0 B10R0.71 BrCCCCCCCCCBr MCULE-3406292941 [0,0,0,0,0,0|2,0,1]=3 1 B10R0.71 C#CCCCCCCCCC MCULE-3352869074 [0,0,0,0,0,0|1,0,1]=2 2 B10R0.71 C#CCCCCCCCCO MCULE-1465013673 [0,0,0,0,0,0|2,0,1]=3 3 B10R0.71 C#CCOCCCCCCO MCULE-6480387579 [0,0,0,0,0,0|3,0,1]=4 4 B10R0.71 C(=CCCCCO)CCCC MCULE-5192933185 [0,0,0,0,0,0|0,0,4]=4 5 B10R0.71 C=CCCCCCCCC#N MCULE-1262733029 [0,0,0,0,0,0|2,0,1]=3 6 B10R0.71 C=CCCCCCCCC=C MCULE-5336376495 [0,0,0,0,0,0|1,0,2]=3 7 B10R0.71 C=CCCCCCCCC=O MCULE-2236196328 [0,0,0,0,0,0|0,0,2]=2 8 B10R0.71 C=CCCCCCCCCBr MCULE-9645873151 [0,0,0,0,0,0|2,0,0]=2 9 B10R0.71 C=CCCCCCCCCC MCULE-8437878932 [0,0,0,0,0,0|1,0,0]=1 10 B10R0.71 C=CCCCCCCCCI MCULE-5534023915 [0,0,0,0,0,0|2,0,0]=2 11 B10R0.71 C=CCCCCCCCCN MCULE-2867070960 [0,0,0,0,0,0|2,0,0]=2 12 B10R0.71 C=CCCCCCCCCN MCULE-6734552056 [0,0,0,0,0,0|2,0,0]=2 13 B10R0.71 C=CCCCCCCCCO MCULE-1808688008 [0,0,0,0,0,0|2,0,0]=2 14 B10R0.71 C=CCCCCSCCCC MCULE-9557499584 [0,0,0,0,0,0|2,0,0]=2 15 B10R0.71 C=CCOCCOCCOC MCULE-4173919087 [0,0,0,0,0,0|4,0,0]=4 16 B10R0.71 C=CCOCCSCCCC MCULE-5814639814 [0,0,0,0,0,0|3,0,0]=3 17 B10R0.71 C=COCCCCCCCC MCULE-9207967577 [0,0,0,0,0,0|2,0,0]=2 18 B10R0.71 CCC#CCCCCCCC MCULE-4172735383 [0,0,0,0,0,0|1,0,3]=4 19 B10R0.71 CCC#CCCCCCCCl MCULE-2143365828 [0,0,0,0,0,0|1,0,3]=4 20 B10R0.71 CCCC/C=C/CCCCO MCULE-8537897542 [0,0,0,0,0,0|0,0,4]=4 21 B10R0.71 CCCC/C=C\CCCCO MCULE-8382129018 [0,0,0,0,0,0|0,0,4]=4 22 B10R0.71 CCCCC#CCCCCC MCULE-9228856431 [0,0,0,0,0,0|1,0,3]=4 23 B10R0.71 CCCCC#CCCCCO MCULE-2516123124 [0,0,0,0,0,0|0,0,4]=4 24 B10R0.71 CCCCC/C=C/C=C/C=O MCULE-8478423084 [0,0,0,0,0,0|0,0,4]=4 25 B10R0.71 CCCCC/C=C/CCC=O MCULE-6310350913 [0,0,0,0,0,0|0,0,2]=2 26 B10R0.71 CCCCC/C=C\CCC=O MCULE-2454675705 [0,0,0,0,0,0|0,0,2]=2 27 B10R0.71 CCCCC/C=C\CCCO MCULE-5673742797 [0,0,0,0,0,0|0,0,4]=4 28 B10R0.71 CCCCCC=CC=CC=O MCULE-9055179345 [0,0,0,0,0,0|0,0,4]=4 29 B10R0.71 CCCCCC=CCCC=O MCULE-4591548304 [0,0,0,0,0,0|0,0,2]=2 30 B10R0.71 CCCCCC=CCCCO MCULE-4774794120 [0,0,0,0,0,0|0,0,4]=4 31 B10R0.71 CCCCCCC#CCCO MCULE-5377358049 [0,0,0,0,0,0|0,0,4]=4 32 B10R0.71 CCCCCCC=CCCO MCULE-7637000822 [0,0,0,0,0,0|0,0,4]=4 33 B10R0.71 CCCCCCCC#CCO MCULE-4211819006 [0,0,0,0,0,0|0,0,4]=4 34 B10R0.71 CCCCCCCC=CC=O MCULE-8898697953 [0,0,0,0,0,0|0,0,2]=2 35 B10R0.71 CCCCCCCC=CCO MCULE-3462895858 [0,0,0,0,0,0|0,0,4]=4 36 B10R0.71 CCCCCCCCC#CBr MCULE-1192896759 [0,0,0,0,0,0|1,0,2]=3 37 B10R0.71 CCCCCCCCC#CO MCULE-7543737628 [0,0,0,0,0,0|0,0,3]=3 38 B10R0.71 CCCCCCCCCC#N MCULE-1090480870 [0,0,0,0,0,0|1,0,1]=2 39 B10R0.71 CCCCCCCCCC=O MCULE-1782320282 [0,0,0,0,0,0|0,0,0]=0 40 B10R0.71 CCCCCCCCCCBr MCULE-1805531766 [0,0,0,0,0,0|1,0,1]=2 41 B10R0.71 CCCCCCCCCCC MCULE-7319807036 [0,0,0,0,0,0|1,0,1]=2 42 B10R0.71 CCCCCCCCCCCl MCULE-7602190189 [0,0,0,0,0,0|1,0,1]=2 43 B10R0.71 CCCCCCCCCCF MCULE-6490238051 [0,0,0,0,0,0|1,0,1]=2 44 B10R0.71 CCCCCCCCCCI MCULE-6718970716 [0,0,0,0,0,0|1,0,1]=2 45 B10R0.71 CCCCCCCCCCN MCULE-3389198970 [0,0,0,0,0,0|1,0,1]=2 46 B10R0.71 CCCCCCCCCCO MCULE-7579570663 [0,0,0,0,0,0|0,0,2]=2 47 B10R0.71 CCCCCCCCCCS MCULE-5945458624 [0,0,0,0,0,0|0,1,1]=2 48 B10R0.71 CCCCCCCCCNC MCULE-3969866054 [0,0,0,0,0,0|2,0,0]=2 49 B10R0.71 CCCCCCCCCNC MCULE-6631883657 [0,0,0,0,0,0|2,0,0]=2 50 B10R0.71 CCCCCCCCCOC MCULE-3906263885 [0,0,0,0,0,0|2,0,0]=2 51 B10R0.71 CCCCCCCCCON MCULE-2563186433 [0,0,0,0,0,0|2,0,0]=2 52 B10R0.71 CCCCCCCCCSC MCULE-9001057781 [0,0,0,0,0,0|2,0,0]=2 53 B10R0.71 CCCCCCCCN=C=O MCULE-8555471006 [0,0,0,0,0,0|1,0,1]=2 54 B10R0.71 CCCCCCCCN=C=S MCULE-4775323786 [0,0,0,0,0,0|1,1,1]=3 55 B10R0.71 CCCCCCCCN=N#N MCULE-4737472724 [0,0,0,0,0,0|3,0,0]=3 56 B10R0.71 CCCCCCCCNC=O MCULE-5327203150 [0,0,0,0,0,0|1,0,0]=1 57 B10R0.71 CCCCCCCCOC=O MCULE-6865253802 [0,0,0,0,0,0|1,0,0]=1 58 B10R0.71 CCCCCCCCOCC MCULE-7803614357 [0,0,0,0,0,0|2,0,1]=3 59 B10R0.71 CCCCCCCCOCCl MCULE-8103995676 [0,0,0,0,0,0|2,0,1]=3 60 B10R0.71 CCCCCCCNOCC MCULE-6718978813 [0,0,0,0,0,0|3,0,1]=4 61 B10R0.71 CCCCCCCNOCC MCULE-7446092946 [0,0,0,0,0,0|3,0,1]=4 62 B10R0.71 CCCCCCCOCCCl MCULE-9608529645 [0,0,0,0,0,0|2,0,1]=3 63 B10R0.71 CCCCCCCOCCO MCULE-4391734532 [0,0,0,0,0,0|1,0,2]=3 64 B10R0.71 CCCCCCCOCCS MCULE-8215096371 [0,0,0,0,0,0|1,1,1]=3 65 B10R0.71 CCCCCCCSCCO MCULE-5713036847 [0,0,0,0,0,0|1,0,2]=3 66 B10R0.71 CCCCCCNCCC#N MCULE-2150602581 [0,0,0,0,0,0|2,0,1]=3 67 B10R0.71 CCCCCCNCCCC MCULE-1698769182 [0,0,0,0,0,0|2,0,1]=3 68 B10R0.71 CCCCCCNCCCCl MCULE-2065775862 [0,0,0,0,0,0|2,0,1]=3 69 B10R0.71 CCCCCCNCCCN MCULE-7482733368 [0,0,0,0,0,0|2,0,1]=3 70 B10R0.71 CCCCCC[NH2+]CCCCl MCULE-1476963531 [0,0,0,0,0,0|2,0,1]=3 71 B10R0.71 CCCCCNCCCCC MCULE-6460289904 [0,0,0,0,0,0|2,0,1]=3 72 B10R0.71 CCCCCNCCCCC MCULE-7466612345 [0,0,0,0,0,0|2,0,1]=3 73 B10R0.71 CCCCCNCCCOC MCULE-8182280213 [0,0,0,0,0,0|3,0,0]=3 74 B10R0.71 CCCCCOCCCCC MCULE-2510849143 [0,0,0,0,0,0|2,0,1]=3 75 B10R0.71 CCCCCSCCCCC MCULE-3839664161 [0,0,0,0,0,0|2,0,1]=3 76 B10R0.71 CCCCNCCOCCO MCULE-6722908845 [0,0,0,0,0,0|2,0,2]=4 77 B10R0.71 CCCCOCCOCCCl MCULE-8993573654 [0,0,0,0,0,0|3,0,1]=4 78 B10R0.71 CCCCOCCOCCN MCULE-5064402317 [0,0,0,0,0,0|3,0,1]=4 79 B10R0.71 CCCCOCCOCCO MCULE-9776383171 [0,0,0,0,0,0|2,0,2]=4 80 B10R0.71 CCCCOCCOCCS MCULE-8185433281 [0,0,0,0,0,0|2,1,1]=4 81 B10R0.71 CCCCOCCSCCO MCULE-1950831912 [0,0,0,0,0,0|2,0,2]=4 82 B10R0.71 CCCCOCOCCCC MCULE-5701893914 [0,0,0,0,0,0|3,0,1]=4 83 B10R0.71 CCCCSCCOCCO MCULE-8485842279 [0,0,0,0,0,0|2,0,2]=4 84 B10R0.71 CCNCCCNCCCO MCULE-4185964299 [0,0,0,0,0,0|2,0,2]=4 85 B10R0.71 CCNCCCNCCOC MCULE-6052245849 [0,0,0,0,0,0|4,0,0]=4 86 B10R0.71 CNCCCNCCCOC MCULE-6241973892 [0,0,0,0,0,0|4,0,0]=4 87 B10R0.71 COCCCCCCCCO MCULE-1529283698 [0,0,0,0,0,0|1,0,2]=3 88 B10R0.71 COCCCOCCCOC MCULE-6346352498 [0,0,0,0,0,0|4,0,0]=4 89 B10R0.71 CSCCCCCCN=C=S MCULE-2418957256 [0,0,0,0,0,0|2,1,1]=4 90 B10R0.71 ClCCCCCCCCCCl MCULE-3488427873 [0,0,0,0,0,0|2,0,1]=3 91 B10R0.71 ClCCCCOCCCCCl MCULE-4604276964 [0,0,0,0,0,0|3,0,1]=4 92 B10R0.71 N#CCCCCCCCC#N MCULE-2036249747 [0,0,0,0,0,0|2,0,2]=4 93 B10R0.71 N#N=NCCCCCCCO MCULE-2020987060 [0,0,0,0,0,0|4,0,0]=4 94 B10R0.71 NCCCCCCCCCN MCULE-8114252394 [0,0,0,0,0,0|2,0,1]=3 95 B10R0.71 NCCCCCCCCCO MCULE-2359018291 [0,0,0,0,0,0|1,0,2]=3 96 B10R0.71 NCCCCCNCCCN MCULE-2406277230 [0,0,0,0,0,0|3,0,1]=4 97 B10R0.71 NCCCCCNCCCN MCULE-9885228454 [0,0,0,0,0,0|3,0,1]=4 98 B10R0.71 NCCCCNCCCCN MCULE-2945581667 [0,0,0,0,0,0|3,0,1]=4 99 B10R0.71 NCCCCNCCCCN MCULE-6342087459 [0,0,0,0,0,0|3,0,1]=4 100 B10R0.71 NOCCCCCCCON MCULE-5906626366 [0,0,0,0,0,0|4,0,0]=4 101 B10R0.71 O=CCCCCCCCCBr MCULE-7863300341 [0,0,0,0,0,0|1,0,0]=1 102 B10R0.71 OCCCCCCCCCBr MCULE-7708976482 [0,0,0,0,0,0|1,0,2]=3 103 B10R0.71 OCCCCCCCCCCl MCULE-4637398536 [0,0,0,0,0,0|1,0,2]=3 104 B10R0.71 OCCCCCCCCCI MCULE-6281256155 [0,0,0,0,0,0|1,0,2]=3 105 B10R0.71 OCCCCCCCCCO MCULE-3258442969 [0,0,0,0,0,0|1,0,2]=3 106 B10R0.71 OCCCCCCCCCS MCULE-3447886598 [0,0,0,0,0,0|1,0,2]=3 107 B10R0.71 OCCCCCCOCCO MCULE-5642986797 [0,0,0,0,0,0|2,0,2]=4 108 B10R0.71 OCCCCNCCCCO MCULE-8546417896 [0,0,0,0,0,0|2,0,2]=4 109 B10R0.71 OCCCCOCCCCO MCULE-7966192236 [0,0,0,0,0,0|2,0,2]=4 110 B10R0.71 OCCOCCCCCCCl MCULE-3240737723 [0,0,0,0,0,0|2,0,2]=4 111 B10R0.71 SCCCCCCCCCS MCULE-1712418590 [0,0,0,0,0,0|1,1,1]=3 112 B10R0.71 [NH2+](CCCC)CCCCCC MCULE-8926764515 [0,0,0,0,0,0|2,0,1]=3 113 B9R0.45 BrCCCCCCCCBr MCULE-7960475988 [1,0,0,0,0,0|2,0,0]=3 114 B9R0.45 C#CCCCCCCCC MCULE-3452683648 [1,0,0,0,0,0|0,0,2]=3 115 B9R0.45 C#CCCCCCCCI MCULE-7418177661 [1,0,0,0,0,0|1,0,2]=4 116 B9R0.45 C#CCCCCCCCO MCULE-8834112591 [1,0,0,0,0,0|0,0,3]=4 117 B9R0.45 C#CCOCCCCC=O MCULE-7005816289 [1,0,0,0,0,0|1,0,2]=4 118 B9R0.45 C(=C\CCCCCO)\CC MCULE-7910166129 [1,0,0,0,0,0|0,0,3]=4 119 B9R0.45 C=CCCCCCCC#N MCULE-9683735042 [1,0,0,0,0,0|1,0,2]=4 120 B9R0.45 C=CCCCCCCC=C MCULE-5867550577 [1,0,0,0,0,0|0,0,3]=4 121 B9R0.45 C=CCCCCCCC=O MCULE-4979248929 [1,0,0,0,0,0|0,0,2]=3 122 B9R0.45 C=CCCCCCCCBr MCULE-6324921683 [1,0,0,0,0,0|1,0,1]=3 123 B9R0.45 C=CCCCCCCCC MCULE-1391753135 [1,0,0,0,0,0|0,0,1]=2 124 B9R0.45 C=CCCCCCCCCl MCULE-3438052360 [1,0,0,0,0,0|1,0,1]=3 125 B9R0.45 C=CCCCCCCCN MCULE-5068886534 [1,0,0,0,0,0|1,0,1]=3 126 B9R0.45 C=CCCCCCCCN MCULE-7639889154 [1,0,0,0,0,0|1,0,1]=3 127 B9R0.45 C=CCCCCCCCO MCULE-9611510472 [1,0,0,0,0,0|1,0,1]=3 128 B9R0.45 C=CCCNCCCCO MCULE-4909275740 [1,0,0,0,0,0|2,0,1]=4 129 B9R0.45 CC#CCCCCCCC MCULE-9888604196 [1,0,0,0,0,0|0,0,3]=4 130 B9R0.45 CC/C=C\CCCCC=O MCULE-6517193376 [1,0,0,0,0,0|0,0,2]=3 131 B9R0.45 CC=CCCCCCCC MCULE-6461098537 [1,0,0,0,0,0|1,0,1]=3 132 B9R0.45 CCC#CCCCCCC MCULE-2394718279 [1,0,0,0,0,0|0,0,3]=4 133 B9R0.45 CCC=CCCCCC=O MCULE-5419350827 [1,0,0,0,0,0|0,0,2]=3 134 B9R0.45 CCC=CCCCCCO MCULE-1504274864 [1,0,0,0,0,0|0,0,3]=4 135 B9R0.45 CCCC#CCCCCC MCULE-7200051907 [1,0,0,0,0,0|0,0,3]=4 136 B9R0.45 CCCC/C=C/CCCC MCULE-5215613168 [1,0,0,0,0,0|0,0,3]=4 137 B9R0.45 CCCC/C=C\CCCC MCULE-7961413462 [1,0,0,0,0,0|0,0,3]=4 138 B9R0.45 CCCCC#CCCCC MCULE-8619108623 [1,0,0,0,0,0|0,0,3]=4 139 B9R0.45 CCCCC#CCCCCl MCULE-2340213018 [1,0,0,0,0,0|1,0,2]=4 140 B9R0.45 CCCCC#CCCCO MCULE-1298739911 [1,0,0,0,0,0|0,0,3]=4 141 B9R0.45 CCCCC/C=C\CCO MCULE-4434068395 [1,0,0,0,0,0|0,0,3]=4 142 B9R0.45 CCCCC=CCCCC MCULE-4261429100 [1,0,0,0,0,0|0,0,3]=4 143 B9R0.45 CCCCCC#CCCO MCULE-7189083538 [1,0,0,0,0,0|0,0,3]=4 144 B9R0.45 CCCCCC/C=C/C=O MCULE-5281758989 [1,0,0,0,0,0|0,0,2]=3 145 B9R0.45 CCCCCC/C=C/CO MCULE-1969100525 [1,0,0,0,0,0|0,0,3]=4 146 B9R0.45 CCCCCC/C=C\CO MCULE-4688229291 [1,0,0,0,0,0|0,0,3]=4 147 B9R0.45 CCCCCC=CCCO MCULE-4969061256 [1,0,0,0,0,0|0,0,3]=4 148 B9R0.45 CCCCCCC#CCO MCULE-7144291083 [1,0,0,0,0,0|0,0,3]=4 149 B9R0.45 CCCCCCC=CC=O MCULE-8114348514 [1,0,0,0,0,0|0,0,2]=3 150 B9R0.45 CCCCCCC=CCO MCULE-8666977236 [1,0,0,0,0,0|0,0,3]=4 151 B9R0.45 CCCCCCCCC#N MCULE-9980153452 [1,0,0,0,0,0|1,0,1]=3 152 B9R0.45 CCCCCCCCC=O MCULE-9888879952 [1,0,0,0,0,0|0,0,0]=1 153 B9R0.45 CCCCCCCCCBr MCULE-1405697483 [1,0,0,0,0,0|1,0,0]=2 154 B9R0.45 CCCCCCCCCC MCULE-6071426098 [1,0,0,0,0,0|0,0,1]=2 155 B9R0.45 CCCCCCCCCCl MCULE-6711902685 [1,0,0,0,0,0|1,0,0]=2 156 B9R0.45 CCCCCCCCCF MCULE-9584148452 [1,0,0,0,0,0|1,0,0]=2 157 B9R0.45 CCCCCCCCCI MCULE-8717337450 [1,0,0,0,0,0|1,0,0]=2 158 B9R0.45 CCCCCCCCCN MCULE-5395407299 [1,0,0,0,0,0|1,0,0]=2 159 B9R0.45 CCCCCCCCCO MCULE-4020281400 [1,0,0,0,0,0|0,0,1]=2 160 B9R0.45 CCCCCCCCCS MCULE-1070515106 [1,0,0,0,0,0|0,1,0]=2 161 B9R0.45 CCCCCCCCNC MCULE-6996288442 [1,0,0,0,0,0|1,0,1]=3 162 B9R0.45 CCCCCCCCOC MCULE-4646070035 [1,0,0,0,0,0|1,0,1]=3 163 B9R0.45 CCCCCCCCSC MCULE-5517176664 [1,0,0,0,0,0|1,0,1]=3 164 B9R0.45 CCCCCCCN=C=O MCULE-8681396809 [1,0,0,0,0,0|1,0,1]=3 165 B9R0.45 CCCCCCCN=C=S MCULE-2877179378 [1,0,0,0,0,0|1,1,1]=4 166 B9R0.45 CCCCCCCN=N#N MCULE-7837723655 [1,0,0,0,0,0|3,0,0]=4 167 B9R0.45 CCCCCCCNC=O MCULE-7638122818 [1,0,0,0,0,0|1,0,0]=2 168 B9R0.45 CCCCCCCNCC MCULE-3055645322 [1,0,0,0,0,0|1,0,1]=3 169 B9R0.45 CCCCCCCOC=O MCULE-6396391540 [1,0,0,0,0,0|1,0,0]=2 170 B9R0.45 CCCCCCNCCN MCULE-2521807905 [1,0,0,0,0,0|2,0,0]=3 171 B9R0.45 CCCCCCNCCN MCULE-5886608711 [1,0,0,0,0,0|2,0,0]=3 172 B9R0.45 CCCCCCNCCO MCULE-6828996225 [1,0,0,0,0,0|1,0,1]=3 173 B9R0.45 CCCCCCNOCC MCULE-7230044709 [1,0,0,0,0,0|2,0,1]=4 174 B9R0.45 CCCCCCNOCC MCULE-8309226243 [1,0,0,0,0,0|2,0,1]=4 175 B9R0.45 CCCCCCOCCCl MCULE-5675234570 [1,0,0,0,0,0|2,0,0]=3 176 B9R0.45 CCCCCCOCCO MCULE-1339769602 [1,0,0,0,0,0|1,0,1]=3 177 B9R0.45 CCCCCCSCCO MCULE-3331753796 [1,0,0,0,0,0|1,0,1]=3 178 B9R0.45 CCCCCNCCC#N MCULE-6878613771 [1,0,0,0,0,0|2,0,1]=4 179 B9R0.45 CCCCCNCCCC MCULE-4324738465 [1,0,0,0,0,0|1,0,1]=3 180 B9R0.45 CCCCCNCCNC MCULE-3521145032 [1,0,0,0,0,0|2,0,1]=4 181 B9R0.45 CCCCCOCCC#N MCULE-7711243368 [1,0,0,0,0,0|2,0,1]=4 182 B9R0.45 CCCCCOCCCO MCULE-3048029561 [1,0,0,0,0,0|1,0,1]=3 183 B9R0.45 CCCCNCCCCO MCULE-1748671401 [1,0,0,0,0,0|1,0,1]=3 184 B9R0.45 CCCCNCCOCC MCULE-5585133594 [1,0,0,0,0,0|2,0,1]=4 185 B9R0.45 CCCCOCCCCO MCULE-1926189258 [1,0,0,0,0,0|1,0,1]=3 186 B9R0.45 CCCCSCCOCC MCULE-4700764338 [1,0,0,0,0,0|2,0,1]=4 187 B9R0.45 CCCCSSCCCC MCULE-5887157893 [1,0,0,0,0,0|2,0,1]=4 188 B9R0.45 CCCC[NH2+]CCCCCl MCULE-2045714641 [1,0,0,0,0,0|2,0,0]=3 189 B9R0.45 CCCC[NH2+]CCCCCl MCULE-2222567485 [1,0,0,0,0,0|2,0,0]=3 190 B9R0.45 CCCNCCCNCC MCULE-1018165528 [1,0,0,0,0,0|2,0,1]=4 191 B9R0.45 CCCNCCNCCC MCULE-7703644113 [1,0,0,0,0,0|2,0,1]=4 192 B9R0.45 CCCNCCOCCO MCULE-9598749389 [1,0,0,0,0,0|2,0,1]=4 193 B9R0.45 CCCOCCOCCCl MCULE-1639946093 [1,0,0,0,0,0|3,0,0]=4 194 B9R0.45 CCCOCCOCCO MCULE-8416880348 [1,0,0,0,0,0|2,0,1]=4 195 B9R0.45 CCOCCCCOCC MCULE-5008558328 [1,0,0,0,0,0|2,0,1]=4 196 B9R0.45 CCSCCCCSCC MCULE-9432415547 [1,0,0,0,0,0|2,0,1]=4 197 B9R0.45 CNCCCCCCNC MCULE-8440815147 [1,0,0,0,0,0|2,0,1]=4 198 B9R0.45 CNCCCNCCCO MCULE-9778642064 [1,0,0,0,0,0|2,0,1]=4 199 B9R0.45 COCCCCCCOC MCULE-8796987038 [1,0,0,0,0,0|2,0,1]=4 200 B9R0.45 COCCCNCCCN MCULE-2970161939 [1,0,0,0,0,0|3,0,0]=4 201 B9R0.45 COCCCOCCCO MCULE-6516268580 [1,0,0,0,0,0|2,0,1]=4 202 B9R0.45 COCCNCCCCO MCULE-8413188192 [1,0,0,0,0,0|2,0,1]=4 203 B9R0.45 COCCOCCCCN MCULE-3477207788 [1,0,0,0,0,0|3,0,0]=4 204 B9R0.45 ClCCCCCCCCCl MCULE-7522868799 [1,0,0,0,0,0|2,0,0]=3 205 B9R0.45 ICCCCCCCCI MCULE-6544838106 [1,0,0,0,0,0|2,0,0]=3 206 B9R0.45 N#CCCCCCCCBr MCULE-5175952413 [1,0,0,0,0,0|2,0,1]=4 207 B9R0.45 NCCCCCCCCBr MCULE-6623783968 [1,0,0,0,0,0|2,0,0]=3 208 B9R0.45 NCCCCCCCCBr MCULE-9911947498 [1,0,0,0,0,0|2,0,0]=3 209 B9R0.45 NCCCCCCCCN MCULE-1106731228 [1,0,0,0,0,0|2,0,0]=3 210 B9R0.45 NCCCCCCCCN MCULE-9889097856 [1,0,0,0,0,0|2,0,0]=3 211 B9R0.45 NCCCCCCCCO MCULE-1230018398 [1,0,0,0,0,0|1,0,1]=3 212 B9R0.45 NCCCCNCCCN MCULE-1390030323 [1,0,0,0,0,0|3,0,0]=4 213 B9R0.45 NCCCCNCCCN MCULE-4146689208 [1,0,0,0,0,0|3,0,0]=4 214 B9R0.45 NCCCCNCCCN MCULE-4688641416 [1,0,0,0,0,0|3,0,0]=4 215 B9R0.45 NCCCCNCCCN MCULE-6635730810 [1,0,0,0,0,0|3,0,0]=4 216 B9R0.45 NCCCCNCCCN MCULE-8096530192 [1,0,0,0,0,0|3,0,0]=4 217 B9R0.45 NCCNCCCCCO MCULE-7178121419 [1,0,0,0,0,0|2,0,1]=4 218 B9R0.45 NCCNCCCCCO MCULE-8348628451 [1,0,0,0,0,0|2,0,1]=4 219 B9R0.45 O=CCCCCCCC=O MCULE-6545234470 [1,0,0,0,0,0|1,0,1]=3 220 B9R0.45 OCCCCCCCCBr MCULE-2005797184 [1,0,0,0,0,0|1,0,1]=3 221 B9R0.45 OCCCCCCCCCl MCULE-8776830410 [1,0,0,0,0,0|1,0,1]=3 222 B9R0.45 OCCCCCCCCI MCULE-7793639517 [1,0,0,0,0,0|1,0,1]=3 223 B9R0.45 OCCCCCCCCO MCULE-7897417838 [1,0,0,0,0,0|1,0,1]=3 224 B9R0.45 OCCCCCCCCS MCULE-8372814979 [1,0,0,0,0,0|1,0,1]=3 225 B9R0.45 SCCCCCCCCS MCULE-5325130158 [1,0,0,0,0,0|1,1,0]=3 226 B9R0.45 [NH2+](CCCC)CCCCC MCULE-5314318531 [1,0,0,0,0,0|1,0,1]=3 227 B11R0.3 BrCCCCCCCCCCBr MCULE-6596890795 [0,1,0,0,0,0|1,0,1]=3 228 B11R0.3 C#CCCCCCCCCCBr MCULE-7590250790 [0,1,0,0,0,0|1,0,1]=3 229 B11R0.3 C#CCCCCCCCCCC MCULE-8413126831 [0,1,0,0,0,0|1,0,1]=3 230 B11R0.3 C#CCCCCCCCCCO MCULE-5387959646 [0,1,0,0,0,0|1,0,1]=3 231 B11R0.3 C#CCOCCCCCCCBr MCULE-9946717443 [0,1,0,0,0,0|2,0,1]=4 232 B11R0.3 C=CCCCC=CCNCCC MCULE-7102803637 [0,1,0,0,0,0|1,0,2]=4 233 B11R0.3 C=CCCCCCCCCC=C MCULE-6018522624 [0,1,0,0,0,0|1,0,1]=3 234 B11R0.3 C=CCCCCCCCCC=O MCULE-2748563286 [0,1,0,0,0,0|0,0,1]=2 235 B11R0.3 C=CCCCCCCCCCBr MCULE-3292244728 [0,1,0,0,0,0|1,0,0]=2 236 B11R0.3 C=CCCCCCCCCCC MCULE-4843306057 [0,1,0,0,0,0|1,0,0]=2 237 B11R0.3 C=CCCCCCCCCCCl MCULE-9014492464 [0,1,0,0,0,0|1,0,0]=2 238 B11R0.3 C=CCCCCCCCCCN MCULE-7839357621 [0,1,0,0,0,0|1,0,0]=2 239 B11R0.3 C=CCCCCCCCCCO MCULE-8086496729 [0,1,0,0,0,0|1,0,0]=2 240 B11R0.3 C=CCOCCCCCCCC MCULE-6446691340 [0,1,0,0,0,0|1,0,0]=2 241 B11R0.3 CC#CCCCCCCCCO MCULE-5846426924 [0,1,0,0,0,0|0,0,3]=4 242 B11R0.3 CCCC/C=C\CCCCCC MCULE-3573509087 [0,1,0,0,0,0|1,0,2]=4 243 B11R0.3 CCCCC#CCCCCCC MCULE-8000000275 [0,1,0,0,0,0|1,0,2]=4 244 B11R0.3 CCCCC=CCCCCCC MCULE-5218594928 [0,1,0,0,0,0|1,0,2]=4 245 B11R0.3 CCCCCC#CCCCCC MCULE-6744782610 [0,1,0,0,0,0|1,0,2]=4 246 B11R0.3 CCCCCC/C=C/C=C/C=O MCULE-7651195452 [0,1,0,0,0,0|0,0,3]=4 247 B11R0.3 CCCCCCC=CC=CC=O MCULE-3891394680 [0,1,0,0,0,0|0,0,3]=4 248 B11R0.3 CCCCCCC=CCCC=O MCULE-4819548256 [0,1,0,0,0,0|0,0,1]=2 249 B11R0.3 CCCCCCCCC=CC=O MCULE-3569381965 [0,1,0,0,0,0|0,0,1]=2 250 B11R0.3 CCCCCCCCC=CCO MCULE-3768375215 [0,1,0,0,0,0|0,0,2]=3 251 B11R0.3 CCCCCCCCCCC#N MCULE-7957242645 [0,1,0,0,0,0|1,0,1]=3 252 B11R0.3 CCCCCCCCCCC=O MCULE-2842613213 [0,1,0,0,0,0|0,0,0]=1 253 B11R0.3 CCCCCCCCCCCBr MCULE-1007413186 [0,1,0,0,0,0|1,0,1]=3 254 B11R0.3 CCCCCCCCCCCC MCULE-3947157412 [0,1,0,0,0,0|1,0,1]=3 255 B11R0.3 CCCCCCCCCCCCl MCULE-9378407763 [0,1,0,0,0,0|1,0,1]=3 256 B11R0.3 CCCCCCCCCCCI MCULE-2947342202 [0,1,0,0,0,0|1,0,1]=3 257 B11R0.3 CCCCCCCCCCCN MCULE-7249870518 [0,1,0,0,0,0|1,0,1]=3 258 B11R0.3 CCCCCCCCCCCO MCULE-9897986150 [0,1,0,0,0,0|0,0,2]=3 259 B11R0.3 CCCCCCCCCCCS MCULE-6868324316 [0,1,0,0,0,0|0,1,1]=3 260 B11R0.3 CCCCCCCCCCNC MCULE-1416369118 [0,1,0,0,0,0|1,0,1]=3 261 B11R0.3 CCCCCCCCCCNC MCULE-6168905746 [0,1,0,0,0,0|1,0,1]=3 262 B11R0.3 CCCCCCCCCCOC MCULE-1264379510 [0,1,0,0,0,0|0,0,2]=3 263 B11R0.3 CCCCCCCCCCON MCULE-2069797576 [0,1,0,0,0,0|0,0,2]=3 264 B11R0.3 CCCCCCCCCCON MCULE-7830749583 [0,1,0,0,0,0|0,0,2]=3 265 B11R0.3 CCCCCCCCCCSC MCULE-7334657081 [0,1,0,0,0,0|0,1,1]=3 266 B11R0.3 CCCCCCCCCN=C=S MCULE-1076001046 [0,1,0,0,0,0|0,1,1]=3 267 B11R0.3 CCCCCCCCCN=N#N MCULE-3134047425 [0,1,0,0,0,0|2,0,0]=3 268 B11R0.3 CCCCCCCCCNCC MCULE-2932168769 [0,1,0,0,0,0|1,0,1]=3 269 B11R0.3 CCCCCCCCCOC=O MCULE-1616501735 [0,1,0,0,0,0|0,0,0]=1 270 B11R0.3 CCCCCCCCCSCC MCULE-6635551100 [0,1,0,0,0,0|1,0,1]=3 271 B11R0.3 CCCCCCCCNCCC MCULE-8531662839 [0,1,0,0,0,0|1,0,1]=3 272 B11R0.3 CCCCCCCCNCCN MCULE-7559905889 [0,1,0,0,0,0|1,0,1]=3 273 B11R0.3 CCCCCCCCNCCO MCULE-7874582103 [0,1,0,0,0,0|0,0,2]=3 274 B11R0.3 CCCCCCCCNOCC MCULE-3650695826 [0,1,0,0,0,0|2,0,1]=4 275 B11R0.3 CCCCCCCCNOCC MCULE-5548504565 [0,1,0,0,0,0|2,0,1]=4 276 B11R0.3 CCCCCCCCOCCCl MCULE-7562352297 [0,1,0,0,0,0|1,0,1]=3 277 B11R0.3 CCCCCCCCOCCN MCULE-8451506183 [0,1,0,0,0,0|1,0,1]=3 278 B11R0.3 CCCCCCCCOCCN MCULE-9814984146 [0,1,0,0,0,0|1,0,1]=3 279 B11R0.3 CCCCCCCCOCCO MCULE-9752110999 [0,1,0,0,0,0|0,0,2]=3 280 B11R0.3 CCCCCCCCSCC#N MCULE-7369043498 [0,1,0,0,0,0|1,0,1]=3 281 B11R0.3 CCCCCCCCSCCN MCULE-5010227243 [0,1,0,0,0,0|1,0,1]=3 282 B11R0.3 CCCCCCCCSCCO MCULE-6587527936 [0,1,0,0,0,0|0,0,2]=3 283 B11R0.3 CCCCCCCCSCCS MCULE-1947094413 [0,1,0,0,0,0|0,1,1]=3 284 B11R0.3 CCCCCCCNCCC#N MCULE-6001009722 [0,1,0,0,0,0|1,0,1]=3 285 B11R0.3 CCCCCCCNCCCC MCULE-4951242533 [0,1,0,0,0,0|1,0,1]=3 286 B11R0.3 CCCCCCCNCCCN MCULE-8536785750 [0,1,0,0,0,0|1,0,1]=3 287 B11R0.3 CCCCCCCNCCCO MCULE-1187615586 [0,1,0,0,0,0|0,0,2]=3 288 B11R0.3 CCCCCCNCCCOC MCULE-6742672078 [0,1,0,0,0,0|2,0,0]=3 289 B11R0.3 CCCCCC[NH2+]CCCCCl MCULE-2636909425 [0,1,0,0,0,0|1,0,1]=3 290 B11R0.3 CCCCCC[NH2+]CCCCCl MCULE-7512641705 [0,1,0,0,0,0|1,0,1]=3 291 B11R0.3 CCCCCSCCOCCO MCULE-1471152415 [0,1,0,0,0,0|1,0,2]=4 292 B11R0.3 CCCCCSSCCCCC MCULE-8624736602 [0,1,0,0,0,0|2,0,1]=4 293 B11R0.3 CCCCNCCNCCCC MCULE-3139037318 [0,1,0,0,0,0|2,0,1]=4 294 B11R0.3 CCCCNCCOCCCC MCULE-4594910638 [0,1,0,0,0,0|2,0,1]=4 295 B11R0.3 CCCCOCCOCCCC MCULE-5261480538 [0,1,0,0,0,0|2,0,1]=4 296 B11R0.3 CCCCOCCOCCOC MCULE-8111177194 [0,1,0,0,0,0|3,0,0]=4 297 B11R0.3 CCCCSCCSCCCC MCULE-9975798821 [0,1,0,0,0,0|2,0,1]=4 298 B11R0.3 CCNCCCCCCNCC MCULE-1626825133 [0,1,0,0,0,0|2,0,1]=4 299 B11R0.3 CCNCCCNCCCOC MCULE-1166620245 [0,1,0,0,0,0|3,0,0]=4 300 B11R0.3 CCOCCCCCCCCO MCULE-8839640265 [0,1,0,0,0,0|0,0,2]=3 301 B11R0.3 CCSCCCCCCSCC MCULE-1161288056 [0,1,0,0,0,0|2,0,1]=4 302 B11R0.3 CNCCCCCCCCNC MCULE-2607021323 [0,1,0,0,0,0|2,0,0]=3 303 B11R0.3 COCCCCCCCCC=O MCULE-4530790122 [0,1,0,0,0,0|0,0,0]=1 304 B11R0.3 COCCCCCCCCCBr MCULE-8740247574 [0,1,0,0,0,0|1,0,1]=3 305 B11R0.3 COCCCCCCCCCN MCULE-5428647902 [0,1,0,0,0,0|1,0,1]=3 306 B11R0.3 COCCCCCCCCCO MCULE-5483027656 [0,1,0,0,0,0|0,0,2]=3 307 B11R0.3 COCCCCCCCCOC MCULE-6292448161 [0,1,0,0,0,0|2,0,0]=3 308 B11R0.3 COCCOCCOCCC=O MCULE-7456622874 [0,1,0,0,0,0|2,0,0]=3 309 B11R0.3 ClCCCCCCCCCCCl MCULE-1936281020 [0,1,0,0,0,0|1,0,1]=3 310 B11R0.3 FCCCCCCCCCCBr MCULE-2498226293 [0,1,0,0,0,0|1,0,1]=3 311 B11R0.3 FCCCCCCCCCCCl MCULE-6086093448 [0,1,0,0,0,0|1,0,1]=3 312 B11R0.3 FCCCCCCCCCCF MCULE-7992467849 [0,1,0,0,0,0|1,0,1]=3 313 B11R0.3 ICCCCCCCCCCI MCULE-9838407052 [0,1,0,0,0,0|1,0,1]=3 314 B11R0.3 N#CCCCCCCCCC#N MCULE-6480099494 [0,1,0,0,0,0|1,0,2]=4 315 B11R0.3 N#N=NCCCCCCCCN MCULE-8754033148 [0,1,0,0,0,0|3,0,0]=4 316 B11R0.3 N#N=NCCCCCCCCO MCULE-2910168198 [0,1,0,0,0,0|3,0,0]=4 317 B11R0.3 NCCCCCCCCCCBr MCULE-2910198089 [0,1,0,0,0,0|1,0,1]=3 318 B11R0.3 NCCCCCCCCCCBr MCULE-9466370190 [0,1,0,0,0,0|1,0,1]=3 319 B11R0.3 NCCCCCCCCCCN MCULE-8635244158 [0,1,0,0,0,0|1,0,1]=3 320 B11R0.3 NCCCCCCCCCCO MCULE-6627355175 [0,1,0,0,0,0|0,0,2]=3 321 B11R0.3 NCCCCCCOCCCO MCULE-2806447363 [0,1,0,0,0,0|1,0,2]=4 322 B11R0.3 O=CCCCCCCCCCBr MCULE-3317881097 [0,1,0,0,0,0|0,0,0]=1 323 B11R0.3 O=CNCCCCCCNC=O MCULE-7870977207 [0,1,0,0,0,0|2,0,1]=4 324 B11R0.3 OCCCCCCCCCCBr MCULE-9238949531 [0,1,0,0,0,0|0,0,2]=3 325 B11R0.3 OCCCCCCCCCCCl MCULE-7857761317 [0,1,0,0,0,0|0,0,2]=3 326 B11R0.3 OCCCCCCCCCCF MCULE-6916719760 [0,1,0,0,0,0|0,0,2]=3 327 B11R0.3 OCCCCCCCCCCO MCULE-3187467810 [0,1,0,0,0,0|0,0,2]=3 328 B11R0.3 SCCCCCCCCCCS MCULE-7368208629 [0,1,0,0,0,0|0,1,1]=3 329 B11R0.3 [NH2+](CCCC)CCCCCCC MCULE-5696674484 [0,1,0,0,0,0|1,0,1]=3 330 B11R0.4 C=CCC(C)CCCCCCC MCULE-9517976108 [0,1,0,0,0,0|1,0,0]=2 331 B11R0.4 C=CCCCCCC(=O)OCC MCULE-7006723315 [0,1,0,0,0,0|2,0,1]=4 332 B11R0.4 C=COC(=O)CCCCCCC MCULE-8119830012 [0,1,0,0,0,0|2,0,1]=4 333 B11R0.4 CCCCCCCC(=O)CCC MCULE-1180729281 [0,1,0,0,0,0|1,0,2]=4 334 B11R0.4 CCCCCCCC(C)N=C=O MCULE-4548041791 [0,1,0,0,0,0|1,0,1]=3 335 B11R0.4 CCCCCCCC(C)N=C=S MCULE-8896292965 [0,1,0,0,0,0|1,1,1]=4 336 B11R0.4 CCCCCCCC(O)CCC MCULE-3007528112 [0,1,0,0,0,0|1,0,1]=3 337 B11R0.4 CCCCCCC[C@@H](C)N=C=S MCULE-5917056909 [0,1,0,0,0,0|1,1,1]=4 338 B11R0.4 CCCCCCC[C@H](C)N=C=O MCULE-3759555717 [0,1,0,0,0,0|1,0,1]=3 339 B11R0.4 CCCCCCC[C@H](C)N=C=S MCULE-8275926324 [0,1,0,0,0,0|1,1,1]=4 340 B11R0.4 CCCCCCC[C@H](C)N=C=S MCULE-9821467527 [0,1,0,0,0,0|1,1,1]=4 341 B11R0.4 CCCCCCC[NH+](C)CCCl MCULE-1778694202 [0,1,0,0,0,0|2,0,1]=4 342 B11R0.4 CCCCCCC[NH+](C)CCCl MCULE-8009615139 [0,1,0,0,0,0|2,0,1]=4 343 B11R0.4 CCOC(=O)CCCCCC=O MCULE-8029913259 [0,1,0,0,0,0|1,0,1]=3 344 B11R0.40 C=C(C=O)CCCCCCCC MCULE-1736101056 [0,1,0,0,0,0|0,0,1]=2 345 B11R0.40 C=CCCCCCCC(O)CN MCULE-2780524307 [0,1,0,0,0,0|2,0,0]=3 346 B11R0.40 C=CS(=O)CCCCCCCC MCULE-1360438768 [0,1,0,0,0,0|2,0,0]=3 347 B11R0.40 CCCCCCCCC(=O)C=O MCULE-2896760493 [0,1,0,0,0,0|0,0,1]=2 348 B11R0.40 CCCCCCCCC(=O)CC MCULE-9958837588 [0,1,0,0,0,0|1,0,2]=4 349 B11R0.40 CCCCCCCCC(=O)NN MCULE-6560373796 [0,1,0,0,0,0|2,0,1]=4 350 B11R0.40 CCCCCCCCC(=O)NO MCULE-7098688577 [0,1,0,0,0,0|1,0,2]=4 351 B11R0.40 CCCCCCCCC(=O)OC MCULE-4760106079 [0,1,0,0,0,0|2,0,1]=4 352 B11R0.40 CCCCCCCCC(Br)CBr MCULE-7825522302 [0,1,0,0,0,0|1,0,1]=3 353 B11R0.40 CCCCCCCCC(C)C#N MCULE-1011753357 [0,1,0,0,0,0|1,0,1]=3 354 B11R0.40 CCCCCCCCC(C)C=O MCULE-9301043210 [0,1,0,0,0,0|0,0,0]=1 355 B11R0.40 CCCCCCCCC(C)CO MCULE-6530142953 [0,1,0,0,0,0|0,0,2]=3 356 B11R0.40 CCCCCCCCC(Cl)CCl MCULE-6741925726 [0,1,0,0,0,0|1,0,1]=3 357 B11R0.40 CCCCCCCCC(N)CO MCULE-3838512887 [0,1,0,0,0,0|0,0,2]=3 358 B11R0.40 CCCCCCCCC(O)CC MCULE-7447063642 [0,1,0,0,0,0|1,0,1]=3 359 B11R0.40 CCCCCCCCC(O)CN MCULE-1386452336 [0,1,0,0,0,0|1,0,1]=3 360 B11R0.40 CCCCCCCCC(O)CO MCULE-4401791520 [0,1,0,0,0,0|0,0,2]=3 361 B11R0.40 CCCCCCCCC([NH3+])CO MCULE-9745638839 [0,1,0,0,0,0|0,0,2]=3 362 B11R0.40 CCCCCCCC[C@@H](Br)C=O MCULE-3823724408 [0,1,0,0,0,0|0,0,0]=1 363 B11R0.40 CCCCCCCC[C@@H](O)CO MCULE-3097644735 [0,1,0,0,0,0|0,0,2]=3 364 B11R0.40 CCCCCCCC[C@@H](O)CO MCULE-9306542938 [0,1,0,0,0,0|0,0,2]=3 365 B11R0.40 CCCCCCCC[C@H](C)C=O MCULE-7337993182 [0,1,0,0,0,0|0,0,0]=1 366 B11R0.40 CCCCCCOCC(O)CCl MCULE-9400857337 [0,1,0,0,0,0|2,0,1]=4 367 B11R0.40 CCCCCCOCC(O)CO MCULE-6836288154 [0,1,0,0,0,0|1,0,2]=4 368 B11R0.40 COC(=O)CCCCCCC=O MCULE-8693929860 [0,1,0,0,0,0|1,0,1]=3 369 B11R0.40 OCCCCCCCC(O)CO MCULE-9195681013 [0,1,0,0,0,0|1,0,2]=4 370 B11R0.81 C=C(CCCC)CCCCCC MCULE-1300928710 [0,1,0,0,0,0|1,0,2]=4 371 B11R0.81 C=CCOC(=O)CCCCCC MCULE-3528769589 [0,1,0,0,0,0|2,0,1]=4 372 B11R0.81 CCCCCCC(=O)C=CC=O MCULE-3978841928 [0,1,0,0,0,0|0,0,3]=4 373 B11R0.81 CCCCCCC(=O)CCCC MCULE-3791343950 [0,1,0,0,0,0|1,0,2]=4 374 B11R0.81 CCCCCCC(C)OCCCl MCULE-5692239728 [0,1,0,0,0,0|2,0,1]=4 375 B11R0.81 CCCCCCC(C)OCCO MCULE-2974953071 [0,1,0,0,0,0|1,0,2]=4 376 B11R0.81 CCCCCCC(O)CCCC MCULE-1549907527 [0,1,0,0,0,0|1,0,1]=3 377 B11R0.81 CCCCS(=O)CCCCCO MCULE-1757503463 [0,1,0,0,0,0|1,0,2]=4 378 B11R0.140 C=CCCCC(O)CCCC=C MCULE-5222419035 [0,1,0,0,0,0|1,0,2]=4 379 B11R0.140 CCCCCC(=O)CCCCC MCULE-5966055848 [0,1,0,0,0,0|1,0,2]=4 380 B11R0.140 CCCCCC(N)CCCCC MCULE-7357551566 [0,1,0,0,0,0|1,0,1]=3 381 B11R0.140 CCCCCC(O)CCCCC MCULE-6556320478 [0,1,0,0,0,0|1,0,1]=3 382 B11R0.140 CCCCCN(C)CCCCC MCULE-7558760842 [0,1,0,0,0,0|2,0,1]=4 383 B11R0.148 C#CCCCCCCCC(=O)O MCULE-1292545040 [0,1,0,0,0,0|0,0,2]=3 384 B11R0.148 C#CCCCCCCCN(C)C MCULE-3039424471 [0,1,0,0,0,0|2,0,1]=4 385 B11R0.148 C=C(Br)CCCCCCCC#N MCULE-9330962697 [0,1,0,0,0,0|2,0,1]=4 386 B11R0.148 C=C(Br)CCCCCCCCC MCULE-3332268450 [0,1,0,0,0,0|1,0,0]=2 387 B11R0.148 C=C(C)CCCCCCCC#N MCULE-9047905081 [0,1,0,0,0,0|1,0,2]=4 388 B11R0.148 C=C(C)CCCCCCCCC MCULE-1709497926 [0,1,0,0,0,0|1,0,0]=2 389 B11R0.148 C=C(Cl)CCCCCCCC#N MCULE-1260885724 [0,1,0,0,0,0|2,0,1]=4 390 B11R0.148 C=C(Cl)CCCCCCCCC MCULE-9304719526 [0,1,0,0,0,0|1,0,0]=2 391 B11R0.148 C=CCCCCCCCC(=C)C MCULE-4065354989 [0,1,0,0,0,0|1,0,1]=3 392 B11R0.148 C=CCCCCCCCC(=O)O MCULE-3892173219 [0,1,0,0,0,0|0,0,2]=3 393 B11R0.148 C=CCCCCCCOC(=O)C MCULE-2561625191 [0,1,0,0,0,0|1,0,2]=4 394 B11R0.148 C=CCCOCCCCC(=O)O MCULE-6026091154 [0,1,0,0,0,0|1,0,2]=4 395 B11R0.148 C=CCOCCCCCC(=O)O MCULE-9227890338 [0,1,0,0,0,0|1,0,2]=4 396 B11R0.148 CC(=O)CCCCCCCCBr MCULE-8502798206 [0,1,0,0,0,0|1,0,0]=2 397 B11R0.148 CC(=O)OCCCCCCC=O MCULE-8513857573 [0,1,0,0,0,0|1,0,1]=3 398 B11R0.148 CC(C)CCCCCCCCO MCULE-9926933955 [0,1,0,0,0,0|0,0,2]=3 399 B11R0.148 CC(C)CCNCCCCCN MCULE-6716499597 [0,1,0,0,0,0|2,0,1]=4 400 B11R0.148 CC(C)CCNCCCCCN MCULE-9913240863 [0,1,0,0,0,0|2,0,1]=4 401 B11R0.148 CC(O)CCCCCCCCO MCULE-6820244164 [0,1,0,0,0,0|0,0,2]=3 402 B11R0.148 CCCC/C=C\CCOC(=O)C MCULE-5044870920 [0,1,0,0,0,0|1,0,2]=4 403 B11R0.148 CCCCC/C=C/CCC(=O)O MCULE-1356880290 [0,1,0,0,0,0|0,0,2]=3 404 B11R0.148 CCCCC=CCCOC(=O)C MCULE-8921990055 [0,1,0,0,0,0|1,0,2]=4 405 B11R0.148 CCCCCC/C=C/CC(=O)O MCULE-1834860815 [0,1,0,0,0,0|0,0,2]=3 406 B11R0.148 CCCCCC=CCCC(=O)O MCULE-1637451620 [0,1,0,0,0,0|0,0,2]=3 407 B11R0.148 CCCCCCC/C=C/C(=O)O MCULE-3189731619 [0,1,0,0,0,0|0,0,2]=3 408 B11R0.148 CCCCCCC/C=C\C(=O)O MCULE-5508964733 [0,1,0,0,0,0|0,0,2]=3 409 B11R0.148 CCCCCCC=CCC(=O)O MCULE-5816262119 [0,1,0,0,0,0|0,0,2]=3 410 B11R0.148 CCCCCCCC=CC(=O)O MCULE-9648702049 [0,1,0,0,0,0|0,0,2]=3 411 B11R0.148 CCCCCCCCCC(=N)N MCULE-6113298447 [0,1,0,0,0,0|1,0,0]=2 412 B11R0.148 CCCCCCCCCC(=N)N MCULE-7599360964 [0,1,0,0,0,0|1,0,0]=2 413 B11R0.148 CCCCCCCCCC(=O)C MCULE-6858373499 [0,1,0,0,0,0|0,0,0]=1 414 B11R0.148 CCCCCCCCCC(=O)Cl MCULE-4226412977 [0,1,0,0,0,0|0,0,0]=1 415 B11R0.148 CCCCCCCCCC(=O)F MCULE-1839398331 [0,1,0,0,0,0|0,0,0]=1 416 B11R0.148 CCCCCCCCCC(=O)N MCULE-1159230758 [0,1,0,0,0,0|0,0,0]=1 417 B11R0.148 CCCCCCCCCC(=O)O MCULE-3914949169 [0,1,0,0,0,0|0,0,0]=1 418 B11R0.148 CCCCCCCCCC(=O)O MCULE-7204730113 [0,1,0,0,0,0|0,0,0]=1 419 B11R0.148 CCCCCCCCCC(=O)[O-] MCULE-2720595773 [0,1,0,0,0,0|0,0,0]=1 420 B11R0.148 CCCCCCCCCC(=O)[O-] MCULE-7398604282 [0,1,0,0,0,0|0,0,0]=1 421 B11R0.148 CCCCCCCCCC(C)C MCULE-1079534714 [0,1,0,0,0,0|1,0,1]=3 422 B11R0.148 CCCCCCCCCC(C)N MCULE-8277808063 [0,1,0,0,0,0|1,0,1]=3 423 B11R0.148 CCCCCCCCCC(C)O MCULE-8628471202 [0,1,0,0,0,0|0,0,2]=3 424 B11R0.148 CCCCCCCCCC(S)S MCULE-7049062381 [0,1,0,0,0,0|0,1,1]=3 425 B11R0.148 CCCCCCCCCN(=O)=O MCULE-5909474153 [0,1,0,0,0,0|1,0,0]=2 426 B11R0.148 CCCCCCCCN=C(N)N MCULE-8281267777 [0,1,0,0,0,0|2,0,0]=3 427 B11R0.148 CCCCCCCCN=C(N)N MCULE-9658902055 [0,1,0,0,0,0|2,0,0]=3 428 B11R0.148 CCCCCCCCNC(=O)N MCULE-1005292011 [0,1,0,0,0,0|1,0,0]=2 429 B11R0.148 CCCCCCCCNC(=S)N MCULE-3981792857 [0,1,0,0,0,0|1,1,0]=3 430 B11R0.148 CCCCCCCCOC(=O)C MCULE-8590238161 [0,1,0,0,0,0|1,0,0]=2 431 B11R0.148 CCCCCCCCOC(=O)Cl MCULE-2623966790 [0,1,0,0,0,0|1,0,0]=2 432 B11R0.148 CCCCCCCCOC(=S)[S-] MCULE-4226166972 [0,1,0,0,0,0|1,1,0]=3 433 B11R0.148 CCCCCCCCOC(=S)[S-] MCULE-7459596444 [0,1,0,0,0,0|1,1,0]=3 434 B11R0.148 CCCCCCCNCC(=O)O MCULE-2155508761 [0,1,0,0,0,0|1,0,0]=2 435 B11R0.148 CCCCCCCNCC(=O)O MCULE-8805007132 [0,1,0,0,0,0|1,0,0]=2 436 B11R0.148 CCCCCCCSCC(=O)O MCULE-7218313490 [0,1,0,0,0,0|1,0,0]=2 437 B11R0.148 CCCCOCCOCC(=O)O MCULE-3118678736 [0,1,0,0,0,0|2,0,0]=3 438 B11R0.148 CCCCSCCCCC(=O)O MCULE-1665011362 [0,1,0,0,0,0|1,0,0]=2 439 B11R0.148 CCOCCOCCCC(=O)O MCULE-5210306588 [0,1,0,0,0,0|2,0,0]=3 440 B11R0.148 CCOCCOCCOC(=O)C MCULE-2995602513 [0,1,0,0,0,0|3,0,0]=4 441 B11R0.148 CN(C)CCCCCCCCN MCULE-6651981566 [0,1,0,0,0,0|2,0,1]=4 442 B11R0.148 CN(C)CCCCCCCCO MCULE-5273481320 [0,1,0,0,0,0|1,0,2]=4 443 B11R0.148 COCCOCCOCC(=O)Cl MCULE-3746882663 [0,1,0,0,0,0|3,0,0]=4 444 B11R0.148 COCCOCCOCC(=O)O MCULE-8142044106 [0,1,0,0,0,0|3,0,0]=4 445 B11R0.148 N#N=NCCCCCCC(=O)O MCULE-5582413457 [0,1,0,0,0,0|3,0,0]=4 446 B11R0.148 N=C(N)NCCCCCCCN MCULE-1860175405 [0,1,0,0,0,0|3,0,0]=4 447 B11R0.148 N=C(N)NCCCCCCCN MCULE-8627758688 [0,1,0,0,0,0|3,0,0]=4 448 B11R0.148 NC(=O)CCCCCCCCCl MCULE-4533445908 [0,1,0,0,0,0|1,0,0]=2 449 B11R0.148 NCCCCCCCCC(=O)O MCULE-9064856591 [0,1,0,0,0,0|1,0,0]=2 450 B11R0.148 NCCOCCOCCC(=O)O MCULE-7286284064 [0,1,0,0,0,0|3,0,0]=4 451 B11R0.148 NCCOCCOCCC(=O)O MCULE-8782232340 [0,1,0,0,0,0|3,0,0]=4 452 B11R0.148 O=C(O)CCCCCCCCBr MCULE-2459167157 [0,1,0,0,0,0|1,0,0]=2 453 B11R0.148 O=C(O)CCCCCCCCCl MCULE-9010808862 [0,1,0,0,0,0|1,0,0]=2 454 B11R0.148 O=C(O)CCCCCCCCO MCULE-6121514710 [0,1,0,0,0,0|1,0,0]=2 455 B11R0.148 O=C(O)CCOCCOCCBr MCULE-3253906029 [0,1,0,0,0,0|3,0,0]=4 456 B11R0.148 O=C(O)CCOCCOCCO MCULE-9797832183 [0,1,0,0,0,0|3,0,0]=4 457 B11R0.148 O=C(O)CCOCCOCCS MCULE-1627429574 [0,1,0,0,0,0|3,0,0]=4 458 B11R0.148 O=CCCCCCCCC(=O)O MCULE-8345312745 [0,1,0,0,0,0|1,0,1]=3 459 B11R0.148 O=N(=O)CCCCCCCCBr MCULE-5806801538 [0,1,0,0,0,0|2,0,0]=3 460 B11R0.148 O=N(=O)CCCCCCCCO MCULE-3641883800 [0,1,0,0,0,0|2,0,0]=3 461 B11R1.4 BrCCCCCN1CCCC1 MCULE-2569347978 [0,0,0,1,0,0|2,0,1]=4 462 B11R1.4 BrCCCCCN1CCCC1 MCULE-8853721324 [0,0,0,1,0,0|2,0,1]=4 463 B11R1.4 C=CCCCOC1CCNC1 MCULE-2687903970 [0,0,0,1,0,0|3,0,0]=4 464 B11R1.4 C=CCCCOC1CCNC1 MCULE-5714171659 [0,0,0,1,0,0|3,0,0]=4 465 B11R1.4 C=CCCNCC1CCCO1 MCULE-7403108950 [0,0,0,1,0,0|3,0,0]=4 466 B11R1.4 CCCCCCC1OCCO1 MCULE-4454812568 [0,0,0,1,0,0|1,0,2]=4 467 B11R1.4 CCCCCOC1CCNC1 MCULE-5489253187 [0,0,0,1,0,0|3,0,0]=4 468 B11R1.4 CCCCCOC1CCNC1 MCULE-5575272982 [0,0,0,1,0,0|3,0,0]=4 469 B11R1.4 CCCCOCC1CCNC1 MCULE-2104330635 [0,0,0,1,0,0|3,0,0]=4 470 B11R1.4 CCCCOCC1CCNC1 MCULE-4194248617 [0,0,0,1,0,0|3,0,0]=4 471 B11R1.4 N#CCCNCC1CCCC1 MCULE-3325005398 [0,0,0,1,0,0|2,0,1]=4 472 B11R1.4 NCCCCCC1CCSS1 MCULE-7441188136 [0,0,0,1,0,0|2,1,0]=4 473 B11R1.4 NCCCCCN1CCCC1 MCULE-5199170638 [0,0,0,1,0,0|2,0,1]=4 474 B11R1.4 NCCCCCN1CCCC1 MCULE-5472914492 [0,0,0,1,0,0|2,0,1]=4 475 B11R1.4 OCCCCCN1CCCC1 MCULE-6150953693 [0,0,0,1,0,0|1,0,2]=4 476 B11R1.4 OCCCNCC1CCCC1 MCULE-4801540502 [0,0,0,1,0,0|1,0,2]=4 477 B11R1.4 OCCCOCC1CCCC1 MCULE-4073733141 [0,0,0,1,0,0|1,0,2]=4 478 B11R1.5 C#CCN1CCCCCC1=O MCULE-4157890671 [0,0,0,1,0,0|1,0,2]=4 479 B11R1.5 CCCC1CCCCNC1=O MCULE-1989909498 [0,0,0,1,0,0|1,0,0]=2 480 B11R1.5 CCCN1CCCNCC1=O MCULE-8150823911 [0,0,0,1,0,0|2,0,0]=3 481 B11R1.5 CCCN1CCNCCC1=O MCULE-1036321145 [0,0,0,1,0,0|2,0,0]=3 482 B11R1.5 CCCN1CCNCCC1=O MCULE-8130444004 [0,0,0,1,0,0|2,0,0]=3 483 B11R1.5 CCOC1CCCCCC1N MCULE-9256143866 [0,0,0,1,0,0|2,0,1]=4 484 B11R1.5 NCCN1CCCCCC1=O MCULE-6085364731 [0,0,0,1,0,0|2,0,0]=3 485 B11R1.5 O=C1CCCCCN1CCO MCULE-2748237095 [0,0,0,1,0,0|2,0,0]=3 486 B11R1.5 O=C1CCOCCN1CCO MCULE-4962884762 [0,0,0,1,0,0|3,0,0]=4 487 B11R1.17 C=CCN[C@@H]1CCCC[C@H]1O MCULE-9735733156 [0,0,0,1,0,0|3,0,0]=4 488 B11R1.17 C=CCN[C@H]1CCCC[C@@H]1O MCULE-7288532879 [0,0,0,1,0,0|3,0,0]=4 489 B11R1.17 CC1CCCCC1OCC#N MCULE-2063046977 [0,0,0,1,0,0|2,0,1]=4 490 B11R1.17 CC1CCCCC1OCCCl MCULE-9791178493 [0,0,0,1,0,0|2,0,1]=4 491 B11R1.17 CC1CCCCC1OCCN MCULE-5310119255 [0,0,0,1,0,0|2,0,1]=4 492 B11R1.17 CC1CCCCN1CCC#N MCULE-6161732278 [0,0,0,1,0,0|2,0,1]=4 493 B11R1.17 CC1CCCCN1CCCN MCULE-2710906420 [0,0,0,1,0,0|2,0,1]=4 494 B11R1.17 CCCCC1CCCCC1O MCULE-7002165342 [0,0,0,1,0,0|0,0,2]=3 495 B11R1.17 CCCCC1NCCNC1=O MCULE-8504158690 [0,0,0,1,0,0|2,0,0]=3 496 B11R1.17 CCCCN1CCNCC1=O MCULE-4836745667 [0,0,0,1,0,0|2,0,0]=3 497 B11R1.17 CCCNC1CCCCC1O MCULE-8368765892 [0,0,0,1,0,0|1,0,2]=4 498 B11R1.17 CCCN[C@@H]1CCCC[C@H]1O MCULE-3339453217 [0,0,0,1,0,0|1,0,2]=4 499 B11R1.17 CCCN[C@@H]1CCCC[C@H]1O MCULE-8427110995 [0,0,0,1,0,0|1,0,2]=4 500 B11R1.17 CCCOC1CCCCC1Cl MCULE-4466673525 [0,0,0,1,0,0|2,0,1]=4 501 B11R1.17 CCNCC1CCCCN1C MCULE-9394605898 [0,0,0,1,0,0|3,0,0]=4 502 B11R1.17 CNCCC1CCCCN1C MCULE-9091837698 [0,0,0,1,0,0|3,0,0]=4 503 B11R1.17 CNCCN1CCCCC1=O MCULE-2748762852 [0,0,0,1,0,0|2,0,0]=3 504 B11R1.17 CNCCN1CCCCC1=O MCULE-6209260920 [0,0,0,1,0,0|2,0,0]=3 505 B11R1.17 CNCCN1CCCCC1C MCULE-3379048726 [0,0,0,1,0,0|3,0,0]=4 506 B11R1.17 COCCC1CCCCN1C MCULE-7106681892 [0,0,0,1,0,0|3,0,0]=4 507 B11R1.17 COCCN1CCNCC1=O MCULE-2792886327 [0,0,0,1,0,0|3,0,0]=4 508 B11R1.17 COCCN1CCNCC1=O MCULE-4479232011 [0,0,0,1,0,0|3,0,0]=4 509 B11R1.17 N#CCCC1CCCCC1=O MCULE-6518120828 [0,0,0,1,0,0|1,0,1]=3 510 B11R1.17 NCCCC1CCCCC1O MCULE-4985421129 [0,0,0,1,0,0|1,0,2]=4 511 B11R1.17 NCCCN1CCCCC1=O MCULE-3264201427 [0,0,0,1,0,0|2,0,0]=3 512 B11R1.17 NCCCN1CCCNC1=O MCULE-1366217387 [0,0,0,1,0,0|3,0,0]=4 513 B11R1.17 O=C1CCCCC1CCCO MCULE-6491492717 [0,0,0,1,0,0|1,0,0]=2 514 B11R1.17 O=C1CCCCN1CCCO MCULE-3358401474 [0,0,0,1,0,0|2,0,0]=3 515 B11R1.17 O=C1COCCN1CCCBr MCULE-5348458347 [0,0,0,1,0,0|3,0,0]=4 516 B11R1.26 COC1CCCCCCC1N MCULE-2038984012 [0,0,0,1,0,0|2,0,1]=4 517 B11R1.26 O=CC1=C(CCCCCC1)Cl MCULE-9053988440 [0,0,0,1,0,0|1,0,2]=4 518 B11R1.28 BrCCCCC1CCCCC1 MCULE-1688175311 [0,0,0,1,0,0|1,0,1]=3 519 B11R1.28 BrCCCCC1CCNCC1 MCULE-2146881103 [0,0,0,1,0,0|2,0,1]=4 520 B11R1.28 BrCCCCC1CCNCC1 MCULE-9773440381 [0,0,0,1,0,0|2,0,1]=4 521 B11R1.28 BrCCCCC1CCOCC1 MCULE-7533322961 [0,0,0,1,0,0|2,0,1]=4 522 B11R1.28 BrCCCCN1CCCCC1 MCULE-2093904387 [0,0,0,1,0,0|2,0,1]=4 523 B11R1.28 BrCCCCN1CCCCC1 MCULE-6368651814 [0,0,0,1,0,0|2,0,1]=4 524 B11R1.28 BrCCCOC1CCCCC1 MCULE-6709385619 [0,0,0,1,0,0|2,0,1]=4 525 B11R1.28 C=CCCCC1CCCCC1 MCULE-7312271164 [0,0,0,1,0,0|1,0,0]=2 526 B11R1.28 C=CCCCC1OCCCO1 MCULE-1837699899 [0,0,0,1,0,0|3,0,0]=4 527 B11R1.28 C=CCCOC1CCCCC1 MCULE-8490111049 [0,0,0,1,0,0|2,0,0]=3 528 B11R1.28 C=CCNCC1CCCCC1 MCULE-2828762425 [0,0,0,1,0,0|2,0,0]=3 529 B11R1.28 C=CCOCC1CCCNC1 MCULE-1368763746 [0,0,0,1,0,0|3,0,0]=4 530 B11R1.28 C=CCOCC1CCCNC1 MCULE-4346971641 [0,0,0,1,0,0|3,0,0]=4 531 B11R1.28 C=CCOCC1CCNCC1 MCULE-7608824055 [0,0,0,1,0,0|3,0,0]=4 532 B11R1.28 C=CCOCC1CCNCC1 MCULE-8864254888 [0,0,0,1,0,0|3,0,0]=4 533 B11R1.28 CCCCCC1CCCCC1 MCULE-8832032133 [0,0,0,1,0,0|1,0,1]=3 534 B11R1.28 CCCCCC1CCCCN1 MCULE-4218318893 [0,0,0,1,0,0|1,0,1]=3 535 B11R1.28 CCCCCN1CCCCC1 MCULE-1046315865 [0,0,0,1,0,0|2,0,1]=4 536 B11R1.28 CCCCC[NH+]1CCCCC1 MCULE-1462611325 [0,0,0,1,0,0|2,0,1]=4 537 B11R1.28 CCCCNC1CCCCC1 MCULE-2774132748 [0,0,0,1,0,0|2,0,1]=4 538 B11R1.28 CCCCNC1CCCCC1 MCULE-7612672790 [0,0,0,1,0,0|2,0,1]=4 539 B11R1.28 CCCCOC1CCCCO1 MCULE-5619472922 [0,0,0,1,0,0|1,0,2]=4 540 B11R1.28 CCCCOC1CCCNC1 MCULE-3625364869 [0,0,0,1,0,0|3,0,0]=4 541 B11R1.28 CCCNCC1CCCCC1 MCULE-3141764161 [0,0,0,1,0,0|2,0,1]=4 542 B11R1.28 CCCNCC1CCCCC1 MCULE-4265324682 [0,0,0,1,0,0|2,0,1]=4 543 B11R1.28 CCCNCC1CCCCO1 MCULE-6602583901 [0,0,0,1,0,0|1,0,2]=4 544 B11R1.28 CCNCCC1CCCOC1 MCULE-4579221343 [0,0,0,1,0,0|3,0,0]=4 545 B11R1.28 CCOCCC1CCCCN1 MCULE-3526880225 [0,0,0,1,0,0|2,0,1]=4 546 B11R1.28 CCOCCC1CCCCN1 MCULE-9747276803 [0,0,0,1,0,0|2,0,1]=4 547 B11R1.28 CCOCCC1CCCNC1 MCULE-1260527024 [0,0,0,1,0,0|3,0,0]=4 548 B11R1.28 CCOCCC1CCCNC1 MCULE-5298677030 [0,0,0,1,0,0|3,0,0]=4 549 B11R1.28 CNCCCC1CCCCC1 MCULE-9069202916 [0,0,0,1,0,0|2,0,0]=3 550 B11R1.28 CNCCCN1CCCCC1 MCULE-1756529985 [0,0,0,1,0,0|3,0,0]=4 551 B11R1.28 CNCCNC1CCCCC1 MCULE-1005065702 [0,0,0,1,0,0|3,0,0]=4 552 B11R1.28 COCCCC1CCCCN1 MCULE-4074520103 [0,0,0,1,0,0|2,0,1]=4 553 B11R1.28 COCCCC1CCCNC1 MCULE-7667635288 [0,0,0,1,0,0|3,0,0]=4 554 B11R1.28 COCCCC1CCNCC1 MCULE-3809566423 [0,0,0,1,0,0|3,0,0]=4 555 B11R1.28 ClCCCOC1CCCCC1 MCULE-4603008047 [0,0,0,1,0,0|2,0,1]=4 556 B11R1.28 ICCCCC1CCCCC1 MCULE-6154026120 [0,0,0,1,0,0|1,0,1]=3 557 B11R1.28 N#CCCCC1CCNCC1 MCULE-6046615720 [0,0,0,1,0,0|2,0,1]=4 558 B11R1.28 N#CCCCN1CCCCC1 MCULE-4940715562 [0,0,0,1,0,0|2,0,1]=4 559 B11R1.28 N#CCCCN1CCCCC1 MCULE-6145271366 [0,0,0,1,0,0|2,0,1]=4 560 B11R1.28 N#CCCNC1CCCCC1 MCULE-2902362345 [0,0,0,1,0,0|2,0,1]=4 561 B11R1.28 N#CCCOC1CCCCC1 MCULE-6114708679 [0,0,0,1,0,0|2,0,1]=4 562 B11R1.28 N#N=NCCC1CCCCC1 MCULE-5737809901 [0,0,0,1,0,0|3,0,0]=4 563 B11R1.28 NCCCCC1CCCCC1 MCULE-2906458062 [0,0,0,1,0,0|1,0,1]=3 564 B11R1.28 NCCCCC1CCNCC1 MCULE-3379707416 [0,0,0,1,0,0|2,0,1]=4 565 B11R1.28 NCCCCN1CCCCC1 MCULE-5864275337 [0,0,0,1,0,0|2,0,1]=4 566 B11R1.28 NCCCCN1CCCCC1 MCULE-6475626573 [0,0,0,1,0,0|2,0,1]=4 567 B11R1.28 NCCCNC1CCCCC1 MCULE-4064689865 [0,0,0,1,0,0|2,0,1]=4 568 B11R1.28 NCCCOC1CCCCC1 MCULE-3609935064 [0,0,0,1,0,0|2,0,1]=4 569 B11R1.28 NCCCSC1CCCCC1 MCULE-7953895791 [0,0,0,1,0,0|2,0,1]=4 570 B11R1.28 NCCOCC1CCCCC1 MCULE-9417766642 [0,0,0,1,0,0|2,0,1]=4 571 B11R1.28 NN=CCCC1CCCCC1 MCULE-2623797759 [0,0,0,1,0,0|2,0,1]=4 572 B11R1.28 NOCCCN1CCCCC1 MCULE-9018743829 [0,0,0,1,0,0|3,0,0]=4 573 B11R1.28 O=CCCCC1CCCCC1 MCULE-8571570461 [0,0,0,1,0,0|0,0,0]=1 574 B11R1.28 O=CCCCN1CCOCC1 MCULE-4787055493 [0,0,0,1,0,0|2,0,0]=3 575 B11R1.28 O=CCCOC1CCCCC1 MCULE-4673250182 [0,0,0,1,0,0|1,0,0]=2 576 B11R1.28 O=CCOCC1CCCCC1 MCULE-7612102606 [0,0,0,1,0,0|1,0,0]=2 577 B11R1.28 O=CCOCC1CCOCC1 MCULE-1054046333 [0,0,0,1,0,0|2,0,0]=3 578 B11R1.28 OCCCCC1CCCCC1 MCULE-3644108501 [0,0,0,1,0,0|0,0,2]=3 579 B11R1.28 OCCCCC1CCCCN1 MCULE-3714334346 [0,0,0,1,0,0|1,0,2]=4 580 B11R1.28 OCCCCC1CCCNC1 MCULE-7769059484 [0,0,0,1,0,0|1,0,2]=4 581 B11R1.28 OCCCCC1CCNCC1 MCULE-2492519799 [0,0,0,1,0,0|1,0,2]=4 582 B11R1.28 OCCCCC1CCNCC1 MCULE-9994111075 [0,0,0,1,0,0|1,0,2]=4 583 B11R1.28 OCCCCN1CCCCC1 MCULE-7640069933 [0,0,0,1,0,0|1,0,2]=4 584 B11R1.28 OCCCCN1CCCCC1 MCULE-9734250002 [0,0,0,1,0,0|1,0,2]=4 585 B11R1.28 OCCCNC1CCCCC1 MCULE-4167772942 [0,0,0,1,0,0|1,0,2]=4 586 B11R1.28 OCCCOC1CCCCC1 MCULE-3209317348 [0,0,0,1,0,0|1,0,2]=4 587 B11R1.28 OCCNCC1CCCCC1 MCULE-1393340274 [0,0,0,1,0,0|1,0,2]=4 588 B11R1.28 OCCNCC1CCCCC1 MCULE-7217857602 [0,0,0,1,0,0|1,0,2]=4 589 B11R1.28 ON=CCCC1CCCCC1 MCULE-7103143157 [0,0,0,1,0,0|1,0,2]=4 590 B11R1.41 CCC1CCCCN1CC#N MCULE-1243830400 [0,0,0,1,0,0|2,0,1]=4 591 B11R1.41 CCC1CCCCN1CC#N MCULE-9773476705 [0,0,0,1,0,0|2,0,1]=4 592 B11R1.41 CCC1CCCCN1CCN MCULE-3604459788 [0,0,0,1,0,0|2,0,1]=4 593 B11R1.41 CCC1CCCCN1CCO MCULE-3619810201 [0,0,0,1,0,0|1,0,2]=4 594 B11R1.41 CCCC1CCCCC1CN MCULE-8861688157 [0,0,0,1,0,0|1,0,1]=3 595 B11R1.41 CCCN1CCCCC1CC MCULE-8487769876 [0,0,0,1,0,0|2,0,1]=4 596 B11R1.41 CCCN1CCCCC1CN MCULE-4827719162 [0,0,0,1,0,0|2,0,1]=4 597 B11R1.41 CCN1CCCCC1CCO MCULE-6546654545 [0,0,0,1,0,0|1,0,2]=4 598 B11R1.41 CCNC1CCCCC1OC MCULE-6579851974 [0,0,0,1,0,0|3,0,0]=4 599 B11R1.41 CCOC1CCCCC1NC MCULE-8269060694 [0,0,0,1,0,0|3,0,0]=4 600 B11R1.47 CCCCCCOC1CNC1 MCULE-3800407294 [0,0,0,1,0,0|3,0,0]=4 601 B11R1.51 CCN1CCCCCC1CO MCULE-9392450597 [0,0,0,1,0,0|1,0,2]=4 602 B11R1.51 CNC1CCCCCC1OC MCULE-2897047131 [0,0,0,1,0,0|3,0,0]=4 603 B11R1.92 C1CCCCCCCCCC1 MCULE-6783863454 [0,0,0,1,0,0|1,0,1]=3 604 B11R1.92 C1CCCCCNCCCC1 MCULE-1671621328 [0,0,0,1,0,0|1,0,1]=3 605 B11R1.99 C=CCCCCCCC1CO1 MCULE-7968068959 [0,0,0,1,0,0|2,0,0]=3 606 B11R1.99 CCCCCCCCC1CO1 MCULE-5254067206 [0,0,0,1,0,0|0,0,2]=3 607 B11R1.99 CCCCCCCC[C@@H]1CO1 MCULE-1956936475 [0,0,0,1,0,0|0,0,2]=3 608 B11R1.99 CCCCCCOCC1CO1 MCULE-4928959956 [0,0,0,1,0,0|1,0,2]=4 609 B11R1.99 CCCCCCOC[C@H]1CO1 MCULE-7895281836 [0,0,0,1,0,0|1,0,2]=4 610 B11R1.99 O=CCOCCOCC1CC1 MCULE-4078770343 [0,0,0,1,0,0|2,0,0]=3 611 B11R1.101 CN1CCCCCNCCC1 MCULE-4396508562 [0,0,0,1,0,0|3,0,0]=4 612 B11R1.101 CN1CCCCCNCCC1 MCULE-4816093548 [0,0,0,1,0,0|3,0,0]=4 613 B11R1.101 NC1CCCCCCCCC1 MCULE-7140828852 [0,0,0,1,0,0|1,0,1]=3 614 B11R1.101 NC1CCCCCCCCC1 MCULE-9762725860 [0,0,0,1,0,0|1,0,1]=3 615 B11R1.101 O=C1CCCCCCCCC1 MCULE-7431354983 [0,0,0,1,0,0|0,0,0]=1 616 B11R1.101 O=C1CCCCCCCCN1 MCULE-4805310836 [0,0,0,1,0,0|1,0,0]=2 617 B11R1.101 O=C1CCNCCCCCN1 MCULE-1892904766 [0,0,0,1,0,0|2,0,0]=3 618 B11R1.101 O=C1CCNCCOCCN1 MCULE-3042541612 [0,0,0,1,0,0|3,0,0]=4 619 B11R1.117 C=CCC1CCCCCCC1 MCULE-5863038923 [0,0,0,1,0,0|1,0,0]=2 620 B11R1.117 CNCC1CCCCCCC1 MCULE-3882363434 [0,0,0,1,0,0|2,0,0]=3 621 B11R1.117 NCCC1CCCCCCC1 MCULE-5038195827 [0,0,0,1,0,0|1,0,1]=3 622 B11R1.117 NCCC1CCCCCCC1 MCULE-9743664308 [0,0,0,1,0,0|1,0,1]=3 623 B11R1.117 S=C=NC1CCCCCCC1 MCULE-7913998054 [0,0,0,1,0,0|1,1,1]=4 624 B11R1.180 CCCCC=C1CCCC1=O MCULE-3061361246 [0,0,0,1,0,0|0,0,2]=3 625 B11R1.180 CCCCCC1=CCCC1=O MCULE-2643922279 [0,0,0,1,0,0|0,0,2]=3 626 B11R1.180 CCCCCC1CCCC1=O MCULE-7048040111 [0,0,0,1,0,0|0,0,0]=1 627 B11R1.180 CCCCCC1CCCC1O MCULE-7690407093 [0,0,0,1,0,0|0,0,2]=3 628 B11R1.180 CCCCCN1CCCC1=O MCULE-7791437264 [0,0,0,1,0,0|1,0,0]=2 629 B11R1.180 CCNCCN1CCCC1=O MCULE-9602250458 [0,0,0,1,0,0|2,0,0]=3 630 B11R1.180 COCCNC1CCCC1C MCULE-4127023609 [0,0,0,1,0,0|3,0,0]=4 631 B11R1.180 NCCCCN1CCCC1=O MCULE-2895726457 [0,0,0,1,0,0|2,0,0]=3 632 B11R1.180 NCCCCN1CCCC1=O MCULE-8478246977 [0,0,0,1,0,0|2,0,0]=3 633 B11R1.203 CCCNC1CCCCCC1 MCULE-1802038783 [0,0,0,1,0,0|2,0,1]=4 634 B11R1.203 CCCNC1CCCCCC1 MCULE-6514815926 [0,0,0,1,0,0|2,0,1]=4 635 B11R1.203 CNCCN1CCCCCC1 MCULE-5062886642 [0,0,0,1,0,0|3,0,0]=4 636 B11R1.203 COCCC1CCCCNC1 MCULE-1439171420 [0,0,0,1,0,0|3,0,0]=4 637 B11R1.203 ClCCCN1CCCCCC1 MCULE-4446350612 [0,0,0,1,0,0|2,0,1]=4 638 B11R1.203 ClCCCN1CCCCCC1 MCULE-5626042622 [0,0,0,1,0,0|2,0,1]=4 639 B11R1.203 ClCCOC1CCCCCC1 MCULE-5770313338 [0,0,0,1,0,0|2,0,1]=4 640 B11R1.203 N#CCCN1CCCCCC1 MCULE-7438786236 [0,0,0,1,0,0|2,0,1]=4 641 B11R1.203 N#CCCN1CCCCCC1 MCULE-7745745211 [0,0,0,1,0,0|2,0,1]=4 642 B11R1.203 N#CCNC1CCCCCC1 MCULE-6076588687 [0,0,0,1,0,0|2,0,1]=4 643 B11R1.203 NCCCN1CCCCCC1 MCULE-6752637133 [0,0,0,1,0,0|2,0,1]=4 644 B11R1.203 NCCCN1CCCCCC1 MCULE-9625062423 [0,0,0,1,0,0|2,0,1]=4 645 B11R1.203 NCCOC1CCCCCC1 MCULE-2079787273 [0,0,0,1,0,0|2,0,1]=4 646 B11R1.203 O=CCCC1CCCCCC1 MCULE-5898493972 [0,0,0,1,0,0|0,0,0]=1 647 B11R1.203 OCCCN1CCCCCC1 MCULE-4520769761 [0,0,0,1,0,0|1,0,2]=4 648 B11R1.203 OCCCN1CCCCCC1 MCULE-4937889727 [0,0,0,1,0,0|1,0,2]=4 649 B11R1.203 OCCNC1CCCCCC1 MCULE-9807195475 [0,0,0,1,0,0|1,0,2]=4 650 B11R1.203 OCCOC1CCCCCC1 MCULE-7377327373 [0,0,0,1,0,0|1,0,2]=4 651 B8R0.4 BrCCCCCCCBr MCULE-4094304263 [2,0,0,0,0,0|2,0,0]=4 652 B8R0.4 C#CCCCCCC=O MCULE-6168802703 [2,0,0,0,0,0|0,0,2]=4 653 B8R0.4 C#CCCCCCCC MCULE-5881425113 [2,0,0,0,0,0|0,0,2]=4 654 B8R0.4 C=CCCCCCC=O MCULE-9514877352 [2,0,0,0,0,0|0,0,2]=4 655 B8R0.4 C=CCCCCCCBr MCULE-6451772855 [2,0,0,0,0,0|1,0,1]=4 656 B8R0.4 C=CCCCCCCC MCULE-8103203416 [2,0,0,0,0,0|0,0,1]=3 657 B8R0.4 C=CCCCCCCCl MCULE-2359680024 [2,0,0,0,0,0|1,0,1]=4 658 B8R0.4 C=CCCCCCCI MCULE-2548377676 [2,0,0,0,0,0|1,0,1]=4 659 B8R0.4 C=CCCCCCCN MCULE-3465800348 [2,0,0,0,0,0|1,0,1]=4 660 B8R0.4 C=CCCCCCCN MCULE-9820466293 [2,0,0,0,0,0|1,0,1]=4 661 B8R0.4 C=CCCCCCCO MCULE-8561904793 [2,0,0,0,0,0|1,0,1]=4 662 B8R0.4 C=CCCCCCNC MCULE-9487840122 [2,0,0,0,0,0|1,0,1]=4 663 B8R0.4 CC=CCCCCCC MCULE-2766900913 [2,0,0,0,0,0|0,0,2]=4 664 B8R0.4 CCC#CCCCCC MCULE-3250800871 [2,0,0,0,0,0|0,0,2]=4 665 B8R0.4 CCC/C=C\CCCC MCULE-1534641855 [2,0,0,0,0,0|0,0,2]=4 666 B8R0.4 CCCC=CCCCC MCULE-6609949802 [2,0,0,0,0,0|0,0,2]=4 667 B8R0.4 CCCCBCCCC MCULE-3163100787 [2,0,0,0,0,0|1,0,0]=3 668 B8R0.4 CCCCBCCCC MCULE-6578781762 [2,0,0,0,0,0|1,0,0]=3 669 B8R0.4 CCCCC/C=C/C=O MCULE-9410244042 [2,0,0,0,0,0|0,0,2]=4 670 B8R0.4 CCCCCC#CC=O MCULE-6367130572 [2,0,0,0,0,0|0,0,2]=4 671 B8R0.4 CCCCCC=CC=O MCULE-7640230490 [2,0,0,0,0,0|0,0,2]=4 672 B8R0.4 CCCCCCC=CI MCULE-3614174427 [2,0,0,0,0,0|1,0,1]=4 673 B8R0.4 CCCCCCCC#N MCULE-3399476727 [2,0,0,0,0,0|1,0,1]=4 674 B8R0.4 CCCCCCCC=O MCULE-7111365457 [2,0,0,0,0,0|0,0,0]=2 675 B8R0.4 CCCCCCCCBr MCULE-7484248707 [2,0,0,0,0,0|1,0,0]=3 676 B8R0.4 CCCCCCCCC MCULE-1865327912 [2,0,0,0,0,0|0,0,0]=2 677 B8R0.4 CCCCCCCCCl MCULE-5953637232 [2,0,0,0,0,0|1,0,0]=3 678 B8R0.4 CCCCCCCCF MCULE-5641912511 [2,0,0,0,0,0|1,0,0]=3 679 B8R0.4 CCCCCCCCI MCULE-7304806902 [2,0,0,0,0,0|1,0,0]=3 680 B8R0.4 CCCCCCCCN MCULE-6095227778 [2,0,0,0,0,0|1,0,0]=3 681 B8R0.4 CCCCCCCCN MCULE-7012389700 [2,0,0,0,0,0|1,0,0]=3 682 B8R0.4 CCCCCCCCN MCULE-7076053015 [2,0,0,0,0,0|1,0,0]=3 683 B8R0.4 CCCCCCCCO MCULE-2656577895 [2,0,0,0,0,0|0,0,1]=3 684 B8R0.4 CCCCCCCCS MCULE-5212273874 [2,0,0,0,0,0|0,1,0]=3 685 B8R0.4 CCCCCCCNC MCULE-1143610772 [2,0,0,0,0,0|1,0,0]=3 686 B8R0.4 CCCCCCCNN MCULE-7800659587 [2,0,0,0,0,0|2,0,0]=4 687 B8R0.4 CCCCCCCON MCULE-6380236924 [2,0,0,0,0,0|2,0,0]=4 688 B8R0.4 CCCCCCCON MCULE-6581043184 [2,0,0,0,0,0|2,0,0]=4 689 B8R0.4 CCCCCCCSC MCULE-5211260102 [2,0,0,0,0,0|1,0,0]=3 690 B8R0.4 CCCCCCN=C=O MCULE-6808788959 [2,0,0,0,0,0|1,0,1]=4 691 B8R0.4 CCCCCCNC=O MCULE-3719637754 [2,0,0,0,0,0|1,0,0]=3 692 B8R0.4 CCCCCCOC=O MCULE-1329787181 [2,0,0,0,0,0|1,0,0]=3 693 B8R0.4 CCCCCCON=O MCULE-9048754026 [2,0,0,0,0,0|2,0,0]=4 694 B8R0.4 CCCCCCSCC MCULE-1449428108 [2,0,0,0,0,0|1,0,0]=3 695 B8R0.4 CCCCCNCCC MCULE-7697830316 [2,0,0,0,0,0|1,0,0]=3 696 B8R0.4 CCCCCNCCN MCULE-5873419228 [2,0,0,0,0,0|2,0,0]=4 697 B8R0.4 CCCCCNCCO MCULE-7662965930 [2,0,0,0,0,0|1,0,1]=4 698 B8R0.4 CCCCCNOCC MCULE-5426574695 [2,0,0,0,0,0|2,0,0]=4 699 B8R0.4 CCCCCNOCC MCULE-6155853359 [2,0,0,0,0,0|2,0,0]=4 700 B8R0.4 CCCCCOCCO MCULE-3393695257 [2,0,0,0,0,0|1,0,1]=4 701 B8R0.4 CCCCCSCCCl MCULE-7680431310 [2,0,0,0,0,0|2,0,0]=4 702 B8R0.4 CCCCCSCCO MCULE-1239137782 [2,0,0,0,0,0|1,0,1]=4 703 B8R0.4 CCCCNCCCC MCULE-1338595384 [2,0,0,0,0,0|1,0,0]=3 704 B8R0.4 CCCCNCCCC MCULE-4720016177 [2,0,0,0,0,0|1,0,0]=3 705 B8R0.4 CCCCNCCCC MCULE-6002936904 [2,0,0,0,0,0|1,0,0]=3 706 B8R0.4 CCCCNCCCC MCULE-8673755112 [2,0,0,0,0,0|1,0,0]=3 707 B8R0.4 CCCCNCCCCl MCULE-6595599220 [2,0,0,0,0,0|2,0,0]=4 708 B8R0.4 CCCCNCCCCl MCULE-8225115019 [2,0,0,0,0,0|2,0,0]=4 709 B8R0.4 CCCCNCCCN MCULE-6098022466 [2,0,0,0,0,0|2,0,0]=4 710 B8R0.4 CCCCNCCCO MCULE-7171357018 [2,0,0,0,0,0|1,0,1]=4 711 B8R0.4 CCCCNCCOC MCULE-5142206385 [2,0,0,0,0,0|2,0,0]=4 712 B8R0.4 CCCCOCCCC MCULE-8568026186 [2,0,0,0,0,0|1,0,0]=3 713 B8R0.4 CCCCOCCCN MCULE-2107763231 [2,0,0,0,0,0|2,0,0]=4 714 B8R0.4 CCCCOCCCO MCULE-2797403638 [2,0,0,0,0,0|1,0,1]=4 715 B8R0.4 CCCCOCCOC MCULE-4497601798 [2,0,0,0,0,0|2,0,0]=4 716 B8R0.4 CCCCSCCCC MCULE-3121918458 [2,0,0,0,0,0|1,0,0]=3 717 B8R0.4 CCCCSCCCN MCULE-6519812920 [2,0,0,0,0,0|2,0,0]=4 718 B8R0.4 CCCC[NH2+]CCCC MCULE-4333811997 [2,0,0,0,0,0|1,0,0]=3 719 B8R0.4 CCCC[NH2+]CCCC MCULE-8030655880 [2,0,0,0,0,0|1,0,0]=3 720 B8R0.4 CCCNCCCCN MCULE-1576152293 [2,0,0,0,0,0|2,0,0]=4 721 B8R0.4 CCCNCCCCN MCULE-2764845788 [2,0,0,0,0,0|2,0,0]=4 722 B8R0.4 CCCNCCCNC MCULE-5061364734 [2,0,0,0,0,0|2,0,0]=4 723 B8R0.4 CCCSCCCCN MCULE-7923615539 [2,0,0,0,0,0|2,0,0]=4 724 B8R0.4 CCNCCCCCN MCULE-1094310455 [2,0,0,0,0,0|2,0,0]=4 725 B8R0.4 CCNCCCNCC MCULE-6294880102 [2,0,0,0,0,0|2,0,0]=4 726 B8R0.4 CCOCCOCC=O MCULE-4431979706 [2,0,0,0,0,0|2,0,0]=4 727 B8R0.4 CNCCCCCCN MCULE-3241182046 [2,0,0,0,0,0|2,0,0]=4 728 B8R0.4 CNCCCCCCO MCULE-2582847385 [2,0,0,0,0,0|1,0,1]=4 729 B8R0.4 COCCCCCCBr MCULE-8590853100 [2,0,0,0,0,0|2,0,0]=4 730 B8R0.4 COCCCCCCO MCULE-5454628686 [2,0,0,0,0,0|1,0,1]=4 731 B8R0.4 COCCCCCOC MCULE-5066626930 [2,0,0,0,0,0|2,0,0]=4 732 B8R0.4 COCCOCCC=O MCULE-4095630051 [2,0,0,0,0,0|2,0,0]=4 733 B8R0.4 CSCCCCCCN MCULE-3785645703 [2,0,0,0,0,0|2,0,0]=4 734 B8R0.4 CSCCCCCCO MCULE-1590282643 [2,0,0,0,0,0|1,0,1]=4 735 B8R0.4 CSCCCCCSC MCULE-3097194542 [2,0,0,0,0,0|2,0,0]=4 736 B8R0.4 ClCCCCCCCBr MCULE-6518226792 [2,0,0,0,0,0|2,0,0]=4 737 B8R0.4 ClCCCCCCCCl MCULE-9270407250 [2,0,0,0,0,0|2,0,0]=4 738 B8R0.4 NCCCCCCCBr MCULE-2103124315 [2,0,0,0,0,0|2,0,0]=4 739 B8R0.4 NCCCCCCCBr MCULE-9591138313 [2,0,0,0,0,0|2,0,0]=4 740 B8R0.4 NCCCCCCCN MCULE-3408586405 [2,0,0,0,0,0|2,0,0]=4 741 B8R0.4 NCCCCCCCO MCULE-6098435698 [2,0,0,0,0,0|1,0,1]=4 742 B8R0.4 NCCCCCCCO MCULE-8352830275 [2,0,0,0,0,0|1,0,1]=4 743 B8R0.4 O=CCCCCCC=O MCULE-7016999051 [2,0,0,0,0,0|1,0,1]=4 744 B8R0.4 O=CCCCCCCBr MCULE-3046622133 [2,0,0,0,0,0|1,0,0]=3 745 B8R0.4 OCCCCCCCBr MCULE-2559114853 [2,0,0,0,0,0|1,0,1]=4 746 B8R0.4 OCCCCCCCCl MCULE-4143586059 [2,0,0,0,0,0|1,0,1]=4 747 B8R0.4 OCCCCCCCI MCULE-3420024644 [2,0,0,0,0,0|1,0,1]=4 748 B8R0.4 OCCCCCCCO MCULE-1201837142 [2,0,0,0,0,0|1,0,1]=4 749 B10R0.1 C=CCC(C)CCCCCC MCULE-9669056285 [1,1,0,0,0,0|0,0,1]=3 750 B10R0.1 CCCCCCC(=O)CCC MCULE-1716736963 [1,1,0,0,0,0|0,0,2]=4 751 B10R0.1 CCCCCCC(C)CCBr MCULE-3565681476 [1,1,0,0,0,0|1,0,0]=3 752 B10R0.1 CCCCCCC(C)CCC MCULE-7297649998 [1,1,0,0,0,0|0,0,1]=3 753 B10R0.1 CCCCCCC(C)CCO MCULE-7361079557 [1,1,0,0,0,0|0,0,1]=3 754 B10R0.1 CCCCCCC(C)N=C=O MCULE-5942468953 [1,1,0,0,0,0|1,0,1]=4 755 B10R0.1 CCCCCCC(Cl)CCC MCULE-2067978007 [1,1,0,0,0,0|0,0,1]=3 756 B10R0.1 CCCCCCC(O)CCC MCULE-2307566607 [1,1,0,0,0,0|0,0,1]=3 757 B10R0.1 CCCCCCC(O)CCO MCULE-4512993407 [1,1,0,0,0,0|0,0,1]=3 758 B10R0.1 CCCCCC[C@H](C)CCC MCULE-5233422494 [1,1,0,0,0,0|0,0,1]=3 759 B10R0.1 CCCCCC[C@H](O)CCC MCULE-3592520258 [1,1,0,0,0,0|0,0,1]=3 760 B10R0.1 CCCCCC[C@H](O)CCC MCULE-8969624714 [1,1,0,0,0,0|0,0,1]=3 761 B10R0.1 CCCCCNC(C)CCC MCULE-9526667622 [1,1,0,0,0,0|1,0,1]=4 762 B10R0.1 CCOC(=O)CCCCC=O MCULE-7732334617 [1,1,0,0,0,0|1,0,1]=4 763 B10R0.4 C#CCCCCCCC(=O)O MCULE-9844370313 [1,1,0,0,0,0|0,0,2]=4 764 B10R0.4 C(=CC(=O)O)CCCCCC MCULE-5063564829 [1,1,0,0,0,0|0,0,2]=4 765 B10R0.4 C=C(Br)CCCCCCCC MCULE-6632348327 [1,1,0,0,0,0|0,0,1]=3 766 B10R0.4 C=C(Br)CCCCCCCCl MCULE-7158264521 [1,1,0,0,0,0|1,0,1]=4 767 B10R0.4 C=C(C)CCCCCCCC MCULE-2486247417 [1,1,0,0,0,0|0,0,1]=3 768 B10R0.4 C=C(C)CCCCCCCCl MCULE-1277821807 [1,1,0,0,0,0|1,0,1]=4 769 B10R0.4 C=C(Cl)CCCCCCCC MCULE-5745154351 [1,1,0,0,0,0|0,0,1]=3 770 B10R0.4 C=C(Cl)CCCCCCCCl MCULE-2676680423 [1,1,0,0,0,0|1,0,1]=4 771 B10R0.4 C=CCCCCCCC(=C)C MCULE-8947679436 [1,1,0,0,0,0|0,0,2]=4 772 B10R0.4 C=CCCCCCCC(=O)C MCULE-3952725967 [1,1,0,0,0,0|0,0,2]=4 773 B10R0.4 C=CCCCCCCC(=O)O MCULE-3663585072 [1,1,0,0,0,0|0,0,2]=4 774 B10R0.4 C=CCCCCCCC(C)O MCULE-8946172514 [1,1,0,0,0,0|0,0,1]=3 775 B10R0.4 C=CCCCCCC[C@@H](C)O MCULE-8592463039 [1,1,0,0,0,0|0,0,1]=3 776 B10R0.4 C=CCCCCCC[C@@H](C)O MCULE-9140993826 [1,1,0,0,0,0|0,0,1]=3 777 B10R0.4 C=CCCCCCC[C@H](C)O MCULE-8109598857 [1,1,0,0,0,0|0,0,1]=3 778 B10R0.4 CC(=O)CCCCCCCO MCULE-6975960500 [1,1,0,0,0,0|1,0,0]=3 779 B10R0.4 CC(=O)NCCCCCCN MCULE-6988947031 [1,1,0,0,0,0|2,0,0]=4 780 B10R0.4 CC(=O)OCCCCCCBr MCULE-9658847674 [1,1,0,0,0,0|2,0,0]=4 781 B10R0.4 CC(=O)OCCCCCCCl MCULE-2777138332 [1,1,0,0,0,0|2,0,0]=4 782 B10R0.4 CC(=O)SCCCCCCN MCULE-6118060031 [1,1,0,0,0,0|2,0,0]=4 783 B10R0.4 CC(=O)SCCCCCCN MCULE-7116355086 [1,1,0,0,0,0|2,0,0]=4 784 B10R0.4 CC(C)CCCCCCC=O MCULE-8509627472 [1,1,0,0,0,0|0,0,0]=2 785 B10R0.4 CC(C)CCCCCCCO MCULE-6712139024 [1,1,0,0,0,0|0,0,1]=3 786 B10R0.4 CC(C)COCCOCC=O MCULE-5148881220 [1,1,0,0,0,0|2,0,0]=4 787 B10R0.4 CC(C)NCCCCCCN MCULE-9998562121 [1,1,0,0,0,0|2,0,0]=4 788 B10R0.4 CCCCC/C=C/CC(=O)O MCULE-1378284129 [1,1,0,0,0,0|0,0,2]=4 789 B10R0.4 CCCCCC/C=C/C(=O)O MCULE-8167234483 [1,1,0,0,0,0|0,0,2]=4 790 B10R0.4 CCCCCC=CCC(=O)O MCULE-5507503933 [1,1,0,0,0,0|0,0,2]=4 791 B10R0.4 CCCCCCC=CC(=O)C MCULE-7025674174 [1,1,0,0,0,0|0,0,2]=4 792 B10R0.4 CCCCCCCCB(O)O MCULE-9483383226 [1,1,0,0,0,0|1,0,1]=4 793 B10R0.4 CCCCCCCCC(=N)N MCULE-1846296312 [1,1,0,0,0,0|1,0,0]=3 794 B10R0.4 CCCCCCCCC(=O)C MCULE-6168357226 [1,1,0,0,0,0|0,0,0]=2 795 B10R0.4 CCCCCCCCC(=O)Cl MCULE-7596715750 [1,1,0,0,0,0|0,0,0]=2 796 B10R0.4 CCCCCCCCC(=O)N MCULE-6415702858 [1,1,0,0,0,0|0,0,0]=2 797 B10R0.4 CCCCCCCCC(=O)O MCULE-4736597375 [1,1,0,0,0,0|0,0,0]=2 798 B10R0.4 CCCCCCCCC(=O)[O-] MCULE-1077439841 [1,1,0,0,0,0|0,0,0]=2 799 B10R0.4 CCCCCCCCC(C)C MCULE-3505579656 [1,1,0,0,0,0|0,0,1]=3 800 B10R0.4 CCCCCCCCC(C)O MCULE-3577613701 [1,1,0,0,0,0|0,0,1]=3 801 B10R0.4 CCCCCCCCN(=O)=O MCULE-2507397154 [1,1,0,0,0,0|1,0,0]=3 802 B10R0.4 CCCCCCCCN(C)C MCULE-2841483956 [1,1,0,0,0,0|1,0,1]=4 803 B10R0.4 CCCCCCCCN(C)C MCULE-8695073136 [1,1,0,0,0,0|1,0,1]=4 804 B10R0.4 CCCCCCCC[C@@H](C)Br MCULE-8624556030 [1,1,0,0,0,0|0,0,1]=3 805 B10R0.4 CCCCCCCC[C@@H](C)O MCULE-6511994487 [1,1,0,0,0,0|0,0,1]=3 806 B10R0.4 CCCCCCCC[C@H](C)O MCULE-7200709868 [1,1,0,0,0,0|0,0,1]=3 807 B10R0.4 CCCCCCCNC(=O)C MCULE-3916780915 [1,1,0,0,0,0|1,0,0]=3 808 B10R0.4 CCCCCCCNC(=S)N MCULE-7534812314 [1,1,0,0,0,0|1,1,0]=4 809 B10R0.4 CCCCCCCOC(=O)C MCULE-7061891812 [1,1,0,0,0,0|1,0,0]=3 810 B10R0.4 CCCCCCCOC(=O)Cl MCULE-9018506867 [1,1,0,0,0,0|1,0,0]=3 811 B10R0.4 CCCCCCCOC(=S)[S-] MCULE-1608327732 [1,1,0,0,0,0|1,1,0]=4 812 B10R0.4 CCCCCCCOC(=S)[S-] MCULE-7650100616 [1,1,0,0,0,0|1,1,0]=4 813 B10R0.4 CCCCCCCSC(=[NH2+])N MCULE-2803933619 [1,1,0,0,0,0|2,0,0]=4 814 B10R0.4 CCCCCCCSC(=[NH2+])N MCULE-5565074928 [1,1,0,0,0,0|2,0,0]=4 815 B10R0.4 CCCCCCNCC(=O)O MCULE-3361498309 [1,1,0,0,0,0|1,0,0]=3 816 B10R0.4 CCCCCCNCC(C)O MCULE-5617215322 [1,1,0,0,0,0|1,0,1]=4 817 B10R0.4 CCCCCCOCC(=O)O MCULE-6951993364 [1,1,0,0,0,0|1,0,0]=3 818 B10R0.4 CCCCCCSCC(=O)O MCULE-5086023021 [1,1,0,0,0,0|1,0,0]=3 819 B10R0.4 CCCCOCCOC(=O)C MCULE-4906127008 [1,1,0,0,0,0|2,0,0]=4 820 B10R0.4 CCCCSCCCC(=O)O MCULE-5928316679 [1,1,0,0,0,0|1,0,0]=3 821 B10R0.4 CCOCCCCCC(=O)O MCULE-9514442276 [1,1,0,0,0,0|1,0,0]=3 822 B10R0.4 CCOCCOCCC(=O)O MCULE-7483626719 [1,1,0,0,0,0|2,0,0]=4 823 B10R0.4 CN(C)CCCCCCCN MCULE-9345898285 [1,1,0,0,0,0|2,0,0]=4 824 B10R0.4 COCCCCCCN(=O)=O MCULE-3117222018 [1,1,0,0,0,0|2,0,0]=4 825 B10R0.4 COCCCNCCC(=O)N MCULE-2468408250 [1,1,0,0,0,0|2,0,0]=4 826 B10R0.4 COCCCOCCC(=O)O MCULE-5178930362 [1,1,0,0,0,0|2,0,0]=4 827 B10R0.4 CSCCCCCCC(=O)O MCULE-9976800222 [1,1,0,0,0,0|1,0,0]=3 828 B10R0.4 NC(=O)CCCCCCCBr MCULE-4427479699 [1,1,0,0,0,0|1,0,0]=3 829 B10R0.4 NCCCCCCCC(=O)O MCULE-2737882810 [1,1,0,0,0,0|1,0,0]=3 830 B10R0.4 NCCCCCCCC(=O)O MCULE-4269382976 [1,1,0,0,0,0|1,0,0]=3 831 B10R0.4 NCCCCCCNC(=O)O MCULE-3865214371 [1,1,0,0,0,0|2,0,0]=4 832 B10R0.4 NCCCNCCCC(=O)O MCULE-2780784491 [1,1,0,0,0,0|2,0,0]=4 833 B10R0.4 NCCCNCCCC(=O)O MCULE-8488597292 [1,1,0,0,0,0|2,0,0]=4 834 B10R0.4 O=C(Cl)CCCCCCCBr MCULE-5775098735 [1,1,0,0,0,0|1,0,0]=3 835 B10R0.4 O=C(O)CCCCCCCBr MCULE-6425557416 [1,1,0,0,0,0|1,0,0]=3 836 B10R0.4 O=C(O)CCCCCCCO MCULE-1839591073 [1,1,0,0,0,0|1,0,0]=3 837 B10R0.4 O=C(O)CCCCCCCS MCULE-6555950664 [1,1,0,0,0,0|1,0,0]=3 838 B10R0.4 O=CCCCCCCC(=O)O MCULE-3146118588 [1,1,0,0,0,0|1,0,1]=4 839 B10R0.4 O=N(=O)CCCCCCCO MCULE-6021483764 [1,1,0,0,0,0|2,0,0]=4 840 B10R0.4 [C@H](C)(O)CCCCCCCC MCULE-7849954701 [1,1,0,0,0,0|0,0,1]=3 841 B10R0.74 C=CC(O)CCCCCCC MCULE-2034118054 [1,1,0,0,0,0|0,0,1]=3 842 B10R0.74 C=CCCCCCC(C)CC MCULE-1533986474 [1,1,0,0,0,0|0,0,1]=3 843 B10R0.74 CCCCCCCC(=O)CC MCULE-3418685291 [1,1,0,0,0,0|0,0,2]=4 844 B10R0.74 CCCCCCCC(C)C=O MCULE-6740449093 [1,1,0,0,0,0|0,0,0]=2 845 B10R0.74 CCCCCCCC(C)CN MCULE-7311446663 [1,1,0,0,0,0|1,0,0]=3 846 B10R0.74 CCCCCCCC(N)CC MCULE-5023964032 [1,1,0,0,0,0|0,0,1]=3 847 B10R0.74 CCCCCCCC(O)CC MCULE-5420300699 [1,1,0,0,0,0|0,0,1]=3 848 B10R0.74 CCCCCCCC(O)CO MCULE-4511310759 [1,1,0,0,0,0|0,0,1]=3 849 B10R0.74 CCCCCCC[C@@H](C)CC MCULE-8718967535 [1,1,0,0,0,0|0,0,1]=3 850 B10R0.74 COC(=O)CCCCCC=O MCULE-1071696685 [1,1,0,0,0,0|1,0,1]=4 851 B10R0.74 OCCCCCCC(O)CO MCULE-1673794211 [1,1,0,0,0,0|1,0,1]=4 852 B10R0.91 C#CCCC(C)CCCCC MCULE-4124175821 [1,1,0,0,0,0|0,0,2]=4 853 B10R0.91 C#CCCC(O)CCCCC MCULE-4675172890 [1,1,0,0,0,0|0,0,2]=4 854 B10R0.91 C=CCCC(C)CCCCC MCULE-1706757342 [1,1,0,0,0,0|0,0,1]=3 855 B10R0.91 CCCCC(C)CCCCO MCULE-9256284581 [1,1,0,0,0,0|0,0,1]=3 856 B10R0.91 CCCCCC(=O)CCCC MCULE-4876992287 [1,1,0,0,0,0|0,0,2]=4 857 B10R0.91 CCCCCC(C)CCC=O MCULE-9659356194 [1,1,0,0,0,0|0,0,0]=2 858 B10R0.91 CCCCCC(C)CCCO MCULE-6947023752 [1,1,0,0,0,0|0,0,1]=3 859 B10R0.91 CCCCCC(O)/C=C/C=O MCULE-7787544395 [1,1,0,0,0,0|0,0,2]=4 860 B10R0.91 CCCCCC(O)C=CC=O MCULE-4013578316 [1,1,0,0,0,0|0,0,2]=4 861 B10R0.91 CCCCCC(O)CCCC MCULE-4028571026 [1,1,0,0,0,0|0,0,1]=3 862 B10R0.91 CCCCC[C@@H](C)CCCC MCULE-6344602419 [1,1,0,0,0,0|0,0,1]=3 863 B10R0.91 CCCCC[C@H](O)CCCC MCULE-3767339379 [1,1,0,0,0,0|0,0,1]=3 864 B10R0.91 CCCCC[C@H](O)CCCC MCULE-8364286143 [1,1,0,0,0,0|0,0,1]=3 865 B10R0.91 CCCCNC(C)CCCC MCULE-1023082742 [1,1,0,0,0,0|1,0,1]=4 866 B12R0.1 C=CCC(C)CCCCCCCC MCULE-8322698729 [0,2,0,0,0,0|1,0,0]=3 867 B12R0.1 C=CCCCCCCC(=O)OCC MCULE-2529046007 [0,2,0,0,0,0|1,0,1]=4 868 B12R0.1 CCCCCCCCC(C)CCC MCULE-8337776414 [0,2,0,0,0,0|1,0,1]=4 869 B12R0.1 CCCCCCCCC(O)CCC MCULE-4193341089 [0,2,0,0,0,0|1,0,1]=4 870 B12R0.1 CCCCCCCCS(=O)CCCl MCULE-5342861128 [0,2,0,0,0,0|1,0,1]=4 871 B12R0.1 CCCCCCCCS(=O)CCO MCULE-7963242650 [0,2,0,0,0,0|0,0,2]=4 872 B12R0.5 BrCCCCCCCCCCCBr MCULE-7714737833 [0,2,0,0,0,0|1,0,1]=4 873 B12R0.5 C#CCCCCCCCCCCC MCULE-4966581415 [0,2,0,0,0,0|1,0,1]=4 874 B12R0.5 C#CCCCCCCCCCCO MCULE-3338769733 [0,2,0,0,0,0|0,0,2]=4 875 B12R0.5 C#CCOCCCCCCCCO MCULE-9833842442 [0,2,0,0,0,0|1,0,1]=4 876 B12R0.5 C=CCCCC=CCNCCCC MCULE-3142484929 [0,2,0,0,0,0|1,0,1]=4 877 B12R0.5 C=CCCCCCCCCCC#N MCULE-4908683971 [0,2,0,0,0,0|1,0,0]=3 878 B12R0.5 C=CCCCCCCCCCC=C MCULE-6862008178 [0,2,0,0,0,0|1,0,0]=3 879 B12R0.5 C=CCCCCCCCCCC=O MCULE-4798960934 [0,2,0,0,0,0|0,0,0]=2 880 B12R0.5 C=CCCCCCCCCCCBr MCULE-1450832602 [0,2,0,0,0,0|1,0,0]=3 881 B12R0.5 C=CCCCCCCCCCCC MCULE-7790972998 [0,2,0,0,0,0|1,0,0]=3 882 B12R0.5 C=CCCCCCCCCCCO MCULE-9436785815 [0,2,0,0,0,0|1,0,0]=3 883 B12R0.5 C=CCOCCCCCCCCO MCULE-5655873802 [0,2,0,0,0,0|1,0,0]=3 884 B12R0.5 C=COCCCCCCCCCC MCULE-9853638067 [0,2,0,0,0,0|1,0,0]=3 885 B12R0.5 C=CSCCCCCCCCCC MCULE-4125685210 [0,2,0,0,0,0|1,0,0]=3 886 B12R0.5 CC/C=C\CCCCCCCCO MCULE-3025560116 [0,2,0,0,0,0|0,0,2]=4 887 B12R0.5 CCC#CCCCCCCCCO MCULE-9432389600 [0,2,0,0,0,0|0,0,2]=4 888 B12R0.5 CCC/C=C\CCCCCCCO MCULE-1596799446 [0,2,0,0,0,0|0,0,2]=4 889 B12R0.5 CCC=CCCCCCCCCO MCULE-1639369196 [0,2,0,0,0,0|0,0,2]=4 890 B12R0.5 CCCC/C=C/CCCCCCO MCULE-1140179766 [0,2,0,0,0,0|0,0,2]=4 891 B12R0.5 CCCC/C=C\CCCCCCO MCULE-5650770931 [0,2,0,0,0,0|0,0,2]=4 892 B12R0.5 CCCC=CCCCCCCCO MCULE-6437929263 [0,2,0,0,0,0|0,0,2]=4 893 B12R0.5 CCCCC#CCCCCCCO MCULE-8221472970 [0,2,0,0,0,0|0,0,2]=4 894 B12R0.5 CCCCC=CCCCCCCO MCULE-6634191602 [0,2,0,0,0,0|0,0,2]=4 895 B12R0.5 CCCCCCC/C=C/C=C/C=O MCULE-2842287177 [0,2,0,0,0,0|0,0,2]=4 896 B12R0.5 CCCCCCCC=CC=CC=O MCULE-2297529084 [0,2,0,0,0,0|0,0,2]=4 897 B12R0.5 CCCCCCCCC/C=C/C=O MCULE-3924650225 [0,2,0,0,0,0|0,0,0]=2 898 B12R0.5 CCCCCCCCC/C=C/CO MCULE-8437286382 [0,2,0,0,0,0|0,0,1]=3 899 B12R0.5 CCCCCCCCC=CCCO MCULE-1965044026 [0,2,0,0,0,0|0,0,2]=4 900 B12R0.5 CCCCCCCCCC#CCO MCULE-3667812839 [0,2,0,0,0,0|0,0,2]=4 901 B12R0.5 CCCCCCCCCC/C=C/I MCULE-7924200766 [0,2,0,0,0,0|1,0,0]=3 902 B12R0.5 CCCCCCCCCC=CC=O MCULE-6984246846 [0,2,0,0,0,0|0,0,0]=2 903 B12R0.5 CCCCCCCCCC=CCO MCULE-9263380318 [0,2,0,0,0,0|0,0,1]=3 904 B12R0.5 CCCCCCCCCCCC#N MCULE-4898299264 [0,2,0,0,0,0|1,0,1]=4 905 B12R0.5 CCCCCCCCCCCC=O MCULE-3814557174 [0,2,0,0,0,0|0,0,0]=2 906 B12R0.5 CCCCCCCCCCCCBr MCULE-2442495006 [0,2,0,0,0,0|1,0,1]=4 907 B12R0.5 CCCCCCCCCCCCC MCULE-7749861366 [0,2,0,0,0,0|1,0,1]=4 908 B12R0.5 CCCCCCCCCCCCCl MCULE-6025385532 [0,2,0,0,0,0|1,0,1]=4 909 B12R0.5 CCCCCCCCCCCCF MCULE-3563531940 [0,2,0,0,0,0|1,0,1]=4 910 B12R0.5 CCCCCCCCCCCCI MCULE-6449418786 [0,2,0,0,0,0|1,0,1]=4 911 B12R0.5 CCCCCCCCCCCCN MCULE-1282419209 [0,2,0,0,0,0|1,0,1]=4 912 B12R0.5 CCCCCCCCCCCCN MCULE-1312431857 [0,2,0,0,0,0|1,0,1]=4 913 B12R0.5 CCCCCCCCCCCCN MCULE-3936839656 [0,2,0,0,0,0|1,0,1]=4 914 B12R0.5 CCCCCCCCCCCCN MCULE-8497998841 [0,2,0,0,0,0|1,0,1]=4 915 B12R0.5 CCCCCCCCCCCCN MCULE-9101484482 [0,2,0,0,0,0|1,0,1]=4 916 B12R0.5 CCCCCCCCCCCCO MCULE-3423087499 [0,2,0,0,0,0|0,0,2]=4 917 B12R0.5 CCCCCCCCCCCCO MCULE-9381688904 [0,2,0,0,0,0|0,0,2]=4 918 B12R0.5 CCCCCCCCCCCCS MCULE-8388213802 [0,2,0,0,0,0|0,1,1]=4 919 B12R0.5 CCCCCCCCCCCNC MCULE-4232799137 [0,2,0,0,0,0|1,0,1]=4 920 B12R0.5 CCCCCCCCCCCNC MCULE-9324463288 [0,2,0,0,0,0|1,0,1]=4 921 B12R0.5 CCCCCCCCCCN=C=S MCULE-4799395674 [0,2,0,0,0,0|0,1,1]=4 922 B12R0.5 CCCCCCCCCCN=N#N MCULE-3752897707 [0,2,0,0,0,0|1,0,1]=4 923 B12R0.5 CCCCCCCCCCNC=O MCULE-2199641461 [0,2,0,0,0,0|0,0,0]=2 924 B12R0.5 CCCCCCCCCCSC#N MCULE-1909270846 [0,2,0,0,0,0|0,1,1]=4 925 B12R0.5 CCCCCCCCCCSCC MCULE-4046728399 [0,2,0,0,0,0|0,1,1]=4 926 B12R0.5 CCCCCCCCCSCCO MCULE-1890346670 [0,2,0,0,0,0|0,0,2]=4 927 B12R0.5 CCCCCCCCNCCC#N MCULE-1909140913 [0,2,0,0,0,0|1,0,1]=4 928 B12R0.5 CCCCCCCCNCCCC MCULE-6370859761 [0,2,0,0,0,0|1,0,1]=4 929 B12R0.5 CCCCCCCCNCCCN MCULE-1576630780 [0,2,0,0,0,0|1,0,1]=4 930 B12R0.5 CCCCCCCCNCCOC MCULE-9794668613 [0,2,0,0,0,0|0,0,2]=4 931 B12R0.5 CCCCCCCCOCCCN MCULE-3428959730 [0,2,0,0,0,0|1,0,1]=4 932 B12R0.5 CCCCCCCCOCCNC MCULE-3720493532 [0,2,0,0,0,0|1,0,1]=4 933 B12R0.5 CCCCCCCCOCCNC MCULE-6027502699 [0,2,0,0,0,0|1,0,1]=4 934 B12R0.5 CCCCCCCCSCCNC MCULE-1591454214 [0,2,0,0,0,0|1,0,1]=4 935 B12R0.5 CCCCCCCCSCCNC MCULE-9041733565 [0,2,0,0,0,0|1,0,1]=4 936 B12R0.5 CCCCCCCNCCCNC MCULE-3143160534 [0,2,0,0,0,0|1,0,1]=4 937 B12R0.5 CCCCCCCOCCCC=O MCULE-7580382219 [0,2,0,0,0,0|0,0,0]=2 938 B12R0.5 CCCCCCCOCCCCO MCULE-4232162406 [0,2,0,0,0,0|0,0,2]=4 939 B12R0.5 CCCCCCNCCCCCC MCULE-3670409724 [0,2,0,0,0,0|1,0,1]=4 940 B12R0.5 CCCCCCNCCCCCC MCULE-4867029659 [0,2,0,0,0,0|1,0,1]=4 941 B12R0.5 CCCCCCNCCCCCC MCULE-9932038203 [0,2,0,0,0,0|1,0,1]=4 942 B12R0.5 CCCCCCOCCCCCC MCULE-3976538682 [0,2,0,0,0,0|1,0,1]=4 943 B12R0.5 CCCCCCOCCOCCCl MCULE-9978237089 [0,2,0,0,0,0|1,0,1]=4 944 B12R0.5 CCCCCCOCCOCCO MCULE-8195636539 [0,2,0,0,0,0|0,0,2]=4 945 B12R0.5 CCCCCCSCCCCCC MCULE-2928486782 [0,2,0,0,0,0|1,0,1]=4 946 B12R0.5 CCCCCCSCCOCCO MCULE-3415483366 [0,2,0,0,0,0|0,0,2]=4 