N)C(C)C MCULE-2081062888 [0,2,0,0,0,0|1,0,0]=3 2274 B7R0.5 COC[C@@H](N)C(C)C MCULE-3286077946 [0,2,0,0,0,0|1,0,0]=3 2275 B7R0.5 COC[C@@H](N)C(C)C MCULE-3882144478 [0,2,0,0,0,0|1,0,0]=3 2276 B7R0.5 COC[C@H](N)C(=O)O MCULE-3719679803 [0,2,0,0,0,0|2,0,0]=4 2277 B7R0.5 COC[C@H](N)C(=O)O MCULE-4874807874 [0,2,0,0,0,0|2,0,0]=4 2278 B7R0.5 COC[C@H](N)C(=O)O MCULE-5303156917 [0,2,0,0,0,0|2,0,0]=4 2279 B7R0.5 COC[C@H](N)C(=O)O MCULE-8138564560 [0,2,0,0,0,0|2,0,0]=4 2280 B7R0.5 COC[C@H](N)C(C)C MCULE-3191900867 [0,2,0,0,0,0|1,0,0]=3 2281 B7R0.5 COC[C@H](N)C(C)C MCULE-3410691563 [0,2,0,0,0,0|1,0,0]=3 2282 B7R0.7 C#CCC(N)COC MCULE-8603079673 [0,2,0,0,0,0|1,0,1]=4 2283 B7R0.7 C#CC[C@@H](O)COC MCULE-5751153207 [0,2,0,0,0,0|1,0,1]=4 2284 B7R0.7 C#CC[C@H](O)COC MCULE-1465786417 [0,2,0,0,0,0|1,0,1]=4 2285 B7R0.7 C=CCC(N)COC MCULE-6306522587 [0,2,0,0,0,0|1,0,1]=4 2286 B7R0.7 CC=CC(O)CCC MCULE-2375824505 [0,2,0,0,0,0|2,0,0]=4 2287 B7R0.7 CCCC(=N)OCC MCULE-5551107242 [0,2,0,0,0,0|1,0,1]=4 2288 B7R0.7 CCCC(=N)OCC MCULE-7790310067 [0,2,0,0,0,0|1,0,1]=4 2289 B7R0.7 CCCC(=O)CCC MCULE-1621649928 [0,2,0,0,0,0|2,0,0]=4 2290 B7R0.7 CCCC(=O)OCC MCULE-9977024136 [0,2,0,0,0,0|1,0,1]=4 2291 B7R0.7 CCCC(=O)OCCl MCULE-5186069317 [0,2,0,0,0,0|1,0,1]=4 2292 B7R0.7 CCCC(Br)CCBr MCULE-7954993658 [0,2,0,0,0,0|2,0,0]=4 2293 B7R0.7 CCCC(Br)CCC MCULE-4124374663 [0,2,0,0,0,0|2,0,0]=4 2294 B7R0.7 CCCC(C)CCC MCULE-5291190768 [0,2,0,0,0,0|2,0,0]=4 2295 B7R0.7 CCCC(C)CCO MCULE-6887128167 [0,2,0,0,0,0|2,0,0]=4 2296 B7R0.7 CCCC(C)NCC MCULE-3443551812 [0,2,0,0,0,0|2,0,0]=4 2297 B7R0.7 CCCC(C)NCC MCULE-7227087576 [0,2,0,0,0,0|2,0,0]=4 2298 B7R0.7 CCCC(C)OCC MCULE-2678814077 [0,2,0,0,0,0|1,0,0]=3 2299 B7R0.7 CCCC(N)CCC MCULE-1003038397 [0,2,0,0,0,0|2,0,0]=4 2300 B7R0.7 CCCC(N)CCC MCULE-3454953409 [0,2,0,0,0,0|2,0,0]=4 2301 B7R0.7 CCCC(N)CCO MCULE-3641094890 [0,2,0,0,0,0|2,0,0]=4 2302 B7R0.7 CCCC(N)CCO MCULE-5323991138 [0,2,0,0,0,0|2,0,0]=4 2303 B7R0.7 CCCC(N)CCO MCULE-6597027417 [0,2,0,0,0,0|2,0,0]=4 2304 B7R0.7 CCCC(N)CCO MCULE-8093709628 [0,2,0,0,0,0|2,0,0]=4 2305 B7R0.7 CCCC(O)CCC MCULE-1942797307 [0,2,0,0,0,0|2,0,0]=4 2306 B7R0.7 CCCC(O)CCN MCULE-3796998426 [0,2,0,0,0,0|2,0,0]=4 2307 B7R0.7 CCCC(O)CCO MCULE-6957178966 [0,2,0,0,0,0|2,0,0]=4 2308 B7R0.7 CCCC(S)CCC MCULE-4775274873 [0,2,0,0,0,0|2,0,0]=4 2309 B7R0.7 CCCC(S)CCO MCULE-7972451905 [0,2,0,0,0,0|2,0,0]=4 2310 B7R0.7 CCCN(C)CCC MCULE-9743961087 [0,2,0,0,0,0|2,0,0]=4 2311 B7R0.7 CCC[C@@H](N)CCO MCULE-1862127512 [0,2,0,0,0,0|2,0,0]=4 2312 B7R0.7 CCC[C@@H](N)CCO MCULE-3031366486 [0,2,0,0,0,0|2,0,0]=4 2313 B7R0.7 CCC[C@@H](N)CCO MCULE-4433535200 [0,2,0,0,0,0|2,0,0]=4 2314 B7R0.7 CCC[C@@H](N)CCO MCULE-8325506694 [0,2,0,0,0,0|2,0,0]=4 2315 B7R0.7 CCC[C@H](N)CCO MCULE-3164100995 [0,2,0,0,0,0|2,0,0]=4 2316 B7R0.7 CCC[C@H](N)CCO MCULE-3262978007 [0,2,0,0,0,0|2,0,0]=4 2317 B7R0.7 CCC[C@H](N)CCO MCULE-3382311889 [0,2,0,0,0,0|2,0,0]=4 2318 B7R0.7 CCC[C@H](N)CCO MCULE-4865013919 [0,2,0,0,0,0|2,0,0]=4 2319 B7R0.7 CCNC(C)COC MCULE-3519332383 [0,2,0,0,0,0|1,0,0]=3 2320 B7R0.7 CCNC(C)COC MCULE-9226487666 [0,2,0,0,0,0|1,0,0]=3 2321 B7R0.7 CCOC(=N)COC MCULE-1358920023 [0,2,0,0,0,0|0,0,1]=3 2322 B7R0.7 CCOC(=N)COC MCULE-8494947544 [0,2,0,0,0,0|0,0,1]=3 2323 B7R0.7 CCOC(=O)CNC MCULE-3219895330 [0,2,0,0,0,0|1,0,1]=4 2324 B7R0.7 CCOC(=O)CNC MCULE-6164649520 [0,2,0,0,0,0|1,0,1]=4 2325 B7R0.7 CCOC(=O)COC MCULE-7739678079 [0,2,0,0,0,0|0,0,1]=3 2326 B7R0.7 CCOC(=O)CON MCULE-4924818206 [0,2,0,0,0,0|1,0,1]=4 2327 B7R0.7 CCOC(=O)CSC MCULE-5199209389 [0,2,0,0,0,0|0,1,1]=4 2328 B7R0.7 CCOC(=O)NOC MCULE-2256963329 [0,2,0,0,0,0|1,0,1]=4 2329 B7R0.7 CCOC(C)CNC MCULE-9630095723 [0,2,0,0,0,0|1,0,0]=3 2330 B7R0.7 CCOC(C)OCC MCULE-7152410134 [0,2,0,0,0,0|2,0,0]=4 2331 B7R0.7 CNCC(O)CNC MCULE-3978089543 [0,2,0,0,0,0|2,0,0]=4 2332 B7R0.7 CNCC(O)COC MCULE-8497493216 [0,2,0,0,0,0|1,0,0]=3 2333 B7R0.7 COCC(=CCBr)C MCULE-6258296852 [0,2,0,0,0,0|1,0,1]=4 2334 B7R0.7 COCC(=O)CC#N MCULE-7023614757 [0,2,0,0,0,0|2,0,0]=4 2335 B7R0.7 COCC(=O)COC MCULE-5119511792 [0,2,0,0,0,0|0,0,0]=2 2336 B7R0.7 COCC(Br)COC MCULE-8590528928 [0,2,0,0,0,0|0,0,0]=2 2337 B7R0.7 COCC(C)CC#N MCULE-8156908577 [0,2,0,0,0,0|1,0,1]=4 2338 B7R0.7 COCC(C)CCO MCULE-6812981556 [0,2,0,0,0,0|1,0,0]=3 2339 B7R0.7 COCC(C)N=C=O MCULE-5875044784 [0,2,0,0,0,0|1,0,1]=4 2340 B7R0.7 COCC(C)N=C=S MCULE-1397440898 [0,2,0,0,0,0|1,0,1]=4 2341 B7R0.7 COCC(Cl)COC MCULE-1871071718 [0,2,0,0,0,0|0,0,0]=2 2342 B7R0.7 COCC(N)CCO MCULE-2569422233 [0,2,0,0,0,0|1,0,0]=3 2343 B7R0.7 COCC(N)COC MCULE-3531117264 [0,2,0,0,0,0|0,0,0]=2 2344 B7R0.7 COCC(N)COC MCULE-3609597955 [0,2,0,0,0,0|0,0,0]=2 2345 B7R0.7 COCC(O)CCN MCULE-9524454931 [0,2,0,0,0,0|1,0,0]=3 2346 B7R0.7 COCC(O)COC MCULE-5364514636 [0,2,0,0,0,0|0,0,0]=2 2347 B7R0.7 COCC(O)CON MCULE-3159534337 [0,2,0,0,0,0|1,0,0]=3 2348 B7R0.7 CSCC(N)CCO MCULE-2899374338 [0,2,0,0,0,0|1,1,0]=4 2349 B7R0.10 C=C(OC)C(=O)OC MCULE-3256769494 [0,2,0,0,0,0|0,0,2]=4 2350 B7R0.10 CCC(Br)C(=O)OC MCULE-2335527491 [0,2,0,0,0,0|1,0,1]=4 2351 B7R0.10 CCC(C)C(=O)OC MCULE-9845747952 [0,2,0,0,0,0|1,0,1]=4 2352 B7R0.10 CCC(C)C(C)CC MCULE-8164178184 [0,2,0,0,0,0|2,0,0]=4 2353 B7R0.10 CCC(C)C(O)CC MCULE-3936368693 [0,2,0,0,0,0|2,0,0]=4 2354 B7R0.10 CCC(Cl)C(=O)OC MCULE-4773486285 [0,2,0,0,0,0|1,0,1]=4 2355 B7R0.10 CCC(N)C(=O)OC MCULE-1569242271 [0,2,0,0,0,0|1,0,1]=4 2356 B7R0.10 CCC(N)C(=O)OC MCULE-3183954116 [0,2,0,0,0,0|1,0,1]=4 2357 B7R0.10 CCC(N)C(=O)OC MCULE-4045754117 [0,2,0,0,0,0|1,0,1]=4 2358 B7R0.10 CCC(N)C(=O)OC MCULE-5328984047 [0,2,0,0,0,0|1,0,1]=4 2359 B7R0.10 CCC(N)C(O)CC MCULE-3578258801 [0,2,0,0,0,0|2,0,0]=4 2360 B7R0.10 CCC(O)C(=O)OC MCULE-8768500574 [0,2,0,0,0,0|1,0,1]=4 2361 B7R0.10 CC[C@@H](Br)C(=O)OC MCULE-2676798410 [0,2,0,0,0,0|1,0,1]=4 2362 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-6794991435 [0,2,0,0,0,0|1,0,1]=4 2363 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-6825672331 [0,2,0,0,0,0|1,0,1]=4 2364 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-7307663817 [0,2,0,0,0,0|1,0,1]=4 2365 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-8717527808 [0,2,0,0,0,0|1,0,1]=4 2366 B7R0.10 CC[C@@H](O)C(=O)OC MCULE-6916010003 [0,2,0,0,0,0|1,0,1]=4 2367 B7R0.10 CC[C@@H](O)C(=O)OC MCULE-9376722018 [0,2,0,0,0,0|1,0,1]=4 2368 B7R0.10 CC[C@H](Br)C(=O)OC MCULE-5490793206 [0,2,0,0,0,0|1,0,1]=4 2369 B7R0.10 CC[C@H](N)C(=O)OC MCULE-2336816190 [0,2,0,0,0,0|1,0,1]=4 2370 B7R0.10 CC[C@H](N)C(=O)OC MCULE-3480066740 [0,2,0,0,0,0|1,0,1]=4 2371 B7R0.10 CC[C@H](N)C(=O)OC MCULE-4883083558 [0,2,0,0,0,0|1,0,1]=4 2372 B7R0.10 CC[C@H](N)C(=O)OC MCULE-6241184216 [0,2,0,0,0,0|1,0,1]=4 2373 B7R0.10 CC[C@H](O)C(=O)OC MCULE-5873092635 [0,2,0,0,0,0|1,0,1]=4 2374 B7R0.10 CC[C@H](O)C(=O)OC MCULE-8209874812 [0,2,0,0,0,0|1,0,1]=4 2375 B7R0.10 CNC(C)C(=O)OC MCULE-1524259113 [0,2,0,0,0,0|1,0,1]=4 2376 B7R0.10 CNC(C)C(=O)OC MCULE-2414146201 [0,2,0,0,0,0|1,0,1]=4 2377 B7R0.10 CNC(C)C(=O)OC MCULE-3192973771 [0,2,0,0,0,0|1,0,1]=4 2378 B7R0.10 CNC(C)C(=O)OC MCULE-9929257431 [0,2,0,0,0,0|1,0,1]=4 2379 B7R0.10 CN[C@@H](C)C(=O)OC MCULE-1271745038 [0,2,0,0,0,0|1,0,1]=4 2380 B7R0.10 CN[C@@H](C)C(=O)OC MCULE-3018199319 [0,2,0,0,0,0|1,0,1]=4 2381 B7R0.10 CN[C@H](C)C(=O)OC MCULE-3420184809 [0,2,0,0,0,0|1,0,1]=4 2382 B7R0.10 CN[C@H](C)C(=O)OC MCULE-3818454089 [0,2,0,0,0,0|1,0,1]=4 2383 B7R0.10 CN[C@H](C)C(=O)OC MCULE-8297775033 [0,2,0,0,0,0|1,0,1]=4 2384 B7R0.10 CN[C@H](C)C(=O)OC MCULE-9637759835 [0,2,0,0,0,0|1,0,1]=4 2385 B7R0.10 COC(=O)C(=O)OC MCULE-5018268642 [0,2,0,0,0,0|0,0,2]=4 2386 B7R0.10 COC(=O)C(Br)OC MCULE-5672396067 [0,2,0,0,0,0|0,0,1]=3 2387 B7R0.10 COC(=O)C(C)OC MCULE-3274761391 [0,2,0,0,0,0|0,0,1]=3 2388 B7R0.10 COC(=O)C(C)ON MCULE-1829014190 [0,2,0,0,0,0|1,0,1]=4 2389 B7R0.10 COC(=O)C(C)ON MCULE-4104938309 [0,2,0,0,0,0|1,0,1]=4 2390 B7R0.10 COC(=O)C(C)SC MCULE-6914204626 [0,2,0,0,0,0|0,1,1]=4 2391 B7R0.10 COC(=O)C(Cl)OC MCULE-8296320773 [0,2,0,0,0,0|0,0,1]=3 2392 B7R0.10 COC(=O)C(O)OC MCULE-5465190164 [0,2,0,0,0,0|0,0,1]=3 2393 B7R0.10 COC(=O)[C@H](C)OC MCULE-3095326114 [0,2,0,0,0,0|0,0,1]=3 2394 B7R0.10 COC(C)C(O)C#N MCULE-7134393596 [0,2,0,0,0,0|2,0,0]=4 2395 B7R0.10 COC(Cl)C(Cl)OC MCULE-4404338670 [0,2,0,0,0,0|0,0,0]=2 2396 B7R0.10 [C@@H](C)(NC)C(=O)OC MCULE-1799930850 [0,2,0,0,0,0|1,0,1]=4 2397 B7R0.10 [C@@H](C)(NC)C(=O)OC MCULE-5931188957 [0,2,0,0,0,0|1,0,1]=4 2398 B7R0.11 C#CC(C)(O)COC MCULE-1647227373 [0,2,0,0,0,0|1,0,1]=4 2399 B7R0.11 CCCC(C)(C)CC MCULE-6673337989 [0,2,0,0,0,0|2,0,0]=4 2400 B7R0.11 CCCC(C)(O)CC MCULE-9155096022 [0,2,0,0,0,0|2,0,0]=4 2401 B7R0.11 CCC[Si](C)(C)OC MCULE-9871586607 [0,2,0,0,0,0|1,1,0]=4 2402 B7R0.11 CNC(C)(C)COC MCULE-2651000110 [0,2,0,0,0,0|1,0,0]=3 2403 B7R0.11 CNC(C)(C)COC MCULE-7557622880 [0,2,0,0,0,0|1,0,0]=3 2404 B7R0.11 COC(C)(C)CC=O MCULE-7442199663 [0,2,0,0,0,0|2,0,0]=4 2405 B7R0.11 COC(C)(C)CCBr MCULE-4991560289 [0,2,0,0,0,0|2,0,0]=4 2406 B7R0.11 COC(C)(C)CCN MCULE-7302419141 [0,2,0,0,0,0|2,0,0]=4 2407 B7R0.11 COC(C)(C)CCN MCULE-8717421395 [0,2,0,0,0,0|2,0,0]=4 2408 B7R0.11 COC(C)(C)CCO MCULE-4448949329 [0,2,0,0,0,0|2,0,0]=4 2409 B7R0.11 COCC(C)(C)C#N MCULE-9099540228 [0,2,0,0,0,0|2,0,0]=4 2410 B7R0.11 COCC(C)(C)C=O MCULE-9091298674 [0,2,0,0,0,0|2,0,0]=4 2411 B7R0.11 COCC(C)(C)CBr MCULE-2591763859 [0,2,0,0,0,0|2,0,0]=4 2412 B7R0.11 COCC(C)(C)CN MCULE-6321252323 [0,2,0,0,0,0|2,0,0]=4 2413 B7R0.11 COCC(C)(C)CN MCULE-8662870324 [0,2,0,0,0,0|2,0,0]=4 2414 B7R0.11 COCC(C)(C)CO MCULE-2985367717 [0,2,0,0,0,0|2,0,0]=4 2415 B7R0.11 COCC(C)(N)C#N MCULE-4779930875 [0,2,0,0,0,0|2,0,0]=4 2416 B7R0.11 COCC(C)(N)CN MCULE-1467574919 [0,2,0,0,0,0|2,0,0]=4 2417 B7R0.11 COCC(C)(N)CO MCULE-2603485329 [0,2,0,0,0,0|2,0,0]=4 2418 B7R0.11 COCC(C)(N)CO MCULE-3416999559 [0,2,0,0,0,0|2,0,0]=4 2419 B7R0.11 COCC(C)(O)CN MCULE-8403551049 [0,2,0,0,0,0|2,0,0]=4 2420 B7R0.11 COCC(C)(O)CN MCULE-8479817538 [0,2,0,0,0,0|2,0,0]=4 2421 B7R0.11 COCC(F)(F)CO MCULE-7603400715 [0,2,0,0,0,0|2,0,0]=4 2422 B7R0.12 C#CCC(OC)OC MCULE-9235771006 [0,2,0,0,0,0|1,0,1]=4 2423 B7R0.12 CCC(CC)CON MCULE-6366873843 [0,2,0,0,0,0|2,0,0]=4 2424 B7R0.12 CCC(CSC)NC MCULE-6079897043 [0,2,0,0,0,0|1,1,0]=4 2425 B7R0.12 CCCC(C#N)NC MCULE-1865924335 [0,2,0,0,0,0|2,0,0]=4 2426 B7R0.12 CCCC(C#N)NC MCULE-4445984378 [0,2,0,0,0,0|2,0,0]=4 2427 B7R0.12 CCCC(C#N)OC MCULE-8004262029 [0,2,0,0,0,0|1,0,0]=3 2428 B7R0.12 CCCC(CN)OC MCULE-6456891707 [0,2,0,0,0,0|1,0,0]=3 2429 B7R0.12 CCCC(CO)OC MCULE-9427398002 [0,2,0,0,0,0|1,0,0]=3 2430 B7R0.12 CCCC(OC)OC MCULE-9755419351 [0,2,0,0,0,0|1,0,0]=3 2431 B7R0.12 CCN(CC)COC MCULE-7233086011 [0,2,0,0,0,0|2,0,0]=4 2432 B7R0.12 CNCC(OC)OC MCULE-4492281270 [0,2,0,0,0,0|1,0,0]=3 2433 B7R0.12 COC(C#N)CCN MCULE-5270955180 [0,2,0,0,0,0|2,0,0]=4 2434 B7R0.12 COC(CC#N)OC MCULE-8575138747 [0,2,0,0,0,0|2,0,0]=4 2435 B7R0.12 COC(CCBr)OC MCULE-4690008517 [0,2,0,0,0,0|2,0,0]=4 2436 B7R0.12 COC(CCCl)OC MCULE-1101836062 [0,2,0,0,0,0|2,0,0]=4 2437 B7R0.12 COC(CN)CCN MCULE-6044078562 [0,2,0,0,0,0|2,0,0]=4 2438 B7R0.12 COC(CNN)OC MCULE-2781245077 [0,2,0,0,0,0|2,0,0]=4 2439 B7R0.12 COC(CO)CCN MCULE-1177905249 [0,2,0,0,0,0|2,0,0]=4 2440 B7R0.12 COC(CSC)OC MCULE-7367035915 [0,2,0,0,0,0|0,1,0]=3 2441 B7R0.12 COCC(C#N)OC MCULE-4608647789 [0,2,0,0,0,0|0,0,0]=2 2442 B7R0.12 COCC(CBr)OC MCULE-9551672317 [0,2,0,0,0,0|0,0,0]=2 2443 B7R0.12 COCC(CN)OC MCULE-4660699329 [0,2,0,0,0,0|0,0,0]=2 2444 B7R0.12 COCC(CO)OC MCULE-6775038884 [0,2,0,0,0,0|0,0,0]=2 2445 B7R0.12 COCC(OC)OC MCULE-1839791643 [0,2,0,0,0,0|0,0,0]=2 2446 B7R0.12 COC[C@@H](CO)OC MCULE-7098934437 [0,2,0,0,0,0|0,0,0]=2 2447 B7R0.12 COC[C@H](CN)OC MCULE-7911151873 [0,2,0,0,0,0|0,0,0]=2 2448 B7R0.4 C/C=C/COC(=O)C MCULE-4948306153 [0,2,0,0,0,0|1,0,1]=4 2449 B7R0.4 C=C(C)CCC=CC MCULE-7970794651 [0,2,0,0,0,0|2,0,0]=4 2450 B7R0.4 C=C(C)CCCCC MCULE-6108413722 [0,2,0,0,0,0|2,0,0]=4 2451 B7R0.4 C=CCCOC(=O)C MCULE-4554969214 [0,2,0,0,0,0|1,0,1]=4 2452 B7R0.4 C=COCCN(C)C MCULE-5557000118 [0,2,0,0,0,0|1,0,1]=4 2453 B7R0.4 CC(=O)CCCCBr MCULE-8801446022 [0,2,0,0,0,0|2,0,0]=4 2454 B7R0.4 CC(=O)CCCCCl MCULE-2883443563 [0,2,0,0,0,0|2,0,0]=4 2455 B7R0.4 CC(=O)CCCCO MCULE-9846338144 [0,2,0,0,0,0|2,0,0]=4 2456 B7R0.4 CC(=O)NCCON MCULE-3703048482 [0,2,0,0,0,0|2,0,0]=4 2457 B7R0.4 CC(=O)OCCCBr MCULE-4735159476 [0,2,0,0,0,0|2,0,0]=4 2458 B7R0.4 CC(=O)OCCCCl MCULE-4801419214 [0,2,0,0,0,0|2,0,0]=4 2459 B7R0.4 CC(=O)OCCCI MCULE-5830086336 [0,2,0,0,0,0|2,0,0]=4 2460 B7R0.4 CC(=O)OCCCO MCULE-1423430948 [0,2,0,0,0,0|2,0,0]=4 2461 B7R0.4 CC(=O)OCCCS MCULE-2576827025 [0,2,0,0,0,0|2,0,0]=4 2462 B7R0.4 CC(Br)CCCCO MCULE-2106751856 [0,2,0,0,0,0|2,0,0]=4 2463 B7R0.4 CC(C)CCCCBr MCULE-9236389539 [0,2,0,0,0,0|2,0,0]=4 2464 B7R0.4 CC(C)CCCCCl MCULE-5223516486 [0,2,0,0,0,0|2,0,0]=4 2465 B7R0.4 CC(C)CCCCN MCULE-3591523204 [0,2,0,0,0,0|2,0,0]=4 2466 B7R0.4 CC(C)CCCCO MCULE-9053698607 [0,2,0,0,0,0|2,0,0]=4 2467 B7R0.4 CC(C)CCCON MCULE-5299845209 [0,2,0,0,0,0|2,0,0]=4 2468 B7R0.4 CC(C)CCCON MCULE-8643496539 [0,2,0,0,0,0|2,0,0]=4 2469 B7R0.4 CC(C)CCOC=O MCULE-3671444552 [0,2,0,0,0,0|1,0,1]=4 2470 B7R0.4 CC(C)CCON=O MCULE-5177168468 [0,2,0,0,0,0|2,0,0]=4 2471 B7R0.4 CC(C)OCCC#N MCULE-4613636194 [0,2,0,0,0,0|2,0,0]=4 2472 B7R0.4 CC(C)OCCCBr MCULE-6061340501 [0,2,0,0,0,0|2,0,0]=4 2473 B7R0.4 CC(C)OCCCCl MCULE-5339928259 [0,2,0,0,0,0|2,0,0]=4 2474 B7R0.4 CC(C)OCCCN MCULE-6787172017 [0,2,0,0,0,0|2,0,0]=4 2475 B7R0.4 CC(C)OCCCN MCULE-8495001717 [0,2,0,0,0,0|2,0,0]=4 2476 B7R0.4 CC(C)OCCCO MCULE-9280654202 [0,2,0,0,0,0|2,0,0]=4 2477 B7R0.4 CC(C)OCCON MCULE-8218216454 [0,2,0,0,0,0|1,0,0]=3 2478 B7R0.4 CC(Cl)CCCCCl MCULE-4829013540 [0,2,0,0,0,0|2,0,0]=4 2479 B7R0.4 CC(N)CCCCN MCULE-3497267062 [0,2,0,0,0,0|2,0,0]=4 2480 B7R0.4 CC(N)CCCCN MCULE-9887360104 [0,2,0,0,0,0|2,0,0]=4 2481 B7R0.4 CC(N)CCCCO MCULE-7039935081 [0,2,0,0,0,0|2,0,0]=4 2482 B7R0.4 CC(N)CCCCO MCULE-8167834378 [0,2,0,0,0,0|2,0,0]=4 2483 B7R0.4 CC(O)CCCCO MCULE-3790969400 [0,2,0,0,0,0|2,0,0]=4 2484 B7R0.4 CCCCCC(=O)C MCULE-6017828463 [0,2,0,0,0,0|2,0,0]=4 2485 B7R0.4 CCCCCC(C)Br MCULE-4688847972 [0,2,0,0,0,0|2,0,0]=4 2486 B7R0.4 CCCCCC(C)C MCULE-9815158757 [0,2,0,0,0,0|2,0,0]=4 2487 B7R0.4 CCCCCC(C)Cl MCULE-1461261404 [0,2,0,0,0,0|2,0,0]=4 2488 B7R0.4 CCCCCC(C)N MCULE-1307982487 [0,2,0,0,0,0|2,0,0]=4 2489 B7R0.4 CCCCCC(C)N MCULE-8625441795 [0,2,0,0,0,0|2,0,0]=4 2490 B7R0.4 CCCCCC(C)N MCULE-9791654909 [0,2,0,0,0,0|2,0,0]=4 2491 B7R0.4 CCCCCC(C)O MCULE-2463855771 [0,2,0,0,0,0|2,0,0]=4 2492 B7R0.4 CCCCCC(C)S MCULE-3173115736 [0,2,0,0,0,0|2,0,0]=4 2493 B7R0.4 CCCCC[C@@H](C)N MCULE-2460238945 [0,2,0,0,0,0|2,0,0]=4 2494 B7R0.4 CCCCC[C@@H](C)N MCULE-6386771130 [0,2,0,0,0,0|2,0,0]=4 2495 B7R0.4 CCCCC[C@@H](C)N MCULE-6470246577 [0,2,0,0,0,0|2,0,0]=4 2496 B7R0.4 CCCCC[C@@H](C)O MCULE-1984852239 [0,2,0,0,0,0|2,0,0]=4 2497 B7R0.4 CCCCC[C@@H](C)O MCULE-2769933740 [0,2,0,0,0,0|2,0,0]=4 2498 B7R0.4 CCCCC[C@H](C)N MCULE-8119988811 [0,2,0,0,0,0|2,0,0]=4 2499 B7R0.4 CCCCC[C@H](C)N MCULE-9987283826 [0,2,0,0,0,0|2,0,0]=4 2500 B7R0.4 CCCCC[C@H](C)O MCULE-2305379902 [0,2,0,0,0,0|2,0,0]=4 2501 B7R0.4 CCCCC[C@H](C)O MCULE-5898721044 [0,2,0,0,0,0|2,0,0]=4 2502 B7R0.4 CCCCNC(=O)C MCULE-7266335096 [0,2,0,0,0,0|2,0,0]=4 2503 B7R0.4 CCCCNC(C)C MCULE-2695970517 [0,2,0,0,0,0|2,0,0]=4 2504 B7R0.4 CCCCNC(C)C MCULE-9973816117 [0,2,0,0,0,0|2,0,0]=4 2505 B7R0.4 CCCCOC(=O)C MCULE-2107021121 [0,2,0,0,0,0|1,0,0]=3 2506 B7R0.4 CCCCOC(=O)Cl MCULE-5750652482 [0,2,0,0,0,0|1,0,1]=4 2507 B7R0.4 CCCCOC(=O)N MCULE-7719579696 [0,2,0,0,0,0|1,0,1]=4 2508 B7R0.4 CCCCOC(=S)[S-] MCULE-2197583773 [0,2,0,0,0,0|1,0,1]=4 2509 B7R0.4 CCCCOC(=S)[S-] MCULE-3219674247 [0,2,0,0,0,0|1,0,1]=4 2510 B7R0.4 CCCCOC(C)C MCULE-1504269570 [0,2,0,0,0,0|1,0,0]=3 2511 B7R0.4 CCCCOC(Cl)Cl MCULE-2958816896 [0,2,0,0,0,0|1,0,0]=3 2512 B7R0.4 CCCCON(=O)=O MCULE-9175662186 [0,2,0,0,0,0|2,0,0]=4 2513 B7R0.4 CCCCSC(=O)C MCULE-2653182488 [0,2,0,0,0,0|1,1,0]=4 2514 B7R0.4 CCCNCC(C)C MCULE-2869656642 [0,2,0,0,0,0|2,0,0]=4 2515 B7R0.4 CCCNCC(C)O MCULE-8110237473 [0,2,0,0,0,0|2,0,0]=4 2516 B7R0.4 CCCOCC(C)O MCULE-9214840563 [0,2,0,0,0,0|2,0,0]=4 2517 B7R0.4 CCCSCC(=O)C MCULE-8321448629 [0,2,0,0,0,0|2,0,0]=4 2518 B7R0.4 CCNCCN(C)C MCULE-6722045380 [0,2,0,0,0,0|2,0,0]=4 2519 B7R0.4 CCOCCC(=N)N MCULE-4926091113 [0,2,0,0,0,0|2,0,0]=4 2520 B7R0.4 CCOCCC(=N)N MCULE-8590303415 [0,2,0,0,0,0|2,0,0]=4 2521 B7R0.4 CCOCCC(=O)C MCULE-8449201493 [0,2,0,0,0,0|1,0,0]=3 2522 B7R0.4 CCOCCC(=O)Cl MCULE-8299617790 [0,2,0,0,0,0|2,0,0]=4 2523 B7R0.4 CCOCCC(=O)O MCULE-3962084059 [0,2,0,0,0,0|2,0,0]=4 2524 B7R0.4 CCONCC(C)C MCULE-3595879270 [0,2,0,0,0,0|2,0,0]=4 2525 B7R0.4 CCONCC(C)C MCULE-6329996438 [0,2,0,0,0,0|2,0,0]=4 2526 B7R0.4 CCSCCC(C)N MCULE-6854502332 [0,2,0,0,0,0|1,1,0]=4 2527 B7R0.4 CN(C)CCCCBr MCULE-3700239066 [0,2,0,0,0,0|2,0,0]=4 2528 B7R0.4 CN(C)CCCCBr MCULE-5243977766 [0,2,0,0,0,0|2,0,0]=4 2529 B7R0.4 CN(C)CCCCCl MCULE-5038597183 [0,2,0,0,0,0|2,0,0]=4 2530 B7R0.4 CN(C)CCCCCl MCULE-8885080954 [0,2,0,0,0,0|2,0,0]=4 2531 B7R0.4 CN(C)CCCCN MCULE-4457571368 [0,2,0,0,0,0|2,0,0]=4 2532 B7R0.4 CN(C)CCCCN MCULE-9067239115 [0,2,0,0,0,0|2,0,0]=4 2533 B7R0.4 CN(C)CCCCO MCULE-6973654872 [0,2,0,0,0,0|2,0,0]=4 2534 B7R0.4 CN(C)CCCON MCULE-1245472313 [0,2,0,0,0,0|2,0,0]=4 2535 B7R0.4 CN(C)CCCON MCULE-5946614062 [0,2,0,0,0,0|2,0,0]=4 2536 B7R0.4 CNCCCC(C)C MCULE-1784678333 [0,2,0,0,0,0|2,0,0]=4 2537 B7R0.4 CNCCCN(C)C MCULE-2186520808 [0,2,0,0,0,0|2,0,0]=4 2538 B7R0.4 CNCCNC(=O)C MCULE-5361712613 [0,2,0,0,0,0|2,0,0]=4 2539 B7R0.4 CNCCNC(=O)C MCULE-9798024696 [0,2,0,0,0,0|2,0,0]=4 2540 B7R0.4 CNCCNC(C)C MCULE-9007534493 [0,2,0,0,0,0|2,0,0]=4 2541 B7R0.4 CNCCOC(=O)C MCULE-1850077864 [0,2,0,0,0,0|1,0,0]=3 2542 B7R0.4 CNCCOC(=O)C MCULE-7023987942 [0,2,0,0,0,0|1,0,0]=3 2543 B7R0.4 COCCCC(=O)C MCULE-3606369396 [0,2,0,0,0,0|1,0,0]=3 2544 B7R0.4 COCCCC(=O)O MCULE-3165881573 [0,2,0,0,0,0|1,0,1]=4 2545 B7R0.4 COCCCC(=S)N MCULE-5066867181 [0,2,0,0,0,0|1,0,1]=4 2546 B7R0.4 COCCCC(C)N MCULE-4298611846 [0,2,0,0,0,0|1,0,0]=3 2547 B7R0.4 COCCCC(C)N MCULE-8139434838 [0,2,0,0,0,0|1,0,0]=3 2548 B7R0.4 COCCCC(C)O MCULE-4190294636 [0,2,0,0,0,0|1,0,0]=3 2549 B7R0.4 COCCNC(=N)N MCULE-4122240317 [0,2,0,0,0,0|1,0,1]=4 2550 B7R0.4 COCCNC(=N)N MCULE-5184785677 [0,2,0,0,0,0|1,0,1]=4 2551 B7R0.4 COCCNC(=N)N MCULE-5799549903 [0,2,0,0,0,0|1,0,1]=4 2552 B7R0.4 COCCNC(=O)C MCULE-2794263612 [0,2,0,0,0,0|1,0,0]=3 2553 B7R0.4 COCCNC(=O)N MCULE-1380726553 [0,2,0,0,0,0|1,0,1]=4 2554 B7R0.4 COCCNC(=S)N MCULE-1285240117 [0,2,0,0,0,0|1,0,1]=4 2555 B7R0.4 COCCNC(C)C MCULE-2061720092 [0,2,0,0,0,0|1,0,0]=3 2556 B7R0.4 COCCOC(=O)C MCULE-3221264060 [0,2,0,0,0,0|0,0,0]=2 2557 B7R0.4 COCCOC(=O)Cl MCULE-7308809094 [0,2,0,0,0,0|0,0,1]=3 2558 B7R0.4 COCCOC(=O)N MCULE-3401505850 [0,2,0,0,0,0|0,0,1]=3 2559 B7R0.4 COCCSC(=N)N MCULE-2093405339 [0,2,0,0,0,0|0,1,1]=4 2560 B7R0.4 COCCSC(=N)N MCULE-7836023475 [0,2,0,0,0,0|0,1,1]=4 2561 B7R0.4 CSCCNC(=O)C MCULE-2739431878 [0,2,0,0,0,0|1,1,0]=4 2562 B7R0.4 CSCCOC(=O)C MCULE-3742242959 [0,2,0,0,0,0|0,1,0]=3 2563 B7R0.4 NCCCOC(F)F MCULE-9181708891 [0,2,0,0,0,0|2,0,0]=4 2564 B7R0.6 C=C(C)CCC(=C)C MCULE-6018302318 [0,2,0,0,0,0|2,0,0]=4 2565 B7R0.6 C=C(C)CCC(=O)C MCULE-4201277876 [0,2,0,0,0,0|2,0,0]=4 2566 B7R0.6 C=C(C)CCC(C)Br MCULE-6437209576 [0,2,0,0,0,0|2,0,0]=4 2567 B7R0.6 C=C(C)CCC(C)C MCULE-2459654294 [0,2,0,0,0,0|2,0,0]=4 2568 B7R0.6 C=C(C)CCC(C)N MCULE-9861269774 [0,2,0,0,0,0|2,0,0]=4 2569 B7R0.6 C=C(C)CCC(C)O MCULE-5005514248 [0,2,0,0,0,0|2,0,0]=4 2570 B7R0.6 CC(=O)CCC(=O)C MCULE-3166810473 [0,2,0,0,0,0|2,0,0]=4 2571 B7R0.6 CC(=O)CCC(C)C MCULE-8518693213 [0,2,0,0,0,0|2,0,0]=4 2572 B7R0.6 CC(=O)CCN(C)C MCULE-1601022082 [0,2,0,0,0,0|2,0,0]=4 2573 B7R0.6 CC(=O)CCN(C)C MCULE-2933383790 [0,2,0,0,0,0|2,0,0]=4 2574 B7R0.6 CC(Br)CCC(C)Br MCULE-4511070452 [0,2,0,0,0,0|2,0,0]=4 2575 B7R0.6 CC(C)CCC(C)Br MCULE-4005079361 [0,2,0,0,0,0|2,0,0]=4 2576 B7R0.6 CC(C)CCC(C)C MCULE-4093485278 [0,2,0,0,0,0|2,0,0]=4 2577 B7R0.6 CC(C)CCC(C)N MCULE-3038746969 [0,2,0,0,0,0|2,0,0]=4 2578 B7R0.6 CC(C)CCC(C)N MCULE-7972635029 [0,2,0,0,0,0|2,0,0]=4 2579 B7R0.6 CC(C)CCC(C)O MCULE-6292509345 [0,2,0,0,0,0|2,0,0]=4 2580 B7R0.6 CC(N)CCN(C)C MCULE-9256005237 [0,2,0,0,0,0|2,0,0]=4 2581 B7R0.6 CC(N)CCS(=O)C MCULE-2870651099 [0,2,0,0,0,0|1,1,0]=4 2582 B7R0.6 CC(N)CCS(=O)C MCULE-7863963703 [0,2,0,0,0,0|1,1,0]=4 2583 B7R0.6 CC(O)CCC(C)O MCULE-6170497684 [0,2,0,0,0,0|2,0,0]=4 2584 B7R0.6 CC(O)CCN(C)C MCULE-7246080230 [0,2,0,0,0,0|2,0,0]=4 2585 B7R0.6 CN(C)CCN(C)C MCULE-1720617857 [0,2,0,0,0,0|2,0,0]=4 2586 B7R0.6 CP(C)CCP(C)C MCULE-3093586397 [0,2,0,0,0,0|2,0,0]=4 2587 B7R0.6 C[C@@H](O)CC[C@@H](C)O MCULE-3982464496 [0,2,0,0,0,0|2,0,0]=4 2588 B7R0.6 C[C@@H](O)CC[C@@H](C)O MCULE-6083261012 [0,2,0,0,0,0|2,0,0]=4 2589 B7R0.6 C[C@@H](O)CC[C@@H](C)O MCULE-8142548171 [0,2,0,0,0,0|2,0,0]=4 2590 B7R0.6 C[C@H](O)CC[C@H](C)O MCULE-5867971604 [0,2,0,0,0,0|2,0,0]=4 2591 B7R0.6 C[C@H](O)CC[C@H](C)O MCULE-7024859164 [0,2,0,0,0,0|2,0,0]=4 2592 B7R0.8 CC(C)(C)CCON MCULE-2291447993 [0,2,0,0,0,0|2,0,0]=4 2593 B7R0.8 CCCCC(C)(C)C MCULE-4446772090 [0,2,0,0,0,0|2,0,0]=4 2594 B7R0.8 CCCCC(C)(C)O MCULE-6518378731 [0,2,0,0,0,0|2,0,0]=4 2595 B7R0.8 CCCC[N+](C)(C)C MCULE-6094336787 [0,2,0,0,0,0|2,0,0]=4 2596 B7R0.8 CCCC[N+](C)(C)C MCULE-6922813961 [0,2,0,0,0,0|2,0,0]=4 2597 B7R0.8 CCCC[N+](C)(C)C MCULE-7733910392 [0,2,0,0,0,0|2,0,0]=4 2598 B7R0.8 CCCC[Si](C)(C)Cl MCULE-6810849853 [0,2,0,0,0,0|2,0,0]=4 2599 B7R0.8 CCCC[Si](C)(Cl)Cl MCULE-9750896400 [0,2,0,0,0,0|2,0,0]=4 2600 B7R0.8 CNCCC(C)(C)C MCULE-4129415722 [0,2,0,0,0,0|2,0,0]=4 2601 B7R0.8 CNCCC(C)(C)C MCULE-8255669777 [0,2,0,0,0,0|2,0,0]=4 2602 B7R0.8 CNCCC(C)(C)N MCULE-2728169604 [0,2,0,0,0,0|2,0,0]=4 2603 B7R0.8 CNCCC(C)(C)N MCULE-3540926370 [0,2,0,0,0,0|2,0,0]=4 2604 B7R0.8 CNCCC(C)(C)O MCULE-6866727490 [0,2,0,0,0,0|2,0,0]=4 2605 B7R0.8 CNCCS(=O)(=O)C MCULE-5880210307 [0,2,0,0,0,0|1,1,0]=4 2606 B7R0.8 CNCCS(=O)(=O)C MCULE-6808272578 [0,2,0,0,0,0|1,1,0]=4 2607 B7R0.8 COCCC(C)(C)N MCULE-7159634596 [0,2,0,0,0,0|1,0,0]=3 2608 B7R0.8 COCCS(=O)(=O)Cl MCULE-2673896601 [0,2,0,0,0,0|1,1,0]=4 2609 B7R0.8 COCCS(=O)(=O)F MCULE-2622271041 [0,2,0,0,0,0|1,1,0]=4 2610 B7R0.8 COCCS(=O)(=O)N MCULE-4498428516 [0,2,0,0,0,0|1,1,0]=4 2611 B7R0.8 COCCS(=O)(=O)[O-] MCULE-1587742211 [0,2,0,0,0,0|1,1,0]=4 2612 B7R0.8 COCCS(=O)(=O)[O-] MCULE-3001985511 [0,2,0,0,0,0|1,1,0]=4 2613 B7R0.8 COCC[B-](F)(F)F MCULE-8074166759 [0,2,0,0,0,0|2,0,0]=4 2614 B7R0.8 COCC[B-](F)(F)F MCULE-8911346671 [0,2,0,0,0,0|2,0,0]=4 2615 B7R0.8 CONCC(C)(C)C MCULE-4738335162 [0,2,0,0,0,0|2,0,0]=4 2616 B7R0.8 CSCCC(C)(C)N MCULE-5957026834 [0,2,0,0,0,0|1,1,0]=4 2617 B7R0.8 C[Si](C)(C)CCON MCULE-1449766833 [0,2,0,0,0,0|2,0,0]=4 2618 B7R0.8 C[Si](C)(C)CCON MCULE-4125270419 [0,2,0,0,0,0|2,0,0]=4 2619 B7R0.1 BrCCCCCCBr MCULE-5187406804 [0,2,0,0,0,0|2,0,0]=4 2620 B7R0.1 C#CCCCCCC MCULE-4406928583 [0,2,0,0,0,0|2,0,0]=4 2621 B7R0.1 C#CCCOCC#C MCULE-6678340051 [0,2,0,0,0,0|1,0,1]=4 2622 B7R0.1 C#CCNCCCC MCULE-4241072719 [0,2,0,0,0,0|2,0,0]=4 2623 B7R0.1 C#CCNCCOC MCULE-3073014261 [0,2,0,0,0,0|1,0,0]=3 2624 B7R0.1 C#CCOCCC#N MCULE-7883616690 [0,2,0,0,0,0|2,0,0]=4 2625 B7R0.1 C#CCOCCCN MCULE-2240372630 [0,2,0,0,0,0|2,0,0]=4 2626 B7R0.1 C#CCOCCCN MCULE-8708564884 [0,2,0,0,0,0|2,0,0]=4 2627 B7R0.1 C#CCOCCCO MCULE-2600818859 [0,2,0,0,0,0|2,0,0]=4 2628 B7R0.1 C#CCOCCNC MCULE-6696412694 [0,2,0,0,0,0|1,0,0]=3 2629 B7R0.1 C#CCOCCNC MCULE-9126717873 [0,2,0,0,0,0|1,0,0]=3 2630 B7R0.1 C#CCOCCOC MCULE-4660359112 [0,2,0,0,0,0|0,0,0]=2 2631 B7R0.1 C#CCOCCON MCULE-9143099762 [0,2,0,0,0,0|1,0,0]=3 2632 B7R0.1 C/C=C/CCCCC MCULE-6911363331 [0,2,0,0,0,0|2,0,0]=4 2633 B7R0.1 C/C=C\CCCCC MCULE-9470036254 [0,2,0,0,0,0|2,0,0]=4 2634 B7R0.1 C=CCCCCCC MCULE-6867393536 [0,2,0,0,0,0|2,0,0]=4 2635 B7R0.1 C=CCCCCNC MCULE-3676018759 [0,2,0,0,0,0|2,0,0]=4 2636 B7R0.1 C=CCCCCNC MCULE-9443600983 [0,2,0,0,0,0|2,0,0]=4 2637 B7R0.1 C=CCCCCON MCULE-1155744928 [0,2,0,0,0,0|2,0,0]=4 2638 B7R0.1 C=CCCCCON MCULE-1741904620 [0,2,0,0,0,0|2,0,0]=4 2639 B7R0.1 C=CCCCOCCl MCULE-1172012073 [0,2,0,0,0,0|1,0,1]=4 2640 B7R0.1 C=CCCOCCN MCULE-5958891740 [0,2,0,0,0,0|1,0,1]=4 2641 B7R0.1 C=CCCOCCO MCULE-5369849290 [0,2,0,0,0,0|1,0,1]=4 2642 B7R0.1 C=CCNCCOC MCULE-6576578655 [0,2,0,0,0,0|1,0,0]=3 2643 B7R0.1 C=CCOCCC=O MCULE-3332311483 [0,2,0,0,0,0|2,0,0]=4 2644 B7R0.1 C=CCOCCCBr MCULE-7892533278 [0,2,0,0,0,0|2,0,0]=4 2645 B7R0.1 C=CCOCCCC MCULE-2214755289 [0,2,0,0,0,0|1,0,0]=3 2646 B7R0.1 C=CCOCCCN MCULE-4862923195 [0,2,0,0,0,0|2,0,0]=4 2647 B7R0.1 C=CCOCCOC MCULE-7363927527 [0,2,0,0,0,0|0,0,0]=2 2648 B7R0.1 C=CCSCCCC MCULE-4868736488 [0,2,0,0,0,0|1,1,0]=4 2649 B7R0.1 C=COCCCCC MCULE-4024159480 [0,2,0,0,0,0|1,0,1]=4 2650 B7R0.1 C=COCCCCO MCULE-3537265926 [0,2,0,0,0,0|1,0,1]=4 2651 B7R0.1 CC#CCCC#CC MCULE-1917533580 [0,2,0,0,0,0|2,0,0]=4 2652 B7R0.1 CC#CCCCCBr MCULE-3308414129 [0,2,0,0,0,0|2,0,0]=4 2653 B7R0.1 CC#CCCCCC MCULE-3651650902 [0,2,0,0,0,0|2,0,0]=4 2654 B7R0.1 CC#CCCCCO MCULE-8668355627 [0,2,0,0,0,0|2,0,0]=4 2655 B7R0.1 CC/C=C/CCCC MCULE-7439146649 [0,2,0,0,0,0|2,0,0]=4 2656 B7R0.1 CC=CCCCCC MCULE-7111489659 [0,2,0,0,0,0|2,0,0]=4 2657 B7R0.1 CC=CCCCCO MCULE-8707373340 [0,2,0,0,0,0|2,0,0]=4 2658 B7R0.1 CCC#CCCCC MCULE-5815218275 [0,2,0,0,0,0|2,0,0]=4 2659 B7R0.1 CCC#CCOCC MCULE-8576147807 [0,2,0,0,0,0|1,0,1]=4 2660 B7R0.1 CCC/C=C/CCC MCULE-4580411068 [0,2,0,0,0,0|2,0,0]=4 2661 B7R0.1 CCC/C=C\CCC MCULE-3832748741 [0,2,0,0,0,0|2,0,0]=4 2662 B7R0.1 CCC=CCCCC MCULE-9716720293 [0,2,0,0,0,0|2,0,0]=4 2663 B7R0.1 CCCC#CCCC MCULE-7777692011 [0,2,0,0,0,0|2,0,0]=4 2664 B7R0.1 CCCC/C=C/CO MCULE-5404793542 [0,2,0,0,0,0|2,0,0]=4 2665 B7R0.1 CCCC=CCCC MCULE-6897310592 [0,2,0,0,0,0|2,0,0]=4 2666 B7R0.1 CCCCC#CCO MCULE-9057096480 [0,2,0,0,0,0|2,0,0]=4 2667 B7R0.1 CCCCC=CCBr MCULE-2427659057 [0,2,0,0,0,0|2,0,0]=4 2668 B7R0.1 CCCCC=CCO MCULE-7891403223 [0,2,0,0,0,0|2,0,0]=4 2669 B7R0.1 CCCCCCC#N MCULE-7652123212 [0,2,0,0,0,0|2,0,0]=4 2670 B7R0.1 CCCCCCC=O MCULE-5251820425 [0,2,0,0,0,0|2,0,0]=4 2671 B7R0.1 CCCCCCCBr MCULE-8042829299 [0,2,0,0,0,0|2,0,0]=4 2672 B7R0.1 CCCCCCCC MCULE-3248084959 [0,2,0,0,0,0|2,0,0]=4 2673 B7R0.1 CCCCCCCCl MCULE-6286146566 [0,2,0,0,0,0|2,0,0]=4 2674 B7R0.1 CCCCCCCF MCULE-9794868174 [0,2,0,0,0,0|2,0,0]=4 2675 B7R0.1 CCCCCCCI MCULE-2930393920 [0,2,0,0,0,0|2,0,0]=4 2676 B7R0.1 CCCCCCCN MCULE-1126747714 [0,2,0,0,0,0|2,0,0]=4 2677 B7R0.1 CCCCCCCO MCULE-5882959353 [0,2,0,0,0,0|2,0,0]=4 2678 B7R0.1 CCCCCCCS MCULE-3901364910 [0,2,0,0,0,0|2,0,0]=4 2679 B7R0.1 CCCCCCNC MCULE-1828296852 [0,2,0,0,0,0|2,0,0]=4 2680 B7R0.1 CCCCCCNN MCULE-5116098983 [0,2,0,0,0,0|2,0,0]=4 2681 B7R0.1 CCCCCCNO MCULE-4175875706 [0,2,0,0,0,0|2,0,0]=4 2682 B7R0.1 CCCCCCNO MCULE-8719557426 [0,2,0,0,0,0|2,0,0]=4 2683 B7R0.1 CCCCCCOC MCULE-7148964901 [0,2,0,0,0,0|1,0,0]=3 2684 B7R0.1 CCCCCCON MCULE-1836746134 [0,2,0,0,0,0|2,0,0]=4 2685 B7R0.1 CCCCCCON MCULE-9566158736 [0,2,0,0,0,0|2,0,0]=4 2686 B7R0.1 CCCCCOC=O MCULE-2718009140 [0,2,0,0,0,0|1,0,1]=4 2687 B7R0.1 CCCCCOCC MCULE-6346670527 [0,2,0,0,0,0|1,0,0]=3 2688 B7R0.1 CCCCCON=O MCULE-8065075083 [0,2,0,0,0,0|2,0,0]=4 2689 B7R0.1 CCCCNCC#N MCULE-1687580908 [0,2,0,0,0,0|2,0,0]=4 2690 B7R0.1 CCCCNCCC MCULE-6342731867 [0,2,0,0,0,0|2,0,0]=4 2691 B7R0.1 CCCCNCCN MCULE-3865190511 [0,2,0,0,0,0|2,0,0]=4 2692 B7R0.1 CCCCNCCO MCULE-3582031814 [0,2,0,0,0,0|2,0,0]=4 2693 B7R0.1 CCCCNCCS MCULE-6926403617 [0,2,0,0,0,0|2,0,0]=4 2694 B7R0.1 CCCCOCCBr MCULE-5314812532 [0,2,0,0,0,0|1,0,0]=3 2695 B7R0.1 CCCCOCCCl MCULE-9147804479 [0,2,0,0,0,0|1,0,0]=3 2696 B7R0.1 CCCCOCCI MCULE-3571589392 [0,2,0,0,0,0|1,0,0]=3 2697 B7R0.1 CCCCOCCN MCULE-1817743996 [0,2,0,0,0,0|1,0,0]=3 2698 B7R0.1 CCCCOCCN MCULE-3658840205 [0,2,0,0,0,0|1,0,0]=3 2699 B7R0.1 CCCCOCCO MCULE-1727546427 [0,2,0,0,0,0|1,0,0]=3 2700 B7R0.1 CCCCOCCO MCULE-4417721312 [0,2,0,0,0,0|1,0,0]=3 2701 B7R0.1 CCCCOCCS MCULE-7419398753 [0,2,0,0,0,0|1,0,0]=3 2702 B7R0.1 CCCCSCC#N MCULE-9529960668 [0,2,0,0,0,0|1,1,0]=4 2703 B7R0.1 CCCCSCCC MCULE-3137952516 [0,2,0,0,0,0|1,1,0]=4 2704 B7R0.1 CCCCSCCN MCULE-3521818954 [0,2,0,0,0,0|1,1,0]=4 2705 B7R0.1 CCCCSCCN MCULE-5281011566 [0,2,0,0,0,0|1,1,0]=4 2706 B7R0.1 CCCCSCCO MCULE-8791357083 [0,2,0,0,0,0|1,1,0]=4 2707 B7R0.1 CCCCSCCS MCULE-4109311315 [0,2,0,0,0,0|1,1,0]=4 2708 B7R0.1 CCCNCCCN MCULE-6668094176 [0,2,0,0,0,0|2,0,0]=4 2709 B7R0.1 CCCNCCCO MCULE-4366982860 [0,2,0,0,0,0|2,0,0]=4 2710 B7R0.1 CCCNCCNC MCULE-3857593384 [0,2,0,0,0,0|2,0,0]=4 2711 B7R0.1 CCCNCCOC MCULE-4425567647 [0,2,0,0,0,0|1,0,0]=3 2712 