0 B11R0.3 BrCCCCCCCCCCBr MCULE-6596890795 [0,0,0,0,0,0|2,0,1]=3 1 B11R0.3 C#CCCCCCCCCCBr MCULE-7590250790 [0,0,0,0,0,0|2,0,1]=3 2 B11R0.3 C#CCCCCCCCCCC MCULE-8413126831 [0,0,0,0,0,0|1,0,1]=2 3 B11R0.3 C#CCCCCCCCCCO MCULE-5387959646 [0,0,0,0,0,0|2,0,1]=3 4 B11R0.3 C#CCOCCCCCCCBr MCULE-9946717443 [0,0,0,0,0,0|3,0,1]=4 5 B11R0.3 C=CCCCC=CCNCCC MCULE-7102803637 [0,0,0,0,0,0|2,0,2]=4 6 B11R0.3 C=CCCCCCCCCC=C MCULE-6018522624 [0,0,0,0,0,0|1,0,2]=3 7 B11R0.3 C=CCCCCCCCCC=O MCULE-2748563286 [0,0,0,0,0,0|0,0,2]=2 8 B11R0.3 C=CCCCCCCCCCBr MCULE-3292244728 [0,0,0,0,0,0|2,0,0]=2 9 B11R0.3 C=CCCCCCCCCCC MCULE-4843306057 [0,0,0,0,0,0|1,0,0]=1 10 B11R0.3 C=CCCCCCCCCCCl MCULE-9014492464 [0,0,0,0,0,0|2,0,0]=2 11 B11R0.3 C=CCCCCCCCCCN MCULE-7839357621 [0,0,0,0,0,0|2,0,0]=2 12 B11R0.3 C=CCCCCCCCCCO MCULE-8086496729 [0,0,0,0,0,0|2,0,0]=2 13 B11R0.3 C=CCOCCCCCCCC MCULE-6446691340 [0,0,0,0,0,0|2,0,0]=2 14 B11R0.3 CC#CCCCCCCCCO MCULE-5846426924 [0,0,0,0,0,0|0,0,4]=4 15 B11R0.3 CCCC/C=C\CCCCCC MCULE-3573509087 [0,0,0,0,0,0|1,0,3]=4 16 B11R0.3 CCCCC#CCCCCCC MCULE-8000000275 [0,0,0,0,0,0|1,0,3]=4 17 B11R0.3 CCCCC=CCCCCCC MCULE-5218594928 [0,0,0,0,0,0|1,0,3]=4 18 B11R0.3 CCCCCC#CCCCCC MCULE-6744782610 [0,0,0,0,0,0|1,0,3]=4 19 B11R0.3 CCCCCC/C=C/C=C/C=O MCULE-7651195452 [0,0,0,0,0,0|0,0,4]=4 20 B11R0.3 CCCCCCC=CC=CC=O MCULE-3891394680 [0,0,0,0,0,0|0,0,4]=4 21 B11R0.3 CCCCCCC=CCCC=O MCULE-4819548256 [0,0,0,0,0,0|0,0,2]=2 22 B11R0.3 CCCCCCCCC=CC=O MCULE-3569381965 [0,0,0,0,0,0|0,0,2]=2 23 B11R0.3 CCCCCCCCC=CCO MCULE-3768375215 [0,0,0,0,0,0|0,0,4]=4 24 B11R0.3 CCCCCCCCCCC#N MCULE-7957242645 [0,0,0,0,0,0|1,0,1]=2 25 B11R0.3 CCCCCCCCCCC=O MCULE-2842613213 [0,0,0,0,0,0|0,0,0]=0 26 B11R0.3 CCCCCCCCCCCBr MCULE-1007413186 [0,0,0,0,0,0|1,0,1]=2 27 B11R0.3 CCCCCCCCCCCC MCULE-3947157412 [0,0,0,0,0,0|1,0,1]=2 28 B11R0.3 CCCCCCCCCCCCl MCULE-9378407763 [0,0,0,0,0,0|1,0,1]=2 29 B11R0.3 CCCCCCCCCCCI MCULE-2947342202 [0,0,0,0,0,0|1,0,1]=2 30 B11R0.3 CCCCCCCCCCCN MCULE-7249870518 [0,0,0,0,0,0|1,0,1]=2 31 B11R0.3 CCCCCCCCCCCO MCULE-9897986150 [0,0,0,0,0,0|0,0,2]=2 32 B11R0.3 CCCCCCCCCCCS MCULE-6868324316 [0,0,0,0,0,0|0,1,1]=2 33 B11R0.3 CCCCCCCCCCNC MCULE-1416369118 [0,0,0,0,0,0|2,0,0]=2 34 B11R0.3 CCCCCCCCCCNC MCULE-6168905746 [0,0,0,0,0,0|2,0,0]=2 35 B11R0.3 CCCCCCCCCCOC MCULE-1264379510 [0,0,0,0,0,0|2,0,0]=2 36 B11R0.3 CCCCCCCCCCON MCULE-2069797576 [0,0,0,0,0,0|2,0,0]=2 37 B11R0.3 CCCCCCCCCCON MCULE-7830749583 [0,0,0,0,0,0|2,0,0]=2 38 B11R0.3 CCCCCCCCCCSC MCULE-7334657081 [0,0,0,0,0,0|2,0,0]=2 39 B11R0.3 CCCCCCCCCN=C=S MCULE-1076001046 [0,0,0,0,0,0|1,1,1]=3 40 B11R0.3 CCCCCCCCCN=N#N MCULE-3134047425 [0,0,0,0,0,0|3,0,0]=3 41 B11R0.3 CCCCCCCCCNCC MCULE-2932168769 [0,0,0,0,0,0|2,0,1]=3 42 B11R0.3 CCCCCCCCCOC=O MCULE-1616501735 [0,0,0,0,0,0|1,0,0]=1 43 B11R0.3 CCCCCCCCCSCC MCULE-6635551100 [0,0,0,0,0,0|2,0,1]=3 44 B11R0.3 CCCCCCCCNCCC MCULE-8531662839 [0,0,0,0,0,0|2,0,1]=3 45 B11R0.3 CCCCCCCCNCCN MCULE-7559905889 [0,0,0,0,0,0|2,0,1]=3 46 B11R0.3 CCCCCCCCNCCO MCULE-7874582103 [0,0,0,0,0,0|1,0,2]=3 47 B11R0.3 CCCCCCCCNOCC MCULE-3650695826 [0,0,0,0,0,0|3,0,1]=4 48 B11R0.3 CCCCCCCCNOCC MCULE-5548504565 [0,0,0,0,0,0|3,0,1]=4 49 B11R0.3 CCCCCCCCOCCCl MCULE-7562352297 [0,0,0,0,0,0|2,0,1]=3 50 B11R0.3 CCCCCCCCOCCN MCULE-8451506183 [0,0,0,0,0,0|2,0,1]=3 51 B11R0.3 CCCCCCCCOCCN MCULE-9814984146 [0,0,0,0,0,0|2,0,1]=3 52 B11R0.3 CCCCCCCCOCCO MCULE-9752110999 [0,0,0,0,0,0|1,0,2]=3 53 B11R0.3 CCCCCCCCSCC#N MCULE-7369043498 [0,0,0,0,0,0|2,0,1]=3 54 B11R0.3 CCCCCCCCSCCN MCULE-5010227243 [0,0,0,0,0,0|2,0,1]=3 55 B11R0.3 CCCCCCCCSCCO MCULE-6587527936 [0,0,0,0,0,0|1,0,2]=3 56 B11R0.3 CCCCCCCCSCCS MCULE-1947094413 [0,0,0,0,0,0|1,1,1]=3 57 B11R0.3 CCCCCCCNCCC#N MCULE-6001009722 [0,0,0,0,0,0|2,0,1]=3 58 B11R0.3 CCCCCCCNCCCC MCULE-4951242533 [0,0,0,0,0,0|2,0,1]=3 59 B11R0.3 CCCCCCCNCCCN MCULE-8536785750 [0,0,0,0,0,0|2,0,1]=3 60 B11R0.3 CCCCCCCNCCCO MCULE-1187615586 [0,0,0,0,0,0|1,0,2]=3 61 B11R0.3 CCCCCCNCCCOC MCULE-6742672078 [0,0,0,0,0,0|3,0,0]=3 62 B11R0.3 CCCCCC[NH2+]CCCCCl MCULE-2636909425 [0,0,0,0,0,0|2,0,1]=3 63 B11R0.3 CCCCCC[NH2+]CCCCCl MCULE-7512641705 [0,0,0,0,0,0|2,0,1]=3 64 B11R0.3 CCCCCSCCOCCO MCULE-1471152415 [0,0,0,0,0,0|2,0,2]=4 65 B11R0.3 CCCCCSSCCCCC MCULE-8624736602 [0,0,0,0,0,0|3,0,1]=4 66 B11R0.3 CCCCNCCNCCCC MCULE-3139037318 [0,0,0,0,0,0|3,0,1]=4 67 B11R0.3 CCCCNCCOCCCC MCULE-4594910638 [0,0,0,0,0,0|3,0,1]=4 68 B11R0.3 CCCCOCCOCCCC MCULE-5261480538 [0,0,0,0,0,0|3,0,1]=4 69 B11R0.3 CCCCOCCOCCOC MCULE-8111177194 [0,0,0,0,0,0|4,0,0]=4 70 B11R0.3 CCCCSCCSCCCC MCULE-9975798821 [0,0,0,0,0,0|3,0,1]=4 71 B11R0.3 CCNCCCCCCNCC MCULE-1626825133 [0,0,0,0,0,0|3,0,1]=4 72 B11R0.3 CCNCCCNCCCOC MCULE-1166620245 [0,0,0,0,0,0|4,0,0]=4 73 B11R0.3 CCOCCCCCCCCO MCULE-8839640265 [0,0,0,0,0,0|1,0,2]=3 74 B11R0.3 CCSCCCCCCSCC MCULE-1161288056 [0,0,0,0,0,0|3,0,1]=4 75 B11R0.3 CNCCCCCCCCNC MCULE-2607021323 [0,0,0,0,0,0|3,0,0]=3 76 B11R0.3 COCCCCCCCCC=O MCULE-4530790122 [0,0,0,0,0,0|1,0,0]=1 77 B11R0.3 COCCCCCCCCCBr MCULE-8740247574 [0,0,0,0,0,0|2,0,1]=3 78 B11R0.3 COCCCCCCCCCN MCULE-5428647902 [0,0,0,0,0,0|2,0,1]=3 79 B11R0.3 COCCCCCCCCCO MCULE-5483027656 [0,0,0,0,0,0|1,0,2]=3 80 B11R0.3 COCCCCCCCCOC MCULE-6292448161 [0,0,0,0,0,0|3,0,0]=3 81 B11R0.3 COCCOCCOCCC=O MCULE-7456622874 [0,0,0,0,0,0|3,0,0]=3 82 B11R0.3 ClCCCCCCCCCCCl MCULE-1936281020 [0,0,0,0,0,0|2,0,1]=3 83 B11R0.3 FCCCCCCCCCCBr MCULE-2498226293 [0,0,0,0,0,0|2,0,1]=3 84 B11R0.3 FCCCCCCCCCCCl MCULE-6086093448 [0,0,0,0,0,0|2,0,1]=3 85 B11R0.3 FCCCCCCCCCCF MCULE-7992467849 [0,0,0,0,0,0|2,0,1]=3 86 B11R0.3 ICCCCCCCCCCI MCULE-9838407052 [0,0,0,0,0,0|2,0,1]=3 87 B11R0.3 N#CCCCCCCCCC#N MCULE-6480099494 [0,0,0,0,0,0|2,0,2]=4 88 B11R0.3 N#N=NCCCCCCCCN MCULE-8754033148 [0,0,0,0,0,0|4,0,0]=4 89 B11R0.3 N#N=NCCCCCCCCO MCULE-2910168198 [0,0,0,0,0,0|4,0,0]=4 90 B11R0.3 NCCCCCCCCCCBr MCULE-2910198089 [0,0,0,0,0,0|2,0,1]=3 91 B11R0.3 NCCCCCCCCCCBr MCULE-9466370190 [0,0,0,0,0,0|2,0,1]=3 92 B11R0.3 NCCCCCCCCCCN MCULE-8635244158 [0,0,0,0,0,0|2,0,1]=3 93 B11R0.3 NCCCCCCCCCCO MCULE-6627355175 [0,0,0,0,0,0|1,0,2]=3 94 B11R0.3 NCCCCCCOCCCO MCULE-2806447363 [0,0,0,0,0,0|2,0,2]=4 95 B11R0.3 O=CCCCCCCCCCBr MCULE-3317881097 [0,0,0,0,0,0|1,0,0]=1 96 B11R0.3 O=CNCCCCCCNC=O MCULE-7870977207 [0,0,0,0,0,0|3,0,1]=4 97 B11R0.3 OCCCCCCCCCCBr MCULE-9238949531 [0,0,0,0,0,0|1,0,2]=3 98 B11R0.3 OCCCCCCCCCCCl MCULE-7857761317 [0,0,0,0,0,0|1,0,2]=3 99 B11R0.3 OCCCCCCCCCCF MCULE-6916719760 [0,0,0,0,0,0|1,0,2]=3 100 B11R0.3 OCCCCCCCCCCO MCULE-3187467810 [0,0,0,0,0,0|1,0,2]=3 101 B11R0.3 SCCCCCCCCCCS MCULE-7368208629 [0,0,0,0,0,0|1,1,1]=3 102 B11R0.3 [NH2+](CCCC)CCCCCCC MCULE-5696674484 [0,0,0,0,0,0|2,0,1]=3 103 B10R0.71 BrCCCCCCCCCBr MCULE-3406292941 [1,0,0,0,0,0|2,0,0]=3 104 B10R0.71 C#CCCCCCCCCC MCULE-3352869074 [1,0,0,0,0,0|0,0,2]=3 105 B10R0.71 C#CCCCCCCCCO MCULE-1465013673 [1,0,0,0,0,0|0,0,3]=4 106 B10R0.71 C(=CCCCCO)CCCC MCULE-5192933185 [1,0,0,0,0,0|0,0,3]=4 107 B10R0.71 C=CCCCCCCCC#N MCULE-1262733029 [1,0,0,0,0,0|1,0,2]=4 108 B10R0.71 C=CCCCCCCCC=C MCULE-5336376495 [1,0,0,0,0,0|0,0,3]=4 109 B10R0.71 C=CCCCCCCCC=O MCULE-2236196328 [1,0,0,0,0,0|0,0,2]=3 110 B10R0.71 C=CCCCCCCCCBr MCULE-9645873151 [1,0,0,0,0,0|1,0,1]=3 111 B10R0.71 C=CCCCCCCCCC MCULE-8437878932 [1,0,0,0,0,0|0,0,1]=2 112 B10R0.71 C=CCCCCCCCCI MCULE-5534023915 [1,0,0,0,0,0|1,0,1]=3 113 B10R0.71 C=CCCCCCCCCN MCULE-2867070960 [1,0,0,0,0,0|1,0,1]=3 114 B10R0.71 C=CCCCCCCCCN MCULE-6734552056 [1,0,0,0,0,0|1,0,1]=3 115 