947 B12R0.5 CCCOCCCCCCCCO MCULE-6159515912 [0,2,0,0,0,0|0,0,2]=4 948 B12R0.5 CCOCCCCCCCCCBr MCULE-4453801533 [0,2,0,0,0,0|1,0,1]=4 949 B12R0.5 CCOCCCCCCCCCO MCULE-6343777651 [0,2,0,0,0,0|0,0,2]=4 950 B12R0.5 ClCCCCCOCCCCCCl MCULE-6237389376 [0,2,0,0,0,0|1,0,1]=4 951 B12R0.5 ICCCCCCCCCCCI MCULE-1394798562 [0,2,0,0,0,0|1,0,1]=4 952 B12R0.5 N#CCCCCCCCCCC#N MCULE-3961185998 [0,2,0,0,0,0|1,0,1]=4 953 B12R0.5 N#N=NCCCCCCCCCN MCULE-3364636937 [0,2,0,0,0,0|2,0,0]=4 954 B12R0.5 N#N=NCCCCCCCCCO MCULE-6954750928 [0,2,0,0,0,0|2,0,0]=4 955 B12R0.5 NCCCCCCCCCCCN MCULE-2996124008 [0,2,0,0,0,0|1,0,1]=4 956 B12R0.5 NCCCCCCCCCCCO MCULE-5135515993 [0,2,0,0,0,0|0,0,2]=4 957 B12R0.5 NCCCCCCCCCCCS MCULE-2278372977 [0,2,0,0,0,0|0,1,1]=4 958 B12R0.5 NCCCCCCCCCCCS MCULE-7023358275 [0,2,0,0,0,0|0,1,1]=4 959 B12R0.5 O=CCCCCCCCCCCBr MCULE-8057974781 [0,2,0,0,0,0|0,0,0]=2 960 B12R0.5 OCCCCCCCCCCCBr MCULE-5881088914 [0,2,0,0,0,0|0,0,2]=4 961 B12R0.5 OCCCCCCCCCCCO MCULE-6987509130 [0,2,0,0,0,0|0,0,2]=4 962 B12R0.5 OCCCCCCCCCCCS MCULE-4791107478 [0,2,0,0,0,0|0,0,2]=4 963 B12R0.5 OCCCCCOCCCCCO MCULE-5243842214 [0,2,0,0,0,0|0,0,2]=4 964 B12R0.5 OCCCCCSCCCCCO MCULE-3316565485 [0,2,0,0,0,0|0,0,2]=4 965 B12R0.5 SCCCCCCCCCCCBr MCULE-7291453493 [0,2,0,0,0,0|0,1,1]=4 966 B12R0.5 [NH2+](CCCC)CCCCCCCC MCULE-9696707679 [0,2,0,0,0,0|1,0,1]=4 967 B12R0.47 C=CCOCC(O)CSCCCC MCULE-3081176081 [0,2,0,0,0,0|2,0,0]=4 968 B12R0.47 CCCCCCC(=O)CCCCC MCULE-2532885187 [0,2,0,0,0,0|1,0,1]=4 969 B12R0.47 CCCCCCC(O)CCCCC MCULE-9826172328 [0,2,0,0,0,0|1,0,1]=4 970 B12R0.206 CCCCCCCC(=O)CCCC MCULE-8871455068 [0,2,0,0,0,0|1,0,1]=4 971 B12R0.206 CCCCCCCC(O)CCCC MCULE-7645297712 [0,2,0,0,0,0|1,0,1]=4 972 B12R0.206 CCCCCCOC(C)CCCC MCULE-3599664509 [0,2,0,0,0,0|1,0,1]=4 973 B12R0.234 C#CCCCCCCCCC(=O)Cl MCULE-2889527190 [0,2,0,0,0,0|0,0,1]=3 974 B12R0.234 C#CCCCCCCCCC(=O)O MCULE-2483655428 [0,2,0,0,0,0|0,0,1]=3 975 B12R0.234 C=C(Br)CCCCCCCCCC MCULE-6429692740 [0,2,0,0,0,0|1,0,0]=3 976 B12R0.234 C=C(C)CCCCCCCCCC MCULE-5430192671 [0,2,0,0,0,0|1,0,0]=3 977 B12R0.234 C=C(Cl)CCCCCCCCCC MCULE-5277185113 [0,2,0,0,0,0|1,0,0]=3 978 B12R0.234 C=CCCCCCCCCC(=O)C MCULE-8465504630 [0,2,0,0,0,0|0,0,1]=3 979 B12R0.234 C=CCCCCCCCCC(=O)Cl MCULE-1643300518 [0,2,0,0,0,0|0,0,1]=3 980 B12R0.234 C=CCCCCCCCCC(=O)N MCULE-2069893872 [0,2,0,0,0,0|0,0,1]=3 981 B12R0.234 C=CCCCCCCCCC(=O)O MCULE-7928135942 [0,2,0,0,0,0|0,0,1]=3 982 B12R0.234 C=CCCCCCCCCC(=O)[O-] MCULE-4921741648 [0,2,0,0,0,0|0,0,1]=3 983 B12R0.234 C=CCCCCCCCCC(=O)[O-] MCULE-8671525222 [0,2,0,0,0,0|0,0,1]=3 984 B12R0.234 C=CCCCCCCCCN(=O)=O MCULE-9960791760 [0,2,0,0,0,0|1,0,1]=4 985 B12R0.234 C=CCCCCCCCOC(=O)C MCULE-7392620730 [0,2,0,0,0,0|0,0,2]=4 986 B12R0.234 CC#CCCCCCCCC(=O)O MCULE-8975663292 [0,2,0,0,0,0|0,0,1]=3 987 B12R0.234 CC(=O)NCCCCNCCCN MCULE-7493998252 [0,2,0,0,0,0|2,0,0]=4 988 B12R0.234 CC(=O)NCCCCNCCCN MCULE-9577502089 [0,2,0,0,0,0|2,0,0]=4 989 B12R0.234 CC(=O)NCCCNCCCCN MCULE-3303778613 [0,2,0,0,0,0|2,0,0]=4 990 B12R0.234 CC(=O)NCCCNCCCCN MCULE-8365270729 [0,2,0,0,0,0|2,0,0]=4 991 B12R0.234 CC(=O)OCCCCCCCCBr MCULE-4728650316 [0,2,0,0,0,0|1,0,0]=3 992 B12R0.234 CCC=CCCCCCOC(=O)C MCULE-2714811926 [0,2,0,0,0,0|0,0,2]=4 993 B12R0.234 CCCCCCC/C=C/CC(=O)C MCULE-6992455059 [0,2,0,0,0,0|0,0,1]=3 994 B12R0.234 CCCCCCCC/C=C/C(=O)O MCULE-6786701242 [0,2,0,0,0,0|0,0,1]=3 995 B12R0.234 CCCCCCCCC=CC(=O)O MCULE-7750983255 [0,2,0,0,0,0|0,0,1]=3 996 B12R0.234 CCCCCCCCCCB(O)O MCULE-6277841305 [0,2,0,0,0,0|0,0,2]=4 997 B12R0.234 CCCCCCCCCCC(=O)C MCULE-3936750617 [0,2,0,0,0,0|0,0,0]=2 998 B12R0.234 CCCCCCCCCCC(=O)Cl MCULE-1131766423 [0,2,0,0,0,0|0,0,0]=2 999 B12R0.234 CCCCCCCCCCC(=O)N MCULE-7086521203 [0,2,0,0,0,0|0,0,0]=2 1000 B12R0.234 CCCCCCCCCCC(=O)O MCULE-5110587542 [0,2,0,0,0,0|0,0,0]=2 1001 B12R0.234 CCCCCCCCCCC(C)N MCULE-6206499625 [0,2,0,0,0,0|1,0,1]=4 1002 B12R0.234 CCCCCCCCCCC(C)O MCULE-9407036721 [0,2,0,0,0,0|0,0,2]=4 1003 B12R0.234 CCCCCCCCCCN(=O)=O MCULE-9525688454 [0,2,0,0,0,0|0,0,1]=3 1004 B12R0.234 CCCCCCCCCCN(C)C MCULE-5051937267 [0,2,0,0,0,0|1,0,1]=4 1005 B12R0.234 CCCCCCCCCCS(=O)C MCULE-1607212944 [0,2,0,0,0,0|0,0,1]=3 1006 B12R0.234 CCCCCCCCCOC(=O)C MCULE-7712513310 [0,2,0,0,0,0|0,0,0]=2 1007 B12R0.234 CCCCCCCCCOC(=O)Cl MCULE-4937657236 [0,2,0,0,0,0|0,0,0]=2 1008 B12R0.234 CCCCCCCCCOC(=S)[S-] MCULE-1048722427 [0,2,0,0,0,0|0,1,0]=3 1009 B12R0.234 CCCCCCCCCOC(=S)[S-] MCULE-2082950273 [0,2,0,0,0,0|0,1,0]=3 1010 B12R0.234 CCCCCCCCCSC(=N)N MCULE-2574065227 [0,2,0,0,0,0|1,0,0]=3 1011 B12R0.234 CCCCCCCCCSC(=N)N MCULE-7175152082 [0,2,0,0,0,0|1,0,0]=3 1012 B12R0.234 CCCCCCCCNCC(C)O MCULE-9293787711 [0,2,0,0,0,0|0,0,2]=4 1013 B12R0.234 CCCCCCCCOCC(=O)O MCULE-8710960938 [0,2,0,0,0,0|0,0,0]=2 1014 B12R0.234 CCCCCCCCOCC(C)O MCULE-7262368590 [0,2,0,0,0,0|0,0,2]=4 1015 B12R0.234 CCCCCCCCSCC(=O)N MCULE-3095528852 [0,2,0,0,0,0|0,0,0]=2 1016 B12R0.234 CCCCCCCCSCC(=O)O MCULE-8082253480 [0,2,0,0,0,0|0,0,0]=2 1017 B12R0.234 CCCCCCCC[NH2+]CC(=O)O MCULE-1736831432 [0,2,0,0,0,0|0,0,0]=2 1018 B12R0.234 CCCCCCCC[NH2+]CC(=O)O MCULE-8284012398 [0,2,0,0,0,0|0,0,0]=2 1019 B12R0.234 CCCCCCCNCCC(=O)N MCULE-9973742738 [0,2,0,0,0,0|0,0,0]=2 1020 B12R0.234 CCOCCCCCCCC(=O)O MCULE-4393917993 [0,2,0,0,0,0|0,0,0]=2 1021 B12R0.234 CNCCOCCOCCC(=O)O MCULE-5859151176 [0,2,0,0,0,0|2,0,0]=4 1022 B12R0.234 COCCOCCOCCC(=O)Cl MCULE-4397360863 [0,2,0,0,0,0|2,0,0]=4 1023 B12R0.234 COCCOCCOCCC(=O)O MCULE-3073877899 [0,2,0,0,0,0|2,0,0]=4 1024 B12R0.234 N#CCCCCCCCCC(=O)O MCULE-1219422242 [0,2,0,0,0,0|0,0,1]=3 1025 B12R0.234 N#N=NCCCCCCCC(=O)O MCULE-5693417997 [0,2,0,0,0,0|2,0,0]=4 1026 B12R0.234 NCCCCCCCCCC(=O)O MCULE-1324986945 [0,2,0,0,0,0|0,0,0]=2 1027 B12R0.234 NCCOCCOCCCC(=O)O MCULE-2525701431 [0,2,0,0,0,0|2,0,0]=4 1028 B12R0.234 O=C(O)/C=C/CCCCCCCO MCULE-7936793574 [0,2,0,0,0,0|0,0,2]=4 1029 B12R0.234 O=C(O)C=CCCCCCCCO MCULE-6067845776 [0,2,0,0,0,0|0,0,2]=4 1030 B12R0.234 O=C(O)CCCCCCCCCBr MCULE-5728710095 [0,2,0,0,0,0|0,0,0]=2 1031 B12R0.234 O=C(O)CCCCCCCCCF MCULE-1907577974 [0,2,0,0,0,0|0,0,0]=2 1032 B12R0.234 O=C(O)CCCCCCCCCO MCULE-3771681317 [0,2,0,0,0,0|0,0,0]=2 1033 B12R0.234 O=N(=O)CCCCCCCCCBr MCULE-3636866484 [0,2,0,0,0,0|1,0,0]=3 1034 B12R0.234 O=N(=O)CCCCCCCCCO MCULE-4658294221 [0,2,0,0,0,0|1,0,0]=3 1035 B12R0.248 C=CC(=O)NCCCCCCCC MCULE-9686941876 [0,2,0,0,0,0|1,0,0]=3 1036 B12R0.248 C=CC(=O)OCCCCCCCC MCULE-8708207271 [0,2,0,0,0,0|1,0,0]=3 1037 B12R0.248 C=CCCCCCCCC(=O)OC MCULE-1843303649 [0,2,0,0,0,0|0,0,2]=4 1038 B12R0.248 CCCCCCCCC/C(=N\O)/N MCULE-5582103663 [0,2,0,0,0,0|0,0,1]=3 1039 B12R0.248 CCCCCCCCCC(=O)CC MCULE-8070056231 [0,2,0,0,0,0|0,0,0]=2 1040 B12R0.248 CCCCCCCCCC(=O)NC MCULE-5903490737 [0,2,0,0,0,0|0,0,0]=2 1041 B12R0.248 CCCCCCCCCC(=O)NN MCULE-5225093755 [0,2,0,0,0,0|0,0,0]=2 1042 B12R0.248 CCCCCCCCCC(=O)NO MCULE-3922115888 [0,2,0,0,0,0|0,0,0]=2 1043 B12R0.248 CCCCCCCCCC(=O)OC MCULE-3080392178 [0,2,0,0,0,0|0,0,0]=2 1044 B12R0.248 CCCCCCCCCC(C)C=O MCULE-7485962352 [0,2,0,0,0,0|0,0,0]=2 1045 B12R0.248 CCCCCCCCCC(O)CC MCULE-8088841540 [0,2,0,0,0,0|0,0,2]=4 1046 B12R0.248 CCCCCCCCCC(O)CO MCULE-3958170897 [0,2,0,0,0,0|0,0,2]=4 1047 B12R0.248 CCCCCCCCCC([NH3+])CO MCULE-4329139225 [0,2,0,0,0,0|0,0,2]=4 1048 B12R0.248 CCCCCCCCCC([NH3+])CO MCULE-6424120612 [0,2,0,0,0,0|0,0,2]=4 1049 B12R0.248 CCCCCCCCNC(=O)CCl MCULE-4427362960 [0,2,0,0,0,0|1,0,0]=3 1050 B12R0.248 CCCCCCCCNC(=S)NN MCULE-7622055380 [0,2,0,0,0,0|1,1,0]=4 1051 B12R0.248 CCCCCCCCOC(=O)CBr MCULE-6221987137 [0,2,0,0,0,0|1,0,0]=3 1052 B12R0.248 CCCCCCCCOC(=O)CC MCULE-3871560069 [0,2,0,0,0,0|1,0,0]=3 1053 B12R0.248 CCCCCCCCOC(=O)CCl MCULE-4822709810 [0,2,0,0,0,0|1,0,0]=3 1054 B12R0.248 CCCCCCCCOC(=O)CN MCULE-1232197423 [0,2,0,0,0,0|1,0,0]=3 1055 B12R0.248 CCCCCCCCOC(=O)CN MCULE-3856902884 [0,2,0,0,0,0|1,0,0]=3 1056 B12R0.248 CCCCCCCCOC(=O)CS MCULE-8976044992 [0,2,0,0,0,0|1,0,0]=3 1057 B12R0.248 CCCCCCCSCC(=O)OC MCULE-8419218207 [0,2,0,0,0,0|1,0,0]=3 1058 B12R0.248 CNCCCCCCCC(=O)OC MCULE-2073535841 [0,2,0,0,0,0|1,0,0]=3 1059 B12R0.248 COC(=O)CCCCCCCC=O MCULE-8962678443 [0,2,0,0,0,0|0,0,1]=3 1060 B12R0.248 COC(=O)CCCCCCCCBr MCULE-8360143365 [0,2,0,0,0,0|1,0,0]=3 1061 B12R0.248 COC(=O)CCCCCCCCO MCULE-5867988584 [0,2,0,0,0,0|1,0,0]=3 1062 B12R0.248 OCCCCCCCCC(O)CO MCULE-5399962147 [0,2,0,0,0,0|0,0,2]=4 1063 B12R0.4 C=C(C)CC(C)CCCCCCC MCULE-8010438575 [0,2,0,0,0,0|1,0,0]=3 1064 B12R0.4 CCCCCCCC(C)CC(=O)O MCULE-8785424338 [0,2,0,0,0,0|0,0,0]=2 1065 B12R0.4 CCCCCCCC(C)OC(=O)C MCULE-5744025046 [0,2,0,0,0,0|1,0,0]=3 1066 B12R0.4 CCCCCCCC(N)CC(=O)O MCULE-6703111524 [0,2,0,0,0,0|0,0,0]=2 1067 B12R0.4 CCCCCCCC(N)CC(=O)O MCULE-7291666407 [0,2,0,0,0,0|0,0,0]=2 1068 B12R0.4 CCCCCCCC(O)CC(=O)O MCULE-4360629497 [0,2,0,0,0,0|0,0,0]=2 1069 B12R0.4 CCCCCCCC(O)CC(C)C MCULE-5733681054 [0,2,0,0,0,0|1,0,1]=4 1070 B12R0.4 CCCCCCC[C@@H](O)CC(=O)O MCULE-9404172021 [0,2,0,0,0,0|0,0,0]=2 1071 B12R0.4 CCCCCCC[C@H](O)CC(=O)O MCULE-4030960180 [0,2,0,0,0,0|0,0,0]=2 1072 B12R0.4 CCCCCCOC(=O)CC(=O)C MCULE-9729311906 [0,2,0,0,0,0|1,0,1]=4 1073 B12R0.277 CCCC(=O)CCCCCC(=O)O MCULE-2592304646 [0,2,0,0,0,0|0,0,1]=3 1074 B12R0.277 CCCC(C)CCCCCC(=O)O MCULE-8094468025 [0,2,0,0,0,0|0,0,0]=2 1075 B12R0.277 CCCC(N)CCCCCC(=O)O MCULE-6921348147 [0,2,0,0,0,0|0,0,0]=2 1076 B12R0.277 CCOC(=O)CCCCCC(=O)C MCULE-9869285908 [0,2,0,0,0,0|1,0,1]=4 1077 B12R0.277 CCOC(=O)CCCCCC(=O)Cl MCULE-5720452434 [0,2,0,0,0,0|1,0,1]=4 1078 B12R0.277 CCOC(=O)CCCCCC(=O)O MCULE-3615439341 [0,2,0,0,0,0|1,0,1]=4 1079 B12R0.434 C=CCC(C)(C)CCCCCCC MCULE-9569887134 [0,2,0,0,0,0|1,0,0]=3 1080 B12R0.57 CCCCCCCCC(CC)CO MCULE-4207731459 [0,2,0,0,0,0|0,0,2]=4 1081 B12R0.57 CCCCCCCCC(OC)OC MCULE-1801269369 [0,2,0,0,0,0|2,0,0]=4 1082 B12R0.184 C=CC(O)CCCCCCC(=O)O MCULE-2198484452 [0,2,0,0,0,0|0,0,2]=4 1083 B12R0.184 CCC(=O)CCCCCCC(=O)O MCULE-4717498477 [0,2,0,0,0,0|0,0,1]=3 1084 B12R0.184 CCC(C)CCCCCCC(=O)O MCULE-2900681210 [0,2,0,0,0,0|0,0,0]=2 1085 B12R0.184 COC(=O)CCCCCCC(=O)Cl MCULE-8021290059 [0,2,0,0,0,0|1,0,1]=4 1086 B12R0.184 COC(=O)CCCCCCC(=O)O MCULE-9793115364 [0,2,0,0,0,0|1,0,1]=4 1087 B12R0.251 C=CCCCCCC[C@@H](N)C(=O)O MCULE-2799345068 [0,2,0,0,0,0|0,0,2]=4 1088 B12R0.251 C=CCCCCCC[C@@H](N)C(=O)O MCULE-9903243220 [0,2,0,0,0,0|0,0,2]=4 1089 B12R0.251 C=CCCCCCC[C@H](N)C(=O)O MCULE-2269405644 [0,2,0,0,0,0|0,0,2]=4 1090 B12R0.251 C=CCCCCCC[C@H](N)C(=O)O MCULE-9502690178 [0,2,0,0,0,0|0,0,2]=4 1091 B12R0.251 CCCCCCCCC(=C(F)F)F MCULE-6308736081 [0,2,0,0,0,0|1,0,1]=4 1092 B12R0.251 CCCCCCCCC(Br)C(=O)O MCULE-2249695757 [0,2,0,0,0,0|0,0,0]=2 1093 B12R0.251 CCCCCCCCC(C)C(=O)O MCULE-5055484783 [0,2,0,0,0,0|0,0,0]=2 1094 B12R0.251 CCCCCCCCC(N)C(=O)O MCULE-5147614071 [0,2,0,0,0,0|0,0,0]=2 1095 B12R0.251 CCCCCCCCC(O)C(=O)O MCULE-8352063977 [0,2,0,0,0,0|0,0,0]=2 1096 B12R0.251 CCCCCCCC[C@@H](C)C(=O)O MCULE-7683022827 [0,2,0,0,0,0|0,0,0]=2 1097 B12R0.251 CCCCCCCC[C@@H](N)C(=O)O MCULE-7339170439 [0,2,0,0,0,0|0,0,0]=2 1098 B12R0.251 CCCCCCCC[C@H](N)C(=O)O MCULE-4486967061 [0,2,0,0,0,0|0,0,0]=2 1099 B12R0.251 CCCCCCCC[C@H](N)C(=O)O MCULE-5097554565 [0,2,0,0,0,0|0,0,0]=2 1100 B12R0.251 CCCCCCCC[C@H](O)C(=O)O MCULE-8055488376 [0,2,0,0,0,0|0,0,0]=2 1101 B12R0.251 CCCCCCCC[C@H](O)C(=O)O MCULE-9794122537 [0,2,0,0,0,0|0,0,0]=2 1102 B12R0.251 CCCCCCCOC(C)C(=O)O MCULE-7189109747 [0,2,0,0,0,0|1,0,0]=3 1103 B12R0.251 [C@@H](N)(CCCCCCCC)C(=O)O MCULE-7027186088 [0,2,0,0,0,0|0,0,0]=2 1104 B12R0.312 C=CS(=O)(=O)CCCCCCCC MCULE-1033727057 [0,2,0,0,0,0|2,0,0]=4 1105 B12R0.312 C=C[Si](Cl)(Cl)CCCCCCCC MCULE-9501239126 [0,2,0,0,0,0|1,1,0]=4 1106 B12R0.95 CCCCC(=O)CCCCC(=O)O MCULE-6207970958 [0,2,0,0,0,0|0,0,1]=3 1107 B12R0.111 CCCCCCC(CBr)CCCC MCULE-7835474539 [0,2,0,0,0,0|1,0,1]=4 1108 B12R0.111 CCCCCCC(CN)CCCC MCULE-6128760964 [0,2,0,0,0,0|1,0,1]=4 1109 B12R0.111 CCCCCCC(CO)CCCC MCULE-4486658642 [0,2,0,0,0,0|1,0,1]=4 1110 B12R0.255 CCCCCCC(=O)CCC(=O)O MCULE-1506437124 [0,2,0,0,0,0|0,0,1]=3 1111 B12R0.255 CCCCCCC(O)CCC(=O)O MCULE-5591309975 [0,2,0,0,0,0|0,0,0]=2 1112 B12R0.255 CCCCCCC(O)CCC(=O)[O-] MCULE-4395510611 [0,2,0,0,0,0|0,0,0]=2 1113 B12R0.255 CCCCCCS(=O)CCC(=O)[O-] MCULE-1159145242 [0,2,0,0,0,0|1,0,0]=3 1114 B12R0.255 CCCCCCS(=O)CCC(=O)[O-] MCULE-6759587023 [0,2,0,0,0,0|1,0,0]=3 1115 B12R0.255 CCCCOCC(S)CNC(=O)N MCULE-2533024157 [0,2,0,0,0,0|2,0,0]=4 1116 B12R0.233 C=CCCCC(C)CCCC(C)C MCULE-6957174509 [0,2,0,0,0,0|1,0,0]=3 1117 B12R0.233 CC(C)CCCC(C)CCCCO MCULE-2297914249 [0,2,0,0,0,0|0,0,2]=4 1118 B12R0.233 CCCCCC(=O)CCCC(=O)O MCULE-7183792222 [0,2,0,0,0,0|0,0,1]=3 1119 B12R0.233 CCCCCC(=O)NCCC(=O)O MCULE-7265291580 [0,2,0,0,0,0|1,0,1]=4 1120 B12R0.233 CCCCCC(O)CCCC(=O)O MCULE-2335278488 [0,2,0,0,0,0|0,0,0]=2 1121 B12R0.233 CCCCCC(O)CCCC(=O)[O-] MCULE-7035156488 [0,2,0,0,0,0|0,0,0]=2 1122 B12R0.233 CCCCNC(=O)CCCC(=O)O MCULE-9110065966 [0,2,0,0,0,0|1,0,1]=4 1123 B12R0.119 CCCCCCCCCC(C)(C)S MCULE-3176642019 [0,2,0,0,0,0|0,1,1]=4 1124 B12R0.119 CCCCCCCCCC(F)(F)F MCULE-3213902129 [0,2,0,0,0,0|1,0,1]=4 1125 B12R0.119 CCCCCCCCCP(=O)(O)O MCULE-4052139199 [0,2,0,0,0,0|1,0,0]=3 1126 B12R0.119 CCCCCCCCCS(=O)(=O)Cl MCULE-8052966186 [0,2,0,0,0,0|1,0,0]=3 1127 B12R0.119 CCCCCCCCCS(=O)(=O)[O-] MCULE-1927567552 [0,2,0,0,0,0|1,0,0]=3 1128 B12R0.119 CCCCCCCCCS(=O)(=O)[O-] MCULE-3281419364 [0,2,0,0,0,0|1,0,0]=3 1129 B12R0.119 CCCCCCCCC[N+](C)(C)C MCULE-4520557522 [0,2,0,0,0,0|2,0,0]=4 1130 B12R0.119 CCCCCCCCC[N+](C)(C)C MCULE-7843133892 [0,2,0,0,0,0|2,0,0]=4 1131 B12R0.119 CCCCCCCCOP(=O)(C)C MCULE-5071482809 [0,2,0,0,0,0|2,0,0]=4 1132 B12R0.119 CCCCCCCCOP(=O)(Cl)Cl MCULE-2430760129 [0,2,0,0,0,0|2,0,0]=4 1133 B12R0.119 CCCCCCCCOP(=O)(O)O MCULE-5203489281 [0,2,0,0,0,0|2,0,0]=4 1134 B12R0.119 CCCCCCCCOS(=O)(=O)[O-] MCULE-5107186458 [0,2,0,0,0,0|2,0,0]=4 1135 B12R0.119 CCCCCCCCOS(=O)(=O)[O-] MCULE-8859174394 [0,2,0,0,0,0|2,0,0]=4 1136 B12R0.268 C=C(C)CCCCCCOC(=O)C MCULE-3590471537 [0,2,0,0,0,0|1,0,1]=4 1137 B12R0.268 CC(=O)CCCCCCCC(=O)O MCULE-5299092348 [0,2,0,0,0,0|0,0,1]=3 1138 B12R0.268 CC(C)CCCCCCCC(=O)O MCULE-5820446421 [0,2,0,0,0,0|0,0,0]=2 1139 B12R0.268 CC(C)SCCCCCCC(=O)O MCULE-2523005761 [0,2,0,0,0,0|1,0,0]=3 1140 B12R0.268 CC(O)CCCCCCCC(=O)O MCULE-2753582455 [0,2,0,0,0,0|0,0,0]=2 1141 B12R0.268 NC(=O)CCCCCCCC(=O)O MCULE-3125592334 [0,2,0,0,0,0|1,0,1]=4 1142 B12R0.268 O=C(Cl)CCCCCCCC(=O)Cl MCULE-9993434552 [0,2,0,0,0,0|1,0,1]=4 1143 B12R0.268 O=C(O)CCCCCCCC(=O)O MCULE-4093240509 [0,2,0,0,0,0|1,0,1]=4 1144 B10R1.4 C#CCC1CCCCC1=O MCULE-5207298577 [1,0,0,1,0,0|0,0,2]=4 1145 B10R1.4 C=CCC1CCCCC1=O MCULE-5192402567 [1,0,0,1,0,0|0,0,2]=4 1146 B10R1.4 C=CCC1CCCCC1N MCULE-4315709833 [1,0,0,1,0,0|1,0,1]=4 1147 B10R1.4 C=CCC1CCCCC1O MCULE-3098883814 [1,0,0,1,0,0|1,0,1]=4 1148 B10R1.4 CC1CCCCC1CCN MCULE-3335129206 [1,0,0,1,0,0|1,0,0]=3 1149 B10R1.4 CC1CCCCN1CCN MCULE-4480524507 [1,0,0,1,0,0|2,0,0]=4 1150 B10R1.4 CC1CCCCN1CCO MCULE-3413721569 [1,0,0,1,0,0|1,0,1]=4 1151 B10R1.4 CC1CCCNC1CCO MCULE-6750887095 [1,0,0,1,0,0|1,0,1]=4 1152 B10R1.4 CCCC1=CCCCC1=O MCULE-9765434554 [1,0,0,1,0,0|0,0,2]=4 1153 B10R1.4 CCCC1CCCCC1=O MCULE-3320705054 [1,0,0,1,0,0|0,0,0]=2 1154 B10R1.4 CCCC1CCCCC1N MCULE-5022700480 [1,0,0,1,0,0|1,0,0]=3 1155 B10R1.4 CCCC1CCCCC1O MCULE-7446006713 [1,0,0,1,0,0|0,0,1]=3 1156 B10R1.4 CCCC1CCCCN1C MCULE-6814041819 [1,0,0,1,0,0|1,0,1]=4 1157 B10R1.4 CCCC1NCCCC1C MCULE-4751690957 [1,0,0,1,0,0|1,0,1]=4 1158 B10R1.4 CCCC1NCCCC1C MCULE-6973288431 [1,0,0,1,0,0|1,0,1]=4 1159 B10R1.4 CCCC1NCCNC1=O MCULE-9907026950 [1,0,0,1,0,0|2,0,0]=4 1160 B10R1.4 CCCN1CCCCC1C MCULE-9681487051 [1,0,0,1,0,0|1,0,1]=4 1161 B10R1.4 CCCN1CCNCC1=O MCULE-6335276136 [1,0,0,1,0,0|2,0,0]=4 1162 B10R1.4 CCCN1CCNCC1=O MCULE-9352928130 [1,0,0,1,0,0|2,0,0]=4 1163 B10R1.4 CCC[C@H]1OCCC[C@@H]1O MCULE-6368727966 [1,0,0,1,0,0|1,0,1]=4 