B7R0.1 CCCNNCCC MCULE-1099710970 [0,2,0,0,0,0|2,0,0]=4 2713 B7R0.1 CCCNNCCC MCULE-3763521244 [0,2,0,0,0,0|2,0,0]=4 2714 B7R0.1 CCCOCCCN MCULE-5875738973 [0,2,0,0,0,0|2,0,0]=4 2715 B7R0.1 CCCSCCCN MCULE-2911445961 [0,2,0,0,0,0|2,0,0]=4 2716 B7R0.1 CCCSSCCC MCULE-2667977107 [0,2,0,0,0,0|2,0,0]=4 2717 B7R0.1 CCNCCCCO MCULE-4851249509 [0,2,0,0,0,0|2,0,0]=4 2718 B7R0.1 CCNCCNCC MCULE-2663126630 [0,2,0,0,0,0|2,0,0]=4 2719 B7R0.1 CCNCCNCC MCULE-8627955138 [0,2,0,0,0,0|2,0,0]=4 2720 B7R0.1 CCNCCNCC MCULE-9858982602 [0,2,0,0,0,0|2,0,0]=4 2721 B7R0.1 CCNCCOCC MCULE-8895991816 [0,2,0,0,0,0|1,0,0]=3 2722 B7R0.1 CCOCCCC#N MCULE-6256619755 [0,2,0,0,0,0|1,0,1]=4 2723 B7R0.1 CCOCCCCN MCULE-6583734908 [0,2,0,0,0,0|1,0,0]=3 2724 B7R0.1 CCOCCCCO MCULE-9986213119 [0,2,0,0,0,0|1,0,0]=3 2725 B7R0.1 CCOCCN=C=S MCULE-3401173404 [0,2,0,0,0,0|1,0,1]=4 2726 B7R0.1 CCOCCN=N#N MCULE-5023136876 [0,2,0,0,0,0|2,0,0]=4 2727 B7R0.1 CCOCCOCC MCULE-5593873009 [0,2,0,0,0,0|0,0,0]=2 2728 B7R0.1 CCONCCOC MCULE-2883736672 [0,2,0,0,0,0|0,0,0]=2 2729 B7R0.1 CCONCCOC MCULE-8885999080 [0,2,0,0,0,0|0,0,0]=2 2730 B7R0.1 CCSCCCCN MCULE-7961306984 [0,2,0,0,0,0|1,1,0]=4 2731 B7R0.1 CCSCCCCO MCULE-1712194349 [0,2,0,0,0,0|1,1,0]=4 2732 B7R0.1 CCSCCSCC MCULE-2178899960 [0,2,0,0,0,0|0,2,0]=4 2733 B7R0.1 CNCCCCCN MCULE-8023367999 [0,2,0,0,0,0|2,0,0]=4 2734 B7R0.1 CNCCCCCO MCULE-2988249730 [0,2,0,0,0,0|2,0,0]=4 2735 B7R0.1 CNCCCCCO MCULE-8033733525 [0,2,0,0,0,0|2,0,0]=4 2736 B7R0.1 CNCCCCNC MCULE-4466243376 [0,2,0,0,0,0|2,0,0]=4 2737 B7R0.1 CNCCCCOC MCULE-3203262011 [0,2,0,0,0,0|1,0,0]=3 2738 B7R0.1 CNCCNCCN MCULE-6347214757 [0,2,0,0,0,0|2,0,0]=4 2739 B7R0.1 CNCCNCCN MCULE-8600289461 [0,2,0,0,0,0|2,0,0]=4 2740 B7R0.1 CNCCOCCCl MCULE-4700720996 [0,2,0,0,0,0|1,0,0]=3 2741 B7R0.1 CNCCOCCCl MCULE-6741879544 [0,2,0,0,0,0|1,0,0]=3 2742 B7R0.1 CNCCOCCN MCULE-8077914280 [0,2,0,0,0,0|1,0,0]=3 2743 B7R0.1 CNCCOCCO MCULE-7869540361 [0,2,0,0,0,0|1,0,0]=3 2744 B7R0.1 COCC#CCOC MCULE-7228915705 [0,2,0,0,0,0|0,0,0]=2 2745 B7R0.1 COCCCCC#N MCULE-5969342869 [0,2,0,0,0,0|1,0,0]=3 2746 B7R0.1 COCCCCCBr MCULE-9843465236 [0,2,0,0,0,0|1,0,0]=3 2747 B7R0.1 COCCCCCCl MCULE-6956815361 [0,2,0,0,0,0|1,0,0]=3 2748 B7R0.1 COCCCCCN MCULE-2109050097 [0,2,0,0,0,0|1,0,0]=3 2749 B7R0.1 COCCCCCO MCULE-6003118644 [0,2,0,0,0,0|1,0,0]=3 2750 B7R0.1 COCCCCOC MCULE-3614881304 [0,2,0,0,0,0|0,0,0]=2 2751 B7R0.1 COCCCN=C=O MCULE-9248091945 [0,2,0,0,0,0|1,0,1]=4 2752 B7R0.1 COCCCN=C=S MCULE-6346177825 [0,2,0,0,0,0|1,0,1]=4 2753 B7R0.1 COCCNCC#N MCULE-6690993214 [0,2,0,0,0,0|1,0,0]=3 2754 B7R0.1 COCCNCCF MCULE-1482164073 [0,2,0,0,0,0|1,0,0]=3 2755 B7R0.1 COCCNCCF MCULE-4419696614 [0,2,0,0,0,0|1,0,0]=3 2756 B7R0.1 COCCNCCN MCULE-4860380919 [0,2,0,0,0,0|1,0,0]=3 2757 B7R0.1 COCCNCCN MCULE-8558629867 [0,2,0,0,0,0|1,0,0]=3 2758 B7R0.1 COCCNCCO MCULE-3082225541 [0,2,0,0,0,0|1,0,0]=3 2759 B7R0.1 COCCOCC#N MCULE-9585469959 [0,2,0,0,0,0|0,0,0]=2 2760 B7R0.1 COCCOCC=O MCULE-2621317944 [0,2,0,0,0,0|0,0,0]=2 2761 B7R0.1 COCCOCCBr MCULE-7766640443 [0,2,0,0,0,0|0,0,0]=2 2762 B7R0.1 COCCOCCCl MCULE-5502842762 [0,2,0,0,0,0|0,0,0]=2 2763 B7R0.1 COCCOCCI MCULE-4051748367 [0,2,0,0,0,0|0,0,0]=2 2764 B7R0.1 COCCOCCN MCULE-7016705271 [0,2,0,0,0,0|0,0,0]=2 2765 B7R0.1 COCCOCCO MCULE-4230242952 [0,2,0,0,0,0|0,0,0]=2 2766 B7R0.1 COCCOCCS MCULE-5015015605 [0,2,0,0,0,0|0,0,0]=2 2767 B7R0.1 COCCSCCO MCULE-5057235828 [0,2,0,0,0,0|0,1,0]=3 2768 B7R0.1 COCOCCC#N MCULE-4331006522 [0,2,0,0,0,0|1,0,1]=4 2769 B7R0.1 COCOCCC=O MCULE-3632276453 [0,2,0,0,0,0|1,0,1]=4 2770 B7R0.1 COCOCCCN MCULE-4340598730 [0,2,0,0,0,0|1,0,0]=3 2771 B7R0.1 CSCCCCC#N MCULE-5901122432 [0,2,0,0,0,0|1,1,0]=4 2772 B7R0.1 CSCCCCCN MCULE-8771942873 [0,2,0,0,0,0|1,1,0]=4 2773 B7R0.1 CSCCCCCO MCULE-3422729293 [0,2,0,0,0,0|1,1,0]=4 2774 B7R0.1 ClCCCCCCBr MCULE-7471712605 [0,2,0,0,0,0|2,0,0]=4 2775 B7R0.1 ClCCCCCCCl MCULE-2423183693 [0,2,0,0,0,0|2,0,0]=4 2776 B7R0.1 ClCCCCCCI MCULE-2662361744 [0,2,0,0,0,0|2,0,0]=4 2777 B7R0.1 ClCCCCOCCl MCULE-6534731124 [0,2,0,0,0,0|1,0,0]=3 2778 B7R0.1 FCCCCCCBr MCULE-9238324978 [0,2,0,0,0,0|2,0,0]=4 2779 B7R0.1 ICCCCCCI MCULE-1005202656 [0,2,0,0,0,0|2,0,0]=4 2780 B7R0.1 N#CCCOCCCl MCULE-9575015027 [0,2,0,0,0,0|2,0,0]=4 2781 B7R0.1 N#CCCOCCN MCULE-6674432245 [0,2,0,0,0,0|2,0,0]=4 2782 B7R0.1 N#CCCOCCN MCULE-8115918193 [0,2,0,0,0,0|2,0,0]=4 2783 B7R0.1 N#CCCOCCO MCULE-4006569384 [0,2,0,0,0,0|2,0,0]=4 2784 B7R0.1 N#CCOCCCO MCULE-3858235861 [0,2,0,0,0,0|2,0,0]=4 2785 B7R0.1 NCCCCCCBr MCULE-4017495581 [0,2,0,0,0,0|2,0,0]=4 2786 B7R0.1 NCCCCCCBr MCULE-4048883510 [0,2,0,0,0,0|2,0,0]=4 2787 B7R0.1 NCCCCCCN MCULE-1038764376 [0,2,0,0,0,0|2,0,0]=4 2788 B7R0.1 NCCCCCCN MCULE-3766020930 [0,2,0,0,0,0|2,0,0]=4 2789 B7R0.1 NCCCCCCN MCULE-9535729200 [0,2,0,0,0,0|2,0,0]=4 2790 B7R0.1 NCCCCCCO MCULE-2264326846 [0,2,0,0,0,0|2,0,0]=4 2791 B7R0.1 NCCCCCCS MCULE-3764839885 [0,2,0,0,0,0|2,0,0]=4 2792 B7R0.1 NCCCCCCS MCULE-5822376723 [0,2,0,0,0,0|2,0,0]=4 2793 B7R0.1 NCCCOCCO MCULE-7244821044 [0,2,0,0,0,0|2,0,0]=4 2794 B7R0.1 NCCOCCCO MCULE-2435588099 [0,2,0,0,0,0|2,0,0]=4 2795 B7R0.1 NCCOCCCO MCULE-9188421727 [0,2,0,0,0,0|2,0,0]=4 2796 B7R0.1 NOCCOCCO MCULE-7815173940 [0,2,0,0,0,0|1,0,0]=3 2797 B7R0.1 O=COCCOC=O MCULE-6942322322 [0,2,0,0,0,0|0,0,2]=4 2798 B7R0.1 OCCCCCCBr MCULE-3500356936 [0,2,0,0,0,0|2,0,0]=4 2799 B7R0.1 OCCCCCCCl MCULE-4507452440 [0,2,0,0,0,0|2,0,0]=4 2800 B7R0.1 OCCCCCCF MCULE-7082491218 [0,2,0,0,0,0|2,0,0]=4 2801 B7R0.1 OCCCCCCI MCULE-3710706648 [0,2,0,0,0,0|2,0,0]=4 2802 B7R0.1 OCCCCCCO MCULE-8817570517 [0,2,0,0,0,0|2,0,0]=4 2803 B7R0.1 OCCCCCCS MCULE-9135853131 [0,2,0,0,0,0|2,0,0]=4 2804 B7R0.1 OCCCOCCCl MCULE-9172390990 [0,2,0,0,0,0|2,0,0]=4 2805 B7R0.1 OCCOCCCBr MCULE-3397483886 [0,2,0,0,0,0|2,0,0]=4 2806 B7R0.1 SCCCCCCS MCULE-2873828857 [0,2,0,0,0,0|2,0,0]=4 2807 B7R0.1 [NH3+]CCCCCC[NH3+] MCULE-2211304471 [0,2,0,0,0,0|2,0,0]=4 2808 B5R1.1 B1CCOO1 MCULE-4859234466 [1,0,0,1,0,0|2,0,0]=4 2809 B5R1.1 C1=CCCC1 MCULE-8785635218 [1,0,0,1,0,0|1,0,1]=4 2810 B5R1.1 C1=CCOC1 MCULE-1252378718 [1,0,0,1,0,0|0,0,2]=4 2811 B5R1.1 C1=COCC1 MCULE-7714726225 [1,0,0,1,0,0|0,0,2]=4 2812 B5R1.1 C1CCNC1 MCULE-2816679267 [1,0,0,1,0,0|1,0,0]=3 2813 B5R1.1 C1CCNC1 MCULE-8439725600 [1,0,0,1,0,0|1,0,0]=3 2814 B5R1.1 C1CCNC1 MCULE-8653165010 [1,0,0,1,0,0|1,0,0]=3 2815 B5R1.1 C1CCNC1 MCULE-9053007443 [1,0,0,1,0,0|1,0,0]=3 2816 B5R1.1 C1CCOC1 MCULE-3873245085 [1,0,0,1,0,0|0,0,0]=2 2817 B5R1.1 C1CCSC1 MCULE-4519380555 [1,0,0,1,0,0|0,1,0]=3 2818 B5R1.1 C1CNCN1 MCULE-6666768806 [1,0,0,1,0,0|2,0,0]=4 2819 B5R1.1 C1CNNC1 MCULE-9192384720 [1,0,0,1,0,0|2,0,0]=4 2820 B5R1.1 C1CNNC1 MCULE-9418244562 [1,0,0,1,0,0|2,0,0]=4 2821 B5R1.1 C1CNOC1 MCULE-3922840312 [1,0,0,1,0,0|1,0,0]=3 2822 B5R1.1 C1CNOC1 MCULE-6084499894 [1,0,0,1,0,0|1,0,0]=3 2823 B5R1.1 C1COCN1 MCULE-4693733872 [1,0,0,1,0,0|1,0,0]=3 2824 B5R1.1 C1COCO1 MCULE-3967810235 [1,0,0,1,0,0|0,0,0]=2 2825 B5R1.1 C1CSCN1 MCULE-1445529876 [1,0,0,1,0,0|1,1,0]=4 2826 B5R1.1 C1CSCN1 MCULE-8646299838 [1,0,0,1,0,0|1,1,0]=4 2827 B5R1.1 C1CSCS1 MCULE-2954642463 [1,0,0,1,0,0|0,2,0]=4 2828 B5R1.2 BrC1CCC1 MCULE-3713567804 [1,0,0,1,0,0|2,0,0]=4 2829 B5R1.2 BrC1CNC1 MCULE-4959282437 [1,0,0,1,0,0|2,0,0]=4 2830 B5R1.2 BrC1CNC1 MCULE-5635086924 [1,0,0,1,0,0|2,0,0]=4 2831 B5R1.2 BrC1CNC1 MCULE-7561312043 [1,0,0,1,0,0|2,0,0]=4 2832 B5R1.2 BrC1COC1 MCULE-7527620035 [1,0,0,1,0,0|1,0,0]=3 2833 B5R1.2 C=C1CCC1 MCULE-8318650413 [1,0,0,1,0,0|1,0,1]=4 2834 B5R1.2 C=C1COC1 MCULE-1822645869 [1,0,0,1,0,0|0,0,2]=4 2835 B5R1.2 CC1CCN1 MCULE-7952714343 [1,0,0,1,0,0|2,0,0]=4 2836 B5R1.2 CC1CCN1 MCULE-9084374728 [1,0,0,1,0,0|2,0,0]=4 2837 B5R1.2 CC1CNC1 MCULE-3977066574 [1,0,0,1,0,0|1,0,0]=3 2838 B5R1.2 CC1CNC1 MCULE-7868611457 [1,0,0,1,0,0|1,0,0]=3 2839 B5R1.2 C[C@@H]1CCN1 MCULE-1326888606 [1,0,0,1,0,0|2,0,0]=4 2840 B5R1.2 C[C@@H]1CCN1 MCULE-4242598105 [1,0,0,1,0,0|2,0,0]=4 2841 B5R1.2 C[C@@H]1CCN1 MCULE-7982357684 [1,0,0,1,0,0|2,0,0]=4 2842 B5R1.2 C[C@@H]1CCN1 MCULE-9443505478 [1,0,0,1,0,0|2,0,0]=4 2843 B5R1.2 C[C@H]1CCN1 MCULE-3178162849 [1,0,0,1,0,0|2,0,0]=4 2844 B5R1.2 C[C@H]1CCN1 MCULE-4001397038 [1,0,0,1,0,0|2,0,0]=4 2845 B5R1.2 C[C@H]1CCN1 MCULE-4361200248 [1,0,0,1,0,0|2,0,0]=4 2846 B5R1.2 C[C@H]1CCN1 MCULE-6534579029 [1,0,0,1,0,0|2,0,0]=4 2847 B5R1.2 ClC1CCC1 MCULE-2602937313 [1,0,0,1,0,0|2,0,0]=4 2848 B5R1.2 ClC1CNC1 MCULE-2051705029 [1,0,0,1,0,0|2,0,0]=4 2849 B5R1.2 ClC1CNC1 MCULE-6678325694 [1,0,0,1,0,0|2,0,0]=4 2850 B5R1.2 ClC1COC1 MCULE-7266812470 [1,0,0,1,0,0|1,0,0]=3 2851 B5R1.2 FC1CNC1 MCULE-5746598794 [1,0,0,1,0,0|2,0,0]=4 2852 B5R1.2 FC1CNC1 MCULE-9427948721 [1,0,0,1,0,0|2,0,0]=4 2853 B5R1.2 FC1COC1 MCULE-7899811313 [1,0,0,1,0,0|1,0,0]=3 2854 B5R1.2 IC1CCC1 MCULE-3890796264 [1,0,0,1,0,0|2,0,0]=4 2855 B5R1.2 IC1CNC1 MCULE-5957681014 [1,0,0,1,0,0|2,0,0]=4 2856 B5R1.2 IC1CNC1 MCULE-7396587981 [1,0,0,1,0,0|2,0,0]=4 2857 B5R1.2 IC1COC1 MCULE-6736781201 [1,0,0,1,0,0|1,0,0]=3 2858 B5R1.2 NC1CCC1 MCULE-7511834789 [1,0,0,1,0,0|2,0,0]=4 2859 B5R1.2 NC1CCC1 MCULE-9118406840 [1,0,0,1,0,0|2,0,0]=4 2860 B5R1.2 NC1CNC1 MCULE-3069271350 [1,0,0,1,0,0|2,0,0]=4 2861 B5R1.2 NC1CNC1 MCULE-4785323807 [1,0,0,1,0,0|2,0,0]=4 2862 B5R1.2 NC1COC1 MCULE-3457998413 [1,0,0,1,0,0|1,0,0]=3 2863 B5R1.2 NC1COC1 MCULE-8439862131 [1,0,0,1,0,0|1,0,0]=3 2864 B5R1.2 NC1CSC1 MCULE-8155396913 [1,0,0,1,0,0|1,1,0]=4 2865 B5R1.2 NC1CSC1 MCULE-8463545676 [1,0,0,1,0,0|1,1,0]=4 2866 B5R1.2 NC1CSC1 MCULE-8920812656 [1,0,0,1,0,0|1,1,0]=4 2867 B5R1.2 NN1CCC1 MCULE-8176731673 [1,0,0,1,0,0|2,0,0]=4 2868 B5R1.2 NN1CCC1 MCULE-8382619719 [1,0,0,1,0,0|2,0,0]=4 2869 B5R1.2 O=C1CCC1 MCULE-4870967355 [1,0,0,1,0,0|2,0,0]=4 2870 B5R1.2 O=C1CCO1 MCULE-1277069147 [1,0,0,1,0,0|2,0,0]=4 2871 B5R1.2 O=C1COC1 MCULE-6847248632 [1,0,0,1,0,0|0,0,2]=4 2872 B5R1.2 OC1CCC1 MCULE-2856311430 [1,0,0,1,0,0|1,0,0]=3 2873 B5R1.2 OC1CNC1 MCULE-3596383447 [1,0,0,1,0,0|1,0,0]=3 2874 B5R1.2 OC1CNC1 MCULE-7913518128 [1,0,0,1,0,0|1,0,0]=3 2875 B5R1.2 OC1COC1 MCULE-2630355859 [1,0,0,1,0,0|0,0,0]=2 2876 B5R1.2 OC1CSC1 MCULE-6759275460 [1,0,0,1,0,0|0,1,0]=3 2877 B5R1.2 SC1CCC1 MCULE-1779239394 [1,0,0,1,0,0|1,1,0]=4 2878 B5R1.2 SC1CNC1 MCULE-5823473779 [1,0,0,1,0,0|1,1,0]=4 2879 B5R1.2 SC1CNC1 MCULE-9002536698 [1,0,0,1,0,0|1,1,0]=4 2880 B5R1.2 SC1COC1 MCULE-2175099379 [1,0,0,1,0,0|0,1,0]=3 2881 B5R1.3 BrCC1CC1 MCULE-6057571576 [1,0,0,1,0,0|2,0,0]=4 2882 B5R1.3 BrCC1CO1 MCULE-1054784183 [1,0,0,1,0,0|1,0,0]=3 2883 B5R1.3 C#CC1CC1 MCULE-8413731516 [1,0,0,1,0,0|1,0,1]=4 2884 B5R1.3 C1(CO1)CCl MCULE-2239256431 [1,0,0,1,0,0|1,0,0]=3 2885 B5R1.3 C=CC1CC1 MCULE-4323158851 [1,0,0,1,0,0|1,0,1]=4 2886 B5R1.3 C=CC1CO1 MCULE-1428696186 [1,0,0,1,0,0|0,0,2]=4 2887 B5R1.3 CCC1CO1 MCULE-4316722229 [1,0,0,1,0,0|0,0,0]=2 2888 B5R1.3 CCC1CO1 MCULE-8341828978 [1,0,0,1,0,0|0,0,0]=2 2889 B5R1.3 CC[C@@H]1CO1 MCULE-4349820919 [1,0,0,1,0,0|0,0,0]=2 2890 B5R1.3 CC[C@@H]1CO1 MCULE-5929218989 [1,0,0,1,0,0|0,0,0]=2 2891 B5R1.3 CC[C@H]1CO1 MCULE-3647278168 [1,0,0,1,0,0|0,0,0]=2 2892 B5R1.3 CC[C@H]1CO1 MCULE-4369524443 [1,0,0,1,0,0|0,0,0]=2 2893 B5R1.3 CNC1CC1 MCULE-4055097650 [1,0,0,1,0,0|1,0,0]=3 2894 B5R1.3 CNC1CC1 MCULE-8040280524 [1,0,0,1,0,0|1,0,0]=3 2895 B5R1.3 ClCC1CC1 MCULE-3906493674 [1,0,0,1,0,0|2,0,0]=4 2896 B5R1.3 ClCC1CO1 MCULE-9759519789 [1,0,0,1,0,0|1,0,0]=3 2897 B5R1.3 ClCC1CS1 MCULE-7368175691 [1,0,0,1,0,0|1,1,0]=4 2898 B5R1.3 ClC[C@@H]1CO1 MCULE-8144448889 [1,0,0,1,0,0|1,0,0]=3 2899 B5R1.3 ClC[C@@H]1CO1 MCULE-8710235870 [1,0,0,1,0,0|1,0,0]=3 2900 B5R1.3 ClC[C@H]1CO1 MCULE-2316124162 [1,0,0,1,0,0|1,0,0]=3 2901 B5R1.3 ClC[C@H]1CO1 MCULE-6957304600 [1,0,0,1,0,0|1,0,0]=3 2902 B5R1.3 FCC1CO1 MCULE-6156138745 [1,0,0,1,0,0|1,0,0]=3 2903 B5R1.3 FC[C@@H]1CO1 MCULE-7477932707 [1,0,0,1,0,0|1,0,0]=3 2904 B5R1.3 FNC1CC1 MCULE-4155496114 [1,0,0,1,0,0|2,0,0]=4 2905 B5R1.3 ICC1CC1 MCULE-2390979991 [1,0,0,1,0,0|2,0,0]=4 2906 B5R1.3 ICC1CO1 MCULE-6993621560 [1,0,0,1,0,0|1,0,0]=3 2907 B5R1.3 N#CC1CC1 MCULE-1838359731 [1,0,0,1,0,0|2,0,0]=4 2908 B5R1.3 NCC1CC1 MCULE-5832294538 [1,0,0,1,0,0|2,0,0]=4 2909 B5R1.3 NCC1CC1 MCULE-9914994928 [1,0,0,1,0,0|2,0,0]=4 2910 B5R1.3 NNC1CC1 MCULE-3522729516 [1,0,0,1,0,0|2,0,0]=4 2911 B5R1.3 NNC1CC1 MCULE-7121199703 [1,0,0,1,0,0|2,0,0]=4 2912 B5R1.3 NNC1CC1 MCULE-8598538666 [1,0,0,1,0,0|2,0,0]=4 2913 B5R1.3 NOC1CC1 MCULE-5379816123 [1,0,0,1,0,0|1,0,0]=3 2914 B5R1.3 O=CC1CC1 MCULE-9773190262 [1,0,0,1,0,0|2,0,0]=4 2915 B5R1.3 OCC1CC1 MCULE-4492474357 [1,0,0,1,0,0|1,0,0]=3 2916 B5R1.3 OCC1CO1 MCULE-2158628585 [1,0,0,1,0,0|0,0,0]=2 2917 B5R1.3 OCC1CO1 MCULE-4063620133 [1,0,0,1,0,0|0,0,0]=2 2918 B5R1.3 OC[C@@H]1CO1 MCULE-4213198809 [1,0,0,1,0,0|0,0,0]=2 2919 B5R1.3 OC[C@@H]1CO1 MCULE-6922911793 [1,0,0,1,0,0|0,0,0]=2 2920 B5R1.3 OC[C@H]1CO1 MCULE-2018407404 [1,0,0,1,0,0|0,0,0]=2 2921 B5R1.3 OC[C@H]1CO1 MCULE-9773081927 [1,0,0,1,0,0|0,0,0]=2 2922 B5R1.3 SCC1CC1 MCULE-9557919804 [1,0,0,1,0,0|1,1,0]=4 2923 B5R1.3 [C@@H]1(CO1)C=C MCULE-9776744095 [1,0,0,1,0,0|0,0,2]=4 2924 B5R1.3 [C@H]1(CO1)C=C MCULE-7934901088 [1,0,0,1,0,0|0,0,2]=4 2925 B5R1.4 CC1CC1N MCULE-4472318973 [1,0,0,1,0,0|2,0,0]=4 2926 B5R1.4 CC1CC1N MCULE-8037315228 [1,0,0,1,0,0|2,0,0]=4 2927 B5R1.4 CC1CC1O MCULE-2006758475 [1,0,0,1,0,0|1,0,0]=3 2928 B5R1.4 CC1OC1C MCULE-9780363671 [1,0,0,1,0,0|2,0,0]=4 2929 B5R1.4 C[C@@H]1C[C@@H]1N MCULE-6282896395 [1,0,0,1,0,0|2,0,0]=4 2930 B5R1.4 C[C@@H]1C[C@H]1N MCULE-1526017761 [1,0,0,1,0,0|2,0,0]=4 2931 B5R1.4 C[C@@H]1C[C@H]1N MCULE-7111745511 [1,0,0,1,0,0|2,0,0]=4 2932 B5R1.4 C[C@@H]1C[C@H]1N MCULE-7879046644 [1,0,0,1,0,0|2,0,0]=4 2933 B5R1.4 C[C@@H]1C[C@H]1N MCULE-9805986423 [1,0,0,1,0,0|2,0,0]=4 2934 B5R1.4 C[C@@H]1O[C@@H]1C MCULE-4355544092 [1,0,0,1,0,0|2,0,0]=4 2935 B5R1.4 C[C@@H]1O[C@H]1C MCULE-1930253682 [1,0,0,1,0,0|2,0,0]=4 2936 B5R1.4 C[C@H]1C[C@@H]1N MCULE-9525222696 [1,0,0,1,0,0|2,0,0]=4 2937 B5R1.4 C[C@H]1C[C@@H]1N MCULE-9658987958 [1,0,0,1,0,0|2,0,0]=4 2938 B5R1.4 C[C@H]1C[C@H]1N MCULE-4953477750 [1,0,0,1,0,0|2,0,0]=4 2939 B5R1.4 C[C@H]1C[C@H]1N MCULE-6429810931 [1,0,0,1,0,0|2,0,0]=4 2940 B5R1.4 C[C@H]1O[C@@H]1C MCULE-4354089942 [1,0,0,1,0,0|2,0,0]=4 2941 B5R1.4 C[C@H]1O[C@@H]1C MCULE-7982793342 [1,0,0,1,0,0|2,0,0]=4 2942 B5R1.4 NC1CC1O MCULE-2677451452 [1,0,0,1,0,0|2,0,0]=4 2943 B5R1.4 NC1CC1O