B10R0.71 C=CCCCCCCCCO MCULE-1808688008 [1,0,0,0,0,0|1,0,1]=3 116 B10R0.71 C=CCCCCSCCCC MCULE-9557499584 [1,0,0,0,0,0|1,0,1]=3 117 B10R0.71 C=CCOCCSCCCC MCULE-5814639814 [1,0,0,0,0,0|2,0,1]=4 118 B10R0.71 C=COCCCCCCCC MCULE-9207967577 [1,0,0,0,0,0|1,0,1]=3 119 B10R0.71 CCC#CCCCCCCC MCULE-4172735383 [1,0,0,0,0,0|0,0,3]=4 120 B10R0.71 CCC#CCCCCCCCl MCULE-2143365828 [1,0,0,0,0,0|1,0,2]=4 121 B10R0.71 CCCC/C=C/CCCCO MCULE-8537897542 [1,0,0,0,0,0|0,0,3]=4 122 B10R0.71 CCCC/C=C\CCCCO MCULE-8382129018 [1,0,0,0,0,0|0,0,3]=4 123 B10R0.71 CCCCC#CCCCCC MCULE-9228856431 [1,0,0,0,0,0|0,0,3]=4 124 B10R0.71 CCCCC#CCCCCO MCULE-2516123124 [1,0,0,0,0,0|0,0,3]=4 125 B10R0.71 CCCCC/C=C/CCC=O MCULE-6310350913 [1,0,0,0,0,0|0,0,2]=3 126 B10R0.71 CCCCC/C=C\CCC=O MCULE-2454675705 [1,0,0,0,0,0|0,0,2]=3 127 B10R0.71 CCCCC/C=C\CCCO MCULE-5673742797 [1,0,0,0,0,0|0,0,3]=4 128 B10R0.71 CCCCCC=CCCC=O MCULE-4591548304 [1,0,0,0,0,0|0,0,2]=3 129 B10R0.71 CCCCCC=CCCCO MCULE-4774794120 [1,0,0,0,0,0|0,0,3]=4 130 B10R0.71 CCCCCCC#CCCO MCULE-5377358049 [1,0,0,0,0,0|0,0,3]=4 131 B10R0.71 CCCCCCC=CCCO MCULE-7637000822 [1,0,0,0,0,0|0,0,3]=4 132 B10R0.71 CCCCCCCC#CCO MCULE-4211819006 [1,0,0,0,0,0|0,0,3]=4 133 B10R0.71 CCCCCCCC=CC=O MCULE-8898697953 [1,0,0,0,0,0|0,0,2]=3 134 B10R0.71 CCCCCCCC=CCO MCULE-3462895858 [1,0,0,0,0,0|0,0,3]=4 135 B10R0.71 CCCCCCCCC#CBr MCULE-1192896759 [1,0,0,0,0,0|1,0,2]=4 136 B10R0.71 CCCCCCCCC#CO MCULE-7543737628 [1,0,0,0,0,0|0,0,3]=4 137 B10R0.71 CCCCCCCCCC#N MCULE-1090480870 [1,0,0,0,0,0|1,0,1]=3 138 B10R0.71 CCCCCCCCCC=O MCULE-1782320282 [1,0,0,0,0,0|0,0,0]=1 139 B10R0.71 CCCCCCCCCCBr MCULE-1805531766 [1,0,0,0,0,0|1,0,0]=2 140 B10R0.71 CCCCCCCCCCC MCULE-7319807036 [1,0,0,0,0,0|0,0,1]=2 141 B10R0.71 CCCCCCCCCCCl MCULE-7602190189 [1,0,0,0,0,0|1,0,0]=2 142 B10R0.71 CCCCCCCCCCF MCULE-6490238051 [1,0,0,0,0,0|1,0,0]=2 143 B10R0.71 CCCCCCCCCCI MCULE-6718970716 [1,0,0,0,0,0|1,0,0]=2 144 B10R0.71 CCCCCCCCCCN MCULE-3389198970 [1,0,0,0,0,0|1,0,0]=2 145 B10R0.71 CCCCCCCCCCO MCULE-7579570663 [1,0,0,0,0,0|0,0,1]=2 146 B10R0.71 CCCCCCCCCCS MCULE-5945458624 [1,0,0,0,0,0|0,1,0]=2 147 B10R0.71 CCCCCCCCCNC MCULE-3969866054 [1,0,0,0,0,0|1,0,1]=3 148 B10R0.71 CCCCCCCCCNC MCULE-6631883657 [1,0,0,0,0,0|1,0,1]=3 149 B10R0.71 CCCCCCCCCOC MCULE-3906263885 [1,0,0,0,0,0|1,0,1]=3 150 B10R0.71 CCCCCCCCCON MCULE-2563186433 [1,0,0,0,0,0|2,0,0]=3 151 B10R0.71 CCCCCCCCCSC MCULE-9001057781 [1,0,0,0,0,0|1,0,1]=3 152 B10R0.71 CCCCCCCCN=C=O MCULE-8555471006 [1,0,0,0,0,0|1,0,1]=3 153 B10R0.71 CCCCCCCCN=C=S MCULE-4775323786 [1,0,0,0,0,0|1,1,1]=4 154 B10R0.71 CCCCCCCCN=N#N MCULE-4737472724 [1,0,0,0,0,0|3,0,0]=4 155 B10R0.71 CCCCCCCCNC=O MCULE-5327203150 [1,0,0,0,0,0|1,0,0]=2 156 B10R0.71 CCCCCCCCOC=O MCULE-6865253802 [1,0,0,0,0,0|1,0,0]=2 157 B10R0.71 CCCCCCCCOCC MCULE-7803614357 [1,0,0,0,0,0|1,0,1]=3 158 B10R0.71 CCCCCCCCOCCl MCULE-8103995676 [1,0,0,0,0,0|2,0,0]=3 159 B10R0.71 CCCCCCCNOCC MCULE-6718978813 [1,0,0,0,0,0|2,0,1]=4 160 B10R0.71 CCCCCCCNOCC MCULE-7446092946 [1,0,0,0,0,0|2,0,1]=4 161 B10R0.71 CCCCCCCOCCCl MCULE-9608529645 [1,0,0,0,0,0|2,0,0]=3 162 B10R0.71 CCCCCCCOCCO MCULE-4391734532 [1,0,0,0,0,0|1,0,1]=3 163 B10R0.71 CCCCCCCOCCS MCULE-8215096371 [1,0,0,0,0,0|1,1,0]=3 164 B10R0.71 CCCCCCCSCCO MCULE-5713036847 [1,0,0,0,0,0|1,0,1]=3 165 B10R0.71 CCCCCCNCCC#N MCULE-2150602581 [1,0,0,0,0,0|2,0,1]=4 166 B10R0.71 CCCCCCNCCCC MCULE-1698769182 [1,0,0,0,0,0|1,0,1]=3 167 B10R0.71 CCCCCCNCCCCl MCULE-2065775862 [1,0,0,0,0,0|2,0,0]=3 168 B10R0.71 CCCCCCNCCCN MCULE-7482733368 [1,0,0,0,0,0|2,0,0]=3 169 B10R0.71 CCCCCC[NH2+]CCCCl MCULE-1476963531 [1,0,0,0,0,0|2,0,0]=3 170 B10R0.71 CCCCCNCCCCC MCULE-6460289904 [1,0,0,0,0,0|1,0,1]=3 171 B10R0.71 CCCCCNCCCCC MCULE-7466612345 [1,0,0,0,0,0|1,0,1]=3 172 B10R0.71 CCCCCNCCCOC MCULE-8182280213 [1,0,0,0,0,0|2,0,1]=4 173 B10R0.71 CCCCCOCCCCC MCULE-2510849143 [1,0,0,0,0,0|1,0,1]=3 174 B10R0.71 CCCCCSCCCCC MCULE-3839664161 [1,0,0,0,0,0|1,0,1]=3 175 B10R0.71 CCCCNCCOCCO MCULE-6722908845 [1,0,0,0,0,0|2,0,1]=4 176 B10R0.71 CCCCOCCOCCCl MCULE-8993573654 [1,0,0,0,0,0|3,0,0]=4 177 B10R0.71 CCCCOCCOCCN MCULE-5064402317 [1,0,0,0,0,0|3,0,0]=4 178 B10R0.71 CCCCOCCOCCO MCULE-9776383171 [1,0,0,0,0,0|2,0,1]=4 179 B10R0.71 CCCCOCCOCCS MCULE-8185433281 [1,0,0,0,0,0|2,1,0]=4 180 B10R0.71 CCCCOCCSCCO MCULE-1950831912 [1,0,0,0,0,0|2,0,1]=4 181 B10R0.71 CCCCOCOCCCC MCULE-5701893914 [1,0,0,0,0,0|2,0,1]=4 182 B10R0.71 CCCCSCCOCCO MCULE-8485842279 [1,0,0,0,0,0|2,0,1]=4 183 B10R0.71 CCNCCCNCCCO MCULE-4185964299 [1,0,0,0,0,0|2,0,1]=4 184 B10R0.71 COCCCCCCCCO MCULE-1529283698 [1,0,0,0,0,0|1,0,1]=3 185 B10R0.71 ClCCCCCCCCCCl MCULE-3488427873 [1,0,0,0,0,0|2,0,0]=3 186 B10R0.71 ClCCCCOCCCCCl MCULE-4604276964 [1,0,0,0,0,0|3,0,0]=4 187 B10R0.71 NCCCCCCCCCN MCULE-8114252394 [1,0,0,0,0,0|2,0,0]=3 188 B10R0.71 NCCCCCCCCCO MCULE-2359018291 [1,0,0,0,0,0|1,0,1]=3 189 B10R0.71 NCCCCCNCCCN MCULE-2406277230 [1,0,0,0,0,0|3,0,0]=4 190 B10R0.71 NCCCCCNCCCN MCULE-9885228454 [1,0,0,0,0,0|3,0,0]=4 191 B10R0.71 NCCCCNCCCCN MCULE-2945581667 [1,0,0,0,0,0|3,0,0]=4 192 B10R0.71 NCCCCNCCCCN MCULE-6342087459 [1,0,0,0,0,0|3,0,0]=4 193 B10R0.71 O=CCCCCCCCCBr MCULE-7863300341 [1,0,0,0,0,0|1,0,0]=2 194 B10R0.71 OCCCCCCCCCBr MCULE-7708976482 [1,0,0,0,0,0|1,0,1]=3 195 B10R0.71 OCCCCCCCCCCl MCULE-4637398536 [1,0,0,0,0,0|1,0,1]=3 196 B10R0.71 OCCCCCCCCCI MCULE-6281256155 [1,0,0,0,0,0|1,0,1]=3 197 B10R0.71 OCCCCCCCCCO MCULE-3258442969 [1,0,0,0,0,0|1,0,1]=3 198 B10R0.71 OCCCCCCCCCS MCULE-3447886598 [1,0,0,0,0,0|1,0,1]=3 199 B10R0.71 OCCCCCCOCCO MCULE-5642986797 [1,0,0,0,0,0|2,0,1]=4 200 B10R0.71 OCCCCNCCCCO MCULE-8546417896 [1,0,0,0,0,0|2,0,1]=4 201 B10R0.71 OCCCCOCCCCO MCULE-7966192236 [1,0,0,0,0,0|2,0,1]=4 202 B10R0.71 OCCOCCCCCCCl MCULE-3240737723 [1,0,0,0,0,0|2,0,1]=4 203 B10R0.71 SCCCCCCCCCS MCULE-1712418590 [1,0,0,0,0,0|1,1,0]=3 204 B10R0.71 [NH2+](CCCC)CCCCCC MCULE-8926764515 [1,0,0,0,0,0|1,0,1]=3 205 B12R0.1 C=CCC(C)CCCCCCCC MCULE-8322698729 [0,1,0,0,0,0|1,0,0]=2 206 B12R0.1 C=CCCCCCCC(=O)OCC MCULE-2529046007 [0,1,0,0,0,0|2,0,1]=4 207 B12R0.1 CCCCCCCCC(C)CCC MCULE-8337776414 [0,1,0,0,0,0|1,0,1]=3 208 B12R0.1 CCCCCCCCC(O)CCC MCULE-4193341089 [0,1,0,0,0,0|1,0,1]=3 209 B12R0.1 CCCCCCCCS(=O)CCCl MCULE-5342861128 [0,1,0,0,0,0|2,0,1]=4 210 B12R0.1 CCCCCCCCS(=O)CCO MCULE-7963242650 [0,1,0,0,0,0|1,0,2]=4 211 B12R0.5 BrCCCCCCCCCCCBr MCULE-7714737833 [0,1,0,0,0,0|1,0,1]=3 212 B12R0.5 C#CCCCCCCCCCCC MCULE-4966581415 [0,1,0,0,0,0|1,0,1]=3 213 B12R0.5 C#CCCCCCCCCCCO MCULE-3338769733 [0,1,0,0,0,0|1,0,1]=3 214 B12R0.5 C#CCOCCCCCCCCO MCULE-9833842442 [0,1,0,0,0,0|2,0,1]=4 215 B12R0.5 C=CCCCC=CCNCCCC MCULE-3142484929 [0,1,0,0,0,0|1,0,2]=4 216 B12R0.5 C=CCCCCCCCCCC#N MCULE-4908683971 [0,1,0,0,0,0|1,0,1]=3 217 B12R0.5 C=CCCCCCCCCCC=C MCULE-6862008178 [0,1,0,0,0,0|1,0,1]=3 218 B12R0.5 C=CCCCCCCCCCC=O MCULE-4798960934 [0,1,0,0,0,0|0,0,1]=2 219 B12R0.5 C=CCCCCCCCCCCBr MCULE-1450832602 [0,1,0,0,0,0|1,0,0]=2 220 B12R0.5 C=CCCCCCCCCCCC MCULE-7790972998 [0,1,0,0,0,0|1,0,0]=2 221 B12R0.5 C=CCCCCCCCCCCO MCULE-9436785815 [0,1,0,0,0,0|1,0,0]=2 222 B12R0.5 C=CCOCCCCCCCCO MCULE-5655873802 [0,1,0,0,0,0|2,0,0]=3 223 B12R0.5 C=COCCCCCCCCCC MCULE-9853638067 [0,1,0,0,0,0|1,0,0]=2 224 B12R0.5 C=CSCCCCCCCCCC MCULE-4125685210 [0,1,0,0,0,0|1,0,0]=2 225 B12R0.5 CC/C=C\CCCCCCCCO MCULE-3025560116 [0,1,0,0,0,0|0,0,3]=4 226 B12R0.5 CCC#CCCCCCCCCO MCULE-9432389600 [0,1,0,0,0,0|0,0,3]=4 227 B12R0.5 CCC/C=C\CCCCCCCO MCULE-1596799446 [0,1,0,0,0,0|0,0,3]=4 