1164 B10R1.4 CCNC1CCCCC1O MCULE-2443480945 [1,0,0,1,0,0|1,0,1]=4 1165 B10R1.4 CCN[C@@H]1CCCC[C@H]1O MCULE-3866695986 [1,0,0,1,0,0|1,0,1]=4 1166 B10R1.4 CCN[C@@H]1CCCC[C@H]1O MCULE-9998369380 [1,0,0,1,0,0|1,0,1]=4 1167 B10R1.4 CCOC1CCCCC1=O MCULE-9251299042 [1,0,0,1,0,0|1,0,0]=3 1168 B10R1.4 CCOC1CCCCC1N MCULE-1243583797 [1,0,0,1,0,0|2,0,0]=4 1169 B10R1.4 CCOC1CCCCC1O MCULE-1477945543 [1,0,0,1,0,0|1,0,1]=4 1170 B10R1.4 CCSC1CCCCC1N MCULE-2852174649 [1,0,0,1,0,0|2,0,0]=4 1171 B10R1.4 CN1CCCCC1CCBr MCULE-3856508217 [1,0,0,1,0,0|2,0,0]=4 1172 B10R1.4 CN1CCCCC1CCBr MCULE-9865288112 [1,0,0,1,0,0|2,0,0]=4 1173 B10R1.4 CN1CCCCC1CCCl MCULE-3273219863 [1,0,0,1,0,0|2,0,0]=4 1174 B10R1.4 CN1CCCCC1CCCl MCULE-4749070501 [1,0,0,1,0,0|2,0,0]=4 1175 B10R1.4 CN1CCCCC1CCN MCULE-3050730553 [1,0,0,1,0,0|2,0,0]=4 1176 B10R1.4 CN1CCCCC1CCO MCULE-4857811656 [1,0,0,1,0,0|1,0,1]=4 1177 B10R1.4 CNCC1CCCCC1O MCULE-3103334855 [1,0,0,1,0,0|1,0,1]=4 1178 B10R1.4 N#CCC1CCCCC1=O MCULE-8137543980 [1,0,0,1,0,0|1,0,1]=4 1179 B10R1.4 NCCN1CCCCC1=O MCULE-1427901317 [1,0,0,1,0,0|2,0,0]=4 1180 B10R1.4 NCCN1CCCCC1=O MCULE-6448945987 [1,0,0,1,0,0|2,0,0]=4 1181 B10R1.4 NCCN1CCCCC1=O MCULE-9599542364 [1,0,0,1,0,0|2,0,0]=4 1182 B10R1.4 O=C1CCCCN1CCO MCULE-2557885455 [1,0,0,1,0,0|2,0,0]=4 1183 B10R1.4 O=C1NCCCC1CCO MCULE-7839494483 [1,0,0,1,0,0|2,0,0]=4 1184 B10R1.5 CCCC1CCCC1CN MCULE-4555488401 [1,0,0,1,0,0|1,0,0]=3 1185 B10R1.5 CCCC1CCCC1CN MCULE-7754450722 [1,0,0,1,0,0|1,0,0]=3 1186 B10R1.5 CCCN1CCC[C@H]1CN MCULE-2601229741 [1,0,0,1,0,0|2,0,0]=4 1187 B10R1.5 COCC1CCCN1C=O MCULE-7280935888 [1,0,0,1,0,0|2,0,0]=4 1188 B10R1.5 COC[C@@H]1CCCN1C=O MCULE-1646250924 [1,0,0,1,0,0|2,0,0]=4 1189 B10R1.5 COC[C@@H]1CCCN1C=O MCULE-4654959513 [1,0,0,1,0,0|2,0,0]=4 1190 B10R1.5 COC[C@H]1CCCN1C=O MCULE-1806468932 [1,0,0,1,0,0|2,0,0]=4 1191 B10R1.5 COC[C@H]1CCCN1C=O MCULE-3639368907 [1,0,0,1,0,0|2,0,0]=4 1192 B10R1.7 CC1CCCCCCC1=O MCULE-5002473983 [1,0,0,1,0,0|0,0,0]=2 1193 B10R1.7 NC1CCCCCCC1O MCULE-9142911119 [1,0,0,1,0,0|1,0,1]=4 1194 B10R1.7 N[C@@H]1CCCCCC[C@@H]1O MCULE-1728493798 [1,0,0,1,0,0|1,0,1]=4 1195 B10R1.7 N[C@@H]1CCCCCC[C@H]1O MCULE-8702565765 [1,0,0,1,0,0|1,0,1]=4 1196 B10R1.7 N[C@H]1CCCCCC[C@@H]1O MCULE-4894585058 [1,0,0,1,0,0|1,0,1]=4 1197 B10R1.7 N[C@H]1CCCCCC[C@H]1O MCULE-3214389652 [1,0,0,1,0,0|1,0,1]=4 1198 B10R1.7 O=C1NCCCCCC1I MCULE-6621175147 [1,0,0,1,0,0|2,0,0]=4 1199 B10R1.7 OC1CCCCCCC1O MCULE-4573160076 [1,0,0,1,0,0|1,0,1]=4 1200 B10R1.7 O[C@H]1CCCCCC[C@H]1O MCULE-3578348851 [1,0,0,1,0,0|1,0,1]=4 1201 B10R1.17 BrCCCC1CCCCC1 MCULE-3138331756 [1,0,0,1,0,0|1,0,0]=3 1202 B10R1.17 BrCCCC1CCOCC1 MCULE-5395293889 [1,0,0,1,0,0|2,0,0]=4 1203 B10R1.17 BrCCCN1CCCCC1 MCULE-2209895485 [1,0,0,1,0,0|2,0,0]=4 1204 B10R1.17 BrCCCN1CCCCC1 MCULE-6850782818 [1,0,0,1,0,0|2,0,0]=4 1205 B10R1.17 BrCCOC1CCCCC1 MCULE-5702602298 [1,0,0,1,0,0|2,0,0]=4 1206 B10R1.17 BrCCSC1CCCCC1 MCULE-1994150622 [1,0,0,1,0,0|2,0,0]=4 1207 B10R1.17 C#CCCC1CCCCC1 MCULE-2956732689 [1,0,0,1,0,0|0,0,2]=4 1208 B10R1.17 C=CCNC1CCCCC1 MCULE-2585284590 [1,0,0,1,0,0|1,0,1]=4 1209 B10R1.17 CCCCC1CCCCC1 MCULE-2568850283 [1,0,0,1,0,0|0,0,1]=3 1210 B10R1.17 CCCCC1CCCCN1 MCULE-1100697619 [1,0,0,1,0,0|1,0,0]=3 1211 B10R1.17 CCCCC1CCCCN1 MCULE-8604986429 [1,0,0,1,0,0|1,0,0]=3 1212 B10R1.17 CCCCC1CCCNC1 MCULE-2755229629 [1,0,0,1,0,0|1,0,1]=4 1213 B10R1.17 CCCCC1CCCNC1 MCULE-8332785679 [1,0,0,1,0,0|1,0,1]=4 1214 B10R1.17 CCCCC1CCNCC1 MCULE-5497896254 [1,0,0,1,0,0|1,0,1]=4 1215 B10R1.17 CCCCC1CCNCC1 MCULE-6983922572 [1,0,0,1,0,0|1,0,1]=4 1216 B10R1.17 CCCCN1CCCCC1 MCULE-8831246877 [1,0,0,1,0,0|1,0,1]=4 1217 B10R1.17 CCCNC1CCCCC1 MCULE-1638695988 [1,0,0,1,0,0|1,0,1]=4 1218 B10R1.17 CCCNC1CCCCC1 MCULE-9064160511 [1,0,0,1,0,0|1,0,1]=4 1219 B10R1.17 CCCOC1CCCCO1 MCULE-5501679825 [1,0,0,1,0,0|1,0,1]=4 1220 B10R1.17 CCNCC1CCCCC1 MCULE-1647475331 [1,0,0,1,0,0|1,0,1]=4 1221 B10R1.17 CCNCC1CCCCC1 MCULE-6498702629 [1,0,0,1,0,0|1,0,1]=4 1222 B10R1.17 CCNCC1CCCCO1 MCULE-2963268801 [1,0,0,1,0,0|1,0,1]=4 1223 B10R1.17 CCNCC1CCCCO1 MCULE-3483111447 [1,0,0,1,0,0|1,0,1]=4 1224 B10R1.17 CCOCC1CCCCN1 MCULE-5998981324 [1,0,0,1,0,0|2,0,0]=4 1225 B10R1.17 CCOCC1CCCCN1 MCULE-8699335838 [1,0,0,1,0,0|2,0,0]=4 1226 B10R1.17 CNCCC1CCCCC1 MCULE-9916111513 [1,0,0,1,0,0|1,0,1]=4 1227 B10R1.17 CNCCC1CCCCO1 MCULE-4536076135 [1,0,0,1,0,0|1,0,1]=4 1228 B10R1.17 CNCCC1CCCCO1 MCULE-9123549746 [1,0,0,1,0,0|1,0,1]=4 1229 B10R1.17 COCCC1CCCCN1 MCULE-4851205306 [1,0,0,1,0,0|2,0,0]=4 1230 B10R1.17 COCCC1CCCCN1 MCULE-9206077882 [1,0,0,1,0,0|2,0,0]=4 1231 B10R1.17 ClCCCC1CCCCC1 MCULE-9703542324 [1,0,0,1,0,0|1,0,0]=3 1232 B10R1.17 ClCCCN1CCCCC1 MCULE-3923882354 [1,0,0,1,0,0|2,0,0]=4 1233 B10R1.17 ClCCCN1CCCCC1 MCULE-4945257002 [1,0,0,1,0,0|2,0,0]=4 1234 B10R1.17 ClCCOC1CCCCC1 MCULE-1592615613 [1,0,0,1,0,0|2,0,0]=4 1235 B10R1.17 ClCCSC1CCCCC1 MCULE-4569120853 [1,0,0,1,0,0|2,0,0]=4 1236 B10R1.17 ICCCC1CCCCC1 MCULE-3721842593 [1,0,0,1,0,0|1,0,0]=3 1237 B10R1.17 N#CCCC1CCCCC1 MCULE-1308152967 [1,0,0,1,0,0|1,0,1]=4 1238 B10R1.17 NCCCC1CCCCC1 MCULE-6337829624 [1,0,0,1,0,0|1,0,0]=3 1239 B10R1.17 NCCCC1CCCCC1 MCULE-8205690727 [1,0,0,1,0,0|1,0,0]=3 1240 B10R1.17 NCCCC1CCCCO1 MCULE-8380034501 [1,0,0,1,0,0|1,0,1]=4 1241 B10R1.17 NCCCC1CCCNC1 MCULE-1939938811 [1,0,0,1,0,0|2,0,0]=4 1242 B10R1.17 NCCCC1CCCNC1 MCULE-4530553976 [1,0,0,1,0,0|2,0,0]=4 1243 B10R1.17 NCCCC1CCNCC1 MCULE-7762699076 [1,0,0,1,0,0|2,0,0]=4 1244 B10R1.17 NCCCC1CCOCC1 MCULE-3825722061 [1,0,0,1,0,0|2,0,0]=4 1245 B10R1.17 NCCCC1CCOCC1 MCULE-7895457492 [1,0,0,1,0,0|2,0,0]=4 1246 B10R1.17 NCCCN1CCCCC1 MCULE-1851117442 [1,0,0,1,0,0|2,0,0]=4 1247 B10R1.17 NCCCN1CCCCC1 MCULE-3048721420 [1,0,0,1,0,0|2,0,0]=4 1248 B10R1.17 NCCNC1CCCCC1 MCULE-5255437259 [1,0,0,1,0,0|2,0,0]=4 1249 B10R1.17 NCCOC1CCCCC1 MCULE-6094788525 [1,0,0,1,0,0|2,0,0]=4 1250 B10R1.17 NCCOC1CCCCC1 MCULE-7825800002 [1,0,0,1,0,0|2,0,0]=4 1251 B10R1.17 NCCSC1CCCCC1 MCULE-4703376485 [1,0,0,1,0,0|2,0,0]=4 1252 B10R1.17 NNCCC1CCCCC1 MCULE-1394503563 [1,0,0,1,0,0|2,0,0]=4 1253 B10R1.17 NNCCC1CCCCC1 MCULE-2159579511 [1,0,0,1,0,0|2,0,0]=4 1254 B10R1.17 NOCCC1CCCCC1 MCULE-8421298103 [1,0,0,1,0,0|2,0,0]=4 1255 B10R1.17 NOCCC1CCCCC1 MCULE-8505614906 [1,0,0,1,0,0|2,0,0]=4 1256 B10R1.17 O=C=NCC1CCCCC1 MCULE-8641797577 [1,0,0,1,0,0|1,0,1]=4 1257 B10R1.17 O=CC=CC1CCCCC1 MCULE-6888009707 [1,0,0,1,0,0|0,0,2]=4 1258 B10R1.17 O=CCCC1CCCCC1 MCULE-7542460978 [1,0,0,1,0,0|0,0,0]=2 1259 B10R1.17 O=CCCC1CCOCC1 MCULE-9926976903 [1,0,0,1,0,0|1,0,0]=3 1260 B10R1.17 O=CCCN1CCCCC1 MCULE-1060522965 [1,0,0,1,0,0|1,0,0]=3 1261 B10R1.17 O=CCCN1CCOCC1 MCULE-6110490684 [1,0,0,1,0,0|2,0,0]=4 1262 B10R1.17 O=CCOC1CCCCC1 MCULE-6729274923 [1,0,0,1,0,0|1,0,0]=3 1263 B10R1.17 O=CCOC1CCCCO1 MCULE-5185852140 [1,0,0,1,0,0|2,0,0]=4 1264 B10R1.17 O=CCOC1CCOCC1 MCULE-9271510143 [1,0,0,1,0,0|2,0,0]=4 1265 B10R1.17 OCCCC1CCCCC1 MCULE-6307495993 [1,0,0,1,0,0|0,0,1]=3 1266 B10R1.17 OCCCC1CCCCN1 MCULE-4753823032 [1,0,0,1,0,0|1,0,1]=4 1267 B10R1.17 OCCCC1CCCCN1 MCULE-7684357711 [1,0,0,1,0,0|1,0,1]=4 1268 B10R1.17 OCCCC1CCCCO1 MCULE-8974781617 [1,0,0,1,0,0|1,0,1]=4 1269 B10R1.17 OCCCC1CCCNC1 MCULE-5587440064 [1,0,0,1,0,0|1,0,1]=4 1270 B10R1.17 OCCCC1CCNCC1 MCULE-8103308194 [1,0,0,1,0,0|1,0,1]=4 1271 B10R1.17 OCCCC1CCNCC1 MCULE-9288109884 [1,0,0,1,0,0|1,0,1]=4 1272 B10R1.17 OCCCC1CCOCC1 MCULE-4181244746 [1,0,0,1,0,0|1,0,1]=4 1273 B10R1.17 OCCCN1CCCCC1 MCULE-8412207622 [1,0,0,1,0,0|1,0,1]=4 1274 B10R1.17 OCCNC1CCCCC1 MCULE-7503084631 [1,0,0,1,0,0|1,0,1]=4 1275 B10R1.17 OCCOC1CCCCC1 MCULE-9282353409 [1,0,0,1,0,0|1,0,1]=4 1276 B10R1.19 CCC1CCCCCC1=O MCULE-8032779658 [1,0,0,1,0,0|0,0,0]=2 1277 B10R1.19 CCC1NCCCNC1=O MCULE-3991998861 [1,0,0,1,0,0|2,0,0]=4 1278 B10R1.19 CCN1CCCNCC1=O MCULE-3571024405 [1,0,0,1,0,0|2,0,0]=4 1279 B10R1.19 CCN1CCCNCC1=O MCULE-4254439389 [1,0,0,1,0,0|2,0,0]=4 1280 B10R1.19 CCN1CCNCCC1=O MCULE-7164789319 [1,0,0,1,0,0|2,0,0]=4 1281 B10R1.19 CCN1CCNCCC1=O MCULE-9020529314 [1,0,0,1,0,0|2,0,0]=4 1282 B10R1.19 CC[C@@H]1NCCCNC1=O MCULE-5830249410 [1,0,0,1,0,0|2,0,0]=4 1283 B10R1.19 CC[C@H]1NCCCNC1=O MCULE-4266677415 [1,0,0,1,0,0|2,0,0]=4 1284 B10R1.19 CN1CCCCCC1CN MCULE-6708625209 [1,0,0,1,0,0|2,0,0]=4 1285 B10R1.19 COC1CCCCCC1N MCULE-5223841003 [1,0,0,1,0,0|2,0,0]=4 1286 B10R1.19 N#CC1CCCCCC1=O MCULE-1907886746 [1,0,0,1,0,0|1,0,1]=4 1287 B10R1.19 NC1CCCCCC1CO MCULE-2803910179 [1,0,0,1,0,0|1,0,1]=4 1288 B10R1.19 NCC1CCCCNC1=O MCULE-1946763373 [1,0,0,1,0,0|2,0,0]=4 1289 B10R1.19 NCC1CCCCNC1=O MCULE-4514221590 [1,0,0,1,0,0|2,0,0]=4 1290 B10R1.19 O=C1CCCCCN1CO MCULE-8622356666 [1,0,0,1,0,0|2,0,0]=4 1291 B10R1.19 O=C1NCCCCC1CBr MCULE-4441145418 [1,0,0,1,0,0|2,0,0]=4 1292 B10R1.19 O=C1NCCCCC1CO MCULE-8501668247 [1,0,0,1,0,0|2,0,0]=4 1293 B10R1.19 O=CC1CCCCCC1Cl MCULE-2719076051 [1,0,0,1,0,0|1,0,0]=3 1294 B10R1.20 CCC1CCCCC1C=O MCULE-1484578990 [1,0,0,1,0,0|0,0,0]=2 1295 B10R1.20 CCC1CCCCC1CN MCULE-1374247015 [1,0,0,1,0,0|1,0,0]=3 1296 B10R1.20 CCC1CCCCC1CN MCULE-2869403995 [1,0,0,1,0,0|1,0,0]=3 1297 B10R1.20 CCC1CCCCC1NC MCULE-5620204313 [1,0,0,1,0,0|1,0,1]=4 1298 B10R1.20 CCC1CCCCN1CC MCULE-8729624034 [1,0,0,1,0,0|1,0,1]=4 1299 B10R1.20 CCN1CCCCC1CN MCULE-5949277169 [1,0,0,1,0,0|2,0,0]=4 1300 B10R1.20 CCN1CCCCC1CO MCULE-9707891464 [1,0,0,1,0,0|1,0,1]=4 1301 B10R1.20 COC1CCCCC1CO MCULE-2988894861 [1,0,0,1,0,0|1,0,1]=4 1302 B10R1.20 COC1CCCCN1C=O MCULE-6015330788 [1,0,0,1,0,0|2,0,0]=4 1303 B10R1.20 OCC1CCCCC1CO MCULE-8066977999 [1,0,0,1,0,0|1,0,1]=4 1304 B10R1.20 OC[C@@H]1CCCC[C@H]1CO MCULE-2394544180 [1,0,0,1,0,0|1,0,1]=4 1305 B10R1.20 OC[C@@H]1CCCC[C@H]1CO MCULE-2693534916 [1,0,0,1,0,0|1,0,1]=4 1306 B10R1.20 OC[C@H]1CCCC[C@@H]1CO MCULE-3855557555 [1,0,0,1,0,0|1,0,1]=4 1307 B10R1.20 OC[C@H]1CCCC[C@@H]1CO MCULE-5406023810 [1,0,0,1,0,0|1,0,1]=4 1308 B10R1.20 OC[C@H]1CCCC[C@@H]1CO MCULE-9792878219 [1,0,0,1,0,0|1,0,1]=4 1309 B10R1.20 OC[C@H]1CCCC[C@H]1CO MCULE-3342954422 [1,0,0,1,0,0|1,0,1]=4 1310 B10R1.21 BrCCCCN1CCCC1 MCULE-2533747776 [1,0,0,1,0,0|2,0,0]=4 1311 B10R1.21 BrCCCCN1CCCC1 MCULE-8041818580 [1,0,0,1,0,0|2,0,0]=4 1312 B10R1.21 BrCCOCC1CCCC1 MCULE-4073613841 [1,0,0,1,0,0|2,0,0]=4 1313 B10R1.21 C=CCCNC1CCCC1 MCULE-9451351907 [1,0,0,1,0,0|1,0,1]=4 1314 B10R1.21 CCCCCC1CCCC1 MCULE-2927062716 [1,0,0,1,0,0|0,0,1]=3 1315 B10R1.21 CCCCCC1OCCO1 MCULE-1814222548 [1,0,0,1,0,0|1,0,1]=4 1316 B10R1.21 CCCCNC1CCCC1 MCULE-8673317997 [1,0,0,1,0,0|1,0,1]=4 1317 B10R1.21 CCCCNC1CCCC1 MCULE-9964395388 [1,0,0,1,0,0|1,0,1]=4 1318 B10R1.21 CCCNCC1CCCO1 MCULE-4700464282 [1,0,0,1,0,0|1,0,1]=4 1319 B10R1.21 CNCCCC1CCCC1 MCULE-4994722322 [1,0,0,1,0,0|1,0,1]=4 1320 B10R1.21 CNCCCC1CCCC1 MCULE-8583851497 [1,0,0,1,0,0|1,0,1]=4 1321 B10R1.21 CNCCCC1CCCO1 MCULE-6662766860 [1,0,0,1,0,0|1,0,1]=4 1322 B10R1.21 NCCCCC1CCCC1 MCULE-2916392587 [1,0,0,1,0,0|1,0,0]=3 1323 B10R1.21 NCCCCC1CCCO1 MCULE-5459645657 [1,0,0,1,0,0|1,0,1]=4 1324 B10R1.21 NCCCCC1CCCO1 MCULE-7012525648 [1,0,0,1,0,0|1,0,1]=4 1325 B10R1.21 NCCCCN1CCCC1 MCULE-5156019842 [1,0,0,1,0,0|2,0,0]=4 1326 B10R1.21 NCCCOC1CCCC1 MCULE-3261227616 [1,0,0,1,0,0|2,0,0]=4 1327 B10R1.21 NCCOCC1CCCC1 MCULE-7557950609 [1,0,0,1,0,0|2,0,0]=4 1328 B10R1.21 O=CCCCC1OCCO1 MCULE-3822312994 [1,0,0,1,0,0|2,0,0]=4 1329 B10R1.21 O=CCCOC1CCCC1 MCULE-7685598743 [1,0,0,1,0,0|1,0,0]=3 1330 B10R1.21 O=CCOCC1CCCC1 MCULE-2137455007 [1,0,0,1,0,0|1,0,0]=3 1331 B10R1.21 OCCCCC1CCCC1 MCULE-2531889942 [1,0,0,1,0,0|0,0,1]=3 1332 B10R1.21 OCCCCC1CCCO1 MCULE-4507968926 [1,0,0,1,0,0|1,0,1]=4 1333 B10R1.21 OCCCCN1CCCC1 MCULE-1882081510 [1,0,0,1,0,0|1,0,1]=4 1334 B10R1.21 OCCCNC1CCCC1 MCULE-8914483355 [1,0,0,1,0,0|1,0,1]=4 1335 B10R1.21 OCCCOC1CCCC1 MCULE-7184062888 [1,0,0,1,0,0|1,0,1]=4 1336 B10R1.21 OCCOCC1CCCC1 MCULE-2133060843 [1,0,0,1,0,0|1,0,1]=4 1337 B10R1.29 CC1CCCC1NCCO MCULE-3863073293 [1,0,0,1,0,0|1,0,1]=4 1338 B10R1.29 CCCCC1=CCCC1=O MCULE-3298793962 [1,0,0,1,0,0|0,0,2]=4 1339 B10R1.29 CCCCC1CCCC1=O MCULE-7853231747 [1,0,0,1,0,0|0,0,0]=2 1340 B10R1.29 CCCCC1CCCC1N MCULE-4431843178 [1,0,0,1,0,0|1,0,0]=3 1341 B10R1.29 CCCCN1CCCC1=O MCULE-4214883053 [1,0,0,1,0,0|1,0,0]=3 1342 B10R1.29 CCOCC1CCCC1=O MCULE-9114631954 [1,0,0,1,0,0|1,0,0]=3 1343 B10R1.29 CN1CCCC1CCCO MCULE-9622016302 [1,0,0,1,0,0|1,0,1]=4 1344 B10R1.29 CNCCN1CCCC1=O MCULE-4360482877 [1,0,0,1,0,0|2,0,0]=4 1345 B10R1.29 CNCCN1CCCC1=O MCULE-6909271074 [1,0,0,1,0,0|2,0,0]=4 1346 B10R1.29 COCCC1CCCC1=O MCULE-3820027368 [1,0,0,1,0,0|1,0,0]=3 1347 B10R1.29 COCCC1CCNC1=O MCULE-3116351154 [1,0,0,1,0,0|2,0,0]=4 1348 B10R1.29 COCOC1CCCC1=O MCULE-4014159200 [1,0,0,1,0,0|2,0,0]=4 1349 B10R1.29 N#CCCC1CCCC1=O MCULE-5481171300 [1,0,0,1,0,0|1,0,1]=4 1350 B10R1.29 NCCCC1CCCC1O MCULE-3919877654 [1,0,0,1,0,0|1,0,1]=4 1351 B10R1.29 NCCCC1CCOC1=O MCULE-4266690176 [1,0,0,1,0,0|2,0,0]=4 1352 B10R1.29 NCCCC1CCOC1=O MCULE-9834041839 [1,0,0,1,0,0|2,0,0]=4 1353 B10R1.29 NCCCN1CCCC1=O MCULE-7525290934 [1,0,0,1,0,0|2,0,0]=4 1354 B10R1.29 O=C1CCCC1CCCF MCULE-9345325426 [1,0,0,1,0,0|1,0,0]=3 1355 B10R1.29 O=C1CCCN1CCCCl MCULE-6294076675 [1,0,0,1,0,0|2,0,0]=4 1356 B10R1.29 O=C1CCCN1CCCO MCULE-5493768478 [1,0,0,1,0,0|2,0,0]=4 1357 B10R1.57 OCCCNCC1CCC1 MCULE-8121544435 [1,0,0,1,0,0|1,0,1]=4 1358 B10R1.78 O=C1CCCCCCCC1 MCULE-1205201333 [1,0,0,1,0,0|0,0,0]=2 1359 B10R1.78 O=C1CCCCCCCN1 MCULE-2754830482 [1,0,0,1,0,0|1,0,0]=3 1360 B10R1.78 O=C1CCCCCCCO1 MCULE-8839309567 [1,0,0,1,0,0|1,0,0]=3 1361 B10R1.85 BrCCC1CCCCCC1 MCULE-9479740717 [1,0,0,1,0,0|1,0,0]=3 1362 B10R1.85 C=CCC1CCCCCC1 MCULE-7344516120 [1,0,0,1,0,0|0,0,1]=3 1363 B10R1.85 CCCC1CCCNCC1 MCULE-7394611167 [1,0,0,1,0,0|1,0,1]=4 1364 B10R1.85 CCCC1OCCCCO1 MCULE-5285924074 [1,0,0,1,0,0|1,0,1]=4 1365 B10R1.85 CCNC1CCCCCC1 MCULE-8007459961 [1,0,0,1,0,0|1,0,1]=4 1366 B10R1.85 CNCC1CCCCCC1 MCULE-9325217457 [1,0,0,1,0,0|1,0,1]=4 1367 B10R1.85 ClCCN1CCCCCC1 MCULE-2255479604 [1,0,0,1,0,0|2,0,0]=4 1368 B10R1.85 ClCC[NH+]1CCCCCC1 MCULE-7385330161 [1,0,0,1,0,0|2,0,0]=4 1369 B10R1.85 NCCC1=CCCCCC1 MCULE-4125734570 [1,0,0,1,0,0|1,0,1]=4 1370 B10R1.85 NCCC1=CCCCCC1 MCULE-6059430273 [1,0,0,1,0,0|1,0,1]=4 1371 B10R1.85 NCCC1CCCCCC1 MCULE-1371543041 [1,0,0,1,0,0|1,0,0]=3 1372 B10R1.85 NCCC1CCCCCC1 MCULE-3740795020 [1,0,0,1,0,0|1,0,0]=3 1373 B10R1.85 NCCN1CCCCCC1 MCULE-2687009665 [1,0,0,1,0,0|2,0,0]=4 1374 B10R1.85 NCCN1CCCCCC1 MCULE-6108994261 [1,0,0,1,0,0|2,0,0]=4 1375 B10R1.85 NCCN1CCCCCC1 MCULE-6205939372 [1,0,0,1,0,0|2,0,0]=4 1376 B10R1.85 O=C=NC1CCCCCC1 MCULE-1717120909 [1,0,0,1,0,0|1,0,1]=4 1377 B10R1.85 O=CCC1CCCCCC1 MCULE-6382907203 [1,0,0,1,0,0|0,0,0]=2 1378 B10R1.85 OCCC1CCCCCC1 MCULE-9936994835 [1,0,0,1,0,0|0,0,1]=3 1379 B10R1.85 OCCC1CCCCCN1 MCULE-7960769906 [1,0,0,1,0,0|1,0,1]=4 1380 B10R1.85 OCCC1CCCCCN1 MCULE-8951609776 [1,0,0,1,0,0|1,0,1]=4 1381 B10R1.85 OCCC1CCCNCC1 MCULE-1518082087 [1,0,0,1,0,0|1,0,1]=4 1382 B10R1.85 OCCN1CCCCCC1 MCULE-5823768484 [1,0,0,1,0,0|1,0,1]=4 1383 B10R1.161 C=CC1CCCCCCC1 MCULE-4062427042 [1,0,0,1,0,0|0,0,1]=3 1384 B10R1.161 CNC1CCCCCCC1 MCULE-2172886818 [1,0,0,1,0,0|1,0,1]=4 1385 B10R1.161 CNC1CCCCCCC1 MCULE-2549730402 [1,0,0,1,0,0|1,0,1]=4 1386 B10R1.161 COC1=CCCCCCC1 MCULE-3500334234 [1,0,0,1,0,0|1,0,1]=4 1387 B10R1.161 COC1=CCCCCCC1 MCULE-4140921077 [1,0,0,1,0,0|1,0,1]=4 1388 B10R1.161 N#CC1CCCCCCC1 MCULE-8673985853 [1,0,0,1,0,0|1,0,1]=4 1389 B10R1.161 NCC1CCCCCCC1 MCULE-9635361503 [1,0,0,1,0,0|1,0,0]=3 1390 B10R1.161 O=CC1=CCCCCCC1 MCULE-3035020921 [1,0,0,1,0,0|0,0,2]=4 1391 B10R1.161 O=CC1=CCCCCCC1 MCULE-5359478815 [1,0,0,1,0,0|0,0,2]=4 1392 B10R1.161 O=CC1CCCCCCC1 MCULE-6277104874 [1,0,0,1,0,0|0,0,0]=2 1393 B10R1.161 O=NN1CCCCCCC1 MCULE-4918563903 [1,0,0,1,0,0|2,0,0]=4 1394 B10R1.161 OCC1CCCCCCC1 MCULE-1512335429 [1,0,0,1,0,0|0,0,1]=3 1395 B10R1.177 BrCCCCCCC1CO1 