MCULE-2909581707 [1,0,0,1,0,0|2,0,0]=4 2944 B5R1.4 N[C@@H]1C[C@@H]1O MCULE-1950197706 [1,0,0,1,0,0|2,0,0]=4 2945 B5R1.4 N[C@@H]1C[C@H]1O MCULE-5188790849 [1,0,0,1,0,0|2,0,0]=4 2946 B5R1.4 N[C@@H]1C[C@H]1O MCULE-8531829585 [1,0,0,1,0,0|2,0,0]=4 2947 B5R1.4 N[C@H]1C[C@@H]1O MCULE-4699241997 [1,0,0,1,0,0|2,0,0]=4 2948 B5R1.4 N[C@H]1C[C@H]1O MCULE-3609246488 [1,0,0,1,0,0|2,0,0]=4 2949 B5R1.4 N[C@H]1C[C@H]1O MCULE-3860963329 [1,0,0,1,0,0|2,0,0]=4 2950 B7R1.1 BrCC1CCCC1 MCULE-2472505847 [0,1,0,1,0,0|2,0,0]=4 2951 B7R1.1 BrCC1CCNC1 MCULE-3841325509 [0,1,0,1,0,0|2,0,0]=4 2952 B7R1.1 BrCC1CCNC1 MCULE-4302321173 [0,1,0,1,0,0|2,0,0]=4 2953 B7R1.1 BrCC1CCNC1 MCULE-7802125485 [0,1,0,1,0,0|2,0,0]=4 2954 B7R1.1 BrCC1CCOC1 MCULE-5109533414 [0,1,0,1,0,0|1,0,0]=3 2955 B7R1.1 BrC[C@H]1CCOC1 MCULE-3326059942 [0,1,0,1,0,0|1,0,0]=3 2956 B7R1.1 C#CC1CCOC1 MCULE-6007232344 [0,1,0,1,0,0|1,0,1]=4 2957 B7R1.1 C1(CCNC1)CC MCULE-1733412139 [0,1,0,1,0,0|2,0,0]=4 2958 B7R1.1 C1(CCNC1)CC MCULE-9295480110 [0,1,0,1,0,0|2,0,0]=4 2959 B7R1.1 C1(CCNC1)CO MCULE-7897000858 [0,1,0,1,0,0|2,0,0]=4 2960 B7R1.1 C1(CCNC1)CO MCULE-9939548436 [0,1,0,1,0,0|2,0,0]=4 2961 B7R1.1 C1(CCNC1)OC MCULE-4107032989 [0,1,0,1,0,0|1,0,0]=3 2962 B7R1.1 C1(CCNC1)OC MCULE-7879953493 [0,1,0,1,0,0|1,0,0]=3 2963 B7R1.1 C1(CCOC1)CN MCULE-1674920995 [0,1,0,1,0,0|1,0,0]=3 2964 B7R1.1 C1(CCOC1)CN MCULE-9715233219 [0,1,0,1,0,0|1,0,0]=3 2965 B7R1.1 C1(CCOC1)CO MCULE-2350780678 [0,1,0,1,0,0|1,0,0]=3 2966 B7R1.1 C1(CCOC1)NC MCULE-8636753374 [0,1,0,1,0,0|1,0,0]=3 2967 B7R1.1 CC=C1CCCC1 MCULE-9763131004 [0,1,0,1,0,0|2,0,0]=4 2968 B7R1.1 CC=C1CCNC1 MCULE-9077980338 [0,1,0,1,0,0|2,0,0]=4 2969 B7R1.1 CC=C1CCNC1 MCULE-9519724391 [0,1,0,1,0,0|2,0,0]=4 2970 B7R1.1 CCC1CCCC1 MCULE-1974854934 [0,1,0,1,0,0|2,0,0]=4 2971 B7R1.1 CCC1CCCN1 MCULE-1775351089 [0,1,0,1,0,0|2,0,0]=4 2972 B7R1.1 CCC1CCCN1 MCULE-2065682250 [0,1,0,1,0,0|2,0,0]=4 2973 B7R1.1 CCC1CCCN1 MCULE-8326168982 [0,1,0,1,0,0|2,0,0]=4 2974 B7R1.1 CCC1CCCN1 MCULE-9831560442 [0,1,0,1,0,0|2,0,0]=4 2975 B7R1.1 CCC1CCNC1 MCULE-1558031098 [0,1,0,1,0,0|2,0,0]=4 2976 B7R1.1 CCC1CCNC1 MCULE-1877930466 [0,1,0,1,0,0|2,0,0]=4 2977 B7R1.1 CCN1CCCC1 MCULE-3590039255 [0,1,0,1,0,0|2,0,0]=4 2978 B7R1.1 CC[C@@H]1CCCN1 MCULE-1829706908 [0,1,0,1,0,0|2,0,0]=4 2979 B7R1.1 CC[C@@H]1CCCN1 MCULE-6310895621 [0,1,0,1,0,0|2,0,0]=4 2980 B7R1.1 CC[C@@H]1CCCN1 MCULE-6770634475 [0,1,0,1,0,0|2,0,0]=4 2981 B7R1.1 CC[C@@H]1CCCN1 MCULE-9259891597 [0,1,0,1,0,0|2,0,0]=4 2982 B7R1.1 CC[C@@H]1CCNC1 MCULE-1468303255 [0,1,0,1,0,0|2,0,0]=4 2983 B7R1.1 CC[C@@H]1CCNC1 MCULE-2434021547 [0,1,0,1,0,0|2,0,0]=4 2984 B7R1.1 CC[C@@H]1CCNC1 MCULE-4288710106 [0,1,0,1,0,0|2,0,0]=4 2985 B7R1.1 CC[C@@H]1CCNC1 MCULE-5295271815 [0,1,0,1,0,0|2,0,0]=4 2986 B7R1.1 CC[C@H]1CCCN1 MCULE-2347458277 [0,1,0,1,0,0|2,0,0]=4 2987 B7R1.1 CC[C@H]1CCCN1 MCULE-3796565634 [0,1,0,1,0,0|2,0,0]=4 2988 B7R1.1 CC[C@H]1CCCN1 MCULE-6193768639 [0,1,0,1,0,0|2,0,0]=4 2989 B7R1.1 CC[C@H]1CCCN1 MCULE-9679619003 [0,1,0,1,0,0|2,0,0]=4 2990 B7R1.1 CC[C@H]1CCNC1 MCULE-5122116015 [0,1,0,1,0,0|2,0,0]=4 2991 B7R1.1 CC[C@H]1CCNC1 MCULE-5302237772 [0,1,0,1,0,0|2,0,0]=4 2992 B7R1.1 CC[C@H]1CCNC1 MCULE-9447387540 [0,1,0,1,0,0|2,0,0]=4 2993 B7R1.1 CC[C@H]1CCNC1 MCULE-9743799071 [0,1,0,1,0,0|2,0,0]=4 2994 B7R1.1 CNC1CCCC1 MCULE-1391832163 [0,1,0,1,0,0|2,0,0]=4 2995 B7R1.1 CNC1CCCC1 MCULE-8242451793 [0,1,0,1,0,0|2,0,0]=4 2996 B7R1.1 CNC1CCNC1 MCULE-5544853841 [0,1,0,1,0,0|2,0,0]=4 2997 B7R1.1 CNC1CCNC1 MCULE-9402107922 [0,1,0,1,0,0|2,0,0]=4 2998 B7R1.1 CNC1CCOC1 MCULE-5628928593 [0,1,0,1,0,0|1,0,0]=3 2999 B7R1.1 CNC1CCOC1 MCULE-7465078745 [0,1,0,1,0,0|1,0,0]=3 3000 B7R1.1 CNC1CCOC1 MCULE-8928979869 [0,1,0,1,0,0|1,0,0]=3 3001 B7R1.1 CNC1CCSC1 MCULE-1603222229 [0,1,0,1,0,0|1,1,0]=4 3002 B7R1.1 CNC1CCSC1 MCULE-5376977039 [0,1,0,1,0,0|1,1,0]=4 3003 B7R1.1 CNC1CCSC1 MCULE-9789640029 [0,1,0,1,0,0|1,1,0]=4 3004 B7R1.1 CNC1CSSC1 MCULE-4275371555 [0,1,0,1,0,0|1,1,0]=4 3005 B7R1.1 CN[C@@H]1CCNC1 MCULE-1090651309 [0,1,0,1,0,0|2,0,0]=4 3006 B7R1.1 CN[C@@H]1CCNC1 MCULE-6088625234 [0,1,0,1,0,0|2,0,0]=4 3007 B7R1.1 CN[C@@H]1CCNC1 MCULE-8530771803 [0,1,0,1,0,0|2,0,0]=4 3008 B7R1.1 CN[C@@H]1CCNC1 MCULE-9769572717 [0,1,0,1,0,0|2,0,0]=4 3009 B7R1.1 CN[C@@H]1CCOC1 MCULE-2275496757 [0,1,0,1,0,0|1,0,0]=3 3010 B7R1.1 CN[C@@H]1CCOC1 MCULE-4479731635 [0,1,0,1,0,0|1,0,0]=3 3011 B7R1.1 CN[C@@H]1CCOC1 MCULE-4936509842 [0,1,0,1,0,0|1,0,0]=3 3012 B7R1.1 CN[C@@H]1CCOC1 MCULE-7543653230 [0,1,0,1,0,0|1,0,0]=3 3013 B7R1.1 CN[C@H]1CCNC1 MCULE-3142856248 [0,1,0,1,0,0|2,0,0]=4 3014 B7R1.1 CN[C@H]1CCNC1 MCULE-7615640017 [0,1,0,1,0,0|2,0,0]=4 3015 B7R1.1 CN[C@H]1CCNC1 MCULE-9192229718 [0,1,0,1,0,0|2,0,0]=4 3016 B7R1.1 CN[C@H]1CCOC1 MCULE-3884907072 [0,1,0,1,0,0|1,0,0]=3 3017 B7R1.1 CN[C@H]1CCOC1 MCULE-5671082057 [0,1,0,1,0,0|1,0,0]=3 3018 B7R1.1 CN[C@H]1CCOC1 MCULE-7223789451 [0,1,0,1,0,0|1,0,0]=3 3019 B7R1.1 CN[C@H]1CCOC1 MCULE-7903690510 [0,1,0,1,0,0|1,0,0]=3 3020 B7R1.1 COC1=CCCC1 MCULE-6260649761 [0,1,0,1,0,0|1,0,1]=4 3021 B7R1.1 COC1=NCCC1 MCULE-2625712954 [0,1,0,1,0,0|1,0,1]=4 3022 B7R1.1 COC1CC=CC1 MCULE-3537302351 [0,1,0,1,0,0|1,0,0]=3 3023 B7R1.1 COC1CCCC1 MCULE-7539347010 [0,1,0,1,0,0|1,0,0]=3 3024 B7R1.1 COC1CCCO1 MCULE-8363423240 [0,1,0,1,0,0|1,0,0]=3 3025 B7R1.1 COC1CCNC1 MCULE-1194889067 [0,1,0,1,0,0|1,0,0]=3 3026 B7R1.1 COC1CCNC1 MCULE-2551543855 [0,1,0,1,0,0|1,0,0]=3 3027 B7R1.1 COC1CNOC1 MCULE-1407072401 [0,1,0,1,0,0|0,0,0]=2 3028 B7R1.1 COC1CNOC1 MCULE-3670243548 [0,1,0,1,0,0|0,0,0]=2 3029 B7R1.1 COC1OCCO1 MCULE-9935127218 [0,1,0,1,0,0|2,0,0]=4 3030 B7R1.1 CO[C@@H]1CCNC1 MCULE-1457133388 [0,1,0,1,0,0|1,0,0]=3 3031 B7R1.1 CO[C@@H]1CCNC1 MCULE-5592053485 [0,1,0,1,0,0|1,0,0]=3 3032 B7R1.1 CO[C@@H]1CCNC1 MCULE-9586958523 [0,1,0,1,0,0|1,0,0]=3 3033 B7R1.1 CO[C@@H]1CCNC1 MCULE-9627985971 [0,1,0,1,0,0|1,0,0]=3 3034 B7R1.1 CO[C@H]1CCNC1 MCULE-4011037765 [0,1,0,1,0,0|1,0,0]=3 3035 B7R1.1 CO[C@H]1CCNC1 MCULE-6371005292 [0,1,0,1,0,0|1,0,0]=3 3036 B7R1.1 CO[C@H]1CCNC1 MCULE-6820243921 [0,1,0,1,0,0|1,0,0]=3 3037 B7R1.1 CO[C@H]1CCNC1 MCULE-9345557765 [0,1,0,1,0,0|1,0,0]=3 3038 B7R1.1 CSC1CCNC1 MCULE-8160363271 [0,1,0,1,0,0|1,1,0]=4 3039 B7R1.1 CSC1CCNC1 MCULE-8993526132 [0,1,0,1,0,0|1,1,0]=4 3040 B7R1.1 CS[C@@H]1CCNC1 MCULE-5068595479 [0,1,0,1,0,0|1,1,0]=4 3041 B7R1.1 CS[C@@H]1CCNC1 MCULE-7615711516 [0,1,0,1,0,0|1,1,0]=4 3042 B7R1.1 CS[C@@H]1CCNC1 MCULE-8265640185 [0,1,0,1,0,0|1,1,0]=4 3043 B7R1.1 CS[C@@H]1CCNC1 MCULE-9548332479 [0,1,0,1,0,0|1,1,0]=4 3044 B7R1.1 ClCC1=NOCC1 MCULE-8714304275 [0,1,0,1,0,0|2,0,0]=4 3045 B7R1.1 ClCC1CCCC1 MCULE-7652893931 [0,1,0,1,0,0|2,0,0]=4 3046 B7R1.1 ClCC1CCNC1 MCULE-3647066500 [0,1,0,1,0,0|2,0,0]=4 3047 B7R1.1 ClCC1CCNC1 MCULE-4046034551 [0,1,0,1,0,0|2,0,0]=4 3048 B7R1.1 ClCC1CCOC1 MCULE-1203835826 [0,1,0,1,0,0|1,0,0]=3 3049 B7R1.1 ClC[C@@H]1CCNC1 MCULE-3561633948 [0,1,0,1,0,0|2,0,0]=4 3050 B7R1.1 ClC[C@@H]1CCNC1 MCULE-9146547190 [0,1,0,1,0,0|2,0,0]=4 3051 B7R1.1 ClC[C@H]1CCNC1 MCULE-1113644310 [0,1,0,1,0,0|2,0,0]=4 3052 B7R1.1 ClC[C@H]1CCNC1 MCULE-4950070763 [0,1,0,1,0,0|2,0,0]=4 3053 B7R1.1 FCC1CCNC1 MCULE-1978414491 [0,1,0,1,0,0|2,0,0]=4 3054 B7R1.1 FCC1CCNC1 MCULE-5950087621 [0,1,0,1,0,0|2,0,0]=4 3055 B7R1.1 FCC1CCNC1 MCULE-7750703127 [0,1,0,1,0,0|2,0,0]=4 3056 B7R1.1 FCC1CCNC1 MCULE-8603606998 [0,1,0,1,0,0|2,0,0]=4 3057 B7R1.1 FC[C@@H]1CCNC1 MCULE-2159002313 [0,1,0,1,0,0|2,0,0]=4 3058 B7R1.1 FC[C@@H]1CCNC1 MCULE-4712597711 [0,1,0,1,0,0|2,0,0]=4 3059 B7R1.1 FC[C@@H]1CCNC1 MCULE-6166975534 [0,1,0,1,0,0|2,0,0]=4 3060 B7R1.1 FC[C@@H]1CCNC1 MCULE-7608233986 [0,1,0,1,0,0|2,0,0]=4 3061 B7R1.1 FC[C@H]1CCNC1 MCULE-2828011524 [0,1,0,1,0,0|2,0,0]=4 3062 B7R1.1 FC[C@H]1CCNC1 MCULE-4192540640 [0,1,0,1,0,0|2,0,0]=4 3063 B7R1.1 FC[C@H]1CCNC1 MCULE-5280605995 [0,1,0,1,0,0|2,0,0]=4 3064 B7R1.1 FC[C@H]1CCNC1 MCULE-8886310417 [0,1,0,1,0,0|2,0,0]=4 3065 B7R1.1 ICC1CCCC1 MCULE-5940886897 [0,1,0,1,0,0|2,0,0]=4 3066 B7R1.1 ICC1CCNC1 MCULE-4259439945 [0,1,0,1,0,0|2,0,0]=4 3067 B7R1.1 ICC1CCNC1 MCULE-6061564929 [0,1,0,1,0,0|2,0,0]=4 3068 B7R1.1 ICC1CCOC1 MCULE-2014671156 [0,1,0,1,0,0|1,0,0]=3 3069 B7R1.1 IC[C@H]1CCOC1 MCULE-5163407500 [0,1,0,1,0,0|1,0,0]=3 3070 B7R1.1 N#CC1CCOC1 MCULE-5555423051 [0,1,0,1,0,0|1,0,1]=4 3071 B7R1.1 N#C[C@@H]1CCOC1 MCULE-4697885787 [0,1,0,1,0,0|1,0,1]=4 3072 B7R1.1 N#C[C@@H]1CCOC1 MCULE-7073460204 [0,1,0,1,0,0|1,0,1]=4 3073 B7R1.1 N#C[C@H]1CCOC1 MCULE-6745266026 [0,1,0,1,0,0|1,0,1]=4 3074 B7R1.1 N#C[C@H]1CCOC1 MCULE-6946151061 [0,1,0,1,0,0|1,0,1]=4 3075 B7R1.1 NCC1CCCC1 MCULE-3629796849 [0,1,0,1,0,0|2,0,0]=4 3076 B7R1.1 NCC1CCCC1 MCULE-8453900433 [0,1,0,1,0,0|2,0,0]=4 3077 B7R1.1 NCC1CCNC1 MCULE-1458513231 [0,1,0,1,0,0|2,0,0]=4 3078 B7R1.1 NCC1CCNC1 MCULE-3817893631 [0,1,0,1,0,0|2,0,0]=4 3079 B7R1.1 NCC1CCOC1 MCULE-4208746127 [0,1,0,1,0,0|1,0,0]=3 3080 B7R1.1 NCC1CCOC1 MCULE-6540410947 [0,1,0,1,0,0|1,0,0]=3 3081 B7R1.1 NCC1CCSC1 MCULE-6868901477 [0,1,0,1,0,0|1,1,0]=4 3082 B7R1.1 NCC1COCO1 MCULE-1657884847 [0,1,0,1,0,0|2,0,0]=4 3083 B7R1.1 NCC1COCO1 MCULE-9310217083 [0,1,0,1,0,0|2,0,0]=4 3084 B7R1.1 NC[C@@H]1CCOC1 MCULE-2941934022 [0,1,0,1,0,0|1,0,0]=3 3085 B7R1.1 NC[C@@H]1CCOC1 MCULE-2981279377 [0,1,0,1,0,0|1,0,0]=3 3086 B7R1.1 NC[C@@H]1CCOC1 MCULE-6671508282 [0,1,0,1,0,0|1,0,0]=3 3087 B7R1.1 NC[C@@H]1CCOC1 MCULE-7170580817 [0,1,0,1,0,0|1,0,0]=3 3088 B7R1.1 NC[C@H]1CCOC1 MCULE-1537228220 [0,1,0,1,0,0|1,0,0]=3 3089 B7R1.1 NC[C@H]1CCOC1 MCULE-2673094483 [0,1,0,1,0,0|1,0,0]=3 3090 B7R1.1 NC[C@H]1CCOC1 MCULE-4873739830 [0,1,0,1,0,0|1,0,0]=3 3091 B7R1.1 NC[C@H]1CCOC1 MCULE-6059527282 [0,1,0,1,0,0|1,0,0]=3 3092 B7R1.1 NNC1CCOC1 MCULE-5497635104 [0,1,0,1,0,0|2,0,0]=4 3093 B7R1.1 NNC1CCOC1 MCULE-9086625827 [0,1,0,1,0,0|2,0,0]=4 3094 B7R1.1 NNC1CCOC1 MCULE-9696991785 [0,1,0,1,0,0|2,0,0]=4 3095 B7R1.1 NN[C@@H]1CCOC1 MCULE-5277138269 [0,1,0,1,0,0|2,0,0]=4 3096 B7R1.1 NN[C@@H]1CCOC1 MCULE-5921785384 [0,1,0,1,0,0|2,0,0]=4 3097 B7R1.1 NN[C@@H]1CCOC1 MCULE-7398479477 [0,1,0,1,0,0|2,0,0]=4 3098 B7R1.1 NN[C@@H]1CCOC1 MCULE-9971593238 [0,1,0,1,0,0|2,0,0]=4 3099 B7R1.1 NN[C@H]1CCOC1 MCULE-2032105408 [0,1,0,1,0,0|2,0,0]=4 3100 B7R1.1 NN[C@H]1CCOC1 MCULE-4857620237 [0,1,0,1,0,0|2,0,0]=4 3101 B7R1.1 NN[C@H]1CCOC1 MCULE-5796183363 [0,1,0,1,0,0|2,0,0]=4 3102 B7R1.1 NN[C@H]1CCOC1 MCULE-8921088992 [0,1,0,1,0,0|2,0,0]=4 3103 B7R1.1 NOC1CCCC1 MCULE-1504814106 [0,1,0,1,0,0|2,0,0]=4 3104 B7R1.1 NOC1CCCC1 MCULE-1973418119 [0,1,0,1,0,0|2,0,0]=4 3105 B7R1.1 NOC1CCOC1 MCULE-1016688849 [0,1,0,1,0,0|1,0,0]=3 3106 B7R1.1 O=CC1CCOC1 MCULE-9515567606 [0,1,0,1,0,0|1,0,1]=4 3107 B7R1.1 O=C[C@@H]1CCOC1 MCULE-5181257964 [0,1,0,1,0,0|1,0,1]=4 3108 B7R1.1 O=C[C@H]1CCOC1 MCULE-4532427366 [0,1,0,1,0,0|1,0,1]=4 3109 B7R1.1 OCC1CCCC1 MCULE-2985338933 [0,1,0,1,0,0|2,0,0]=4 3110 B7R1.1 OCC1CCNC1 MCULE-7883947611 [0,1,0,1,0,0|2,0,0]=4 3111 B7R1.1 OCC1CCNC1 MCULE-9689521155 [0,1,0,1,0,0|2,0,0]=4 3112 B7R1.1 OCC1CCOC1 MCULE-8926405046 [0,1,0,1,0,0|1,0,0]=3 3113 B7R1.1 OCC1CCON1 MCULE-1199975481 [0,1,0,1,0,0|2,0,0]=4 3114 B7R1.1 OCC1CCON1 MCULE-4772487016 [0,1,0,1,0,0|2,0,0]=4 3115 B7R1.1 OCC1CCSC1 MCULE-2226132734 [0,1,0,1,0,0|1,1,0]=4 3116 B7R1.1 OCC1COCO1 MCULE-3470022742 [0,1,0,1,0,0|2,0,0]=4 3117 B7R1.1 OC[C@@H]1CCNC1 MCULE-3126404140 [0,1,0,1,0,0|2,0,0]=4 3118 B7R1.1 OC[C@@H]1CCNC1 MCULE-4876549629 [0,1,0,1,0,0|2,0,0]=4 3119 B7R1.1 OC[C@@H]1CCNC1 MCULE-7050415145 [0,1,0,1,0,0|2,0,0]=4 3120 B7R1.1 OC[C@@H]1CCNC1 MCULE-8785146407 [0,1,0,1,0,0|2,0,0]=4 3121 B7R1.1 OC[C@@H]1CCOC1 MCULE-2004616524 [0,1,0,1,0,0|1,0,0]=3 3122 B7R1.1 OC[C@@H]1CCOC1 MCULE-3801423698 [0,1,0,1,0,0|1,0,0]=3 3123 B7R1.1 OC[C@H]1CCNC1 MCULE-3909770597 [0,1,0,1,0,0|2,0,0]=4 3124 B7R1.1 OC[C@H]1CCNC1 MCULE-5006682123 [0,1,0,1,0,0|2,0,0]=4 3125 B7R1.1 OC[C@H]1CCNC1 MCULE-8265382423 [0,1,0,1,0,0|2,0,0]=4 3126 B7R1.1 OC[C@H]1CCNC1 MCULE-8371969680 [0,1,0,1,0,0|2,0,0]=4 3127 B7R1.1 OC[C@H]1CCOC1 MCULE-4226412289 [0,1,0,1,0,0|1,0,0]=3 3128 B7R1.1 OC[C@H]1CCOC1 MCULE-9076004118 [0,1,0,1,0,0|1,0,0]=3 3129 B7R1.1 SCC1CCCC1 MCULE-7973872166 [0,1,0,1,0,0|2,0,0]=4 3130 B7R1.1 SCC1CCOC1 MCULE-4504314486 [0,1,0,1,0,0|1,0,0]=3 3131 B7R1.2 C1(CCN(C1)C)N MCULE-3665102712 [0,1,0,1,0,0|2,0,0]=4 3132 B7R1.2 C1(CCN(C1)C)O MCULE-5142099784 [0,1,0,1,0,0|2,0,0]=4 3133 B7R1.2 CC1=NC(CC1)C MCULE-9630685459 [0,1,0,1,0,0|2,0,0]=4 3134 B7R1.2 CC1CC(=O)CO1 MCULE-7022597277 [0,1,0,1,0,0|2,0,0]=4 3135 B7R1.2 CC1CC(CO1)N MCULE-5031195609 [0,1,0,1,0,0|2,0,0]=4 3136 B7R1.2 CC1CC(CO1)N MCULE-6627149239 [0,1,0,1,0,0|2,0,0]=4 3137 B7R1.2 CC1CC(CO1)O MCULE-1304022283 [0,1,0,1,0,0|2,0,0]=4 3138 B7R1.2 CC1CCC(=O)C1 MCULE-6716533429 [0,1,0,1,0,0|2,0,0]=4 3139 B7R1.2 CC1CCC(C1)Br MCULE-3834311364 [0,1,0,1,0,0|2,0,0]=4 3140 B7R1.2 CC1CCC(C1)Cl MCULE-7669391571 [0,1,0,1,0,0|2,0,0]=4 3141 B7R1.2 CC1CCC(C1)N MCULE-3681457592 [0,1,0,1,0,0|2,0,0]=4 3142 B7R1.2 CC1CCC(C1)N MCULE-8238390084 [0,1,0,1,0,0|2,0,0]=4 3143 B7R1.2 CC1CCC(C1)O MCULE-7892602703 [0,1,0,1,0,0|2,0,0]=4 3144 B7R1.2 CC1CCC(N1)C MCULE-8652550641 [0,1,0,1,0,0|2,0,0]=4 3145 B7R1.2 CC1CCC(N1)C MCULE-9945795318 [0,1,0,1,0,0|2,0,0]=4 3146 B7R1.2 CC1CCC(O1)C MCULE-6766843462 [0,1,0,1,0,0|2,0,0]=4 3147 B7R1.2 CC1CC[C@H](N1)C MCULE-7537248866 [0,1,0,1,0,0|2,0,0]=4 3148 B7R1.2 CC1CC[C@H](N1)C MCULE-8839413924 [0,1,0,1,0,0|2,0,0]=4 3149 B7R1.2 CC1CNC(C1)C MCULE-3051496448 [0,1,0,1,0,0|2,0,0]=4 3150 B7R1.2 CC1CNC(C1)C MCULE-9324057254 [0,1,0,1,0,0|2,0,0]=4 3151 B7R1.2 CC1COC(=O)C1 MCULE-7226555218 [0,1,0,1,0,0|1,0,1]=4 3152 B7R1.2 CC1COC(O1)C MCULE-5670718739 [0,1,0,1,0,0|2,0,0]=4 3153 B7R1.2 CN1CCC(=O)C1 MCULE-4017029823 [0,1,0,1,0,0|2,0,0]=4 3154 B7R1.2 CN1CCC(=O)C1 MCULE-8684002131 [0,1,0,1,0,0|2,0,0]=4 3155 B7R1.2 CN1CCC(C1)Br MCULE-3493698258 [0,1,0,1,0,0|2,0,0]=4 3156 B7R1.2 CN1CCC(C1)Cl MCULE-4289154186 [0,1,0,1,0,0|2,0,0]=4 3157 B7R1.2 CN1CCC(C1)I MCULE-7694112270 [0,1,0,1,0,0|2,0,0]=4 3158 B7R1.2 CN1CCC(C1)N MCULE-1293214424 [0,1,0,1,0,0|2,0,0]=4 3159 B7R1.2 CN1CCC(C1)N MCULE-1923071969 [0,1,0,1,0,0|2,0,0]=4 3160 B7R1.2 CN1CCC(C1)N MCULE-8906644208 [0,1,0,1,0,0|2,0,0]=4 3161 B7R1.2 CN1CCC(C1)O MCULE-7899934177 [0,1,0,1,0,0|2,0,0]=4 3162 B7R1.2 CN1CC[C@@H](C1)Br MCULE-3557435415 [0,1,0,1,0,0|2,0,0]=4 3163 B7R1.2 CN1CC[C@@H](C1)Cl MCULE-2590203116 [0,1,0,1,0,0|2,0,0]=4 