228 B12R0.5 CCC=CCCCCCCCCO MCULE-1639369196 [0,1,0,0,0,0|0,0,3]=4 229 B12R0.5 CCCC/C=C/CCCCCCO MCULE-1140179766 [0,1,0,0,0,0|0,0,3]=4 230 B12R0.5 CCCC/C=C\CCCCCCO MCULE-5650770931 [0,1,0,0,0,0|0,0,3]=4 231 B12R0.5 CCCC=CCCCCCCCO MCULE-6437929263 [0,1,0,0,0,0|0,0,3]=4 232 B12R0.5 CCCCC#CCCCCCCO MCULE-8221472970 [0,1,0,0,0,0|0,0,3]=4 233 B12R0.5 CCCCC=CCCCCCCO MCULE-6634191602 [0,1,0,0,0,0|0,0,3]=4 234 B12R0.5 CCCCCCC/C=C/C=C/C=O MCULE-2842287177 [0,1,0,0,0,0|0,0,3]=4 235 B12R0.5 CCCCCCCC=CC=CC=O MCULE-2297529084 [0,1,0,0,0,0|0,0,3]=4 236 B12R0.5 CCCCCCCCC/C=C/C=O MCULE-3924650225 [0,1,0,0,0,0|0,0,1]=2 237 B12R0.5 CCCCCCCCC/C=C/CO MCULE-8437286382 [0,1,0,0,0,0|0,0,2]=3 238 B12R0.5 CCCCCCCCC=CCCO MCULE-1965044026 [0,1,0,0,0,0|0,0,3]=4 239 B12R0.5 CCCCCCCCCC#CCO MCULE-3667812839 [0,1,0,0,0,0|0,0,3]=4 240 B12R0.5 CCCCCCCCCC/C=C/I MCULE-7924200766 [0,1,0,0,0,0|1,0,0]=2 241 B12R0.5 CCCCCCCCCC=CC=O MCULE-6984246846 [0,1,0,0,0,0|0,0,1]=2 242 B12R0.5 CCCCCCCCCC=CCO MCULE-9263380318 [0,1,0,0,0,0|0,0,2]=3 243 B12R0.5 CCCCCCCCCCCC#N MCULE-4898299264 [0,1,0,0,0,0|1,0,1]=3 244 B12R0.5 CCCCCCCCCCCC=O MCULE-3814557174 [0,1,0,0,0,0|0,0,0]=1 245 B12R0.5 CCCCCCCCCCCCBr MCULE-2442495006 [0,1,0,0,0,0|1,0,1]=3 246 B12R0.5 CCCCCCCCCCCCC MCULE-7749861366 [0,1,0,0,0,0|1,0,1]=3 247 B12R0.5 CCCCCCCCCCCCCl MCULE-6025385532 [0,1,0,0,0,0|1,0,1]=3 248 B12R0.5 CCCCCCCCCCCCF MCULE-3563531940 [0,1,0,0,0,0|1,0,1]=3 249 B12R0.5 CCCCCCCCCCCCI MCULE-6449418786 [0,1,0,0,0,0|1,0,1]=3 250 B12R0.5 CCCCCCCCCCCCN MCULE-1282419209 [0,1,0,0,0,0|1,0,1]=3 251 B12R0.5 CCCCCCCCCCCCN MCULE-1312431857 [0,1,0,0,0,0|1,0,1]=3 252 B12R0.5 CCCCCCCCCCCCN MCULE-3936839656 [0,1,0,0,0,0|1,0,1]=3 253 B12R0.5 CCCCCCCCCCCCN MCULE-8497998841 [0,1,0,0,0,0|1,0,1]=3 254 B12R0.5 CCCCCCCCCCCCN MCULE-9101484482 [0,1,0,0,0,0|1,0,1]=3 255 B12R0.5 CCCCCCCCCCCCO MCULE-3423087499 [0,1,0,0,0,0|0,0,2]=3 256 B12R0.5 CCCCCCCCCCCCO MCULE-9381688904 [0,1,0,0,0,0|0,0,2]=3 257 B12R0.5 CCCCCCCCCCCCS MCULE-8388213802 [0,1,0,0,0,0|0,1,1]=3 258 B12R0.5 CCCCCCCCCCCNC MCULE-4232799137 [0,1,0,0,0,0|1,0,1]=3 259 B12R0.5 CCCCCCCCCCCNC MCULE-9324463288 [0,1,0,0,0,0|1,0,1]=3 260 B12R0.5 CCCCCCCCCCN=C=S MCULE-4799395674 [0,1,0,0,0,0|0,1,1]=3 261 B12R0.5 CCCCCCCCCCN=N#N MCULE-3752897707 [0,1,0,0,0,0|2,0,0]=3 262 B12R0.5 CCCCCCCCCCNC=O MCULE-2199641461 [0,1,0,0,0,0|0,0,0]=1 263 B12R0.5 CCCCCCCCCCSC#N MCULE-1909270846 [0,1,0,0,0,0|1,0,1]=3 264 B12R0.5 CCCCCCCCCCSCC MCULE-4046728399 [0,1,0,0,0,0|1,0,1]=3 265 B12R0.5 CCCCCCCCCSCCO MCULE-1890346670 [0,1,0,0,0,0|0,0,2]=3 266 B12R0.5 CCCCCCCCNCCC#N MCULE-1909140913 [0,1,0,0,0,0|1,0,1]=3 267 B12R0.5 CCCCCCCCNCCCC MCULE-6370859761 [0,1,0,0,0,0|1,0,1]=3 268 B12R0.5 CCCCCCCCNCCCN MCULE-1576630780 [0,1,0,0,0,0|1,0,1]=3 269 B12R0.5 CCCCCCCCNCCOC MCULE-9794668613 [0,1,0,0,0,0|2,0,0]=3 270 B12R0.5 CCCCCCCCOCCCN MCULE-3428959730 [0,1,0,0,0,0|1,0,1]=3 271 B12R0.5 CCCCCCCCOCCNC MCULE-3720493532 [0,1,0,0,0,0|2,0,0]=3 272 B12R0.5 CCCCCCCCOCCNC MCULE-6027502699 [0,1,0,0,0,0|2,0,0]=3 273 B12R0.5 CCCCCCCCSCCNC MCULE-1591454214 [0,1,0,0,0,0|2,0,0]=3 274 B12R0.5 CCCCCCCCSCCNC MCULE-9041733565 [0,1,0,0,0,0|2,0,0]=3 275 B12R0.5 CCCCCCCNCCCNC MCULE-3143160534 [0,1,0,0,0,0|2,0,0]=3 276 B12R0.5 CCCCCCCOCCCC=O MCULE-7580382219 [0,1,0,0,0,0|0,0,0]=1 277 B12R0.5 CCCCCCCOCCCCO MCULE-4232162406 [0,1,0,0,0,0|0,0,2]=3 278 B12R0.5 CCCCCCNCCCCCC MCULE-3670409724 [0,1,0,0,0,0|1,0,1]=3 279 B12R0.5 CCCCCCNCCCCCC MCULE-4867029659 [0,1,0,0,0,0|1,0,1]=3 280 B12R0.5 CCCCCCNCCCCCC MCULE-9932038203 [0,1,0,0,0,0|1,0,1]=3 281 B12R0.5 CCCCCCOCCCCCC MCULE-3976538682 [0,1,0,0,0,0|1,0,1]=3 282 B12R0.5 CCCCCCOCCOCCCl MCULE-9978237089 [0,1,0,0,0,0|2,0,1]=4 283 B12R0.5 CCCCCCOCCOCCO MCULE-8195636539 [0,1,0,0,0,0|1,0,2]=4 