MCULE-4242614416 [1,0,0,1,0,0|1,0,1]=4 1396 B10R1.177 CCCCCOCC1CO1 MCULE-3592121965 [1,0,0,1,0,0|1,0,1]=4 1397 B10R1.177 OCCCCNCC1CC1 MCULE-2331269117 [1,0,0,1,0,0|1,0,1]=4 1398 B10R1.185 C1CCCCNCCCC1 MCULE-8151021132 [1,0,0,1,0,0|1,0,0]=3 1399 B12R1.8 BrCCCCCN1CCCCC1 MCULE-3804322574 [0,1,0,1,0,0|1,0,1]=4 1400 B12R1.8 BrCCCCCN1CCCCC1 MCULE-4019879158 [0,1,0,1,0,0|1,0,1]=4 1401 B12R1.8 BrCCCCOC1CCCCC1 MCULE-5833376984 [0,1,0,1,0,0|1,0,1]=4 1402 B12R1.8 C=CCCCCC1CCCCC1 MCULE-1420996147 [0,1,0,1,0,0|1,0,0]=3 1403 B12R1.8 C=CCCCOC1CCCCO1 MCULE-4661795005 [0,1,0,1,0,0|2,0,0]=4 1404 B12R1.8 C=CCCCOC1CCCNC1 MCULE-2546068759 [0,1,0,1,0,0|2,0,0]=4 1405 B12R1.8 C=CCCCOC1CCCNC1 MCULE-7029929169 [0,1,0,1,0,0|2,0,0]=4 1406 B12R1.8 C=CCCCOC1CCNCC1 MCULE-2388234125 [0,1,0,1,0,0|2,0,0]=4 1407 B12R1.8 C=CCCCOC1CCNCC1 MCULE-6017547784 [0,1,0,1,0,0|2,0,0]=4 1408 B12R1.8 C=CCOCCC1CCCCN1 MCULE-3208226255 [0,1,0,1,0,0|2,0,0]=4 1409 B12R1.8 C=CCOCCC1CCCCN1 MCULE-5767070473 [0,1,0,1,0,0|2,0,0]=4 1410 B12R1.8 C=CCOCCC1CCCNC1 MCULE-1147857217 [0,1,0,1,0,0|2,0,0]=4 1411 B12R1.8 C=CCOCCC1CCCNC1 MCULE-7362595979 [0,1,0,1,0,0|2,0,0]=4 1412 B12R1.8 C=CCOCCC1CCNCC1 MCULE-6001428759 [0,1,0,1,0,0|2,0,0]=4 1413 B12R1.8 C=CCOCCC1CCNCC1 MCULE-9499636665 [0,1,0,1,0,0|2,0,0]=4 1414 B12R1.8 CCCCCCC1CCCCC1 MCULE-5596413302 [0,1,0,1,0,0|1,0,1]=4 1415 B12R1.8 CCCCCCC1CCCCN1 MCULE-4953489742 [0,1,0,1,0,0|1,0,1]=4 1416 B12R1.8 CCCCCCC1CCCCN1 MCULE-7758843685 [0,1,0,1,0,0|1,0,1]=4 1417 B12R1.8 CCCCCCC1CCCNC1 MCULE-3360628584 [0,1,0,1,0,0|1,0,1]=4 1418 B12R1.8 CCCCCCC1CCCNC1 MCULE-4345567859 [0,1,0,1,0,0|1,0,1]=4 1419 B12R1.8 CCCCCCC1CCNCC1 MCULE-4909056113 [0,1,0,1,0,0|1,0,1]=4 1420 B12R1.8 CCCCCCC1CCNCC1 MCULE-5114194414 [0,1,0,1,0,0|1,0,1]=4 1421 B12R1.8 CCCCCOC1CCCNC1 MCULE-2727859866 [0,1,0,1,0,0|2,0,0]=4 1422 B12R1.8 CCCCCOC1CCCNC1 MCULE-8751831897 [0,1,0,1,0,0|2,0,0]=4 1423 B12R1.8 CCCCOCC1CCCNC1 MCULE-8990874136 [0,1,0,1,0,0|2,0,0]=4 1424 B12R1.8 CCCCOCC1CCCNC1 MCULE-9744445993 [0,1,0,1,0,0|2,0,0]=4 1425 B12R1.8 CCCOCCC1CCCCN1 MCULE-3027895137 [0,1,0,1,0,0|1,0,1]=4 1426 B12R1.8 CCCOCCC1CCCCN1 MCULE-9164772502 [0,1,0,1,0,0|1,0,1]=4 1427 B12R1.8 CCCOCCC1CCCNC1 MCULE-5786080743 [0,1,0,1,0,0|2,0,0]=4 1428 B12R1.8 CCCOCCC1CCCNC1 MCULE-9769817414 [0,1,0,1,0,0|2,0,0]=4 1429 B12R1.8 CNCCCCN1CCCCC1 MCULE-6665875710 [0,1,0,1,0,0|2,0,0]=4 1430 B12R1.8 CNCCCNC1CCCCC1 MCULE-1606901160 [0,1,0,1,0,0|2,0,0]=4 1431 B12R1.8 COCCNCC1CCCCC1 MCULE-2366600296 [0,1,0,1,0,0|2,0,0]=4 1432 B12R1.8 COCCNCC1CCCCC1 MCULE-6797211118 [0,1,0,1,0,0|2,0,0]=4 1433 B12R1.8 N#CCCCCN1CCCCC1 MCULE-3117186695 [0,1,0,1,0,0|1,0,1]=4 1434 B12R1.8 N#CCCCNC1CCCCC1 MCULE-5533357168 [0,1,0,1,0,0|1,0,1]=4 1435 B12R1.8 NCCCCCN1CCCCC1 MCULE-3062074306 [0,1,0,1,0,0|1,0,1]=4 1436 B12R1.8 O=CNOCCN1CCCCC1 MCULE-7516763445 [0,1,0,1,0,0|2,0,0]=4 1437 B12R1.8 OCCCCCN1CCCCC1 MCULE-3016698326 [0,1,0,1,0,0|0,0,2]=4 1438 B12R1.8 OCCCCNC1CCCCC1 MCULE-2543962577 [0,1,0,1,0,0|0,0,2]=4 1439 B12R1.8 OCCCNCC1CCCCC1 MCULE-2206880526 [0,1,0,1,0,0|0,0,2]=4 1440 B12R1.8 OCCCOCC1CCCCC1 MCULE-5047368988 [0,1,0,1,0,0|0,0,2]=4 1441 B12R1.18 CCCCN1CCCCCC1=O MCULE-2860927768 [0,1,0,1,0,0|0,0,0]=2 1442 B12R1.18 CCCCN1CCNCCC1=O MCULE-5173759883 [0,1,0,1,0,0|1,0,0]=3 1443 B12R1.18 COCCN1CCCNCC1=O MCULE-8191923960 [0,1,0,1,0,0|2,0,0]=4 1444 B12R1.18 COCCN1CCNCCC1=O MCULE-4504817503 [0,1,0,1,0,0|2,0,0]=4 1445 B12R1.18 COCCN1CCNCCC1=O MCULE-8800911728 [0,1,0,1,0,0|2,0,0]=4 1446 B12R1.18 N#CCCN1CCCCCC1=O MCULE-1773998051 [0,1,0,1,0,0|1,0,1]=4 1447 B12R1.18 NCCCN1CCCCCC1=O MCULE-7534720301 [0,1,0,1,0,0|1,0,0]=3 1448 B12R1.18 NCCCN1CCCCCC1=O MCULE-7641696435 [0,1,0,1,0,0|1,0,0]=3 1449 B12R1.37 BrCCCCCCN1CCCC1 MCULE-4598709250 [0,1,0,1,0,0|1,0,1]=4 1450 B12R1.37 BrCCCCCCN1CCCC1 MCULE-9859730923 [0,1,0,1,0,0|1,0,1]=4 1451 B12R1.37 C=CCCCOCC1CCNC1 MCULE-1893572611 [0,1,0,1,0,0|2,0,0]=4 1452 B12R1.37 C=CCCCOCC1CCNC1 MCULE-8568203390 [0,1,0,1,0,0|2,0,0]=4 1453 B12R1.37 CCCCCCCC1OCCO1 MCULE-9440265689 [0,1,0,1,0,0|0,0,2]=4 1454 B12R1.37 CCCCCCNC1CCCC1 MCULE-1957642519 [0,1,0,1,0,0|1,0,1]=4 1455 B12R1.37 CCCCCOCC1CCNC1 MCULE-8088160320 [0,1,0,1,0,0|2,0,0]=4 1456 B12R1.37 CCCCCOCC1CCNC1 MCULE-9632689543 [0,1,0,1,0,0|2,0,0]=4 1457 B12R1.37 NCCCCCCN1CCCC1 MCULE-2542705076 [0,1,0,1,0,0|1,0,1]=4 1458 B12R1.37 NCCCCCCN1CCCC1 MCULE-3377761564 [0,1,0,1,0,0|1,0,1]=4 1459 B12R1.52 C#CCN1CCCCCCC1=O MCULE-5498585719 [0,1,0,1,0,0|0,0,2]=4 1460 B12R1.52 CCOC1CCCCCCC1N MCULE-9132533980 [0,1,0,1,0,0|1,0,1]=4 1461 B12R1.121 CCC1CCCCC1OCCO MCULE-2333871269 [0,1,0,1,0,0|0,0,2]=4 1462 B12R1.121 CCC1CCCCN1CCCN MCULE-4667666773 [0,1,0,1,0,0|1,0,1]=4 1463 B12R1.121 CCCCN1CCCCC1CN MCULE-6345040942 [0,1,0,1,0,0|1,0,1]=4 1464 B12R1.169 CCCN1CCCCC1CCCl MCULE-7356825162 [0,1,0,1,0,0|1,0,1]=4 1465 B12R1.215 CN1CCCCCCNCCC1 MCULE-4524414527 [0,1,0,1,0,0|2,0,0]=4 1466 B12R1.215 O=C1CCNCCCCCCN1 MCULE-1263100451 [0,1,0,1,0,0|1,0,0]=3 1467 B12R1.215 O=C1CCNCCCOCCN1 MCULE-2789680382 [0,1,0,1,0,0|2,0,0]=4 1468 B12R1.267 CC1CCCCN1CCCCN MCULE-8278798662 [0,1,0,1,0,0|1,0,1]=4 1469 B12R1.267 CCCCC=C1CCCCC1=O MCULE-6881426714 [0,1,0,1,0,0|0,0,1]=3 1470 B12R1.267 CCCCCC1CCCCC1=O MCULE-3162873716 [0,1,0,1,0,0|0,0,0]=2 1471 B12R1.267 CNCCCN1CCCCC1C MCULE-6495450728 [0,1,0,1,0,0|2,0,0]=4 1472 B12R1.267 NCCCCN1CCCCC1=O MCULE-5609841049 [0,1,0,1,0,0|1,0,0]=3 1473 B12R1.267 O=C1CCCCC1CNCCBr MCULE-7462371251 [0,1,0,1,0,0|1,0,0]=3 1474 B12R1.267 O=C1CCCCC1CNCCBr MCULE-8159055342 [0,1,0,1,0,0|1,0,0]=3 1475 B12R1.271 CNCCCCNCC1CC1C MCULE-7611615406 [0,1,0,1,0,0|2,0,0]=4 1476 B12R1.271 CNCCCCNCC1CC1C MCULE-9251572600 [0,1,0,1,0,0|2,0,0]=4 1477 B12R1.281 CCNC1CCCCCC1OC MCULE-7967143465 [0,1,0,1,0,0|2,0,0]=4 1478 B12R1.281 CCOC1CCCCCC1NC MCULE-5872174102 [0,1,0,1,0,0|2,0,0]=4 1479 B12R1.329 C=CCNC1CCCCCCC1 MCULE-4436940732 [0,1,0,1,0,0|1,0,0]=3 1480 B12R1.329 C=CCNC1CCCCCCC1 MCULE-7467999336 [0,1,0,1,0,0|1,0,0]=3 1481 B12R1.372 CCCCCCC1=CCCC1=O MCULE-1287633510 [0,1,0,1,0,0|0,0,1]=3 1482 B12R1.372 CCCCCCC1CCCC1=O MCULE-9980064191 [0,1,0,1,0,0|0,0,0]=2 1483 B12R1.372 CCCCCCC1CCOC1=O MCULE-7489729502 [0,1,0,1,0,0|0,0,0]=2 1484 B12R1.372 CCCCCCN1CCCC1=O MCULE-1097521229 [0,1,0,1,0,0|0,0,0]=2 1485 B12R1.375 CCCCCCCCC[C@@H]1CO1 MCULE-1904651720 [0,1,0,1,0,0|0,0,2]=4 1486 B12R1.375 CCCCCCCOC[C@H]1CO1 MCULE-6928162982 [0,1,0,1,0,0|0,0,2]=4 1487 B12R1.399 CNC1CCCCCCC1OC MCULE-3417290973 [0,1,0,1,0,0|2,0,0]=4 1488 B12R1.410 CNC1CCCCCCCCC1 MCULE-9906028937 [0,1,0,1,0,0|1,0,1]=4 1489 B12R1.550 C1=CCCCCCCCCCC1 MCULE-7809911769 [0,1,0,1,0,0|1,0,0]=3 1490 B12R1.550 C1=CCCCCCCCCCC1 MCULE-9211992042 [0,1,0,1,0,0|1,0,0]=3 1491 B12R1.550 C1CCCCCCCCCCC1 MCULE-7420288531 [0,1,0,1,0,0|1,0,1]=4 1492 B12R1.1410 CCCCCC1OC1C=CC=O MCULE-4436934736 [0,1,0,1,0,0|0,0,2]=4 1493 B12R1.1410 CCCCC[C@H]1O[C@@H]1C=CC=O MCULE-6093862797 [0,1,0,1,0,0|0,0,2]=4 1494 B12R1.1414 C=CCCCC1CCCCCC1 MCULE-7969593113 [0,1,0,1,0,0|1,0,0]=3 1495 B12R1.1414 CCCCNC1CCCCCC1 MCULE-8285970772 [0,1,0,1,0,0|1,0,1]=4 1496 B12R1.1414 CCCCNC1CCCCCC1 MCULE-8620106588 [0,1,0,1,0,0|1,0,1]=4 1497 B12R1.1414 CNCCCN1CCCCCC1 MCULE-6443571510 [0,1,0,1,0,0|2,0,0]=4 1498 B12R1.1414 NCCCCN1CCCCCC1 MCULE-4655046662 [0,1,0,1,0,0|1,0,1]=4 1499 B12R1.1414 NCCCCN1CCCCCC1 MCULE-8510990715 [0,1,0,1,0,0|1,0,1]=4 1500 B12R1.1414 OCCCCN1CCCCCC1 MCULE-6965728729 [0,1,0,1,0,0|0,0,2]=4 1501 B12R1.1414 OCCCOC1CCCCCC1 MCULE-9402583694 [0,1,0,1,0,0|0,0,2]=4 1502 B12R1.28 CC/C=C\CC1CCCC(=O)O1 MCULE-3393454158 [0,1,0,1,0,0|0,0,2]=4 1503 B12R1.28 CCC=CCC1CCCC(=O)O1 MCULE-9639028527 [0,1,0,1,0,0|0,0,2]=4 1504 B12R1.28 CCCCCC1CC=CC(=O)O1 MCULE-9666662342 [0,1,0,1,0,0|0,0,2]=4 1505 B12R1.28 CCCCCC1CCCC(=O)O1 MCULE-2527242599 [0,1,0,1,0,0|0,0,0]=2 1506 B12R1.28 CCCCC[C@@H]1CC=CC(=O)O1 MCULE-1286702458 [0,1,0,1,0,0|0,0,2]=4 1507 B12R1.28 CCCCC[C@H]1CC=CC(=O)O1 MCULE-7838361683 [0,1,0,1,0,0|0,0,2]=4 1508 B12R1.28 CCCCOC1=CC(=O)CCC1 MCULE-4416106131 [0,1,0,1,0,0|1,0,1]=4 1509 B12R1.28 N#CCCCC1CCCC(=O)C1 MCULE-4819873207 [0,1,0,1,0,0|1,0,1]=4 1510 B12R1.141 O=C1CCCCCCCC(=O)O1 MCULE-2456565439 [0,1,0,1,0,0|1,0,1]=4 1511 B12R1.170 NCCC1CCCCCC(=O)N1 MCULE-7372073941 [0,1,0,1,0,0|1,0,0]=3 1512 B12R1.170 NCCC1CCCCCC(=O)N1 MCULE-9427535286 [0,1,0,1,0,0|1,0,0]=3 1513 B12R1.278 CCCC1CCCC(N1)CCC MCULE-3975828154 [0,1,0,1,0,0|1,0,1]=4 1514 B12R1.278 CCCC1CCCC(N1)CCC MCULE-5475274972 [0,1,0,1,0,0|1,0,1]=4 1515 B12R1.308 CCOC(=O)C1CCCCC1=O MCULE-9805674954 [0,1,0,1,0,0|1,0,1]=4 1516 B12R1.308 CCOC(O)C1CNCCC1=O MCULE-8123782657 [0,1,0,1,0,0|2,0,0]=4 1517 B12R1.308 CCOC(O)C1CNCCC1=O MCULE-8666181437 [0,1,0,1,0,0|2,0,0]=4 1518 B12R1.318 CCOC(=O)CC1CCCC1=O MCULE-1924947890 [0,1,0,1,0,0|1,0,1]=4 1519 B12R1.456 CCOCCN1CC(CC1=O)N MCULE-7101117109 [0,1,0,1,0,0|2,0,0]=4 1520 B12R1.1469 CCC[C@]1(CCCC[C@H]1CO)O MCULE-2560461933 [0,1,0,1,0,0|0,0,2]=4 1521 B12R1.1564 NC(CCO)C1CCCCCC1 MCULE-1391119724 [0,1,0,1,0,0|0,0,2]=4 1522 B12R1.1 CCCCCC1CC=C(CC1)Br MCULE-9220672225 [0,1,0,1,0,0|1,0,1]=4 1523 B12R1.1 CCCCCC1CCC(CC1)N MCULE-1026493155 [0,1,0,1,0,0|1,0,1]=4 1524 B12R1.1 CCCCCC1CCC(CC1)O MCULE-3435416328 [0,1,0,1,0,0|1,0,1]=4 1525 B12R1.1 CCCCC[C@H]1CC[C@@H](CC1)O MCULE-2942273227 [0,1,0,1,0,0|1,0,1]=4 1526 B12R1.1 COCCC[C@H]1CC[C@@H](CC1)N MCULE-6337184087 [0,1,0,1,0,0|2,0,0]=4 1527 B12R1.1 COCCC[C@H]1CC[C@@H](CC1)N MCULE-9928577234 [0,1,0,1,0,0|2,0,0]=4 1528 B12R1.7 CCCC#CCC1CCC(=O)O1 MCULE-9827566704 [0,1,0,1,0,0|0,0,2]=4 1529 B12R1.7 CCCCCCC1CCC(=O)O1 MCULE-8274362783 [0,1,0,1,0,0|0,0,0]=2 1530 B12R1.7 CCCCOCC1CNC(=O)O1 MCULE-6966705652 [0,1,0,1,0,0|2,0,0]=4 1531 B12R1.25 CCCCC1NCCN(C1=O)C MCULE-5309908803 [0,1,0,1,0,0|2,0,0]=4 1532 B12R1.365 CCC(N)C1CCCCNC1=O MCULE-2973623704 [0,1,0,1,0,0|1,0,0]=3 1533 B12R1.365 CCC(N)C1CCCCNC1=O MCULE-3135675523 [0,1,0,1,0,0|1,0,0]=3 1534 B12R1.365 COC(=O)C1CCCCCC1=O MCULE-3603977230 [0,1,0,1,0,0|1,0,1]=4 1535 B12R1.371 COC(=O)CC1CCCCC1=O MCULE-2536809252 [0,1,0,1,0,0|1,0,1]=4 1536 B12R1.30 CCCCC(O)C1CCCCC1 MCULE-9771991264 [0,1,0,1,0,0|1,0,1]=4 1537 B12R1.567 CCCCCC1=C(CCC1=O)C MCULE-6930955162 [0,1,0,1,0,0|0,0,2]=4 1538 B12R1.1785 CCCCC1(CCCCCC1)O MCULE-2884909991 [0,1,0,1,0,0|1,0,1]=4 1539 B12R1.75 CCC1CCCCN1CC(=O)O MCULE-1466936975 [0,1,0,1,0,0|1,0,0]=3 1540 B12R1.75 CCC1CCCCN1CC(=O)O MCULE-4786692834 [0,1,0,1,0,0|1,0,0]=3 1541 B12R1.75 CNC1CCCCC1NC(=O)C MCULE-2047298936 [0,1,0,1,0,0|2,0,0]=4 1542 B12R1.75 COC1COCCC1CC(=O)O MCULE-1148352268 [0,1,0,1,0,0|2,0,0]=4 1543 B12R1.75 O=C(O)CN1CCCCC1CBr MCULE-4745302069 [0,1,0,1,0,0|2,0,0]=4 1544 B12R1.75 O=C(O)CN1CCCCC1CCl MCULE-1771575283 [0,1,0,1,0,0|2,0,0]=4 1545 B12R1.75 O=C(O)CN1CCCCC1CI MCULE-1312726912 [0,1,0,1,0,0|2,0,0]=4 1546 B12R1.75 O=C(O)CN1CCCCC1CO MCULE-9904924658 [0,1,0,1,0,0|2,0,0]=4 1547 B12R1.81 COC1CCCC1NCC(=O)N MCULE-9154365181 [0,1,0,1,0,0|2,0,0]=4 1548 B12R1.81 COC1CCCC1NCC(=O)O MCULE-2262288610 [0,1,0,1,0,0|2,0,0]=4 1549 B12R1.125 CC(=O)OCC1CCCCC1=O MCULE-8211145047 [0,1,0,1,0,0|1,0,1]=4 1550 B12R1.125 CC(C)CC=C1CCCCC1=O MCULE-4428185983 [0,1,0,1,0,0|0,0,2]=4 1551 B12R1.125 CC(C)CCC1CCCCC1O MCULE-6442392278 [0,1,0,1,0,0|0,0,2]=4 1552 B12R1.125 CC1CCCCC1OCC(=O)O MCULE-2149192016 [0,1,0,1,0,0|1,0,0]=3 1553 B12R1.125 CC1CCCCN1CCC(=N)N MCULE-2398652845 [0,1,0,1,0,0|2,0,0]=4 1554 B12R1.125 CC1CCCCN1CCC(=N)N MCULE-7004020111 [0,1,0,1,0,0|2,0,0]=4 1555 B12R1.125 CC1CCCCN1CCC(=O)O MCULE-2264327508 [0,1,0,1,0,0|1,0,0]=3 1556 B12R1.125 CC1CCCCN1CCC(=O)O MCULE-6515087928 [0,1,0,1,0,0|1,0,0]=3 1557 B12R1.125 CC1CNCCC1CCC(=O)O MCULE-8609285846 [0,1,0,1,0,0|1,0,0]=3 1558 B12R1.125 CN1CCCCC1CCC(=O)O MCULE-7324723252 [0,1,0,1,0,0|1,0,0]=3 1559 B12R1.125 CN1CCCCC1CCC(=O)O MCULE-8814910063 [0,1,0,1,0,0|1,0,0]=3 1560 B12R1.125 NC1CCCCC1CCC(=O)O MCULE-6538296828 [0,1,0,1,0,0|1,0,0]=3 1561 B12R1.125 NC1CCCCC1CCC(=O)O MCULE-9802411985 [0,1,0,1,0,0|1,0,0]=3 1562 B12R1.125 O=C(O)CCC1CCCCC1=O MCULE-4224119563 [0,1,0,1,0,0|1,0,1]=4 1563 B12R1.125 O=C(O)CSC1CCCCC1O MCULE-9209996677 [0,1,0,1,0,0|2,0,0]=4 1564 B12R1.130 CN1CCCC1CNCC(=O)O MCULE-3274185883 [0,1,0,1,0,0|2,0,0]=4 1565 B12R1.130 CN1CCCC1COCC(=O)O MCULE-2248139834 [0,1,0,1,0,0|2,0,0]=4 1566 B12R1.130 CN1CCCC1COCC(=O)O MCULE-6246100493 [0,1,0,1,0,0|2,0,0]=4 1567 B12R1.130 CN1CCC[C@H]1CNCC(=O)O MCULE-5802596984 [0,1,0,1,0,0|2,0,0]=4 1568 B12R1.130 CN1CCC[C@H]1COCC(=O)O MCULE-6137867536 [0,1,0,1,0,0|2,0,0]=4 1569 B12R1.210 C=C(C)CN1CCCCCC1=O MCULE-8593964326 [0,1,0,1,0,0|1,0,1]=4 1570 B12R1.210 CC(C)CC1NCCCNC1=O MCULE-2395578966 [0,1,0,1,0,0|2,0,0]=4 1571 B12R1.210 CC(C)CN1CCNCCC1=O MCULE-8054198953 [0,1,0,1,0,0|2,0,0]=4 1572 B12R1.212 CC1CCC=CCCC1C(=O)O MCULE-6485603876 [0,1,0,1,0,0|0,0,2]=4 1573 B12R1.212 NC1CCCCCCC1C(=O)O MCULE-2303513219 [0,1,0,1,0,0|1,0,0]=3 1574 B12R1.212 NC1CCCCCCC1C(=O)O MCULE-5336927273 [0,1,0,1,0,0|1,0,0]=3 1575 B12R1.212 O=C(O)C1CCCCCCC1=O MCULE-5304671902 [0,1,0,1,0,0|1,0,1]=4 1576 B12R1.252 C=C(C)CCCC1CCCCC1 MCULE-7799078786 [0,1,0,1,0,0|1,0,0]=3 1577 B12R1.252 CC(=O)CCC=C1CCCCC1 MCULE-1076445196 [0,1,0,1,0,0|0,0,2]=4 1578 B12R1.252 CC(=O)CCCC1CCCCC1 MCULE-5187598883 [0,1,0,1,0,0|0,0,0]=2 1579 B12R1.252 CC(=O)NCCC1CCCCN1 MCULE-5840104711 [0,1,0,1,0,0|2,0,0]=4 1580 B12R1.252 CC(=O)NCCC1CCCCN1 MCULE-7320206184 [0,1,0,1,0,0|2,0,0]=4 1581 B12R1.252 CC(=O)NCCC1CCCCN1 MCULE-9295576951 [0,1,0,1,0,0|2,0,0]=4 1582 B12R1.252 CC(=O)NCCC1CCCNC1 MCULE-2925470482 [0,1,0,1,0,0|2,0,0]=4 1583 B12R1.252 CC(=O)NCCC1CCCNC1 MCULE-7399408933 [0,1,0,1,0,0|2,0,0]=4 1584 B12R1.252 CC(=O)NCCC1CCNCC1 MCULE-7669887235 [0,1,0,1,0,0|2,0,0]=4 1585 B12R1.252 CC(=O)NCCC1CCNCC1 MCULE-9410705557 [0,1,0,1,0,0|2,0,0]=4 1586 B12R1.252 CC(=O)OCCC1CCCCN1 MCULE-1026387511 [0,1,0,1,0,0|2,0,0]=4 1587 B12R1.252 CC(=O)OCCC1CCCCN1 MCULE-3751642892 [0,1,0,1,0,0|2,0,0]=4 1588 B12R1.252 CC(=O)OCCC1CCCNC1 MCULE-1775660875 [0,1,0,1,0,0|2,0,0]=4 1589 B12R1.252 CC(=O)OCCC1CCCNC1 MCULE-7081319541 [0,1,0,1,0,0|2,0,0]=4 1590 B12R1.252 CC(=O)OCCC1CCNCC1 MCULE-3691332043 [0,1,0,1,0,0|2,0,0]=4 1591 B12R1.252 CC(=O)OCCC1CCNCC1 MCULE-8239323848 [0,1,0,1,0,0|2,0,0]=4 1592 B12R1.252 CC(=O)SCCC1CCCCC1 MCULE-8635148363 [0,1,0,1,0,0|1,0,0]=3 1593 B12R1.252 CC(=O)SCCN1CCCCC1 MCULE-2541705969 [0,1,0,1,0,0|2,0,0]=4 1594 B12R1.252 CC(=O)SCCN1CCCCC1 MCULE-8698410675 [0,1,0,1,0,0|2,0,0]=4 1595 B12R1.252 CC(C)CCCC1CCCCN1 MCULE-8634695776 [0,1,0,1,0,0|1,0,1]=4 1596 B12R1.252 CC(C)CCCC1CCCCN1 MCULE-8948258540 [0,1,0,1,0,0|1,0,1]=4 1597 B12R1.252 NC(=O)CCCC1CCNCC1 MCULE-8068328020 [0,1,0,1,0,0|1,0,0]=3 1598 B12R1.252 NC(=O)CCNC1CCCCC1 MCULE-6961669869 [0,1,0,1,0,0|1,0,0]=3 1599 B12R1.252 NC(=O)CNCC1CCOCC1 MCULE-8061631380 [0,1,0,1,0,0|2,0,0]=4 1600 B12R1.252 O=C(Cl)CCCC1CCCCC1 MCULE-6685434994 [0,1,0,1,0,0|0,0,0]=2 1601 B12R1.252 O=C(O)CCCC1CCCCC1 MCULE-8249292238 [0,1,0,1,0,0|0,0,0]=2 1602 B12R1.252 O=C(O)CCCC1CCCCN1 MCULE-6744436702 [0,1,0,1,0,0|1,0,0]=3 1603 B12R1.252 O=C(O)CCCC1CCCCN1 MCULE-6927833795 [0,1,0,1,0,0|1,0,0]=3 1604 B12R1.252 O=C(O)CCCC1CCNCC1 MCULE-1999021566 [0,1,0,1,0,0|1,0,0]=3 1605 B12R1.252 O=C(O)CCCC1CCNCC1 MCULE-5061937452 [0,1,0,1,0,0|1,0,0]=3 1606 B12R1.252 O=C(O)CCCC1CCOCC1 MCULE-3067113283 [0,1,0,1,0,0|1,0,0]=3 1607 B12R1.252 O=C(O)CCCN1CCCCC1 MCULE-2691750895 [0,1,0,1,0,0|1,0,0]=3 1608 B12R1.252 O=C(O)CCCN1CCCCC1 MCULE-7693123644 [0,1,0,1,0,0|1,0,0]=3 1609 B12R1.252 O=C(O)CCCN1CCOCC1 MCULE-3808061194 [0,1,0,1,0,0|2,0,0]=4 1610 B12R1.252 O=C(O)CCCN1CCOCC1 MCULE-6111321827 [0,1,0,1,0,0|2,0,0]=4 1611 B12R1.252 O=C(O)CCNC1CCCCC1 MCULE-9246786190 [0,1,0,1,0,0|1,0,0]=3 1612 B12R1.252 O=C(O)CCOC1CCCCO1 MCULE-1716928477 [0,1,0,1,0,0|2,0,0]=4 1613 B12R1.252 O=C(O)CCOC1CCOCC1 MCULE-9390535734 [0,1,0,1,0,0|2,0,0]=4 1614 B12R1.252 O=C(O)CNCC1CCCCC1 MCULE-8613545922 [0,1,0,1,0,0|1,0,0]=3 1615 