3164 B7R1.2 CN1CC[C@@H](C1)I MCULE-9659903055 [0,1,0,1,0,0|2,0,0]=4 3165 B7R1.2 CN1CC[C@@H](C1)N MCULE-2789588017 [0,1,0,1,0,0|2,0,0]=4 3166 B7R1.2 CN1CC[C@@H](C1)N MCULE-3064746432 [0,1,0,1,0,0|2,0,0]=4 3167 B7R1.2 CN1CC[C@@H](C1)N MCULE-3417580502 [0,1,0,1,0,0|2,0,0]=4 3168 B7R1.2 CN1CC[C@@H](C1)N MCULE-4507441839 [0,1,0,1,0,0|2,0,0]=4 3169 B7R1.2 CN1CC[C@@H](C1)N MCULE-7304925156 [0,1,0,1,0,0|2,0,0]=4 3170 B7R1.2 CN1CC[C@@H](C1)N MCULE-8752975101 [0,1,0,1,0,0|2,0,0]=4 3171 B7R1.2 CN1CC[C@@H](C1)O MCULE-1236945758 [0,1,0,1,0,0|2,0,0]=4 3172 B7R1.2 CN1CC[C@@H](C1)O MCULE-4275527304 [0,1,0,1,0,0|2,0,0]=4 3173 B7R1.2 CN1CC[C@H](C1)Br MCULE-5126641770 [0,1,0,1,0,0|2,0,0]=4 3174 B7R1.2 CN1CC[C@H](C1)Cl MCULE-6900681925 [0,1,0,1,0,0|2,0,0]=4 3175 B7R1.2 CN1CC[C@H](C1)I MCULE-5536628497 [0,1,0,1,0,0|2,0,0]=4 3176 B7R1.2 CN1CC[C@H](C1)N MCULE-1557911450 [0,1,0,1,0,0|2,0,0]=4 3177 B7R1.2 CN1CC[C@H](C1)N MCULE-2070741351 [0,1,0,1,0,0|2,0,0]=4 3178 B7R1.2 CN1CC[C@H](C1)N MCULE-4287469497 [0,1,0,1,0,0|2,0,0]=4 3179 B7R1.2 CN1CC[C@H](C1)N MCULE-6191225667 [0,1,0,1,0,0|2,0,0]=4 3180 B7R1.2 CN1CC[C@H](C1)N MCULE-7699833473 [0,1,0,1,0,0|2,0,0]=4 3181 B7R1.2 CN1CC[C@H](C1)N MCULE-8419212613 [0,1,0,1,0,0|2,0,0]=4 3182 B7R1.2 CN1CC[C@H](C1)O MCULE-6665002754 [0,1,0,1,0,0|2,0,0]=4 3183 B7R1.2 CN1CC[C@H](C1)O MCULE-8080661086 [0,1,0,1,0,0|2,0,0]=4 3184 B7R1.2 C[C@@H]1CC[C@@H](C1)N MCULE-9471729241 [0,1,0,1,0,0|2,0,0]=4 3185 B7R1.2 C[C@@H]1CC[C@H](C1)N MCULE-5368765184 [0,1,0,1,0,0|2,0,0]=4 3186 B7R1.2 C[C@@H]1CC[C@H](N1)C MCULE-1673197449 [0,1,0,1,0,0|2,0,0]=4 3187 B7R1.2 C[C@@H]1CC[C@H](N1)C MCULE-2729648845 [0,1,0,1,0,0|2,0,0]=4 3188 B7R1.2 C[C@@H]1CC[C@H](N1)C MCULE-4960548681 [0,1,0,1,0,0|2,0,0]=4 3189 B7R1.2 C[C@@H]1CC[C@H](N1)C MCULE-9686295802 [0,1,0,1,0,0|2,0,0]=4 3190 B7R1.2 C[C@@H]1COC(=O)C1 MCULE-1121808555 [0,1,0,1,0,0|1,0,1]=4 3191 B7R1.2 C[C@@H]1COC(=O)C1 MCULE-1627827491 [0,1,0,1,0,0|1,0,1]=4 3192 B7R1.2 C[C@H]1CCC(=O)C1 MCULE-7319626625 [0,1,0,1,0,0|2,0,0]=4 3193 B7R1.2 C[C@H]1CC[C@@H](C1)N MCULE-1080493056 [0,1,0,1,0,0|2,0,0]=4 3194 B7R1.2 C[C@H]1CC[C@@H](N1)C MCULE-4583560293 [0,1,0,1,0,0|2,0,0]=4 3195 B7R1.2 C[C@H]1CC[C@@H](N1)C MCULE-8297612622 [0,1,0,1,0,0|2,0,0]=4 3196 B7R1.2 C[C@H]1CC[C@@H](N1)C MCULE-8699883146 [0,1,0,1,0,0|2,0,0]=4 3197 B7R1.2 C[C@H]1CC[C@@H](N1)C MCULE-8917914682 [0,1,0,1,0,0|2,0,0]=4 3198 B7R1.2 C[C@H]1CC[C@H](C1)C MCULE-8059507758 [0,1,0,1,0,0|2,0,0]=4 3199 B7R1.2 C[C@H]1CC[C@H](C1)N MCULE-7070775136 [0,1,0,1,0,0|2,0,0]=4 3200 B7R1.2 C[C@H]1CC[C@H](N1)C MCULE-1935235769 [0,1,0,1,0,0|2,0,0]=4 3201 B7R1.2 C[C@H]1CC[C@H](N1)C MCULE-9833374653 [0,1,0,1,0,0|2,0,0]=4 3202 B7R1.2 C[C@H]1COC(=O)C1 MCULE-6050720348 [0,1,0,1,0,0|1,0,1]=4 3203 B7R1.2 [C@H]1(CCC(=O)C1)C MCULE-3827565169 [0,1,0,1,0,0|2,0,0]=4 3204 B7R1.3 BrC1=CCOCC1 MCULE-7609274912 [0,1,0,1,0,0|1,0,1]=4 3205 B7R1.3 BrC1CCCCC1 MCULE-7879113781 [0,1,0,1,0,0|2,0,0]=4 3206 B7R1.3 BrC1CCCCN1 MCULE-3863852230 [0,1,0,1,0,0|2,0,0]=4 3207 B7R1.3 BrC1CCCCO1 MCULE-3659439382 [0,1,0,1,0,0|1,0,0]=3 3208 B7R1.3 BrC1CCCNC1 MCULE-5734359694 [0,1,0,1,0,0|2,0,0]=4 3209 B7R1.3 BrC1CCCNC1 MCULE-8772964999 [0,1,0,1,0,0|2,0,0]=4 3210 B7R1.3 BrC1CCCNC1 MCULE-9975168983 [0,1,0,1,0,0|2,0,0]=4 3211 B7R1.3 BrC1CCCOC1 MCULE-5781416415 [0,1,0,1,0,0|1,0,0]=3 3212 B7R1.3 BrC1CCNCC1 MCULE-2524082443 [0,1,0,1,0,0|2,0,0]=4 3213 B7R1.3 BrC1CCNCC1 MCULE-9389571955 [0,1,0,1,0,0|2,0,0]=4 3214 B7R1.3 BrC1CCNCC1 MCULE-9646097822 [0,1,0,1,0,0|2,0,0]=4 3215 B7R1.3 BrC1CCOCC1 MCULE-4896539126 [0,1,0,1,0,0|1,0,0]=3 3216 B7R1.3 BrC1CCSCC1 MCULE-1239956252 [0,1,0,1,0,0|1,1,0]=4 3217 B7R1.3 C1(CCCNC1)F MCULE-2873742972 [0,1,0,1,0,0|2,0,0]=4 3218 B7R1.3 C1(CCCNC1)F MCULE-8247715411 [0,1,0,1,0,0|2,0,0]=4 3219 B7R1.3 C1(CCCNC1)N MCULE-2184623611 [0,1,0,1,0,0|2,0,0]=4 3220 B7R1.3 C1(CCCNC1)N MCULE-6177601832 [0,1,0,1,0,0|2,0,0]=4 3221 B7R1.3 C1(CCCNC1)O MCULE-5944071030 [0,1,0,1,0,0|2,0,0]=4 3222 B7R1.3 C1(CCCNC1)O MCULE-9769032939 [0,1,0,1,0,0|2,0,0]=4 3223 B7R1.3 C1(CCCOC1)N MCULE-7160456966 [0,1,0,1,0,0|1,0,0]=3 3224 B7R1.3 C1(CCCOC1)N MCULE-9418657332 [0,1,0,1,0,0|1,0,0]=3 3225 B7R1.3 C1(CNCCN1)C MCULE-7759957935 [0,1,0,1,0,0|2,0,0]=4 3226 B7R1.3 C1(CNCCO1)C MCULE-2805380245 [0,1,0,1,0,0|1,0,0]=3 3227 B7R1.3 C1(CNCCO1)C MCULE-3532041523 [0,1,0,1,0,0|1,0,0]=3 3228 B7R1.3 C=C1CCCCC1 MCULE-9812236661 [0,1,0,1,0,0|2,0,0]=4 3229 B7R1.3 C=C1CCCOC1 MCULE-5236529273 [0,1,0,1,0,0|1,0,1]=4 3230 B7R1.3 C=C1CCNCC1 MCULE-4460895436 [0,1,0,1,0,0|2,0,0]=4 3231 B7R1.3 C=C1CCNCC1 MCULE-6605411269 [0,1,0,1,0,0|2,0,0]=4 3232 B7R1.3 C=C1CCNCC1 MCULE-6729798105 [0,1,0,1,0,0|2,0,0]=4 3233 B7R1.3 C=C1CCOCC1 MCULE-2744722311 [0,1,0,1,0,0|1,0,0]=3 3234 B7R1.3 CB1OCCCO1 MCULE-5692862103 [0,1,0,1,0,0|2,0,0]=4 3235 B7R1.3 CC1=CCCCC1 MCULE-2795172496 [0,1,0,1,0,0|2,0,0]=4 3236 B7R1.3 CC1=CCCNC1 MCULE-8145216779 [0,1,0,1,0,0|2,0,0]=4 3237 B7R1.3 CC1=CCCNC1 MCULE-9021954061 [0,1,0,1,0,0|2,0,0]=4 3238 B7R1.3 CC1=CCNCC1 MCULE-1503915992 [0,1,0,1,0,0|2,0,0]=4 3239 B7R1.3 CC1=CCNCC1 MCULE-3349815065 [0,1,0,1,0,0|2,0,0]=4 3240 B7R1.3 CC1=NCCNC1 MCULE-2066788449 [0,1,0,1,0,0|2,0,0]=4 3241 B7R1.3 CC1CC=CCC1 MCULE-6343106785 [0,1,0,1,0,0|2,0,0]=4 3242 B7R1.3 CC1CCCCC1 MCULE-3843525768 [0,1,0,1,0,0|2,0,0]=4 3243 B7R1.3 CC1CCCCN1 MCULE-1741870990 [0,1,0,1,0,0|2,0,0]=4 3244 B7R1.3 CC1CCCCN1 MCULE-4453126703 [0,1,0,1,0,0|2,0,0]=4 3245 B7R1.3 CC1CCCCN1 MCULE-6620063962 [0,1,0,1,0,0|2,0,0]=4 3246 B7R1.3 CC1CCCCN1 MCULE-6838766744 [0,1,0,1,0,0|2,0,0]=4 3247 B7R1.3 CC1CCCCN1 MCULE-9227931620 [0,1,0,1,0,0|2,0,0]=4 3248 B7R1.3 CC1CCCCO1 MCULE-4439683294 [0,1,0,1,0,0|1,0,0]=3 3249 B7R1.3 CC1CCCNC1 MCULE-3344207132 [0,1,0,1,0,0|2,0,0]=4 3250 B7R1.3 CC1CCCNC1 MCULE-5707832183 [0,1,0,1,0,0|2,0,0]=4 3251 B7R1.3 CC1CCCNC1 MCULE-7033850891 [0,1,0,1,0,0|2,0,0]=4 3252 B7R1.3 CC1CCCNC1 MCULE-7153943487 [0,1,0,1,0,0|2,0,0]=4 3253 B7R1.3 CC1CCNCC1 MCULE-5873723365 [0,1,0,1,0,0|2,0,0]=4 3254 B7R1.3 CC1CCNCC1 MCULE-6994675149 [0,1,0,1,0,0|2,0,0]=4 3255 B7R1.3 CC1CCNCC1 MCULE-9043030659 [0,1,0,1,0,0|2,0,0]=4 3256 B7R1.3 CC1CCOCC1 MCULE-8623581625 [0,1,0,1,0,0|1,0,0]=3 3257 B7R1.3 CC1CCOCN1 MCULE-5420262342 [0,1,0,1,0,0|1,0,0]=3 3258 B7R1.3 CC1CCOCO1 MCULE-5013590651 [0,1,0,1,0,0|1,0,0]=3 3259 B7R1.3 CC1CNCCN1 MCULE-2536395443 [0,1,0,1,0,0|2,0,0]=4 3260 B7R1.3 CC1CNCCN1 MCULE-6313957247 [0,1,0,1,0,0|2,0,0]=4 3261 B7R1.3 CC1CNCCO1 MCULE-3071497485 [0,1,0,1,0,0|1,0,0]=3 3262 B7R1.3 CC1CNCCO1 MCULE-7956728736 [0,1,0,1,0,0|1,0,0]=3 3263 B7R1.3 CC1CNCCS1 MCULE-7391261862 [0,1,0,1,0,0|1,1,0]=4 3264 B7R1.3 CC1COCCN1 MCULE-1305824409 [0,1,0,1,0,0|1,0,0]=3 3265 B7R1.3 CC1COCCN1 MCULE-4570632464 [0,1,0,1,0,0|1,0,0]=3 3266 B7R1.3 CC1COCCN1 MCULE-6275555682 [0,1,0,1,0,0|1,0,0]=3 3267 B7R1.3 CC1COCCN1 MCULE-8711024794 [0,1,0,1,0,0|1,0,0]=3 3268 B7R1.3 CC1CSCCN1 MCULE-2923436126 [0,1,0,1,0,0|1,1,0]=4 3269 B7R1.3 CC1NCCCO1 MCULE-2236660860 [0,1,0,1,0,0|2,0,0]=4 3270 B7R1.3 CN1CC=CCC1 MCULE-1566475259 [0,1,0,1,0,0|2,0,0]=4 3271 B7R1.3 CN1CC=CCC1 MCULE-7879022625 [0,1,0,1,0,0|2,0,0]=4 3272 B7R1.3 CN1CCCCC1 MCULE-3308944277 [0,1,0,1,0,0|2,0,0]=4 3273 B7R1.3 CN1CCCCO1 MCULE-4407617276 [0,1,0,1,0,0|1,0,0]=3 3274 B7R1.3 CN1CCCCO1 MCULE-6297284655 [0,1,0,1,0,0|1,0,0]=3 3275 B7R1.3 CN1CCNCC1 MCULE-5570228782 [0,1,0,1,0,0|2,0,0]=4 3276 B7R1.3 CN1CCNCC1 MCULE-7182634479 [0,1,0,1,0,0|2,0,0]=4 3277 B7R1.3 CN1CCOCC1 MCULE-1649171852 [0,1,0,1,0,0|1,0,0]=3 3278 B7R1.3 CN1CCSCC1 MCULE-9816739759 [0,1,0,1,0,0|1,1,0]=4 3279 B7R1.3 CN1CSCSC1 MCULE-8189192675 [0,1,0,1,0,0|1,1,0]=4 3280 B7R1.3 C[C@@H]1CCCCN1 MCULE-1372285636 [0,1,0,1,0,0|2,0,0]=4 3281 B7R1.3 C[C@@H]1CCCCN1 MCULE-1676908545 [0,1,0,1,0,0|2,0,0]=4 3282 B7R1.3 C[C@@H]1CCCCN1 MCULE-4298634468 [0,1,0,1,0,0|2,0,0]=4 3283 B7R1.3 C[C@@H]1CCCCN1 MCULE-6629826210 [0,1,0,1,0,0|2,0,0]=4 3284 B7R1.3 C[C@@H]1CCCNC1 MCULE-1079173995 [0,1,0,1,0,0|2,0,0]=4 3285 B7R1.3 C[C@@H]1CCCNC1 MCULE-1230145662 [0,1,0,1,0,0|2,0,0]=4 3286 B7R1.3 C[C@@H]1CCCNC1 MCULE-3423787676 [0,1,0,1,0,0|2,0,0]=4 3287 B7R1.3 C[C@@H]1CCCNC1 MCULE-9303264483 [0,1,0,1,0,0|2,0,0]=4 3288 B7R1.3 C[C@@H]1CNCCN1 MCULE-2959336973 [0,1,0,1,0,0|2,0,0]=4 3289 B7R1.3 C[C@@H]1CNCCN1 MCULE-3870060141 [0,1,0,1,0,0|2,0,0]=4 3290 B7R1.3 C[C@@H]1CNCCN1 MCULE-4214817913 [0,1,0,1,0,0|2,0,0]=4 3291 B7R1.3 C[C@@H]1CNCCN1 MCULE-4368092239 [0,1,0,1,0,0|2,0,0]=4 3292 B7R1.3 C[C@@H]1CNCCO1 MCULE-1787977539 [0,1,0,1,0,0|1,0,0]=3 3293 B7R1.3 C[C@@H]1CNCCO1 MCULE-2608004746 [0,1,0,1,0,0|1,0,0]=3 3294 B7R1.3 C[C@@H]1CNCCO1 MCULE-5447097956 [0,1,0,1,0,0|1,0,0]=3 3295 B7R1.3 C[C@@H]1CNCCO1 MCULE-9396954187 [0,1,0,1,0,0|1,0,0]=3 3296 B7R1.3 C[C@@H]1COCCN1 MCULE-2750151013 [0,1,0,1,0,0|1,0,0]=3 3297 B7R1.3 C[C@@H]1COCCN1 MCULE-4003273424 [0,1,0,1,0,0|1,0,0]=3 3298 B7R1.3 C[C@@H]1COCCN1 MCULE-4627627990 [0,1,0,1,0,0|1,0,0]=3 3299 B7R1.3 C[C@@H]1COCCN1 MCULE-8600287111 [0,1,0,1,0,0|1,0,0]=3 3300 B7R1.3 C[C@@H]1CSCCN1 MCULE-2613889704 [0,1,0,1,0,0|1,1,0]=4 3301 B7R1.3 C[C@H]1CCCCN1 MCULE-3586455704 [0,1,0,1,0,0|2,0,0]=4 3302 B7R1.3 C[C@H]1CCCCN1 MCULE-5638638213 [0,1,0,1,0,0|2,0,0]=4 3303 B7R1.3 C[C@H]1CCCCN1 MCULE-5867717461 [0,1,0,1,0,0|2,0,0]=4 3304 B7R1.3 C[C@H]1CCCCN1 MCULE-7106826493 [0,1,0,1,0,0|2,0,0]=4 3305 B7R1.3 C[C@H]1CCCNC1 MCULE-3372852932 [0,1,0,1,0,0|2,0,0]=4 3306 B7R1.3 C[C@H]1CCCNC1 MCULE-5146147676 [0,1,0,1,0,0|2,0,0]=4 3307 B7R1.3 C[C@H]1CCCNC1 MCULE-7894943546 [0,1,0,1,0,0|2,0,0]=4 3308 B7R1.3 C[C@H]1CCCNC1 MCULE-8016414984 [0,1,0,1,0,0|2,0,0]=4 3309 B7R1.3 C[C@H]1CNCCN1 MCULE-1403559972 [0,1,0,1,0,0|2,0,0]=4 3310 B7R1.3 C[C@H]1CNCCN1 MCULE-5769724060 [0,1,0,1,0,0|2,0,0]=4 3311 B7R1.3 C[C@H]1CNCCO1 MCULE-3158147539 [0,1,0,1,0,0|1,0,0]=3 3312 B7R1.3 C[C@H]1CNCCO1 MCULE-5193705878 [0,1,0,1,0,0|1,0,0]=3 3313 B7R1.3 C[C@H]1CNCCO1 MCULE-8337677707 [0,1,0,1,0,0|1,0,0]=3 3314 B7R1.3 C[C@H]1CNCCO1 MCULE-9425432414 [0,1,0,1,0,0|1,0,0]=3 3315 B7R1.3 C[C@H]1COCCN1 MCULE-1467834624 [0,1,0,1,0,0|1,0,0]=3 3316 B7R1.3 C[C@H]1COCCN1 MCULE-3486079226 [0,1,0,1,0,0|1,0,0]=3 3317 B7R1.3 C[C@H]1COCCN1 MCULE-5726525044 [0,1,0,1,0,0|1,0,0]=3 3318 B7R1.3 C[C@H]1COCCN1 MCULE-9977133603 [0,1,0,1,0,0|1,0,0]=3 3319 B7R1.3 C[C@H]1CSCCN1 MCULE-4076273874 [0,1,0,1,0,0|1,1,0]=4 3320 B7R1.3 ClC1CCCCC1 MCULE-9519865350 [0,1,0,1,0,0|2,0,0]=4 3321 B7R1.3 ClC1CCCCO1 MCULE-3251653488 [0,1,0,1,0,0|1,0,0]=3 3322 B7R1.3 ClC1CCCNC1 MCULE-3870722463 [0,1,0,1,0,0|2,0,0]=4 3323 B7R1.3 ClC1CCCNC1 MCULE-8461718443 [0,1,0,1,0,0|2,0,0]=4 3324 B7R1.3 ClC1CCCOC1 MCULE-5733907796 [0,1,0,1,0,0|1,0,0]=3 3325 B7R1.3 ClC1CCNCC1 MCULE-1320213535 [0,1,0,1,0,0|2,0,0]=4 3326 B7R1.3 ClC1CCNCC1 MCULE-3278149456 [0,1,0,1,0,0|2,0,0]=4 3327 B7R1.3 ClC1CCOCC1 MCULE-5672440693 [0,1,0,1,0,0|1,0,0]=3 3328 B7R1.3 ClN1CCOCC1 MCULE-2275187473 [0,1,0,1,0,0|1,0,0]=3 3329 B7R1.3 Cl[C@@H]1CCCNC1 MCULE-1513190720 [0,1,0,1,0,0|2,0,0]=4 3330 B7R1.3 Cl[C@@H]1CCCNC1 MCULE-4702442384 [0,1,0,1,0,0|2,0,0]=4 3331 B7R1.3 Cl[C@H]1CCCNC1 MCULE-1906196638 [0,1,0,1,0,0|2,0,0]=4 3332 B7R1.3 Cl[C@H]1CCCNC1 MCULE-5435721723 [0,1,0,1,0,0|2,0,0]=4 3333 B7R1.3 FC1CCCCC1 MCULE-4555555520 [0,1,0,1,0,0|2,0,0]=4 3334 B7R1.3 FC1CCCCO1 MCULE-8724227177 [0,1,0,1,0,0|1,0,0]=3 3335 B7R1.3 FC1CCCNC1 MCULE-1207637035 [0,1,0,1,0,0|2,0,0]=4 3336 B7R1.3 FC1CCCNC1 MCULE-8874983109 [0,1,0,1,0,0|2,0,0]=4 3337 B7R1.3 FC1CCCOC1 MCULE-9003204358 [0,1,0,1,0,0|1,0,0]=3 3338 B7R1.3 FC1CCNCC1 MCULE-1146732226 [0,1,0,1,0,0|2,0,0]=4 3339 B7R1.3 FC1CCNCC1 MCULE-9481825539 [0,1,0,1,0,0|2,0,0]=4 3340 B7R1.3 F[C@@H]1CCCNC1 MCULE-1015853975 [0,1,0,1,0,0|2,0,0]=4 3341 B7R1.3 F[C@@H]1CCCNC1 MCULE-2442101978 [0,1,0,1,0,0|2,0,0]=4 3342 B7R1.3 F[C@@H]1CCCNC1 MCULE-3088687742 [0,1,0,1,0,0|2,0,0]=4 3343 B7R1.3 F[C@@H]1CCCNC1 MCULE-3298158493 [0,1,0,1,0,0|2,0,0]=4 3344 B7R1.3 F[C@H]1CCCNC1 MCULE-5863769143 [0,1,0,1,0,0|2,0,0]=4 3345 B7R1.3 F[C@H]1CCCNC1 MCULE-9142728260 [0,1,0,1,0,0|2,0,0]=4 3346 B7R1.3 F[C@H]1CCCNC1 MCULE-9496728832 [0,1,0,1,0,0|2,0,0]=4 3347 B7R1.3 F[C@H]1CCCNC1 MCULE-9795686850 [0,1,0,1,0,0|2,0,0]=4 3348 B7R1.3 IC1CCCCC1 MCULE-4499971048 [0,1,0,1,0,0|2,0,0]=4 3349 B7R1.3 IC1CCNCC1 MCULE-1161879837 [0,1,0,1,0,0|2,0,0]=4 3350 B7R1.3 IC1CCNCC1 MCULE-3953687682 [0,1,0,1,0,0|2,0,0]=4 3351 B7R1.3 IC1CCOCC1 MCULE-7226892860 [0,1,0,1,0,0|1,0,0]=3 3352 B7R1.3 IC1CCSCC1 MCULE-6684613275 [0,1,0,1,0,0|1,1,0]=4 3353 B7R1.3 IN1CCOCC1 MCULE-2342142292 [0,1,0,1,0,0|1,0,0]=3 3354 B7R1.3 IN1CCOCC1 MCULE-6623188938 [0,1,0,1,0,0|1,0,0]=3 3355 B7R1.3 NC1CCCCC1 MCULE-1274688385 [0,1,0,1,0,0|2,0,0]=4 3356 B7R1.3 NC1CCCCC1 MCULE-6218418825 [0,1,0,1,0,0|2,0,0]=4 3357 B7R1.3 NC1CCCCC1 MCULE-7654331405 [0,1,0,1,0,0|2,0,0]=4 3358 B7R1.3 NC1CCCCC1 MCULE-9211684304 [0,1,0,1,0,0|2,0,0]=4 3359 B7R1.3 NC1CCCCN1 MCULE-8429969520 [0,1,0,1,0,0|2,0,0]=4 3360 B7R1.3 NC1CCCNC1 MCULE-2846077424 [0,1,0,1,0,0|2,0,0]=4 3361 B7R1.3 NC1CCCNC1 MCULE-6762552983 [0,1,0,1,0,0|2,0,0]=4 3362 B7R1.3 NC1CCCNC1 MCULE-8978449052 [0,1,0,1,0,0|2,0,0]=4 3363 B7R1.3 NC1CCCOC1 MCULE-3002610862 [0,1,0,1,0,0|1,0,0]=3 3364 B7R1.3 NC1CCCOC1 MCULE-8678558313 [0,1,0,1,0,0|1,0,0]=3 3365 B7R1.3 NC1CCCSC1 MCULE-5361360271 [0,1,0,1,0,0|1,1,0]=4 3366 B7R1.3 NC1CCCSC1 MCULE-5652416535 [0,1,0,1,0,0|1,1,0]=4 3367 B7R1.3 NC1CCNCC1 MCULE-4122223472 [0,1,0,1,0,0|2,0,0]=4 3368 B7R1.3 NC1CCNCC1 MCULE-4894618503 [0,1,0,1,0,0|2,0,0]=4 3369 B7R1.3 NC1CCOCC1 MCULE-4830730893 [0,1,0,1,0,0|1,0,0]=3 3370 B7R1.3 NC1CCOCC1 MCULE-6229850202 [0,1,0,1,0,0|1,0,0]=3 3371 B7R1.3 NC1CCOCC1 MCULE-7619874469 [0,1,0,1,0,0|1,0,0]=3 3372 B7R1.3 NC1CCSCC1 MCULE-1077822824 [0,1,0,1,0,0|1,1,0]=4 3373 B7R1.3 NC1CCSCC1 MCULE-7148332202 [0,1,0,1,0,0|1,1,0]=4 3374 B7R1.3 NN1CCCCC1 MCULE-2078041523 [0,1,0,1,0,0|2,0,0]=4 3375 B7R1.3 NN1CCCCC1 MCULE-3853977450 [0,1,0,1,0,0|2,0,0]=4 3376 B7R1.3 NN1CCNCC1 MCULE-4047900576 [0,1,0,1,0,0|2,0,0]=4 3377 B7R1.3 NN1CCNCC1 MCULE-5083416150 [0,1,0,1,0,0|2,0,0]=4 3378 B7R1.3 NN1CCNCC1 MCULE-7309844454 [0,1,0,1,0,0|2,0,0]=4 3379 B7R1.3 NN1CCOCC1 MCULE-8277539965 [0,1,0,1,0,0|1,0,0]=3 3380 B7R1.3 NN1CCSCC1 MCULE-9712464832 [0,1,0,1,0,0|1,1,0]=4 3381 B7R1.3 N[C@@H]1CCCNC1 MCULE-1539406556 [0,1,0,1,0,0|2,0,0]=4 3382 B7R1.3 N[C@@H]1CCCNC1 MCULE-3403472114 [0,1,0,1,0,0|2,0,0]=4 3383 B7R1.3 N[C@@H]1CCCNC1 MCULE-6313396868 [0,1,0,1,0,0|2,0,0]=4 3384 B7R1.3 N[C@@H]1CCCNC1 MCULE-8281902784 [0,1,0,1,0,0|2,0,0]=4 3385 B7R1.3 N[C@@H]1CCCOC1 MCULE-3329999118 [0,1,0,1,0,0|1,0,0]=3 3386 B7R1.3 N[C@@H]1CCCOC1 MCULE-5434456311 [0,1,0,1,0,0|1,0,0]=3 3387 B7R1.3 N[C@@H]1CCCOC1 MCULE-8416525332 [0,1,0,1,0,0|1,0,0]=3 3388 B7R1.3 N[C@@H]1CCCOC1 MCULE-9941756618 [0,1,0,1,0,0|1,0,0]=3 3389 B7R1.3 N[C@H]1CCCNC1 MCULE-1133561466 [0,1,0,1,0,0|2,0,0]=4 3390 B7R1.3 N[C@H]1CCCNC1 MCULE-3601314617 [0,1,0,1,0,0|2,0,0]=4 3391 B7R1.3 N[C@H]1CCCNC1 MCULE-4741120465 [0,1,0,1,0,0|2,0,0]=4 3392 B7R1.3 N[C@H]1CCCNC1 MCULE-5291619589 [0,1,0,1,0,0|2,0,0]=4 3393 B7R1.3 N[C@H]1CCCNC1 MCULE-8831721515 [0,1,0,1,0,0|2,0,0]=4 3394 B7R1.3 N[C@H]1CCCOC1 MCULE-1619050625 [0,1,0,1,0,0|1,0,0]=3 3395 B7R1.3 N[C@H]1CCCOC1 MCULE-4275969826 [0,1,0,1,0,0|1,0,0]=3 3396 B7R1.3 N[C@H]1CCCOC1 MCULE-4421099383 [0,1,0,1,0,0|1,0,0]=3 3397 B7R1.3 N[C@H]1CCCOC1 MCULE-9281030983 [0,1,0,1,0,0|1,0,0]=3 3398 B7R1.3 O=C1CCCCC1 MCULE-5664385838 [0,1,0,1,0,0|2,0,0]=4 3399 B7R1.3 O=C1CCCCO1 MCULE-4682307363 [0,1,0,1,0,0|1,0,1]=4 3400 B7R1.3 O=C1CCCOC1 MCULE-5268404224 [0,1,0,1,0,0|1,0,1]=4 3401 B7R1.3 O=C1CCNCC1 MCULE-7526186270 [0,1,0,1,0,0|2,0,0]=4 3402 B7R1.3 O=C1CCNCC1 MCULE-9761063200 [0,1,0,1,0,0|2,0,0]=4 3403 B7R1.3 O=C1CCOCC1 MCULE-6728095514 [0,1,0,1,0,0|1,0,0]=3 3404 B7R1.3 O=C1CCSCC1 MCULE-8638366518 [0,1,0,1,0,0|1,1,0]=4 3405 B7R1.3 O=C1CNCCO1 MCULE-2634056082 [0,1,0,1,0,0|1,0,1]=4 3406 B7R1.3 O=C1CNCCO1 MCULE-6420255529 [0,1,0,1,0,0|1,0,1]=4 3407 B7R1.3 O=C1COCCN1 MCULE-8242898041 [0,1,0,1,0,0|1,0,1]=4 3408 B7R1.3 O=C1COCCO1 MCULE-5754504096 [0,1,0,1,0,0|0,0,1]=3 3409 B7R1.3 O=S1CCCCC1 MCULE-1275253796 [0,1,0,1,0,0|1,1,0]=4 3410 B7R1.3 O=S1CCNCC1 MCULE-1812570930 [0,1,0,1,0,0|1,1,0]=4 3411 B7R1.3 O=S1CCNCC1 MCULE-9878649050 [0,1,0,1,0,0|1,1,0]=4 3412 B7R1.3 O=S1CCOCC1 MCULE-4979531002 [0,1,0,1,0,0|0,1,0]=3 3413 B7R1.3 OC1C=CCOC1 MCULE-7810293257 [0,1,0,1,0,0|1,0,1]=4 3414 B7R1.3 OC1CCCCC1 MCULE-8217921343 [0,1,0,1,0,0|2,0,0]=4 3415 B7R1.3 OC1CCCCN1 MCULE-7168605870 [0,1,0,1,0,0|2,0,0]=4 3416 B7R1.3 OC1CCCCN1 MCULE-9833825308 [0,1,0,1,0,0|2,0,0]=4 3417 B7R1.3 OC1CCCCO1 MCULE-1415784498 [0,1,0,1,0,0|1,0,0]=3 3418 B7R1.3 OC1CCCNC1 MCULE-4557845355 [0,1,0,1,0,0|2,0,0]=4 3419 B7R1.3 OC1CCCNC1 MCULE-6040312691 [0,1,0,1,0,0|2,0,0]=4 3420 B7R1.3 OC1CCCOC1 MCULE-3820663957 [0,1,0,1,0,0|1,0,0]=3 3421 B7R1.3 OC1CCCOC1 MCULE-4349250540 [0,1,0,1,0,0|1,0,0]=3 3422 B7R1.3 OC1CCCSC1 MCULE-1448781710 [0,1,0,1,0,0|1,1,0]=4 3423 B7R1.3 OC1CCNCC1 MCULE-3572807775 [0,1,0,1,0,0|2,0,0]=4 3424 B7R1.3 OC1CCNCC1 MCULE-4216905638 [0,1,0,1,0,0|2,0,0]=4 3425 B7R1.3 OC1CCNCC1 MCULE-8298401309 [0,1,0,1,0,0|2,0,0]=4 3426 B7R1.3 OC1CCOCC1 MCULE-3789534226 [0,1,0,1,0,0|1,0,0]=3 3427 B7R1.3 OC1CCSCC1 MCULE-6056663037 [0,1,0,1,0,0|1,1,0]=4 3428 B7R1.3 OC1CNCCO1 MCULE-7048275202 [0,1,0,1,0,0|1,0,0]=3 3429 B7R1.3 OC1CNCCO1 MCULE-9716087824 [0,1,0,1,0,0|1,0,0]=3 3430 B7R1.3 OC1COCOC1 MCULE-1056094446 [0,1,0,1,0,0|2,0,0]=4 3431 B7R1.3 ON1CCCCC1 MCULE-5529301217 [0,1,0,1,0,0|2,0,0]=4 3432 B7R1.3 ON1CCOCC1 MCULE-9071295312 [0,1,0,1,0,0|1,0,0]=3 3433 B7R1.3 O[C@@H]1CCCNC1 MCULE-3395625072 [0,1,0,1,0,0|2,0,0]=4 3434 B7R1.3 O[C@@H]1CCCNC1 MCULE-5041834047 [0,1,0,1,0,0|2,0,0]=4 3435 B7R1.3 O[C@@H]1CCCNC1 MCULE-5939951996 [0,1,0,1,0,0|2,0,0]=4 3436 B7R1.3 O[C@@H]1CCCNC1 MCULE-8822637089 [0,1,0,1,0,0|2,0,0]=4 3437 B7R1.3 O[C@@H]1CCCOC1 MCULE-1439860824 [0,1,0,1,0,0|1,0,0]=3 3438 B7R1.3 O[C@@H]1CCCOC1 MCULE-5515107963 [0,1,0,1,0,0|1,0,0]=3 3439 B7R1.3 O[C@H]1CCCNC1 MCULE-3813591488 [0,1,0,1,0,0|2,0,0]=4 3440 B7R1.3 O[C@H]1CCCNC1 MCULE-5223055424 [0,1,0,1,0,0|2,0,0]=4 3441 B7R1.3 O[C@H]1CCCNC1 MCULE-7646198322 [0,1,0,1,0,0|2,0,0]=4 3442 B7R1.3 O[C@H]1CCCNC1 MCULE-7875547684 [0,1,0,1,0,0|2,0,0]=4 3443 B7R1.3 O[C@H]1CCCOC1 MCULE-2228949296 [0,1,0,1,0,0|1,0,0]=3 3444 B7R1.3 O[C@H]1CCCOC1 MCULE-6500179909 [0,1,0,1,0,0|1,0,0]=3 3445 B7R1.3 S=C1CCCCC1 MCULE-6072375043 [0,1,0,1,0,0|2,0,0]=4 3446 B7R1.3 S=C1COCCN1 MCULE-1743172522 [0,1,0,1,0,0|1,0,1]=4 3447 B7R1.3 SC1CCCCC1 MCULE-2644288416 [0,1,0,1,0,0|2,0,0]=4 3448 B7R1.3 SC1CCCNC1 MCULE-4464031027 [0,1,0,1,0,0|2,0,0]=4 3449 B7R1.3 SC1CCCNC1 MCULE-5566651293 [0,1,0,1,0,0|2,0,0]=4 3450 B7R1.3 SC1CCCOC1 MCULE-9540212924 [0,1,0,1,0,0|1,0,0]=3 3451 B7R1.3 SC1CCNCC1 MCULE-2780144586 [0,1,0,1,0,0|2,0,0]=4 3452 B7R1.3 SC1CCNCC1 MCULE-4297654743 [0,1,0,1,0,0|2,0,0]=4 3453 B7R1.3 SC1CCOCC1 MCULE-1287019115 [0,1,0,1,0,0|1,0,0]=3 3454 B7R1.3 SC1CCSCC1 MCULE-8741596394 [0,1,0,1,0,0|1,1,0]=4 3455 B7R1.3 S[C@H]1CCCNC1 MCULE-5377455102 [0,1,0,1,0,0|2,0,0]=4 3456 B7R1.3 S[C@H]1CCCNC1 MCULE-9668422285 [0,1,0,1,0,0|2,0,0]=4 3457 B7R1.3 [NH3+]C1CCCCC1 MCULE-7876724648 [0,1,0,1,0,0|2,0,0]=4 3458 B7R1.4 C=C1COCC1N MCULE-4632261286 [0,1,0,1,0,0|1,0,1]=4 3459 B7R1.4 C=C1COCC1N MCULE-7153575301 [0,1,0,1,0,0|1,0,1]=4 3460 B7R1.4 CC1CCCC1Br MCULE-7816907673 [0,1,0,1,0,0|2,0,0]=4 3461 B7R1.4 CC1CCCC1N MCULE-4318156403 [0,1,0,1,0,0|2,0,0]=4 3462 B7R1.4 CC1CCCC1N MCULE-4434172193 [0,1,0,1,0,0|2,0,0]=4 3463 B7R1.4 CC1CCCC1O MCULE-1288711765 [0,1,0,1,0,0|2,0,0]=4 3464 B7R1.4 CC1CCNC1C MCULE-2184586167 [0,1,0,1,0,0|2,0,0]=4 3465 B7R1.4 CC1CCOC1=O MCULE-2223078294 [0,1,0,1,0,0|1,0,1]=4 3466 B7R1.4 CC1CNCC1C MCULE-5821391512 [0,1,0,1,0,0|2,0,0]=4 3467 B7R1.4 CC1CNCC1C MCULE-6626101399 [0,1,0,1,0,0|2,0,0]=4 3468 B7R1.4 CC1CNCC1F MCULE-4834888455 [0,1,0,1,0,0|2,0,0]=4 3469 B7R1.4 CC1CNCC1F MCULE-7766072724 [0,1,0,1,0,0|2,0,0]=4 3470 B7R1.4 CC1CNCC1N MCULE-2314973615 [0,1,0,1,0,0|2,0,0]=4 3471 B7R1.4 CC1CNCC1N MCULE-8542352354 [0,1,0,1,0,0|2,0,0]=4 3472 B7R1.4 CC1CNCC1O MCULE-3308447861 [0,1,0,1,0,0|2,0,0]=4 3473 B7R1.4 CC1CNCC1O MCULE-8526879323 [0,1,0,1,0,0|2,0,0]=4 3474 B7R1.4 CC1COCC1=O MCULE-8115238635 [0,1,0,1,0,0|1,0,1]=4 3475 B7R1.4 CC1COCC1N MCULE-5453471722 [0,1,0,1,0,0|1,0,0]=3 3476 B7R1.4 CC1COCC1N MCULE-6647217023 [0,1,0,1,0,0|1,0,0]=3 3477 B7R1.4 CC1COCC1O MCULE-5925280081 [0,1,0,1,0,0|1,0,0]=3 3478 B7R1.4 CC1CSCC1N MCULE-5628200403 [0,1,0,1,0,0|1,1,0]=4 3479 B7R1.4 CC1OCCC1=O MCULE-8278816952 [0,1,0,1,0,0|2,0,0]=4 3480 B7R1.4 CC1OCCC1N MCULE-4343663724 [0,1,0,1,0,0|2,0,0]=4 3481 B7R1.4 CC1OCCC1N MCULE-9003879039 [0,1,0,1,0,0|2,0,0]=4 3482 B7R1.4 CC1OCCC1O MCULE-6904695721 [0,1,0,1,0,0|2,0,0]=4 3483 B7R1.4 CC1OCCC1S MCULE-9127694888 [0,1,0,1,0,0|2,0,0]=4 3484 B7R1.4 CC1OCOC1C MCULE-9497186094 [0,1,0,1,0,0|2,0,0]=4 3485 B7R1.4 CN1CCOC1=O MCULE-7467321799 [0,1,0,1,0,0|1,0,1]=4 3486 B7R1.4 C[C@@H]1CCC[C@@H]1N MCULE-6206070680 [0,1,0,1,0,0|2,0,0]=4 3487 B7R1.4 C[C@@H]1CCC[C@@H]1N MCULE-9964938082 [0,1,0,1,0,0|2,0,0]=4 3488 B7R1.4 C[C@@H]1CCC[C@@H]1O MCULE-2617120620 [0,1,0,1,0,0|2,0,0]=4 3489 B7R1.4 C[C@@H]1CCC[C@H]1N MCULE-8385969474 [0,1,0,1,0,0|2,0,0]=4 3490 B7R1.4 C[C@@H]1CCC[C@H]1O MCULE-3398682980 [0,1,0,1,0,0|2,0,0]=4 3491 B7R1.4 C[C@@H]1CNC[C@@H]1C MCULE-4592161485 [0,1,0,1,0,0|2,0,0]=4 3492 B7R1.4 C[C@@H]1CNC[C@@H]1C MCULE-5506149631 [0,1,0,1,0,0|2,0,0]=4 3493 B7R1.4 C[C@@H]1CNC[C@@H]1F MCULE-4204399527 [0,1,0,1,0,0|2,0,0]=4 3494 B7R1.4 C[C@@H]1CNC[C@@H]1F MCULE-8451199903 [0,1,0,1,0,0|2,0,0]=4 3495 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-2290594563 [0,1,0,1,0,0|2,0,0]=4 3496 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-2611807697 [0,1,0,1,0,0|2,0,0]=4 3497 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-3707409979 [0,1,0,1,0,0|2,0,0]=4 3498 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-4317636252 [0,1,0,1,0,0|2,0,0]=4 3499 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-2015388080 [0,1,0,1,0,0|2,0,0]=4 3500 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-3625149028 [0,1,0,1,0,0|2,0,0]=4 3501 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-5773404554 [0,1,0,1,0,0|2,0,0]=4 3502 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-6014391902 [0,1,0,1,0,0|2,0,0]=4 3503 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-6476104556 [0,1,0,1,0,0|2,0,0]=4 3504 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-6537028059 [0,1,0,1,0,0|2,0,0]=4 3505 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-2567871968 [0,1,0,1,0,0|2,0,0]=4 3506 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-5626188867 [0,1,0,1,0,0|2,0,0]=4 3507 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-7438009663 [0,1,0,1,0,0|2,0,0]=4 3508 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-8649896095 [0,1,0,1,0,0|2,0,0]=4 3509 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-4207581523 [0,1,0,1,0,0|2,0,0]=4 3510 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-6158474994 [0,1,0,1,0,0|2,0,0]=4 3511 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-7380960276 [0,1,0,1,0,0|2,0,0]=4 3512 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-7589629864 [0,1,0,1,0,0|2,0,0]=4 3513 B7R1.4 C[C@@H]1COC[C@@H]1O MCULE-3198029643 [0,1,0,1,0,0|1,0,0]=3 3514 B7R1.4 C[C@@H]1COC[C@H]1N MCULE-1145772262 [0,1,0,1,0,0|1,0,0]=3 3515 B7R1.4 C[C@@H]1COC[C@H]1N MCULE-6639849267 [0,1,0,1,0,0|1,0,0]=3 3516 B7R1.4 C[C@@H]1COC[C@H]1N MCULE-9659959713 [0,1,0,1,0,0|1,0,0]=3 3517 B7R1.4 C[C@@H]1COC[C@H]1O MCULE-1967963278 [0,1,0,1,0,0|1,0,0]=3 3518 B7R1.4 C[C@@H]1OCC[C@H]1N MCULE-5910807847 [0,1,0,1,0,0|2,0,0]=4 3519 B7R1.4 C[C@@H]1OCC[C@H]1N MCULE-7586038907 [0,1,0,1,0,0|2,0,0]=4 3520 B7R1.4 C[C@H]1CCC[C@@H]1N MCULE-4150988023 [0,1,0,1,0,0|2,0,0]=4 3521 B7R1.4 C[C@H]1CCC[C@@H]1O MCULE-5212653059 [0,1,0,1,0,0|2,0,0]=4 3522 B7R1.4 C[C@H]1CCC[C@@H]1O MCULE-7997646273 [0,1,0,1,0,0|2,0,0]=4 3523 B7R1.4 C[C@H]1CCC[C@H]1N MCULE-3329868072 [0,1,0,1,0,0|2,0,0]=4 3524 B7R1.4 C[C@H]1CCC[C@H]1N MCULE-4186145172 [0,1,0,1,0,0|2,0,0]=4 3525 B7R1.4 C[C@H]1CCC[C@H]1O MCULE-3291842365 [0,1,0,1,0,0|2,0,0]=4 3526 B7R1.4 C[C@H]1CCC[C@H]1O MCULE-7570125274 [0,1,0,1,0,0|2,0,0]=4 3527 B7R1.4 C[C@H]1CCN[C@@H]1C MCULE-7622265949 [0,1,0,1,0,0|2,0,0]=4 3528 B7R1.4 C[C@H]1CCN[C@@H]1C MCULE-7686056776 [0,1,0,1,0,0|2,0,0]=4 3529 B7R1.4 C[C@H]1CNC[C@@H]1C MCULE-2214344957 [0,1,0,1,0,0|2,0,0]=4 3530 B7R1.4 C[C@H]1CNC[C@@H]1C MCULE-2877312650 [0,1,0,1,0,0|2,0,0]=4 3531 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-2282810666 [0,1,0,1,0,0|2,0,0]=4 3532 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-2772361871 [0,1,0,1,0,0|2,0,0]=4 3533 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-3274154422 [0,1,0,1,0,0|2,0,0]=4 3534 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-3608199633 [0,1,0,1,0,0|2,0,0]=4 3535 B7R1.4 C[C@H]1CNC[C@H]1N MCULE-6069899229 [0,1,0,1,0,0|2,0,0]=4 3536 B7R1.4 C[C@H]1CNC[C@H]1N MCULE-8539137579 [0,1,0,1,0,0|2,0,0]=4 3537 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-1988679936 [0,1,0,1,0,0|2,0,0]=4 3538 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-3451477960 [0,1,0,1,0,0|2,0,0]=4 3539 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-4396463600 [0,1,0,1,0,0|2,0,0]=4 3540 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-7975653844 [0,1,0,1,0,0|2,0,0]=4 3541 B7R1.4 C[C@H]1COC[C@@H]1O MCULE-3765921602 [0,1,0,1,0,0|1,0,0]=3 3542 B7R1.4 C[C@H]1COC[C@@H]1O MCULE-5201903195 [0,1,0,1,0,0|1,0,0]=3 3543 B7R1.4 C[C@H]1COC[C@H]1O MCULE-2974083166 [0,1,0,1,0,0|1,0,0]=3 3544 B7R1.4 C[C@H]1COC[C@H]1O MCULE-6725207001 [0,1,0,1,0,0|1,0,0]=3 3545 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-1432785321 [0,1,0,1,0,0|2,0,0]=4 3546 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-3008045787 [0,1,0,1,0,0|2,0,0]=4 3547 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-7656776924 [0,1,0,1,0,0|2,0,0]=4 3548 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-8087379612 [0,1,0,1,0,0|2,0,0]=4 3549 B7R1.4 ClC1CCOC1Cl MCULE-1186010832 [0,1,0,1,0,0|2,0,0]=4 3550 B7R1.4 NC1COCC1Br MCULE-5821692966 [0,1,0,1,0,0|2,0,0]=4 3551 B7R1.4 NC1COCC1F MCULE-5032224318 [0,1,0,1,0,0|2,0,0]=4 3552 B7R1.4 NC1COCC1F MCULE-8302920845 [0,1,0,1,0,0|2,0,0]=4 3553 B7R1.4 NC1COCC1N MCULE-1202195361 [0,1,0,1,0,0|2,0,0]=4 3554 B7R1.4 NC1COCC1N MCULE-4117465167 [0,1,0,1,0,0|2,0,0]=4 3555 B7R1.4 NC1COCC1O MCULE-3115911209 [0,1,0,1,0,0|2,0,0]=4 3556 B7R1.4 NC1COCC1O MCULE-9837103399 [0,1,0,1,0,0|2,0,0]=4 3557 B7R1.4 N[C@@H]1COC[C@@H]1F MCULE-1582887664 [0,1,0,1,0,0|2,0,0]=4 3558 B7R1.4 N[C@@H]1COC[C@@H]1F MCULE-3978694929 [0,1,0,1,0,0|2,0,0]=4 3559 B7R1.4 N[C@@H]1COC[C@@H]1F MCULE-4503972605 [0,1,0,1,0,0|2,0,0]=4 3560 B7R1.4 N[C@@H]1COC[C@@H]1F MCULE-6640537480 [0,1,0,1,0,0|2,0,0]=4 3561 B7R1.4 N[C@@H]1COC[C@@H]1N MCULE-5625344145 [0,1,0,1,0,0|2,0,0]=4 3562 B7R1.4 N[C@@H]1COC[C@@H]1N MCULE-5743565778 [0,1,0,1,0,0|2,0,0]=4 3563 B7R1.4 N[C@@H]1COC[C@@H]1N MCULE-7916026303 [0,1,0,1,0,0|2,0,0]=4 3564 B7R1.4 N[C@@H]1COC[C@@H]1O MCULE-2891920420 [0,1,0,1,0,0|2,0,0]=4 3565 B7R1.4 N[C@@H]1COC[C@@H]1O MCULE-5764643856 [0,1,0,1,0,0|2,0,0]=4 3566 B7R1.4 N[C@@H]1COC[C@H]1F MCULE-3183837574 [0,1,0,1,0,0|2,0,0]=4 3567 B7R1.4 N[C@@H]1COC[C@H]1F MCULE-3329511858 [0,1,0,1,0,0|2,0,0]=4 3568 B7R1.4 N[C@@H]1COC[C@H]1N MCULE-3234416434 [0,1,0,1,0,0|2,0,0]=4 3569 B7R1.4 N[C@@H]1COC[C@H]1N MCULE-3421021007 [0,1,0,1,0,0|2,0,0]=4 3570 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-1399984261 [0,1,0,1,0,0|2,0,0]=4 3571 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-2321912677 [0,1,0,1,0,0|2,0,0]=4 3572 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-4422404071 [0,1,0,1,0,0|2,0,0]=4 3573 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-7801515292 [0,1,0,1,0,0|2,0,0]=4 3574 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-9112718041 [0,1,0,1,0,0|2,0,0]=4 3575 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-9447703783 [0,1,0,1,0,0|2,0,0]=4 3576 B7R1.4 N[C@H]1COC[C@@H]1F MCULE-1031359839 [0,1,0,1,0,0|2,0,0]=4 3577 B7R1.4 N[C@H]1COC[C@@H]1F MCULE-6239060869 [0,1,0,1,0,0|2,0,0]=4 3578 B7R1.4 N[C@H]1COC[C@@H]1N MCULE-4495433095 [0,1,0,1,0,0|2,0,0]=4 3579 B7R1.4 N[C@H]1COC[C@@H]1N MCULE-6217406845 [0,1,0,1,0,0|2,0,0]=4 3580 B7R1.4 N[C@H]1COC[C@@H]1N MCULE-9762071646 [0,1,0,1,0,0|2,0,0]=4 3581 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-1604156911 [0,1,0,1,0,0|2,0,0]=4 3582 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-3157811195 [0,1,0,1,0,0|2,0,0]=4 3583 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-4377495223 [0,1,0,1,0,0|2,0,0]=4 