284 B12R0.5 CCCCCCSCCCCCC MCULE-2928486782 [0,1,0,0,0,0|1,0,1]=3 285 B12R0.5 CCCCCCSCCOCCO MCULE-3415483366 [0,1,0,0,0,0|1,0,2]=4 286 B12R0.5 CCCOCCCCCCCCO MCULE-6159515912 [0,1,0,0,0,0|0,0,2]=3 287 B12R0.5 CCOCCCCCCCCCBr MCULE-4453801533 [0,1,0,0,0,0|1,0,1]=3 288 B12R0.5 CCOCCCCCCCCCO MCULE-6343777651 [0,1,0,0,0,0|0,0,2]=3 289 B12R0.5 ClCCCCCOCCCCCCl MCULE-6237389376 [0,1,0,0,0,0|2,0,1]=4 290 B12R0.5 ICCCCCCCCCCCI MCULE-1394798562 [0,1,0,0,0,0|1,0,1]=3 291 B12R0.5 N#CCCCCCCCCCC#N MCULE-3961185998 [0,1,0,0,0,0|1,0,2]=4 292 B12R0.5 N#N=NCCCCCCCCCN MCULE-3364636937 [0,1,0,0,0,0|3,0,0]=4 293 B12R0.5 N#N=NCCCCCCCCCO MCULE-6954750928 [0,1,0,0,0,0|3,0,0]=4 294 B12R0.5 NCCCCCCCCCCCN MCULE-2996124008 [0,1,0,0,0,0|1,0,1]=3 295 B12R0.5 NCCCCCCCCCCCO MCULE-5135515993 [0,1,0,0,0,0|0,0,2]=3 296 B12R0.5 NCCCCCCCCCCCS MCULE-2278372977 [0,1,0,0,0,0|0,1,1]=3 297 B12R0.5 NCCCCCCCCCCCS MCULE-7023358275 [0,1,0,0,0,0|0,1,1]=3 298 B12R0.5 O=CCCCCCCCCCCBr MCULE-8057974781 [0,1,0,0,0,0|0,0,0]=1 299 B12R0.5 OCCCCCCCCCCCBr MCULE-5881088914 [0,1,0,0,0,0|0,0,2]=3 300 B12R0.5 OCCCCCCCCCCCO MCULE-6987509130 [0,1,0,0,0,0|0,0,2]=3 301 B12R0.5 OCCCCCCCCCCCS MCULE-4791107478 [0,1,0,0,0,0|0,0,2]=3 302 B12R0.5 OCCCCCOCCCCCO MCULE-5243842214 [0,1,0,0,0,0|1,0,2]=4 303 B12R0.5 OCCCCCSCCCCCO MCULE-3316565485 [0,1,0,0,0,0|1,0,2]=4 304 B12R0.5 SCCCCCCCCCCCBr MCULE-7291453493 [0,1,0,0,0,0|0,1,1]=3 305 B12R0.5 [NH2+](CCCC)CCCCCCCC MCULE-9696707679 [0,1,0,0,0,0|1,0,1]=3 306 B12R0.47 C=CCOCC(O)CSCCCC MCULE-3081176081 [0,1,0,0,0,0|3,0,0]=4 307 B12R0.47 CCCCCCC(=O)CCCCC MCULE-2532885187 [0,1,0,0,0,0|1,0,2]=4 308 B12R0.47 CCCCCCC(O)CCCCC MCULE-9826172328 [0,1,0,0,0,0|1,0,1]=3 309 B12R0.206 CCCCCCCC(=O)CCCC MCULE-8871455068 [0,1,0,0,0,0|1,0,2]=4 310 B12R0.206 CCCCCCCC(O)CCCC MCULE-7645297712 [0,1,0,0,0,0|1,0,1]=3 311 B12R0.206 CCCCCCOC(C)CCCC MCULE-3599664509 [0,1,0,0,0,0|2,0,1]=4 312 B12R0.234 C#CCCCCCCCCC(=O)Cl MCULE-2889527190 [0,1,0,0,0,0|0,0,2]=3 313 B12R0.234 C#CCCCCCCCCC(=O)O MCULE-2483655428 [0,1,0,0,0,0|0,0,2]=3 314 B12R0.234 C=C(Br)CCCCCCCCCC MCULE-6429692740 [0,1,0,0,0,0|1,0,0]=2 315 B12R0.234 C=C(C)CCCCCCCCCC MCULE-5430192671 [0,1,0,0,0,0|1,0,0]=2 316 B12R0.234 C=C(Cl)CCCCCCCCCC MCULE-5277185113 [0,1,0,0,0,0|1,0,0]=2 317 B12R0.234 C=CCCCCCCCCC(=O)C MCULE-8465504630 [0,1,0,0,0,0|0,0,2]=3 318 B12R0.234 C=CCCCCCCCCC(=O)Cl MCULE-1643300518 [0,1,0,0,0,0|0,0,2]=3 319 B12R0.234 C=CCCCCCCCCC(=O)N MCULE-2069893872 [0,1,0,0,0,0|0,0,2]=3 320 B12R0.234 C=CCCCCCCCCC(=O)O MCULE-7928135942 [0,1,0,0,0,0|0,0,2]=3 321 B12R0.234 C=CCCCCCCCCC(=O)[O-] MCULE-4921741648 [0,1,0,0,0,0|0,0,2]=3 322 B12R0.234 C=CCCCCCCCCC(=O)[O-] MCULE-8671525222 [0,1,0,0,0,0|0,0,2]=3 323 B12R0.234 C=CCCCCCCCCN(=O)=O MCULE-9960791760 [0,1,0,0,0,0|1,0,2]=4 324 B12R0.234 C=CCCCCCCCOC(=O)C MCULE-7392620730 [0,1,0,0,0,0|1,0,2]=4 325 B12R0.234 CC#CCCCCCCCC(=O)O MCULE-8975663292 [0,1,0,0,0,0|0,0,2]=3 326 B12R0.234 CC(=O)NCCCCNCCCN MCULE-7493998252 [0,1,0,0,0,0|3,0,0]=4 327 B12R0.234 CC(=O)NCCCCNCCCN MCULE-9577502089 [0,1,0,0,0,0|3,0,0]=4 328 B12R0.234 CC(=O)NCCCNCCCCN MCULE-3303778613 [0,1,0,0,0,0|3,0,0]=4 329 B12R0.234 CC(=O)NCCCNCCCCN MCULE-8365270729 [0,1,0,0,0,0|3,0,0]=4 330 B12R0.234 CC(=O)OCCCCCCCCBr MCULE-4728650316 [0,1,0,0,0,0|2,0,0]=3 331 B12R0.234 CCC=CCCCCCOC(=O)C MCULE-2714811926 [0,1,0,0,0,0|1,0,2]=4 332 B12R0.234 CCCCCCC/C=C/CC(=O)C MCULE-6992455059 [0,1,0,0,0,0|0,0,2]=3 333 B12R0.234 CCCCCCCC/C=C/C(=O)O MCULE-6786701242 [0,1,0,0,0,0|0,0,2]=3 334 B12R0.234 CCCCCCCCC=CC(=O)O MCULE-7750983255 [0,1,0,0,0,0|0,0,2]=3 335 B12R0.234 CCCCCCCCCCB(O)O MCULE-6277841305 [0,1,0,0,0,0|1,0,1]=3 336 B12R0.234 CCCCCCCCCCC(=O)C MCULE-3936750617 [0,1,0,0,0,0|0,0,0]=1 337 B12R0.234 CCCCCCCCCCC(=O)Cl