B12R1.252 O=C(O)CNCC1CCCCC1 MCULE-8778334854 [0,1,0,1,0,0|1,0,0]=3 1616 B12R1.252 O=C(O)COCC1CCCCO1 MCULE-4058015104 [0,1,0,1,0,0|2,0,0]=4 1617 B12R1.252 O=C(O)CSCC1CCCCO1 MCULE-4195821334 [0,1,0,1,0,0|2,0,0]=4 1618 B12R1.252 O=C([O-])CCCC1CCCCC1 MCULE-8598802518 [0,1,0,1,0,0|0,0,0]=2 1619 B12R1.252 OB(O)CCCC1CCCCC1 MCULE-4093256475 [0,1,0,1,0,0|1,0,1]=4 1620 B12R1.255 NC(=O)CCCCC1CCSS1 MCULE-3905195412 [0,1,0,1,0,0|2,0,0]=4 1621 B12R1.255 NC(=O)CCNCC1CCCO1 MCULE-9163751662 [0,1,0,1,0,0|2,0,0]=4 1622 B12R1.255 O=C(O)CCCCC1CCSS1 MCULE-1034910084 [0,1,0,1,0,0|2,0,0]=4 1623 B12R1.255 O=C(O)CCCCC1CSSC1 MCULE-2400272112 [0,1,0,1,0,0|2,0,0]=4 1624 B12R1.255 O=C(O)CCCCC1OCCO1 MCULE-2471174890 [0,1,0,1,0,0|2,0,0]=4 1625 B12R1.255 O=C(O)CCCCN1CCCC1 MCULE-4626905282 [0,1,0,1,0,0|1,0,0]=3 1626 B12R1.255 O=C(O)CCCCN1CCCC1 MCULE-9805744856 [0,1,0,1,0,0|1,0,0]=3 1627 B12R1.255 O=C(O)CCCC[C@@H]1CCSS1 MCULE-3939318333 [0,1,0,1,0,0|2,0,0]=4 1628 B12R1.255 O=C(O)CCCC[C@@H]1CCSS1 MCULE-5119858094 [0,1,0,1,0,0|2,0,0]=4 1629 B12R1.255 O=C(O)CCCC[C@H]1CCSS1 MCULE-3745351545 [0,1,0,1,0,0|2,0,0]=4 1630 B12R1.255 O=C(O)CCCC[C@H]1CCSS1 MCULE-4196115946 [0,1,0,1,0,0|2,0,0]=4 1631 B12R1.255 O=C(O)CCOCC1CCCO1 MCULE-6575689085 [0,1,0,1,0,0|2,0,0]=4 1632 B12R1.255 O=C(O)CSCCN1CCCC1 MCULE-8161223615 [0,1,0,1,0,0|2,0,0]=4 1633 B12R1.255 O=C(O)CSCCN1CCCC1 MCULE-9395650023 [0,1,0,1,0,0|2,0,0]=4 1634 B12R1.255 O=C([O-])CCCCC1CCSS1 MCULE-7092697398 [0,1,0,1,0,0|2,0,0]=4 1635 B12R1.283 CCCN1CCCCC1C(=O)O MCULE-1283308328 [0,1,0,1,0,0|1,0,0]=3 1636 B12R1.283 CCCN1CCCCC1C(=O)O MCULE-5666620583 [0,1,0,1,0,0|1,0,0]=3 1637 B12R1.283 CCCN1CCNCC1C(=O)O MCULE-8138651228 [0,1,0,1,0,0|2,0,0]=4 1638 B12R1.283 CNCC1CCCCN1C(=O)C MCULE-9756626362 [0,1,0,1,0,0|2,0,0]=4 1639 B12R1.289 COCC1CCCN1CC(=O)O MCULE-8271632316 [0,1,0,1,0,0|2,0,0]=4 1640 B12R1.384 CC1(COCCN1CCC=O)C MCULE-7080231005 [0,1,0,1,0,0|2,0,0]=4 1641 B12R1.386 CCNCC1CCCN1C(=O)C MCULE-8894860154 [0,1,0,1,0,0|2,0,0]=4 1642 B12R1.386 CCNC[C@@H]1CCCN1C(=O)C MCULE-7509434787 [0,1,0,1,0,0|2,0,0]=4 1643 B12R1.405 CCN1CCCCCC1C(=O)O MCULE-2326419949 [0,1,0,1,0,0|1,0,0]=3 1644 B12R1.1033 O=C1CCCCCCCC1(F)F MCULE-3662646976 [0,1,0,1,0,0|1,0,0]=3 1645 B12R1.1343 CC(=O)CCC1CCCCCC1 MCULE-1678869086 [0,1,0,1,0,0|0,0,0]=2 1646 B12R1.1343 O=C(O)CCC1CCCCCC1 MCULE-3221739644 [0,1,0,1,0,0|0,0,0]=2 1647 B12R1.1343 O=C(O)CCN1CCCCCC1 MCULE-6902441701 [0,1,0,1,0,0|1,0,0]=3 1648 B12R1.1343 O=C(O)CCN1CCCCCC1 MCULE-8652213601 [0,1,0,1,0,0|1,0,0]=3 1649 B12R1.1343 O=C(O)CNC1CCCCCC1 MCULE-3407473628 [0,1,0,1,0,0|1,0,0]=3 1650 B12R1.1343 O=C(O)COC1CCCCCC1 MCULE-7705697205 [0,1,0,1,0,0|1,0,0]=3 1651 B12R1.1392 C=C(C)CC1CCCCCCC1 MCULE-8129802280 [0,1,0,1,0,0|1,0,0]=3 1652 B12R1.1392 CC(=O)OC1CCCCCCC1 MCULE-6350829843 [0,1,0,1,0,0|1,0,0]=3 1653 B12R1.1392 NC(=O)NC1CCCCCCC1 MCULE-8088379075 [0,1,0,1,0,0|1,0,0]=3 1654 B12R1.1392 O=C(O)CN1CCCCCCC1 MCULE-5706680135 [0,1,0,1,0,0|1,0,0]=3 1655 B12R2.2 C1CCC(C1)C2CCCNC2 MCULE-8916145578 [0,0,0,2,0,0|2,0,0]=4 1656 B12R2.2 C1CCC(CC1)C2CCCN2 MCULE-7010533009 [0,0,0,2,0,0|1,0,1]=4 1657 B12R2.2 C1CCC(CC1)C2CCNC2 MCULE-6618879022 [0,0,0,2,0,0|2,0,0]=4 1658 B12R2.2 C1CCC(CC1)C2CCNC2 MCULE-7223246071 [0,0,0,2,0,0|2,0,0]=4 1659 B12R2.2 C1CCC(NC1)C2CCCC2 MCULE-2617645533 [0,0,0,2,0,0|1,0,1]=4 1660 B12R2.2 C1CCC(NC1)C2CCCC2 MCULE-4854177510 [0,0,0,2,0,0|1,0,1]=4 1661 B12R2.7 NC1CCCCC12CCCC2 MCULE-4756301005 [0,0,0,2,0,0|1,0,1]=4 1662 B12R2.7 O=C1CCCCC12CCCC2 MCULE-2674738319 [0,0,0,2,0,0|0,0,0]=2 1663 B12R2.7 O=C1CCCCC12OCCO2 MCULE-6346003232 [0,0,0,2,0,0|2,0,0]=4 1664 B12R2.7 O=C1CCNCC12CCCC2 MCULE-7001240727 [0,0,0,2,0,0|1,0,0]=3 1665 B12R2.7 O=C1NCCCC12CCCC2 MCULE-4003925548 [0,0,0,2,0,0|1,0,0]=3 1666 B12R2.7 O=C1NCCCC12CCCN2 MCULE-3628239818 [0,0,0,2,0,0|2,0,0]=4 1667 B12R2.7 O=C1NCCCC12CCCN2 MCULE-6136711115 [0,0,0,2,0,0|2,0,0]=4 1668 B12R2.7 O=C1NCCCC12CCNC2 MCULE-7835953096 [0,0,0,2,0,0|2,0,0]=4 1669 B12R2.7 O=C1NCCCC12CCNC2 MCULE-9705262931 [0,0,0,2,0,0|2,0,0]=4 1670 B12R2.7 O=C1NCCNC12CCCC2 MCULE-3068523257 [0,0,0,2,0,0|2,0,0]=4 1671 B12R2.7 O=C1NCCNC12CCCC2 MCULE-8516961031 [0,0,0,2,0,0|2,0,0]=4 1672 B12R2.10 O=C1CCCC1=C2CCCC2 MCULE-4205891729 [0,0,0,2,0,0|0,0,2]=4 1673 B12R2.10 O=C1CCCC1C2CCCC2 MCULE-8113761933 [0,0,0,2,0,0|0,0,0]=2 1674 B12R2.10 O=C1CCCC1C2CCCN2 MCULE-9553411546 [0,0,0,2,0,0|1,0,0]=3 1675 B12R2.10 O=C1CCCN1C2CCNC2 MCULE-2968825742 [0,0,0,2,0,0|2,0,0]=4 1676 B12R2.10 O=C1CCCN1C2CCNC2 MCULE-8880581543 [0,0,0,2,0,0|2,0,0]=4 1677 B12R2.10 O=C1NCCN1C2CCCC2 MCULE-2081250735 [0,0,0,2,0,0|2,0,0]=4 1678 B12R2.98 C1CCC(C1)CC2CCCN2 MCULE-7149580562 [0,0,0,2,0,0|1,0,1]=4 1679 B12R2.98 C1CCC(C1)CC2CCCN2 MCULE-7227065575 [0,0,0,2,0,0|1,0,1]=4 1680 B12R2.98 C1CCC(C1)CC2CCNC2 MCULE-2913606797 [0,0,0,2,0,0|2,0,0]=4 1681 B12R2.98 C1CCC(C1)CC2CCNC2 MCULE-5580219085 [0,0,0,2,0,0|2,0,0]=4 1682 B12R2.229 O=C1CCNCC2N1CCC2 MCULE-5354866844 [0,0,0,2,0,0|2,0,0]=4 1683 B12R2.229 O=C1CCNC[C@H]2N1CCC2 MCULE-3430808630 [0,0,0,2,0,0|2,0,0]=4 1684 B12R2.229 O=C1NCCCC2C1CNC2 MCULE-6681743352 [0,0,0,2,0,0|2,0,0]=4 1685 B12R2.229 O=C1NCCCC2C1CNC2 MCULE-8669557280 [0,0,0,2,0,0|2,0,0]=4 1686 B12R2.2336 OCCCC1CC2CCC1C2 MCULE-1860404254 [0,0,0,2,0,0|0,0,2]=4 1687 B12R2.4328 C1CCCC2(CC1)CCNC2 MCULE-2993831600 [0,0,0,2,0,0|2,0,0]=4 1688 B12R2.4328 C1CCCC2(CC1)CCNC2 MCULE-5441899310 [0,0,0,2,0,0|2,0,0]=4 1689 B12R2.41 C1CCC2=NCCCN2CC1 MCULE-9669804011 [0,0,0,2,0,0|2,0,0]=4 1690 B12R2.41 C1CCN2CCCCC2=NC1 MCULE-5484146437 [0,0,0,2,0,0|2,0,0]=4 1691 B12R2.455 O=C1CNCC2CCCN1C2 MCULE-6746069011 [0,0,0,2,0,0|2,0,0]=4 1692 B12R2.455 [C@@H]12CCCN(C1)C(=O)CNC2 MCULE-8701369821 [0,0,0,2,0,0|2,0,0]=4 1693 B12R2.1019 [C@H]12CCC[C@H](CNC1)C(=O)N2 MCULE-4526920635 [0,0,0,2,0,0|2,0,0]=4 1694 B12R2.1019 [C@H]12CCC[C@H](CNC1)C(=O)N2 MCULE-6171952464 [0,0,0,2,0,0|2,0,0]=4 1695 B12R2.1041 O=C1CC2CCCCCC2C1 MCULE-3866880179 [0,0,0,2,0,0|0,0,0]=2 1696 B12R2.5472 O=C1NCCCNC12CCC2 MCULE-1154057454 [0,0,0,2,0,0|2,0,0]=4 1697 B12R2.24 CC1CCC2CCCCC2C1 MCULE-4606886782 [0,0,0,2,0,0|1,0,1]=4 1698 B12R2.24 CC1CCC2CCCCC2N1 MCULE-9774586861 [0,0,0,2,0,0|1,0,1]=4 1699 B12R2.24 NC1CCC2CCCCC2C1 MCULE-7370221449 [0,0,0,2,0,0|1,0,1]=4 1700 B12R2.24 O=C1C=C2CCCCC2CC1 MCULE-1925425954 [0,0,0,2,0,0|0,0,2]=4 1701 B12R2.24 O=C1CCC2CCCCC2C1 MCULE-5132415908 [0,0,0,2,0,0|0,0,0]=2 1702 B12R2.24 O=C1CCC2CCCCC2O1 MCULE-8264574980 [0,0,0,2,0,0|1,0,0]=3 1703 B12R2.24 O=C1CCC2CCCNC2C1 MCULE-6331379359 [0,0,0,2,0,0|1,0,0]=3 1704 B12R2.24 O=C1CCC2CNCCC2N1 MCULE-1605613797 [0,0,0,2,0,0|2,0,0]=4 1705 B12R2.24 O=C1CCC2CNCCC2N1 MCULE-4751402400 [0,0,0,2,0,0|2,0,0]=4 1706 B12R2.24 O=C1CCC2COCCC2C1 MCULE-2996737699 [0,0,0,2,0,0|1,0,0]=3 1707 B12R2.24 O=C1CCN2CCCCC2C1 MCULE-8834975179 [0,0,0,2,0,0|1,0,0]=3 1708 B12R2.24 O=C1CCN2CCOCC2C1 MCULE-9653993684 [0,0,0,2,0,0|2,0,0]=4 1709 B12R2.24 O=C1CN2CCCCC2CN1 MCULE-4553224664 [0,0,0,2,0,0|2,0,0]=4 1710 B12R2.24 O=C1CNC2CCCCC2N1 MCULE-4636303193 [0,0,0,2,0,0|2,0,0]=4 1711 B12R2.24 O=C1CNC2CCCCC2O1 MCULE-1674440433 [0,0,0,2,0,0|2,0,0]=4 1712 B12R2.24 O=C1COC2CCCCC2N1 MCULE-3544591104 [0,0,0,2,0,0|2,0,0]=4 1713 B12R2.24 O=C1CSC2CCCCC2O1 MCULE-2850415472 [0,0,0,2,0,0|2,0,0]=4 1714 B12R2.24 OC1CCC2CCCCC2C1 MCULE-5725182462 [0,0,0,2,0,0|0,0,2]=4 1715 B12R2.24 O[C@H]1CC[C@H]2CCCC[C@@H]2C1 MCULE-4891406192 [0,0,0,2,0,0|0,0,2]=4 1716 B12R2.24 [C@@H]12CCCCC1CC[C@H](C2)O MCULE-6819576815 [0,0,0,2,0,0|0,0,2]=4 1717 B12R2.24 [C@@H]12CCCC[C@H]1NC(=O)CN2 MCULE-2920414481 [0,0,0,2,0,0|2,0,0]=4 1718 B12R2.24 [C@H]12CCCC[C@H]1NC(=O)CN2 MCULE-7195121221 [0,0,0,2,0,0|2,0,0]=4 1719 B12R2.130 O=C1CCC2CC1CCC2=O MCULE-6636550443 [0,0,0,2,0,0|1,0,1]=4 1720 B12R2.130 [C@@H]12CCC(=O)[C@@H](C1)CCC2=O MCULE-7683880861 [0,0,0,2,0,0|1,0,1]=4 1721 B12R2.225 O=C1CCCCC1OC2CC2 MCULE-1497562604 [0,0,0,2,0,0|1,0,0]=3 1722 B12R2.225 O=C1CNCCN1CC2CC2 MCULE-6049139827 [0,0,0,2,0,0|2,0,0]=4 1723 B12R2.225 O=C1CNCCN1CC2CC2 MCULE-8255629720 [0,0,0,2,0,0|2,0,0]=4 1724 B12R2.517 O=C1CCCCC1C2COC2 MCULE-7214040965 [0,0,0,2,0,0|1,0,0]=3 1725 B12R2.517 O=C1CCCCN1C2CNC2 MCULE-3566269042 [0,0,0,2,0,0|2,0,0]=4 1726 B12R2.517 O=C1CCCCN1C2CNC2 MCULE-7799850305 [0,0,0,2,0,0|2,0,0]=4 1727 B12R2.1081 C12CCCC(=O)C1CCCN2 MCULE-7871473963 [0,0,0,2,0,0|1,0,0]=3 1728 B12R2.1081 C12CCCCC1C(=O)CCN2 MCULE-5542279033 [0,0,0,2,0,0|1,0,0]=3 1729 B12R2.1081 CC1CCCC2C1NCCC2 MCULE-6375693448 [0,0,0,2,0,0|2,0,0]=4 1730 B12R2.1081 CN1CCCC2C1CCCC2 MCULE-9036286750 [0,0,0,2,0,0|2,0,0]=4 1731 B12R2.1081 CN1CCCC2C1CCCC2 MCULE-9275770123 [0,0,0,2,0,0|2,0,0]=4 1732 B12R2.1081 NC1CCCC2C1CCCC2 MCULE-1973551737 [0,0,0,2,0,0|1,0,1]=4 1733 B12R2.1081 NC1CCCC2C1CCCC2 MCULE-3131682518 [0,0,0,2,0,0|1,0,1]=4 1734 B12R2.1081 O=C1CCCC2C1CC=CC2 MCULE-1897949638 [0,0,0,2,0,0|0,0,2]=4 1735 B12R2.1081 O=C1CCCC2C1CCCC2 MCULE-8480896518 [0,0,0,2,0,0|0,0,0]=2 1736 B12R2.1081 O=C1CCCC2N1CCNC2 MCULE-5025496575 [0,0,0,2,0,0|2,0,0]=4 1737 B12R2.1081 O=C1CCCC2N1CCNC2 MCULE-5496789049 [0,0,0,2,0,0|2,0,0]=4 1738 B12R2.1081 O=C1CCCN2C1CCCC2 MCULE-3277635107 [0,0,0,2,0,0|1,0,0]=3 1739 B12R2.1081 O=C1CCCN2C1CSCC2 MCULE-2541019053 [0,0,0,2,0,0|2,0,0]=4 1740 B12R2.1081 O=C1CCCN2C1CSCC2 MCULE-9694267198 [0,0,0,2,0,0|2,0,0]=4 1741 B12R2.1081 O=C1CCC[C@@H]2[C@@H]1CCCC2 MCULE-5964799305 [0,0,0,2,0,0|0,0,0]=2 1742 B12R2.1081 O=C1CCNC2C1CCCC2 MCULE-6781228133 [0,0,0,2,0,0|1,0,0]=3 1743 B12R2.1081 O=C1CCNC2N1CCCC2 MCULE-7383053948 [0,0,0,2,0,0|2,0,0]=4 1744 B12R2.1081 O=C1CNCC2N1CCCC2 MCULE-5438706854 [0,0,0,2,0,0|2,0,0]=4 1745 B12R2.1081 O=C1CNCC2N1CCCC2 MCULE-9023773742 [0,0,0,2,0,0|2,0,0]=4 1746 B12R2.1081 O=C1NCCC2C1CCNC2 MCULE-4722262759 [0,0,0,2,0,0|2,0,0]=4 1747 B12R2.1081 O=C1NCCC2C1CCNC2 MCULE-5602366246 [0,0,0,2,0,0|2,0,0]=4 1748 B12R2.1081 O=C1NCCC2C1CCNC2 MCULE-8721795873 [0,0,0,2,0,0|2,0,0]=4 1749 B12R2.1081 O=C1NCCC2C1NCCC2 MCULE-2965834050 [0,0,0,2,0,0|2,0,0]=4 1750 B12R2.1081 O=C1NCCN2C1CCCC2 MCULE-4674978248 [0,0,0,2,0,0|2,0,0]=4 1751 B12R2.1081 OC1CCCC2C1CCCC2 MCULE-2885059856 [0,0,0,2,0,0|0,0,2]=4 1752 B12R2.1081 O[C@H]1CCCC2C1CCCC2 MCULE-2747777640 [0,0,0,2,0,0|0,0,2]=4 1753 B12R2.1081 [C@@H]12CCCC(=O)N1CCNC2 MCULE-4764122446 [0,0,0,2,0,0|2,0,0]=4 1754 B12R2.1081 [C@@H]12CCCC(=O)N1CCNC2 MCULE-8407336784 [0,0,0,2,0,0|2,0,0]=4 1755 B12R2.1081 [C@@H]12CCCCC1[C@H](CCC2)O MCULE-7662556694 [0,0,0,2,0,0|0,0,2]=4 1756 B12R2.1081 [C@@H]12CCCCN1C(=O)CNC2 MCULE-3371879382 [0,0,0,2,0,0|2,0,0]=4 1757 B12R2.1081 [C@@H]12CCCCN1C(=O)CNC2 MCULE-6889335982 [0,0,0,2,0,0|2,0,0]=4 1758 B12R2.1081 [C@@H]12CCCC[C@@H]1C(CCC2)O MCULE-4935151944 [0,0,0,2,0,0|0,0,2]=4 1759 B12R2.1081 [C@@H]12CCCC[C@H]1C(=O)CCN2 MCULE-3781193879 [0,0,0,2,0,0|1,0,0]=3 1760 B12R2.1081 [C@@H]12CCCC[C@H]1C(=O)CCN2 MCULE-5151768324 [0,0,0,2,0,0|1,0,0]=3 1761 B12R2.1081 [C@H]12CCCC(=O)N1CCNC2 MCULE-4814093132 [0,0,0,2,0,0|2,0,0]=4 1762 B12R2.1081 [C@H]12CCCC(=O)N1CCNC2 MCULE-9247976237 [0,0,0,2,0,0|2,0,0]=4 1763 B12R2.1081 [C@H]12CCCCN1C(=O)CNC2 MCULE-6245598698 [0,0,0,2,0,0|2,0,0]=4 1764 B12R2.1081 [C@H]12CCCC[C@H]1C(CCC2)O MCULE-3874298930 [0,0,0,2,0,0|0,0,2]=4 1765 B12R2.2317 O=C1C2CCC(C1COC2)O MCULE-9468138741 [0,0,0,2,0,0|2,0,0]=4 1766 B12R2.82 CC1NCC2CCCN2C1=O MCULE-4807084329 [0,0,0,2,0,0|2,0,0]=4 1767 B12R2.82 CC1NCC2CCCN2C1=O MCULE-7293264638 [0,0,0,2,0,0|2,0,0]=4 1768 B12R2.82 CN1CCC2CNCC2C1=O MCULE-5172721279 [0,0,0,2,0,0|2,0,0]=4 1769 B12R2.82 CN1CC[C@@H]2CNC[C@@H]2C1=O MCULE-7921370446 [0,0,0,2,0,0|2,0,0]=4 1770 B12R2.82 C[C@@H]1NC[C@@H]2CCCN2C1=O MCULE-5345925323 [0,0,0,2,0,0|2,0,0]=4 1771 B12R2.82 C[C@@H]1NC[C@@H]2CCCN2C1=O MCULE-6397327484 [0,0,0,2,0,0|2,0,0]=4 1772 B12R2.82 C[C@@H]1NC[C@H]2CCCN2C1=O MCULE-1852127644 [0,0,0,2,0,0|2,0,0]=4 1773 B12R2.82 C[C@@H]1NC[C@H]2CCCN2C1=O MCULE-2686754010 [0,0,0,2,0,0|2,0,0]=4 1774 B12R2.82 C[C@H]1NC[C@@H]2CCCN2C1=O MCULE-3411878873 [0,0,0,2,0,0|2,0,0]=4 1775 B12R2.82 C[C@H]1NC[C@@H]2CCCN2C1=O MCULE-4181706164 [0,0,0,2,0,0|2,0,0]=4 1776 B12R2.82 C[C@H]1NC[C@H]2CCCN2C1=O MCULE-2167424341 [0,0,0,2,0,0|2,0,0]=4 1777 B12R2.82 C[C@H]1NC[C@H]2CCCN2C1=O MCULE-2380979743 [0,0,0,2,0,0|2,0,0]=4 1778 B12R2.82 [C@H]12CCN(C(=O)[C@H]1CNC2)C MCULE-2153344671 [0,0,0,2,0,0|2,0,0]=4 1779 B12R2.527 O=C1CCCCCCC12CC2 MCULE-4979412263 [0,0,0,2,0,0|0,0,0]=2 1780 B12R2.1067 O=C1NC2C1CCCCCC2 MCULE-1390214368 [0,0,0,2,0,0|1,0,0]=3 1781 B12R2.8 NC1CCCC12CCCCC2 MCULE-6542970559 [0,0,0,2,0,0|1,0,1]=4 1782 B12R2.8 NC1CCCC12CCCCC2 MCULE-8287369641 [0,0,0,2,0,0|1,0,1]=4 1783 B12R2.8 O=C1CCCC12CCCCC2 MCULE-9298549455 [0,0,0,2,0,0|0,0,0]=2 1784 B12R2.8 O=C1CCCC12CCCCO2 MCULE-1136852767 [0,0,0,2,0,0|1,0,0]=3 1785 B12R2.8 O=C1CCCC12CCNCC2 MCULE-1556519667 [0,0,0,2,0,0|1,0,0]=3 1786 B12R2.8 O=C1CCCC12CCNCC2 MCULE-5511389506 [0,0,0,2,0,0|1,0,0]=3 1787 B12R2.8 O=C1CCCC12CCOCC2 MCULE-5216795208 [0,0,0,2,0,0|1,0,0]=3 1788 B12R2.8 O=C1CCNC12CCCCC2 MCULE-2135170746 [0,0,0,2,0,0|1,0,0]=3 1789 B12R2.8 O=C1CCNC12CCCCC2 MCULE-5158335905 [0,0,0,2,0,0|1,0,0]=3 1790 B12R2.8 O=C1CCOC12CCCCC2 MCULE-7988152610 [0,0,0,2,0,0|1,0,0]=3 1791 B12R2.8 O=C1CCOC12CCOCC2 MCULE-2523497109 [0,0,0,2,0,0|2,0,0]=4 1792 B12R2.8 O=C1COCC12CCNCC2 MCULE-4028752836 [0,0,0,2,0,0|2,0,0]=4 1793 B12R2.8 O=C1COCC12CCNCC2 MCULE-7007400256 [0,0,0,2,0,0|2,0,0]=4 1794 B12R2.8 O=C1NCCC12CCCCC2 MCULE-6119455539 [0,0,0,2,0,0|1,0,0]=3 1795 B12R2.8 O=C1NCCC12CCCCN2 MCULE-7915882875 [0,0,0,2,0,0|2,0,0]=4 1796 B12R2.8 O=C1NCCC12CCCCN2 MCULE-8171160853 [0,0,0,2,0,0|2,0,0]=4 1797 B12R2.8 O=C1NCCC12CCCNC2 MCULE-3093425024 [0,0,0,2,0,0|2,0,0]=4 1798 B12R2.8 O=C1NCCC12CCCNC2 MCULE-5555034305 [0,0,0,2,0,0|2,0,0]=4 1799 B12R2.8 O=C1NCCC12CCNCC2 MCULE-1200506011 [0,0,0,2,0,0|2,0,0]=4 1800 B12R2.8 O=C1NCCC12CCNCC2 MCULE-1898782138 [0,0,0,2,0,0|2,0,0]=4 1801 B12R2.8 O=C1NCCC12CCOCC2 MCULE-7988759417 [0,0,0,2,0,0|2,0,0]=4 1802 B12R2.8 O=C1OCCC12CCCCC2 MCULE-8668963304 [0,0,0,2,0,0|1,0,0]=3 1803 B12R2.8 O=C1OCCC12CCNCC2 MCULE-3112643480 [0,0,0,2,0,0|2,0,0]=4 1804 B12R2.8 O=C1OCCC12CCNCC2 MCULE-4821486023 [0,0,0,2,0,0|2,0,0]=4 1805 B12R2.23 O=C1CCN1C2CCNCC2 MCULE-5833239774 [0,0,0,2,0,0|2,0,0]=4 1806 B12R2.23 O=C1CCN1C2CCNCC2 MCULE-7641617906 [0,0,0,2,0,0|2,0,0]=4 1807 B12R2.2058 C1CCC(NC1)CC2CCC2 MCULE-6956577475 [0,0,0,2,0,0|1,0,1]=4 1808 B12R2.4370 C1=NCCCC12CCCCC2 MCULE-5273050716 [0,0,0,2,0,0|2,0,0]=4 1809 B12R2.4370 C1CCC2(CC1)CCCNC2 MCULE-1604797009 [0,0,0,2,0,0|2,0,0]=4 1810 B12R2.4370 C1CCC2(CC1)CCCNC2 MCULE-9956091938 [0,0,0,2,0,0|2,0,0]=4 1811 B12R2.18 C12CCNCC1C(=O)N(C2)C MCULE-9080387229 [0,0,0,2,0,0|2,0,0]=4 1812 B12R2.18 CC1CC2CNCCN2C1=O MCULE-4391482993 [0,0,0,2,0,0|2,0,0]=4 1813 B12R2.18 CN1C[C@@H]2CCNC[C@@H]2C1=O MCULE-2440214710 [0,0,0,2,0,0|2,0,0]=4 1814 B12R2.18 NC1CC2CCCCN2C1=O MCULE-2295676222 [0,0,0,2,0,0|2,0,0]=4 1815 B12R2.18 NC1CC2CCCCN2C1=O MCULE-8697120383 [0,0,0,2,0,0|2,0,0]=4 1816 B12R2.18 [C@@H]12CCNC[C@@H]1C(=O)N(C2)C MCULE-8821608101 [0,0,0,2,0,0|2,0,0]=4 1817 B12R2.18 [C@H]12CCNC[C@H]1C(=O)N(C2)C MCULE-5746013976 [0,0,0,2,0,0|2,0,0]=4 1818 B12R2.18 [C@H]12CCNC[C@H]1C(=O)N(C2)C MCULE-8251231234 [0,0,0,2,0,0|2,0,0]=4 1819 B12R2.2048 NCC1CCCCC1C2CC2 MCULE-2631576623 [0,0,0,2,0,0|1,0,1]=4 1820 B12R2.2048 NCC1CCCCC1C2CC2 MCULE-3940595539 [0,0,0,2,0,0|1,0,1]=4 1821 B12R2.3807 C1CCCC(CC1)C2CNC2 MCULE-2488310560 [0,0,0,2,0,0|2,0,0]=4 1822 B12R2.3807 C1CCCC(CC1)C2CNC2 MCULE-9281592045 [0,0,0,2,0,0|2,0,0]=4 1823 B12R2.114 O=C1CCCC2CNCC2N1 MCULE-8908023981 [0,0,0,2,0,0|2,0,0]=4 1824 B12R2.114 O=C1CCC[C@@H]2CNC[C@@H]2N1 MCULE-9416220594 [0,0,0,2,0,0|2,0,0]=4 1825 B12R2.114 [C@H]12CCCC(=O)N[C@H]1CCN2 MCULE-1453873523 [0,0,0,2,0,0|2,0,0]=4 1826 B12R2.114 [C@H]12CCCC(=O)N[C@H]1CCN2 MCULE-8235994215 [0,0,0,2,0,0|2,0,0]=4 1827 B12R2.96 O=C1CCCC12CCCC2=O MCULE-1588691126 [0,0,0,2,0,0|1,0,1]=4