3584 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-8412403655 [0,1,0,1,0,0|2,0,0]=4 3585 B7R1.4 N[C@H]1COC[C@H]1F MCULE-7980939593 [0,1,0,1,0,0|2,0,0]=4 3586 B7R1.4 N[C@H]1COC[C@H]1F MCULE-8990550970 [0,1,0,1,0,0|2,0,0]=4 3587 B7R1.4 N[C@H]1COC[C@H]1O MCULE-5907972681 [0,1,0,1,0,0|2,0,0]=4 3588 B7R1.4 N[C@H]1COC[C@H]1O MCULE-7502895716 [0,1,0,1,0,0|2,0,0]=4 3589 B7R1.4 N[C@H]1COC[C@H]1O MCULE-8985833831 [0,1,0,1,0,0|2,0,0]=4 3590 B7R1.4 N[C@H]1COC[C@H]1O MCULE-9971794275 [0,1,0,1,0,0|2,0,0]=4 3591 B7R1.4 OC1COCC1Br MCULE-8642236751 [0,1,0,1,0,0|2,0,0]=4 3592 B7R1.4 OC1COCC1F MCULE-3255803142 [0,1,0,1,0,0|2,0,0]=4 3593 B7R1.4 OC1COCC1O MCULE-2982401803 [0,1,0,1,0,0|2,0,0]=4 3594 B7R1.4 O[C@@H]1COC[C@H]1F MCULE-2460253154 [0,1,0,1,0,0|2,0,0]=4 3595 B7R1.4 O[C@@H]1COC[C@H]1F MCULE-3624406213 [0,1,0,1,0,0|2,0,0]=4 3596 B7R1.4 O[C@@H]1COC[C@H]1O MCULE-5846282762 [0,1,0,1,0,0|2,0,0]=4 3597 B7R1.4 O[C@H]1COC[C@@H]1F MCULE-7724910066 [0,1,0,1,0,0|2,0,0]=4 3598 B7R1.4 O[C@H]1COC[C@@H]1O MCULE-2140544466 [0,1,0,1,0,0|2,0,0]=4 3599 B7R1.4 O[C@H]1COC[C@@H]1O MCULE-9526811966 [0,1,0,1,0,0|2,0,0]=4 3600 B7R1.4 O[C@H]1COC[C@H]1O MCULE-2862505352 [0,1,0,1,0,0|2,0,0]=4 3601 B7R1.4 [C@@H]1(CCC[C@H]1N)C MCULE-2430440513 [0,1,0,1,0,0|2,0,0]=4 3602 B7R1.4 [C@@H]1(CCC[C@H]1N)C MCULE-8503171996 [0,1,0,1,0,0|2,0,0]=4 3603 B7R1.4 [C@@H]1(COC[C@@H]1F)N MCULE-3635591654 [0,1,0,1,0,0|2,0,0]=4 3604 B7R1.4 [C@@H]1(COC[C@@H]1F)N MCULE-5914925477 [0,1,0,1,0,0|2,0,0]=4 3605 B7R1.4 [C@@H]1(COC[C@@H]1N)N MCULE-4324328112 [0,1,0,1,0,0|2,0,0]=4 3606 B7R1.4 [C@H]1(COC[C@H]1N)C MCULE-5920046767 [0,1,0,1,0,0|1,0,0]=3 3607 B7R1.4 [C@H]1(COC[C@H]1N)C MCULE-6282053067 [0,1,0,1,0,0|1,0,0]=3 3608 B7R1.4 [C@H]1(COC[C@H]1N)C MCULE-8432332245 [0,1,0,1,0,0|1,0,0]=3 3609 B7R1.5 CCCC1CC1N MCULE-6204339829 [0,1,0,1,0,0|2,0,0]=4 3610 B7R1.5 CCCC1ON1C MCULE-8959342998 [0,1,0,1,0,0|1,0,0]=3 3611 B7R1.5 CCOC1CC1N MCULE-1141331549 [0,1,0,1,0,0|2,0,0]=4 3612 B7R1.5 CNCC1CC1C MCULE-9748636910 [0,1,0,1,0,0|2,0,0]=4 3613 B7R1.6 BrCCC1CCC1 MCULE-8124070706 [0,1,0,1,0,0|2,0,0]=4 3614 B7R1.6 BrCCC1CCO1 MCULE-2777479085 [0,1,0,1,0,0|2,0,0]=4 3615 B7R1.6 BrCCC1COC1 MCULE-8858681111 [0,1,0,1,0,0|1,0,0]=3 3616 B7R1.6 C1(CCN1)COC MCULE-6891607313 [0,1,0,1,0,0|1,0,0]=3 3617 B7R1.6 CCCC1CCN1 MCULE-7330412999 [0,1,0,1,0,0|2,0,0]=4 3618 B7R1.6 CCCC1CNC1 MCULE-4374477641 [0,1,0,1,0,0|2,0,0]=4 3619 B7R1.6 CCCC1CNC1 MCULE-8036298863 [0,1,0,1,0,0|2,0,0]=4 3620 B7R1.6 CCNC1CCC1 MCULE-2055959297 [0,1,0,1,0,0|2,0,0]=4 3621 B7R1.6 CCNC1CCC1 MCULE-2989731173 [0,1,0,1,0,0|2,0,0]=4 3622 B7R1.6 CCNC1CNC1 MCULE-3810334615 [0,1,0,1,0,0|2,0,0]=4 3623 B7R1.6 CCNC1CNC1 MCULE-3811754191 [0,1,0,1,0,0|2,0,0]=4 3624 B7R1.6 CCNC1COC1 MCULE-6357248771 [0,1,0,1,0,0|1,0,0]=3 3625 B7R1.6 CCNC1COC1 MCULE-8144856469 [0,1,0,1,0,0|1,0,0]=3 3626 B7R1.6 CCOC1CNC1 MCULE-5408347465 [0,1,0,1,0,0|1,0,0]=3 3627 B7R1.6 CCOC1CNC1 MCULE-5853062591 [0,1,0,1,0,0|1,0,0]=3 3628 B7R1.6 CCOC1CNC1 MCULE-7457457501 [0,1,0,1,0,0|1,0,0]=3 3629 B7R1.6 CCOC1CNC1 MCULE-9277972796 [0,1,0,1,0,0|1,0,0]=3 3630 B7R1.6 CNCC1CCC1 MCULE-3632390845 [0,1,0,1,0,0|2,0,0]=4 3631 B7R1.6 CNCC1CCC1 MCULE-4932211047 [0,1,0,1,0,0|2,0,0]=4 3632 B7R1.6 CNCC1CCO1 MCULE-5990606434 [0,1,0,1,0,0|1,0,0]=3 3633 B7R1.6 CNCC1CNC1 MCULE-3335619423 [0,1,0,1,0,0|2,0,0]=4 3634 B7R1.6 CNCC1COC1 MCULE-9048388624 [0,1,0,1,0,0|1,0,0]=3 3635 B7R1.6 COC=C1COC1 MCULE-5631176777 [0,1,0,1,0,0|0,0,1]=3 3636 B7R1.6 COCC1CCN1 MCULE-3275131561 [0,1,0,1,0,0|1,0,0]=3 3637 B7R1.6 COCC1CCN1 MCULE-4183304984 [0,1,0,1,0,0|1,0,0]=3 3638 B7R1.6 COCC1CCN1 MCULE-7159192750 [0,1,0,1,0,0|1,0,0]=3 3639 B7R1.6 COCC1CNC1 MCULE-4967592714 [0,1,0,1,0,0|1,0,0]=3 3640 B7R1.6 COCC1CNC1 MCULE-6804867712 [0,1,0,1,0,0|1,0,0]=3 3641 B7R1.6 COCC1CNC1 MCULE-9862500955 [0,1,0,1,0,0|1,0,0]=3 3642 B7R1.6 COC[C@@H]1CCN1 MCULE-2241257059 [0,1,0,1,0,0|1,0,0]=3 3643 B7R1.6 COC[C@@H]1CCN1 MCULE-4677436919 [0,1,0,1,0,0|1,0,0]=3 3644 B7R1.6 COC[C@@H]1CCN1 MCULE-5280330847 [0,1,0,1,0,0|1,0,0]=3 3645 B7R1.6 COC[C@@H]1CCN1 MCULE-9466463613 [0,1,0,1,0,0|1,0,0]=3 3646 B7R1.6 COC[C@H]1CCN1 MCULE-7456820187 [0,1,0,1,0,0|1,0,0]=3 3647 B7R1.6 COC[C@H]1CCN1 MCULE-7652894052 [0,1,0,1,0,0|1,0,0]=3 3648 B7R1.6 CON=C1CNC1 MCULE-2691046364 [0,1,0,1,0,0|1,0,1]=4 3649 B7R1.6 CON=C1CNC1 MCULE-6524296055 [0,1,0,1,0,0|1,0,1]=4 3650 B7R1.6 ClCOC1CCC1 MCULE-3275885126 [0,1,0,1,0,0|1,0,0]=3 3651 B7R1.6 ICCC1CCO1 MCULE-3778448773 [0,1,0,1,0,0|2,0,0]=4 3652 B7R1.6 ICCC1COC1 MCULE-6063305860 [0,1,0,1,0,0|1,0,0]=3 3653 B7R1.6 N#CCC1COC1 MCULE-7466805866 [0,1,0,1,0,0|1,0,1]=4 3654 B7R1.6 N#N=NC1COC1 MCULE-3343393458 [0,1,0,1,0,0|2,0,0]=4 3655 B7R1.6 NCCC1CCC1 MCULE-2620603238 [0,1,0,1,0,0|2,0,0]=4 3656 B7R1.6 NCCC1CCC1 MCULE-8653518690 [0,1,0,1,0,0|2,0,0]=4 3657 B7R1.6 NCCC1CCO1 MCULE-3619983020 [0,1,0,1,0,0|2,0,0]=4 3658 B7R1.6 NCCC1CNC1 MCULE-7195412134 [0,1,0,1,0,0|2,0,0]=4 3659 B7R1.6 NCCC1COC1 MCULE-6363254952 [0,1,0,1,0,0|1,0,0]=3 3660 B7R1.6 NCCC1COC1 MCULE-6907504739 [0,1,0,1,0,0|1,0,0]=3 3661 B7R1.6 NCCC1CSC1 MCULE-5034757527 [0,1,0,1,0,0|1,1,0]=4 3662 B7R1.6 NCC[C@@H]1CCO1 MCULE-5442768835 [0,1,0,1,0,0|2,0,0]=4 3663 B7R1.6 NOCC1CCC1 MCULE-1477129462 [0,1,0,1,0,0|2,0,0]=4 3664 B7R1.6 NOCC1CCC1 MCULE-7638467520 [0,1,0,1,0,0|2,0,0]=4 3665 B7R1.6 O=CCC1COC1 MCULE-3070858256 [0,1,0,1,0,0|1,0,1]=4 3666 B7R1.6 OCCC1CCC1 MCULE-1014969390 [0,1,0,1,0,0|2,0,0]=4 3667 B7R1.6 OCCC1CCO1 MCULE-3323265996 [0,1,0,1,0,0|2,0,0]=4 3668 B7R1.6 OCCC1CNC1 MCULE-1975411420 [0,1,0,1,0,0|2,0,0]=4 3669 B7R1.6 OCCC1CNC1 MCULE-4993890888 [0,1,0,1,0,0|2,0,0]=4 3670 B7R1.6 OCCC1COC1 MCULE-2515762048 [0,1,0,1,0,0|1,0,0]=3 3671 B7R1.6 OCC[C@@H]1CCO1 MCULE-6606073727 [0,1,0,1,0,0|2,0,0]=4 3672 B7R1.6 OCC[C@H]1CCO1 MCULE-4848994972 [0,1,0,1,0,0|2,0,0]=4 3673 B7R1.6 OCC[C@H]1CCO1 MCULE-9787306242 [0,1,0,1,0,0|2,0,0]=4 3674 B7R1.8 CC1CCC1CO MCULE-4677269341 [0,1,0,1,0,0|2,0,0]=4 3675 B7R1.8 CN1CCC1CN MCULE-2100632643 [0,1,0,1,0,0|2,0,0]=4 3676 B7R1.8 CN1CCC1CN MCULE-3660614289 [0,1,0,1,0,0|2,0,0]=4 3677 B7R1.8 CN1CCC1CN MCULE-3692131671 [0,1,0,1,0,0|2,0,0]=4 3678 B7R1.8 CN1CCC1CN MCULE-7629527689 [0,1,0,1,0,0|2,0,0]=4 3679 B7R1.8 CN1CCC1CO MCULE-3475629266 [0,1,0,1,0,0|2,0,0]=4 3680 B7R1.8 CN1CC[C@@H]1CN MCULE-3688982926 [0,1,0,1,0,0|2,0,0]=4 3681 B7R1.8 CN1CC[C@@H]1CN MCULE-5002925247 [0,1,0,1,0,0|2,0,0]=4 3682 B7R1.8 CN1CC[C@@H]1CN MCULE-7546481794 [0,1,0,1,0,0|2,0,0]=4 3683 B7R1.8 CN1CC[C@@H]1CO MCULE-2590783241 [0,1,0,1,0,0|2,0,0]=4 3684 B7R1.8 CN1CC[C@@H]1CO MCULE-9683847113 [0,1,0,1,0,0|2,0,0]=4 3685 B7R1.8 CN1CC[C@H]1CN MCULE-1178047911 [0,1,0,1,0,0|2,0,0]=4 3686 B7R1.8 CN1CC[C@H]1CN MCULE-1250398573 [0,1,0,1,0,0|2,0,0]=4 3687 B7R1.8 CN1CC[C@H]1CN MCULE-2733818158 [0,1,0,1,0,0|2,0,0]=4 3688 B7R1.8 CN1CC[C@H]1CN MCULE-4100743401 [0,1,0,1,0,0|2,0,0]=4 3689 B7R1.8 CN1CC[C@H]1CN MCULE-4459814320 [0,1,0,1,0,0|2,0,0]=4 3690 B7R1.8 CN1CC[C@H]1CN MCULE-4703409645 [0,1,0,1,0,0|2,0,0]=4 3691 B7R1.8 CN1CC[C@H]1CN MCULE-6317046346 [0,1,0,1,0,0|2,0,0]=4 3692 B7R1.8 CN1CC[C@H]1CN MCULE-7413844263 [0,1,0,1,0,0|2,0,0]=4 3693 B7R1.8 CN1CC[C@H]1CO MCULE-6507300625 [0,1,0,1,0,0|2,0,0]=4 3694 B7R1.8 CN1CC[C@H]1CO MCULE-9641004134 [0,1,0,1,0,0|2,0,0]=4 3695 B7R1.8 CN[C@H]1CC[C@@H]1O MCULE-4638367588 [0,1,0,1,0,0|2,0,0]=4 3696 B7R1.8 COC1CCC1=O MCULE-6511996246 [0,1,0,1,0,0|1,0,1]=4 3697 B7R1.8 COC1CCC1N MCULE-4537411385 [0,1,0,1,0,0|1,0,0]=3 3698 B7R1.8 COC1CCC1N MCULE-6423037026 [0,1,0,1,0,0|1,0,0]=3 3699 B7R1.8 CO[C@@H]1CC[C@@H]1N MCULE-3087283983 [0,1,0,1,0,0|1,0,0]=3 3700 B7R1.8 CO[C@@H]1CC[C@@H]1N MCULE-8723342484 [0,1,0,1,0,0|1,0,0]=3 3701 B7R1.8 CO[C@@H]1CC[C@H]1N MCULE-1324573121 [0,1,0,1,0,0|1,0,0]=3 3702 B7R1.8 CO[C@@H]1CC[C@H]1N MCULE-4430321170 [0,1,0,1,0,0|1,0,0]=3 3703 B7R1.8 CO[C@@H]1CC[C@H]1N MCULE-4876260929 [0,1,0,1,0,0|1,0,0]=3 3704 B7R1.8 CO[C@@H]1CC[C@H]1N MCULE-5060858396 [0,1,0,1,0,0|1,0,0]=3 3705 B7R1.8 CO[C@@H]1CC[C@H]1N MCULE-5711735047 [0,1,0,1,0,0|1,0,0]=3 3706 B7R1.8 CO[C@@H]1CC[C@H]1N MCULE-9952102635 [0,1,0,1,0,0|1,0,0]=3 3707 B7R1.8 CO[C@H]1CC[C@@H]1N MCULE-2991866514 [0,1,0,1,0,0|1,0,0]=3 3708 B7R1.8 CO[C@H]1CC[C@@H]1N MCULE-9729569658 [0,1,0,1,0,0|1,0,0]=3 3709 B7R1.8 CO[C@H]1CC[C@H]1N MCULE-9859722305 [0,1,0,1,0,0|1,0,0]=3 3710 B7R1.8 CO[C@H]1CC[C@H]1N MCULE-9948570347 [0,1,0,1,0,0|1,0,0]=3 3711 B7R1.9 CCC1CC1CN MCULE-6264158284 [0,1,0,1,0,0|2,0,0]=4 3712 B7R1.9 CCC1CC1CN MCULE-7047201371 [0,1,0,1,0,0|2,0,0]=4 3713 B7R1.9 CCC1CC1CO MCULE-3342087238 [0,1,0,1,0,0|2,0,0]=4 3714 B7R1.9 COC1CC1C=O MCULE-8346964880 [0,1,0,1,0,0|1,0,1]=4 3715 B7R1.10 C=C1CC(C1)NC MCULE-3988893291 [0,1,0,1,0,0|2,0,0]=4 3716 B7R1.10 CCC1CC(=O)C1 MCULE-6356390328 [0,1,0,1,0,0|2,0,0]=4 3717 B7R1.10 CNC1CC(C1)C MCULE-5081801744 [0,1,0,1,0,0|2,0,0]=4 3718 B7R1.10 CNC1CC(C1)C MCULE-9449007216 [0,1,0,1,0,0|2,0,0]=4 3719 B7R1.10 CNC1CC(C1)F MCULE-6289158357 [0,1,0,1,0,0|2,0,0]=4 3720 B7R1.10 CNC1CC(C1)O MCULE-1360972312 [0,1,0,1,0,0|2,0,0]=4 3721 B7R1.10 CNC1CC(C1)O MCULE-1798280109 [0,1,0,1,0,0|2,0,0]=4 3722 B7R1.10 CNC1CN(C1)C MCULE-3613414950 [0,1,0,1,0,0|2,0,0]=4 3723 B7R1.10 CNC1CN(C1)C MCULE-4522081258 [0,1,0,1,0,0|2,0,0]=4 3724 B7R1.10 CNC1CN(C1)C MCULE-8058351524 [0,1,0,1,0,0|2,0,0]=4 3725 B7R1.10 CN[C@H]1C[C@@H](C1)F MCULE-2488083119 [0,1,0,1,0,0|2,0,0]=4 3726 B7R1.10 CN[C@H]1C[C@@H](C1)O MCULE-2573139583 [0,1,0,1,0,0|2,0,0]=4 3727 B7R1.10 CN[C@H]1C[C@@H](C1)O MCULE-8240672064 [0,1,0,1,0,0|2,0,0]=4 3728 B7R1.10 CN[C@H]1C[C@H](C1)F MCULE-9478460669 [0,1,0,1,0,0|2,0,0]=4 3729 B7R1.10 CN[C@H]1C[C@H](C1)O MCULE-1676114682 [0,1,0,1,0,0|2,0,0]=4 3730 B7R1.10 CN[C@H]1C[C@H](C1)O MCULE-5219886186 [0,1,0,1,0,0|2,0,0]=4 3731 B7R1.10 COC1CC(=O)C1 MCULE-3488458490 [0,1,0,1,0,0|1,0,0]=3 3732 B7R1.10 COC1CC(C1)Br MCULE-8691368603 [0,1,0,1,0,0|1,0,0]=3 3733 B7R1.10 COC1CC(C1)N MCULE-1660819417 [0,1,0,1,0,0|1,0,0]=3 3734 B7R1.10 COC1CC(C1)N MCULE-8999221377 [0,1,0,1,0,0|1,0,0]=3 3735 B7R1.10 COC1CC(C1)O MCULE-6762585493 [0,1,0,1,0,0|1,0,0]=3 3736 B7R1.10 CO[C@H]1C[C@@H](C1)Br MCULE-1579786868 [0,1,0,1,0,0|1,0,0]=3 3737 B7R1.10 CO[C@H]1C[C@@H](C1)N MCULE-7191327129 [0,1,0,1,0,0|1,0,0]=3 3738 B7R1.10 CO[C@H]1C[C@@H](C1)N MCULE-8453539406 [0,1,0,1,0,0|1,0,0]=3 3739 B7R1.10 CO[C@H]1C[C@@H](C1)O MCULE-8355585959 [0,1,0,1,0,0|1,0,0]=3 3740 B7R1.10 CO[C@H]1C[C@H](C1)N MCULE-1470713902 [0,1,0,1,0,0|1,0,0]=3 3741 B7R1.10 CO[C@H]1C[C@H](C1)N MCULE-7213635913 [0,1,0,1,0,0|1,0,0]=3 3742 B7R1.10 CO[C@H]1C[C@H](C1)O MCULE-4960775262 [0,1,0,1,0,0|1,0,0]=3 3743 B7R1.10 CSC1CC(=O)C1 MCULE-4578180421 [0,1,0,1,0,0|1,1,0]=4 3744 B7R1.10 CSC1CC(C1)N MCULE-3576120726 [0,1,0,1,0,0|1,1,0]=4 3745 B7R1.10 CSC1CC(C1)N MCULE-5640448812 [0,1,0,1,0,0|1,1,0]=4 3746 B7R1.10 CSC1CC(C1)O MCULE-1605912153 [0,1,0,1,0,0|1,1,0]=4 3747 B7R1.21 CCCC1(CC1)N MCULE-2015286161 [0,1,0,1,0,0|2,0,0]=4 3748 B7R1.21 CCCC1(CC1)N MCULE-9864007655 [0,1,0,1,0,0|2,0,0]=4 3749 B7R1.21 CNCC1(CC1)C MCULE-5523822723 [0,1,0,1,0,0|2,0,0]=4 3750 B7R1.21 CNCC1(CC1)O MCULE-3223715599 [0,1,0,1,0,0|2,0,0]=4 3751 B7R1.21 CNCC1(CC1)O MCULE-4292226298 [0,1,0,1,0,0|2,0,0]=4 3752 B7R1.21 COCC1(CC1)N MCULE-1201230014 [0,1,0,1,0,0|1,0,0]=3 3753 B7R1.21 COCC1(CC1)N MCULE-3690729649 [0,1,0,1,0,0|1,0,0]=3 3754 B7R1.21 COCC1(CO1)C MCULE-8694642597 [0,1,0,1,0,0|0,0,0]=2 3755 B7R1.22 C1(CO1)C(=O)OC MCULE-1350193594 [0,1,0,1,0,0|0,0,1]=3 3756 B7R1.22 C=C[C@H](O)[C@H]1CO1 MCULE-8949250499 [0,1,0,1,0,0|1,0,1]=4 3757 B7R1.22 CC(ON)C1CC1 MCULE-7159103218 [0,1,0,1,0,0|2,0,0]=4 3758 B7R1.22 CC(ON)C1CC1 MCULE-9475793465 [0,1,0,1,0,0|2,0,0]=4 3759 B7R1.22 CCC(N)C1CC1 MCULE-2935155085 [0,1,0,1,0,0|2,0,0]=4 3760 B7R1.22 CCC(N)C1CC1 MCULE-7295156418 [0,1,0,1,0,0|2,0,0]=4 3761 B7R1.22 CCC(O)C1CC1 MCULE-5753196768 [0,1,0,1,0,0|2,0,0]=4 3762 B7R1.22 CC[C@@H](N)C1CC1 MCULE-8184175332 [0,1,0,1,0,0|2,0,0]=4 3763 B7R1.22 CC[C@H](N)C1CC1 MCULE-5395953598 [0,1,0,1,0,0|2,0,0]=4 3764 B7R1.22 CC[C@H](N)C1CC1 MCULE-6843001585 [0,1,0,1,0,0|2,0,0]=4 3765 B7R1.22 CC[C@H](N)C1CC1 MCULE-8773009184 [0,1,0,1,0,0|2,0,0]=4 3766 B7R1.22 CNC(C)C1CC1 MCULE-3862123004 [0,1,0,1,0,0|2,0,0]=4 3767 B7R1.22 CNC(C)C1CC1 MCULE-5338638792 [0,1,0,1,0,0|2,0,0]=4 3768 B7R1.22 COC(=N)C1CC1 MCULE-3594886802 [0,1,0,1,0,0|1,0,1]=4 3769 B7R1.22 COC(=N)C1CC1 MCULE-6548060912 [0,1,0,1,0,0|1,0,1]=4 3770 B7R1.22 COC(=O)C1CC1 MCULE-3338113454 [0,1,0,1,0,0|1,0,1]=4 3771 B7R1.22 COC(=O)C1CN1 MCULE-2166427972 [0,1,0,1,0,0|1,0,1]=4 3772 B7R1.22 COC(=O)C1CO1 MCULE-1745412030 [0,1,0,1,0,0|0,0,1]=3 3773 B7R1.22 COC(=O)[C@@H]1CN1 MCULE-1955059175 [0,1,0,1,0,0|1,0,1]=4 3774 B7R1.22 COC(=O)[C@@H]1CN1 MCULE-5011635876 [0,1,0,1,0,0|1,0,1]=4 3775 B7R1.22 COC(=O)[C@@H]1CO1 MCULE-2259836812 [0,1,0,1,0,0|0,0,1]=3 3776 B7R1.22 COC(=O)[C@H]1CN1 MCULE-5882979938 [0,1,0,1,0,0|1,0,1]=4 3777 B7R1.22 COC(=O)[C@H]1CN1 MCULE-8601280412 [0,1,0,1,0,0|1,0,1]=4 3778 B7R1.22 COC(=O)[C@H]1CO1 MCULE-5568309714 [0,1,0,1,0,0|0,0,1]=3 3779 B7R1.22 COC(=O)[C@H]1CO1 MCULE-9432053348 [0,1,0,1,0,0|0,0,1]=3 3780 B7R1.22 ClCC(Cl)C1CO1 MCULE-4739045871 [0,1,0,1,0,0|2,0,0]=4 3781 B7R1.22 [C@H]1(CO1)C(=O)OC MCULE-2114123664 [0,1,0,1,0,0|0,0,1]=3 3782 B7R1.25 C#CC1(COC1)C MCULE-8884347965 [0,1,0,1,0,0|1,0,1]=4 3783 B7R1.25 C#CC1(COC1)F MCULE-7627715668 [0,1,0,1,0,0|1,0,1]=4 3784 B7R1.25 C#CC1(COC1)N MCULE-5433976736 [0,1,0,1,0,0|1,0,1]=4 3785 B7R1.25 C#CC1(COC1)N MCULE-9884833232 [0,1,0,1,0,0|1,0,1]=4 3786 B7R1.25 C#CC1(COC1)O MCULE-8197450802 [0,1,0,1,0,0|1,0,1]=4 3787 B7R1.25 C=CC1(COC1)N MCULE-1446171155 [0,1,0,1,0,0|1,0,1]=4 3788 B7R1.25 C=CC1(COC1)N MCULE-2444826926 [0,1,0,1,0,0|1,0,1]=4 3789 B7R1.25 C=CC1(COC1)O MCULE-3192470057 [0,1,0,1,0,0|1,0,1]=4 3790 B7R1.25 CC1(COC1)C#N MCULE-2081182478 [0,1,0,1,0,0|2,0,0]=4 3791 B7R1.25 CC1(COC1)C=O MCULE-4295634366 [0,1,0,1,0,0|2,0,0]=4 3792 B7R1.25 CC1(COC1)CBr MCULE-5644951797 [0,1,0,1,0,0|2,0,0]=4 3793 B7R1.25 CC1(COC1)CCl MCULE-3299014950 [0,1,0,1,0,0|2,0,0]=4 3794 B7R1.25 CC1(COC1)CI MCULE-2311899293 [0,1,0,1,0,0|2,0,0]=4 3795 B7R1.25 CC1(COC1)CN MCULE-1465461565 [0,1,0,1,0,0|2,0,0]=4 3796 B7R1.25 CC1(COC1)CN MCULE-9032740574 [0,1,0,1,0,0|2,0,0]=4 3797 B7R1.25 CC1(COC1)CN MCULE-9508101523 [0,1,0,1,0,0|2,0,0]=4 3798 B7R1.25 CC1(COC1)CO MCULE-5859568263 [0,1,0,1,0,0|2,0,0]=4 3799 B7R1.25 CC1(COC1)CS MCULE-6297617076 [0,1,0,1,0,0|2,0,0]=4 3800 B7R1.25 CCC1(CCC1)N MCULE-5053916607 [0,1,0,1,0,0|2,0,0]=4 3801 B7R1.25 CCC1(CCC1)N MCULE-5413278315 [0,1,0,1,0,0|2,0,0]=4 3802 B7R1.25 CCC1(CNC1)C MCULE-6047240128 [0,1,0,1,0,0|2,0,0]=4 3803 B7R1.25 CCC1(CNC1)C MCULE-7401095376 [0,1,0,1,0,0|2,0,0]=4 3804 B7R1.25 CCC1(CNC1)F MCULE-1017966726 [0,1,0,1,0,0|2,0,0]=4 3805 B7R1.25 CCC1(CNC1)F MCULE-7766358285 [0,1,0,1,0,0|2,0,0]=4 3806 B7R1.25 CCC1(CNC1)N MCULE-3356995774 [0,1,0,1,0,0|2,0,0]=4 3807 B7R1.25 CCC1(CNC1)N MCULE-3405511665 [0,1,0,1,0,0|2,0,0]=4 3808 B7R1.25 CCC1(CNC1)N MCULE-9106873585 [0,1,0,1,0,0|2,0,0]=4 3809 B7R1.25 CCC1(CNC1)O MCULE-5663327812 [0,1,0,1,0,0|2,0,0]=4 3810 B7R1.25 CCC1(CNC1)O MCULE-5973200057 [0,1,0,1,0,0|2,0,0]=4 3811 B7R1.25 CCC1(CNC1)O MCULE-7770950299 [0,1,0,1,0,0|2,0,0]=4 3812 B7R1.25 CCC1(COC1)N MCULE-1675536237 [0,1,0,1,0,0|1,0,0]=3 3813 B7R1.25 CCC1(COC1)N MCULE-2070317664 [0,1,0,1,0,0|1,0,0]=3 3814 B7R1.25 CCC1(COC1)O MCULE-7543171366 [0,1,0,1,0,0|1,0,0]=3 3815 B7R1.25 CNC1(CNC1)C MCULE-2295222646 [0,1,0,1,0,0|2,0,0]=4 3816 B7R1.25 CNC1(COC1)C MCULE-4717844922 [0,1,0,1,0,0|1,0,0]=3 3817 B7R1.25 CNC1(COC1)C MCULE-6586517624 [0,1,0,1,0,0|1,0,0]=3 3818 B7R1.25 COC1(CNC1)C MCULE-6665716453 [0,1,0,1,0,0|1,0,0]=3 3819 B7R1.25 COC1(CNC1)C MCULE-9047074177 [0,1,0,1,0,0|1,0,0]=3 3820 B7R1.25 FC1(COC1)CBr MCULE-5677480606 [0,1,0,1,0,0|2,0,0]=4 3821 B7R1.25 FC1(COC1)CI MCULE-7872792591 [0,1,0,1,0,0|2,0,0]=4 3822 B7R1.25 N#CC1(COC1)N MCULE-7987341637 [0,1,0,1,0,0|2,0,0]=4 3823 B7R1.25 N#CC1(COC1)N MCULE-8030800216 [0,1,0,1,0,0|2,0,0]=4 3824 B7R1.25 N#CC1(COC1)O MCULE-4264738108 [0,1,0,1,0,0|2,0,0]=4 3825 B7R1.25 NC1(COC1)CF MCULE-5210114564 [0,1,0,1,0,0|2,0,0]=4 3826 B7R1.25 NC1(COC1)CF MCULE-9301949135 [0,1,0,1,0,0|2,0,0]=4 3827 B7R1.25 NC1(COC1)CO MCULE-5347414182 [0,1,0,1,0,0|2,0,0]=4 3828 B7R1.25 NCC1(COC1)F MCULE-4525292125 [0,1,0,1,0,0|2,0,0]=4 3829 B7R1.25 NCC1(COC1)N MCULE-1079562077 [0,1,0,1,0,0|2,0,0]=4 3830 B7R1.25 NCC1(COC1)N MCULE-6820840703 [0,1,0,1,0,0|2,0,0]=4 3831 B7R1.25 NCC1(COC1)N MCULE-6888014911 [0,1,0,1,0,0|2,0,0]=4 3832 B7R1.25 NCC1(COC1)O MCULE-6677052127 [0,1,0,1,0,0|2,0,0]=4 3833 B7R1.25 OC1(COC1)CF MCULE-1428128025 [0,1,0,1,0,0|2,0,0]=4 3834 B7R1.25 OCC1(COC1)F MCULE-9098723776 [0,1,0,1,0,0|2,0,0]=4 3835 B7R1.25 OCC1(COC1)O MCULE-4207928663 [0,1,0,1,0,0|2,0,0]=4 3836 B7R1.27 COC1(CC1N)C MCULE-2779937239 [0,1,0,1,0,0|2,0,0]=4 3837 B7R1.7 BrCCCC1CC1 MCULE-1359115765 [0,1,0,1,0,0|2,0,0]=4 3838 B7R1.7 C#CCCC1CO1 MCULE-8252140231 [0,1,0,1,0,0|1,0,1]=4 3839 B7R1.7 C=CCCC1CO1 MCULE-2331378134 [0,1,0,1,0,0|1,0,1]=4 3840 B7R1.7 C=CCC[C@H]1CO1 MCULE-4953904401 [0,1,0,1,0,0|1,0,1]=4 3841 B7R1.7 C=CCC[C@H]1CO1 MCULE-7730579466 [0,1,0,1,0,0|1,0,1]=4 3842 B7R1.7 CC/C=C/[C@H]1CO1 MCULE-2083815927 [0,1,0,1,0,0|1,0,1]=4 3843 B7R1.7 CCCCC1CO1 MCULE-8403189539 [0,1,0,1,0,0|1,0,0]=3 3844 B7R1.7 CCCNC1CC1 MCULE-7033521193 [0,1,0,1,0,0|2,0,0]=4 3845 B7R1.7 CCCNC1CC1 MCULE-8227176324 [0,1,0,1,0,0|2,0,0]=4 3846 B7R1.7 CCNCC1CC1 MCULE-3070053773 [0,1,0,1,0,0|2,0,0]=4 3847 B7R1.7 CCNCC1CC1 MCULE-5997221486 [0,1,0,1,0,0|2,0,0]=4 3848 B7R1.7 CCOCC1CO1 MCULE-2647353662 [0,1,0,1,0,0|0,0,0]=2 3849 B7R1.7 CCONC1CC1 MCULE-5199479207 [0,1,0,1,0,0|2,0,0]=4 3850 B7R1.7 CCONC1CC1 MCULE-5905564764 [0,1,0,1,0,0|2,0,0]=4 3851 B7R1.7 CNCCC1CC1 MCULE-2375777124 [0,1,0,1,0,0|2,0,0]=4 3852 B7R1.7 CNCCC1CC1 MCULE-9913761675 [0,1,0,1,0,0|2,0,0]=4 3853 B7R1.7 CNOCC1CC1 MCULE-1735426846 [0,1,0,1,0,0|1,0,0]=3 3854 B7R1.7 CNOCC1CC1 MCULE-3664885073 [0,1,0,1,0,0|1,0,0]=3 3855 B7R1.7 COC=CC1CC1 MCULE-6861075225 [0,1,0,1,0,0|1,0,1]=4 3856 B7R1.7 COCCC1CO1 MCULE-9068008411 [0,1,0,1,0,0|0,0,0]=2 3857 B7R1.7 COCNC1CC1 MCULE-6233934333 [0,1,0,1,0,0|1,0,0]=3 3858 B7R1.7 NCCCC1CC1 MCULE-1579218471 [0,1,0,1,0,0|2,0,0]=4 3859 B7R1.7 NCCCC1CC1 MCULE-8160460213 [0,1,0,1,0,0|2,0,0]=4 3860 B7R1.7 NOCCC1CC1 MCULE-1304023980 [0,1,0,1,0,0|2,0,0]=4 3861 B7R1.7 NOCCC1CC1 MCULE-8656049274 [0,1,0,1,0,0|2,0,0]=4 3862 B7R1.7 OCCCC1CC1 MCULE-5336501479 [0,1,0,1,0,0|2,0,0]=4 3863 B7R1.12 CC(=O)C1CC1C MCULE-5857709747 [0,1,0,1,0,0|2,0,0]=4 3864 B7R1.12 CC(=O)[C@@H]1C[C@H]1C MCULE-4367650211 [0,1,0,1,0,0|2,0,0]=4 3865 B7R1.14 CC1(CCCC1)Br MCULE-8706490914 [0,1,0,1,0,0|2,0,0]=4 3866 B7R1.14 CC1(CCCC1)N MCULE-1696024032 [0,1,0,1,0,0|2,0,0]=4 3867 B7R1.14 CC1(CCCC1)N MCULE-7897960444 [0,1,0,1,0,0|2,0,0]=4 3868 B7R1.14 CC1(CCCC1)O MCULE-1425529053 [0,1,0,1,0,0|2,0,0]=4 3869 B7R1.14 CC1(CCNC1)C MCULE-3460660754 [0,1,0,1,0,0|2,0,0]=4 3870 B7R1.14 CC1(CCNC1)C MCULE-7874744806 [0,1,0,1,0,0|2,0,0]=4 3871 B7R1.14 CC1(CCNC1)C MCULE-9717378283 [0,1,0,1,0,0|2,0,0]=4 3872 B7R1.14 CC1(CCNC1)F MCULE-1205333206 [0,1,0,1,0,0|2,0,0]=4 3873 B7R1.14 CC1(CCNC1)F MCULE-8512729081 [0,1,0,1,0,0|2,0,0]=4 3874 B7R1.14 CC1(CCNC1)N MCULE-9317786482 [0,1,0,1,0,0|2,0,0]=4 3875 B7R1.14 CC1(CCNC1)N MCULE-9638120938 [0,1,0,1,0,0|2,0,0]=4 3876 B7R1.14 CC1(CCNC1)O MCULE-1812572207 [0,1,0,1,0,0|2,0,0]=4 3877 B7R1.14 CC1(CCNC1)O MCULE-3978790995 [0,1,0,1,0,0|2,0,0]=4 3878 B7R1.14 CC1(CCNC1)O MCULE-6355817754 [0,1,0,1,0,0|2,0,0]=4 3879 B7R1.14 CC1(CCNC1)O MCULE-7199660654 [0,1,0,1,0,0|2,0,0]=4 3880 B7R1.14 CC1(CCOC1)N MCULE-1997756007 [0,1,0,1,0,0|1,0,0]=3 3881 B7R1.14 CC1(CCOC1)N MCULE-5807249895 [0,1,0,1,0,0|1,0,0]=3 3882 B7R1.14 CC1(CCOC1)O MCULE-5065022086 [0,1,0,1,0,0|1,0,0]=3 3883 B7R1.14 CC1(CCSC1)O MCULE-3138867143 [0,1,0,1,0,0|1,1,0]=4 3884 B7R1.14 CC1(COCN1)C MCULE-4655412355 [0,1,0,1,0,0|2,0,0]=4 3885 B7R1.14 C[C@@]1(CCNC1)F MCULE-1340440767 [0,1,0,1,0,0|2,0,0]=4 3886 B7R1.14 C[C@@]1(CCNC1)F MCULE-5898059594 [0,1,0,1,0,0|2,0,0]=4 3887 B7R1.14 C[C@@]1(CCNC1)F MCULE-6901424312 [0,1,0,1,0,0|2,0,0]=4 3888 B7R1.14 C[C@@]1(CCNC1)F MCULE-9433824470 [0,1,0,1,0,0|2,0,0]=4 3889 B7R1.14 C[C@@]1(CCNC1)N MCULE-3652011553 [0,1,0,1,0,0|2,0,0]=4 3890 B7R1.14 C[C@@]1(CCNC1)O MCULE-2185266890 [0,1,0,1,0,0|2,0,0]=4 3891 B7R1.14 C[C@@]1(CCNC1)O MCULE-4472850857 [0,1,0,1,0,0|2,0,0]=4 3892 B7R1.14 C[C@@]1(CCNC1)O MCULE-7216590589 [0,1,0,1,0,0|2,0,0]=4 3893 B7R1.14 C[C@@]1(CCNC1)O MCULE-9031112405 [0,1,0,1,0,0|2,0,0]=4 3894 B7R1.14 C[C@@]1(CNOC1)O MCULE-2135476163 [0,1,0,1,0,0|2,0,0]=4 3895 B7R1.14 C[C@@]1(CNOC1)O MCULE-2596956621 [0,1,0,1,0,0|2,0,0]=4 3896 B7R1.14 C[C@@]1(CNOC1)O MCULE-6080745149 [0,1,0,1,0,0|2,0,0]=4 3897 B7R1.14 C[C@@]1(CNOC1)O MCULE-7091595110 [0,1,0,1,0,0|2,0,0]=4 3898 B7R1.14 C[C@]1(CCNC1)F MCULE-1291336282 [0,1,0,1,0,0|2,0,0]=4 3899 B7R1.14 C[C@]1(CCNC1)F MCULE-2571688853 [0,1,0,1,0,0|2,0,0]=4 3900 B7R1.14 C[C@]1(CCNC1)O MCULE-2513078981 [0,1,0,1,0,0|2,0,0]=4 3901 B7R1.14 C[C@]1(CCNC1)O MCULE-2837064957 [0,1,0,1,0,0|2,0,0]=4 3902 B7R1.14 C[C@]1(CCNC1)O MCULE-5133863014 [0,1,0,1,0,0|2,0,0]=4 3903 B7R1.14 C[C@]1(CCNC1)O MCULE-5887726834 [0,1,0,1,0,0|2,0,0]=4 3904 B7R1.14 C[C@]1(CNOC1)O MCULE-1405004782 [0,1,0,1,0,0|2,0,0]=4 3905 B7R1.14 C[C@]1(CNOC1)O MCULE-4558122242 [0,1,0,1,0,0|2,0,0]=4 3906 B7R1.14 C[N+]1(CCCC1)C MCULE-3715522497 [0,1,0,1,0,0|2,0,0]=4 3907 B7R1.14 C[N+]1(CCCC1)C MCULE-9941565311 [0,1,0,1,0,0|2,0,0]=4 3908 B7R1.14 C[Si]1(CCCC1)C MCULE-1541355807 [0,1,0,1,0,0|2,0,0]=4 3909 B7R1.18 CC(=O)C1CCC1 MCULE-5770046789 [0,1,0,1,0,0|2,0,0]=4 3910 B7R1.18 CC(=O)C1CNC1 MCULE-2354733934 [0,1,0,1,0,0|2,0,0]=4 3911 B7R1.18 CC(=O)C1CNC1 MCULE-3110609785 [0,1,0,1,0,0|2,0,0]=4 3912 B7R1.18 CC(=O)C1CNC1 MCULE-4112322251 [0,1,0,1,0,0|2,0,0]=4 3913 B7R1.18 CC(=O)C1COC1 MCULE-3416774210 [0,1,0,1,0,0|1,0,0]=3 3914 B7R1.18 CC(C)C1CNC1 MCULE-4830353053 [0,1,0,1,0,0|2,0,0]=4 3915 B7R1.18 CC(C)C1CNC1 MCULE-7304386148 [0,1,0,1,0,0|2,0,0]=4 3916 B7R1.18 CC(N)C1CCC1 MCULE-1055775237 [0,1,0,1,0,0|2,0,0]=4 3917 B7R1.18 CC(N)C1CCC1 MCULE-4303681430 [0,1,0,1,0,0|2,0,0]=4 3918 B7R1.18 CC(N)C1COC1 MCULE-1380624257 [0,1,0,1,0,0|1,0,0]=3 3919 B7R1.18 CC(N)C1CSC1 MCULE-5095506053 [0,1,0,1,0,0|1,1,0]=4 3920 B7R1.18 CC(O)C1CCC1 MCULE-7846963519 [0,1,0,1,0,0|2,0,0]=4 3921 B7R1.18 CC(O)C1CNC1 MCULE-1265886795 [0,1,0,1,0,0|2,0,0]=4 3922 B7R1.18 CC(O)C1CNC1 MCULE-5108259269 [0,1,0,1,0,0|2,0,0]=4 3923 B7R1.18 CC(O)C1CNC1 MCULE-8265279011 [0,1,0,1,0,0|2,0,0]=4 3924 B7R1.18 CC(O)C1COC1 MCULE-4981198639 [0,1,0,1,0,0|1,0,0]=3 3925 B7R1.18 CN(C)C1CNC1 MCULE-2552414122 [0,1,0,1,0,0|2,0,0]=4 3926 B7R1.18 CN(C)C1CNC1 MCULE-4686829927 [0,1,0,1,0,0|2,0,0]=4 3927 B7R1.18 CN(C)C1CNC1 MCULE-8337480938 [0,1,0,1,0,0|2,0,0]=4 3928 B7R1.18 CS(=O)C1CNC1 MCULE-1896314246 [0,1,0,1,0,0|1,1,0]=4 3929 B7R1.18 CS(=O)C1CNC1 MCULE-3655021594 [0,1,0,1,0,0|1,1,0]=4 3930 B7R1.18 C[C@@H](N)C1CCC1 MCULE-4670161237 [0,1,0,1,0,0|2,0,0]=4 3931 B7R1.18 C[C@@H](N)C1CCC1 MCULE-6520272933 [0,1,0,1,0,0|2,0,0]=4 3932 B7R1.18 C[C@@H](N)C1CCC1 MCULE-8342688572 [0,1,0,1,0,0|2,0,0]=4 3933 B7R1.18 C[C@@H](N)C1CCC1 MCULE-9076983662 [0,1,0,1,0,0|2,0,0]=4 3934 B7R1.18 C[C@@H](N)C1COC1 MCULE-7669553866 [0,1,0,1,0,0|1,0,0]=3 3935 B7R1.18 C[C@@H](O)C1CCC1 MCULE-6990873960 [0,1,0,1,0,0|2,0,0]=4 3936 B7R1.18 C[C@@H](O)C1COC1 MCULE-5223611242 [0,1,0,1,0,0|1,0,0]=3 3937 B7R1.18 C[C@@H](O)C1COC1 MCULE-5819578881 [0,1,0,1,0,0|1,0,0]=3 3938 B7R1.18 C[C@H](N)C1CCC1 MCULE-2555280675 [0,1,0,1,0,0|2,0,0]=4 3939 B7R1.18 C[C@H](N)C1CCC1 MCULE-3888125434 [0,1,0,1,0,0|2,0,0]=4 3940 B7R1.18 C[C@H](N)C1CCC1 MCULE-6963105805 [0,1,0,1,0,0|2,0,0]=4 3941 B7R1.18 C[C@H](N)C1CCC1 MCULE-7483270694 [0,1,0,1,0,0|2,0,0]=4 3942 B7R1.18 C[C@H](N)C1COC1 MCULE-8337949293 [0,1,0,1,0,0|1,0,0]=3 3943 B7R1.18 C[C@H](O)C1CCC1 MCULE-5072123772 [0,1,0,1,0,0|2,0,0]=4 3944 B7R1.18 C[C@H](O)C1CCC1 MCULE-6701623925 [0,1,0,1,0,0|2,0,0]=4 3945 B7R1.18 C[C@H](O)C1CNC1 MCULE-4694154501 [0,1,0,1,0,0|2,0,0]=4 3946 B7R1.18 C[C@H](O)C1CNC1 MCULE-5870270724 [0,1,0,1,0,0|2,0,0]=4 3947 B7R1.18 C[C@H](O)C1COC1 MCULE-1396791034 [0,1,0,1,0,0|1,0,0]=3 3948 B7R1.18 C[C@H](O)C1COC1 MCULE-8805369596 [0,1,0,1,0,0|1,0,0]=3 3949 B7R1.18 NC(=O)C1COC1 MCULE-1077689713 [0,1,0,1,0,0|2,0,0]=4 3950 B7R1.18 O=C(O)C1COC1 MCULE-2530431165 [0,1,0,1,0,0|2,0,0]=4 3951 B7R1.18 O=N(=O)C1COC1 MCULE-1243582303 [0,1,0,1,0,0|2,0,0]=4 3952 B7R1.20 CC(=O)CC1CC1 MCULE-3465510397 [0,1,0,1,0,0|2,0,0]=4 3953 B7R1.20 CC(C)CC1CO1 MCULE-7259971470 [0,1,0,1,0,0|1,0,0]=3 3954 B7R1.20 CC(N)CC1CC1 MCULE-1913565015 [0,1,0,1,0,0|2,0,0]=4 3955 B7R1.20 CC(N)CC1CC1 MCULE-2214997571 [0,1,0,1,0,0|2,0,0]=4 3956 B7R1.20 CC(O)CC1CC1 MCULE-1952195648 [0,1,0,1,0,0|2,0,0]=4 3957 B7R1.20 CN(C)CC1CC1 MCULE-6678267289 [0,1,0,1,0,0|2,0,0]=4 3958 B7R1.20 CN(C)CC1CO1 MCULE-3116266625 [0,1,0,1,0,0|1,0,0]=3 3959 B7R1.20 C[C@@H](O)CC1CC1 MCULE-2616688976 [0,1,0,1,0,0|2,0,0]=4 3960 B7R1.20 C[C@H](O)CC1CC1 MCULE-5001414363 [0,1,0,1,0,0|2,0,0]=4 3961 B7R1.20 NC(=O)CC1CO1 MCULE-9954364706 [0,1,0,1,0,0|2,0,0]=4 3962 B7R1.20 O=C(O)CC1CO1 MCULE-5322663834 [0,1,0,1,0,0|2,0,0]=4 3963 B7R1.20 O=C(O)C[C@H]1CO1 MCULE-2418249972 [0,1,0,1,0,0|2,0,0]=4 3964 B7R1.23 CNC1CC1(C)C MCULE-2392748327 [0,1,0,1,0,0|2,0,0]=4 3965 B7R1.23 CNC1CC1(C)C MCULE-6195602506 [0,1,0,1,0,0|2,0,0]=4 3966 B7R1.24 C1=CCCCCC1 MCULE-4514853156 [0,1,0,1,0,0|2,0,0]=4 3967 B7R1.24 C1=CCCNCC1 MCULE-4540835407 [0,1,0,1,0,0|2,0,0]=4 3968 B7R1.24 C1=CCCNCC1 MCULE-9349712539 [0,1,0,1,0,0|2,0,0]=4 3969 B7R1.24 C1=CCOCOC1 MCULE-2815492798 [0,1,0,1,0,0|1,0,1]=4 3970 B7R1.24 C1CCCCCC1 MCULE-5257270866 [0,1,0,1,0,0|2,0,0]=4 3971 B7R1.24 C1CCCNCC1 MCULE-6467465155 [0,1,0,1,0,0|2,0,0]=4 3972 B7R1.24 C1CCCOCC1 MCULE-9994899395 [0,1,0,1,0,0|1,0,0]=3 3973 B7R1.24 C1CCNCNC1 MCULE-9023922794 [0,1,0,1,0,0|2,0,0]=4 3974 B7R1.24 C1CCNNCC1 MCULE-1174944539 [0,1,0,1,0,0|2,0,0]=4 3975 B7R1.24 C1CCNNCC1 MCULE-8518491960 [0,1,0,1,0,0|2,0,0]=4 3976 B7R1.24 C1CCNOCC1 MCULE-7242354366 [0,1,0,1,0,0|1,0,0]=3 3977 B7R1.24 C1CCNOCC1 MCULE-7451936178 [0,1,0,1,0,0|1,0,0]=3 3978 B7R1.24 C1CCOCOC1 MCULE-4779745094 [0,1,0,1,0,0|1,0,0]=3 3979 B7R1.24 C1CNCCNC1 MCULE-8878366291 [0,1,0,1,0,0|2,0,0]=4 3980 B7R1.24 C1CNCCOC1 MCULE-9147617519 [0,1,0,1,0,0|1,0,0]=3 3981 B7R1.24 C1CNCCOC1 MCULE-9722986943 [0,1,0,1,0,0|1,0,0]=3 3982 B7R1.24 C1CNCCSC1 MCULE-3091366568 [0,1,0,1,0,0|1,1,0]=4 3983 B7R1.24 C1CNCCSC1 MCULE-7881506212 [0,1,0,1,0,0|1,1,0]=4 3984 B7R1.24 C1CNNCCN1 MCULE-5761778560 [0,1,0,1,0,0|2,0,0]=4 3985 B7R1.24 C1CNOCCN1 MCULE-3548078740 [0,1,0,1,0,0|1,0,0]=3 3986 B7R1.24 C1CNOCCN1 MCULE-4676245477 [0,1,0,1,0,0|1,0,0]=3 3987 B7R1.24 C1COCCNN1 MCULE-5237837037 [0,1,0,1,0,0|1,0,0]=3 3988 B7R1.24 C1COCCNN1 MCULE-6195400312 [0,1,0,1,0,0|1,0,0]=3 3989 B7R1.24 C1COCCNN1 MCULE-8018224954 [0,1,0,1,0,0|1,0,0]=3 3990 B7R1.24 C1COCCON1 MCULE-1064422282 [0,1,0,1,0,0|0,0,0]=2 3991 B7R1.24 C1COCCON1 MCULE-2039128953 [0,1,0,1,0,0|0,0,0]=2 3992 B7R1.24 C1CSSCCN1 MCULE-1533838386 [0,1,0,1,0,0|1,1,0]=4 3993 B7R2.13 C1=CC2OC2C1 MCULE-9601635666 [0,0,0,2,0,0|1,0,1]=4 3994 B7R2.13 C1CC2CC2C1 MCULE-4998824123 [0,0,0,2,0,0|2,0,0]=4 3995 B7R2.13 C1CC2CC2N1 MCULE-5625544754 [0,0,0,2,0,0|2,0,0]=4 3996 B7R2.13 C1CC2CC2N1 MCULE-6822939101 [0,0,0,2,0,0|2,0,0]=4 3997 B7R2.13 C1CC2NC2C1 MCULE-4807869634 [0,0,0,2,0,0|2,0,0]=4 3998 B7R2.13 C1CC2OC2C1 MCULE-9831160642 [0,0,0,2,0,0|1,0,0]=3 3999 B7R2.13 C1NCC2C1C2 MCULE-5688427614 [0,0,0,2,0,0|2,0,0]=4 4000 B7R2.13 C1NCC2C1C2 MCULE-7833686848 [0,0,0,2,0,0|2,0,0]=4 4001 B7R2.13 C1NCC2C1O2 MCULE-2427865207 [0,0,0,2,0,0|1,0,0]=3 4002 B7R2.13 C1NCC2C1O2 MCULE-9737269595 [0,0,0,2,0,0|1,0,0]=3 4003 B7R2.13 C1NC[C@H]2[C@@H]1C2 MCULE-2763696860 [0,0,0,2,0,0|2,0,0]=4 4004 B7R2.13 C1OCC2C1O2 MCULE-5569274990 [0,0,0,2,0,0|0,0,0]=2 4005 B7R2.11 C1CN2CN1C2 MCULE-1423842949 [0,0,0,2,0,0|2,0,0]=4 4006 B7R2.11 C1NC2CC1C2 MCULE-3826765557 [0,0,0,2,0,0|2,0,0]=4 4007 B7R2.11 C1NC2CC1C2 MCULE-4168683722 [0,0,0,2,0,0|2,0,0]=4 4008 B7R2.1 C1CC1C2CO2 MCULE-9859676878 [0,0,0,2,0,0|1,0,0]=3 4009 B7R2.1 C1O[C@@H]1[C@@H]2CO2 MCULE-3158496673 [0,0,0,2,0,0|0,0,0]=2 4010 B7R2.1 C1O[C@@H]1[C@@H]2CO2 MCULE-4139336692 [0,0,0,2,0,0|0,0,0]=2 4011 B7R2.16 C1CC12CNC2 MCULE-1662267844 [0,0,0,2,0,0|2,0,0]=4 4012 B7R2.16 C1CC12CNC2 MCULE-4114455551 [0,0,0,2,0,0|2,0,0]=4 4013 B7R2.16 C1CC12CNC2 MCULE-4499246227 [0,0,0,2,0,0|2,0,0]=4 4014 B7R2.16 C1CC12CNC2 MCULE-7427814071 [0,0,0,2,0,0|2,0,0]=4 4015 B7R2.16 C1CC2(C1)CO2 MCULE-6375096145 [0,0,0,2,0,0|1,0,0]=3 4016 B7R2.16 C1OCC12CO2 MCULE-4629544610 [0,0,0,2,0,0|0,0,0]=2