MCULE-1131766423 [0,1,0,0,0,0|0,0,0]=1 338 B12R0.234 CCCCCCCCCCC(=O)N MCULE-7086521203 [0,1,0,0,0,0|0,0,0]=1 339 B12R0.234 CCCCCCCCCCC(=O)O MCULE-5110587542 [0,1,0,0,0,0|0,0,0]=1 340 B12R0.234 CCCCCCCCCCC(C)N MCULE-6206499625 [0,1,0,0,0,0|1,0,1]=3 341 B12R0.234 CCCCCCCCCCC(C)O MCULE-9407036721 [0,1,0,0,0,0|0,0,2]=3 342 B12R0.234 CCCCCCCCCCN(=O)=O MCULE-9525688454 [0,1,0,0,0,0|1,0,0]=2 343 B12R0.234 CCCCCCCCCCN(C)C MCULE-5051937267 [0,1,0,0,0,0|2,0,0]=3 344 B12R0.234 CCCCCCCCCCS(=O)C MCULE-1607212944 [0,1,0,0,0,0|1,0,0]=2 345 B12R0.234 CCCCCCCCCOC(=O)C MCULE-7712513310 [0,1,0,0,0,0|1,0,0]=2 346 B12R0.234 CCCCCCCCCOC(=O)Cl MCULE-4937657236 [0,1,0,0,0,0|1,0,0]=2 347 B12R0.234 CCCCCCCCCOC(=S)[S-] MCULE-1048722427 [0,1,0,0,0,0|1,1,0]=3 348 B12R0.234 CCCCCCCCCOC(=S)[S-] MCULE-2082950273 [0,1,0,0,0,0|1,1,0]=3 349 B12R0.234 CCCCCCCCCSC(=N)N MCULE-2574065227 [0,1,0,0,0,0|2,0,0]=3 350 B12R0.234 CCCCCCCCCSC(=N)N MCULE-7175152082 [0,1,0,0,0,0|2,0,0]=3 351 B12R0.234 CCCCCCCCNCC(C)O MCULE-9293787711 [0,1,0,0,0,0|1,0,2]=4 352 B12R0.234 CCCCCCCCOCC(=O)O MCULE-8710960938 [0,1,0,0,0,0|1,0,0]=2 353 B12R0.234 CCCCCCCCOCC(C)O MCULE-7262368590 [0,1,0,0,0,0|1,0,2]=4 354 B12R0.234 CCCCCCCCSCC(=O)N MCULE-3095528852 [0,1,0,0,0,0|1,0,0]=2 355 B12R0.234 CCCCCCCCSCC(=O)O MCULE-8082253480 [0,1,0,0,0,0|1,0,0]=2 356 B12R0.234 CCCCCCCC[NH2+]CC(=O)O MCULE-1736831432 [0,1,0,0,0,0|1,0,0]=2 357 B12R0.234 CCCCCCCC[NH2+]CC(=O)O MCULE-8284012398 [0,1,0,0,0,0|1,0,0]=2 358 B12R0.234 CCCCCCCNCCC(=O)N MCULE-9973742738 [0,1,0,0,0,0|1,0,0]=2 359 B12R0.234 CCOCCCCCCCC(=O)O MCULE-4393917993 [0,1,0,0,0,0|1,0,0]=2 360 B12R0.234 CNCCOCCOCCC(=O)O MCULE-5859151176 [0,1,0,0,0,0|3,0,0]=4 361 B12R0.234 COCCOCCOCCC(=O)Cl MCULE-4397360863 [0,1,0,0,0,0|3,0,0]=4 362 B12R0.234 COCCOCCOCCC(=O)O MCULE-3073877899 [0,1,0,0,0,0|3,0,0]=4 363 B12R0.234 N#CCCCCCCCCC(=O)O MCULE-1219422242 [0,1,0,0,0,0|1,0,1]=3 364 B12R0.234 N#N=NCCCCCCCC(=O)O MCULE-5693417997 [0,1,0,0,0,0|3,0,0]=4 365 B12R0.234 NCCCCCCCCCC(=O)O MCULE-1324986945 [0,1,0,0,0,0|1,0,0]=2 366 B12R0.234 NCCOCCOCCCC(=O)O MCULE-2525701431 [0,1,0,0,0,0|3,0,0]=4 367 B12R0.234 O=C(O)/C=C/CCCCCCCO MCULE-7936793574 [0,1,0,0,0,0|1,0,2]=4 368 B12R0.234 O=C(O)C=CCCCCCCCO MCULE-6067845776 [0,1,0,0,0,0|1,0,2]=4 369 B12R0.234 O=C(O)CCCCCCCCCBr MCULE-5728710095 [0,1,0,0,0,0|1,0,0]=2 370 B12R0.234 O=C(O)CCCCCCCCCF MCULE-1907577974 [0,1,0,0,0,0|1,0,0]=2 371 B12R0.234 O=C(O)CCCCCCCCCO MCULE-3771681317 [0,1,0,0,0,0|1,0,0]=2 372 B12R0.234 O=N(=O)CCCCCCCCCBr MCULE-3636866484 [0,1,0,0,0,0|2,0,0]=3 373 B12R0.234 O=N(=O)CCCCCCCCCO MCULE-4658294221 [0,1,0,0,0,0|2,0,0]=3 374 B12R0.248 C=CC(=O)NCCCCCCCC MCULE-9686941876 [0,1,0,0,0,0|2,0,1]=4 375 B12R0.248 C=CC(=O)OCCCCCCCC MCULE-8708207271 [0,1,0,0,0,0|2,0,1]=4 376 B12R0.248 C=CCCCCCCCC(=O)OC MCULE-1843303649 [0,1,0,0,0,0|2,0,1]=4 377 B12R0.248 CCCCCCCCC/C(=N\O)/N MCULE-5582103663 [0,1,0,0,0,0|1,0,2]=4 378 B12R0.248 CCCCCCCCCC(=O)CC MCULE-8070056231 [0,1,0,0,0,0|1,0,2]=4 379 B12R0.248 CCCCCCCCCC(=O)NC MCULE-5903490737 [0,1,0,0,0,0|2,0,1]=4 380 B12R0.248 CCCCCCCCCC(=O)NN MCULE-5225093755 [0,1,0,0,0,0|2,0,1]=4 381 B12R0.248 CCCCCCCCCC(=O)NO MCULE-3922115888 [0,1,0,0,0,0|1,0,2]=4 382 B12R0.248 CCCCCCCCCC(=O)OC MCULE-3080392178 [0,1,0,0,0,0|2,0,1]=4 383 B12R0.248 CCCCCCCCCC(C)C=O MCULE-7485962352 [0,1,0,0,0,0|0,0,0]=1 384 B12R0.248 CCCCCCCCCC(O)CC MCULE-8088841540 [0,1,0,0,0,0|1,0,1]=3 385 B12R0.248 CCCCCCCCCC(O)CO MCULE-3958170897 [0,1,0,0,0,0|0,0,2]=3 386 B12R0.248 CCCCCCCCCC([NH3+])CO MCULE-4329139225 [0,1,0,0,0,0|0,0,2]=3 387 B12R0.248 CCCCCCCCCC([NH3+])CO MCULE-6424120612 [0,1,0,0,0,0|0,0,2]=3 388 B12R0.248 COC(=O)CCCCCCCC=O MCULE-8962678443 [0,1,0,0,0,0|1,0,1]=3 389 B12R0.248 OCCCCCCCCC(O)CO MCULE-5399962147 [0,1,0,0,0,0|1,0,2]=4 390 B12R1.8 BrCCCCCN1CCCCC1 MCULE-3804322574 [0,0,0,1,0,0|2,0,1]=4 391 B12R1.8 BrCCCCCN1CCCCC1 MCULE-4019879158 [0,0,0,1,0,0|2,0,1]=4 392 B12R1.8 BrCCCCOC1CCCCC1 MCULE-5833376984 [0,0,0,1,0,0|2,0,1]=4 393 B12R1.8 C=CCCCCC1CCCCC1 MCULE-1420996147 [0,0,0,1,0,0|1,0,0]=2 394 B12R1.8 C=CCCCOC1CCCCO1 MCULE-4661795005 [0,0,0,1,0,0|3,0,0]=4 395 B12R1.8 C=CCCCOC1CCCNC1 MCULE-2546068759 [0,0,0,1,0,0|3,0,0]=4 396 B12R1.8 C=CCCCOC1CCCNC1 MCULE-7029929169 [0,0,0,1,0,0|3,0,0]=4 397 B12R1.8 C=CCCCOC1CCNCC1 MCULE-2388234125 [0,0,0,1,0,0|3,0,0]=4 398 B12R1.8 C=CCCCOC1CCNCC1 MCULE-6017547784 [0,0,0,1,0,0|3,0,0]=4 399 B12R1.8 C=CCOCCC1CCCCN1 MCULE-3208226255 [0,0,0,1,0,0|3,0,0]=4 400 B12R1.8 C=CCOCCC1CCCCN1 MCULE-5767070473 [0,0,0,1,0,0|3,0,0]=4 401 B12R1.8 C=CCOCCC1CCCNC1 MCULE-1147857217 [0,0,0,1,0,0|3,0,0]=4 402 B12R1.8 C=CCOCCC1CCCNC1 MCULE-7362595979 [0,0,0,1,0,0|3,0,0]=4 403 B12R1.8 C=CCOCCC1CCNCC1 MCULE-6001428759 [0,0,0,1,0,0|3,0,0]=4 404 B12R1.8 C=CCOCCC1CCNCC1 MCULE-9499636665 [0,0,0,1,0,0|3,0,0]=4 405 B12R1.8 CCCCCCC1CCCCC1 MCULE-5596413302 [0,0,0,1,0,0|1,0,1]=3 406 B12R1.8 CCCCCCC1CCCCN1 MCULE-4953489742 [0,0,0,1,0,0|1,0,1]=3 407 B12R1.8 CCCCCCC1CCCCN1 MCULE-7758843685 [0,0,0,1,0,0|1,0,1]=3 408 B12R1.8 CCCCCCC1CCCNC1 MCULE-3360628584 [0,0,0,1,0,0|2,0,0]=3 409 B12R1.8 CCCCCCC1CCCNC1 MCULE-4345567859 [0,0,0,1,0,0|2,0,0]=3 410 B12R1.8 CCCCCCC1CCNCC1 MCULE-4909056113 [0,0,0,1,0,0|2,0,1]=4 411 B12R1.8 CCCCCCC1CCNCC1 MCULE-5114194414 [0,0,0,1,0,0|2,0,1]=4 412 B12R1.8 CCCCCOC1CCCNC1 MCULE-2727859866 [0,0,0,1,0,0|3,0,0]=4 413 B12R1.8 CCCCCOC1CCCNC1 MCULE-8751831897 [0,0,0,1,0,0|3,0,0]=4 414 B12R1.8 CCCCOCC1CCCNC1 MCULE-8990874136 [0,0,0,1,0,0|3,0,0]=4 415 B12R1.8 CCCCOCC1CCCNC1 MCULE-9744445993 [0,0,0,1,0,0|3,0,0]=4 416 B12R1.8 CCCOCCC1CCCCN1 MCULE-3027895137 [0,0,0,1,0,0|2,0,1]=4 417 B12R1.8 CCCOCCC1CCCCN1 MCULE-9164772502 [0,0,0,1,0,0|2,0,1]=4 418 B12R1.8 CCCOCCC1CCCNC1 MCULE-5786080743 [0,0,0,1,0,0|3,0,0]=4 419 B12R1.8 CCCOCCC1CCCNC1 MCULE-9769817414 [0,0,0,1,0,0|3,0,0]=4 420 B12R1.8 CNCCCCN1CCCCC1 MCULE-6665875710 [0,0,0,1,0,0|3,0,0]=4 421 B12R1.8 CNCCCNC1CCCCC1 MCULE-1606901160 [0,0,0,1,0,0|3,0,0]=4 422 B12R1.8 COCCNCC1CCCCC1 MCULE-2366600296 [0,0,0,1,0,0|3,0,0]=4 423 B12R1.8 COCCNCC1CCCCC1 MCULE-6797211118 [0,0,0,1,0,0|3,0,0]=4 424 B12R1.8 N#CCCCCN1CCCCC1 MCULE-3117186695 [0,0,0,1,0,0|2,0,1]=4 425 B12R1.8 N#CCCCNC1CCCCC1 MCULE-5533357168 [0,0,0,1,0,0|2,0,1]=4 426 B12R1.8 NCCCCCN1CCCCC1 MCULE-3062074306 [0,0,0,1,0,0|2,0,1]=4 427 B12R1.8 O=CNOCCN1CCCCC1 MCULE-7516763445 [0,0,0,1,0,0|3,0,0]=4 428 B12R1.8 OCCCCCN1CCCCC1 MCULE-3016698326 [0,0,0,1,0,0|1,0,2]=4 429 B12R1.8 OCCCCNC1CCCCC1 MCULE-2543962577 [0,0,0,1,0,0|1,0,2]=4 430 B12R1.8 OCCCNCC1CCCCC1 MCULE-2206880526 [0,0,0,1,0,0|1,0,2]=4 431 B12R1.8 OCCCOCC1CCCCC1 MCULE-5047368988 [0,0,0,1,0,0|1,0,2]=4 432 B12R1.18 CCCCN1CCCCCC1=O MCULE-2860927768 [0,0,0,1,0,0|1,0,0]=2 433 B12R1.18 CCCCN1CCNCCC1=O MCULE-5173759883 [0,0,0,1,0,0|2,0,0]=3 434 B12R1.18 COCCN1CCCNCC1=O MCULE-8191923960 [0,0,0,1,0,0|3,0,0]=4 435 B12R1.18 COCCN1CCNCCC1=O MCULE-4504817503 [0,0,0,1,0,0|3,0,0]=4 436 B12R1.18 COCCN1CCNCCC1=O MCULE-8800911728 [0,0,0,1,0,0|3,0,0]=4 437 B12R1.18 N#CCCN1CCCCCC1=O MCULE-1773998051 [0,0,0,1,0,0|2,0,1]=4 438 B12R1.18 NCCCN1CCCCCC1=O MCULE-7534720301 [0,0,0,1,0,0|2,0,0]=3 439 B12R1.18 NCCCN1CCCCCC1=O MCULE-7641696435 [0,0,0,1,0,0|2,0,0]=3 440 B12R1.37 BrCCCCCCN1CCCC1 MCULE-4598709250 [0,0,0,1,0,0|2,0,1]=4 441 B12R1.37 BrCCCCCCN1CCCC1 MCULE-9859730923 [0,0,0,1,0,0|2,0,1]=4 442 B12R1.37 C=CCCCOCC1CCNC1 MCULE-1893572611 [0,0,0,1,0,0|3,0,0]=4 443 B12R1.37 C=CCCCOCC1CCNC1 MCULE-8568203390 [0,0,0,1,0,0|3,0,0]=4 444 B12R1.37 CCCCCCCC1OCCO1 MCULE-9440265689 [0,0,0,1,0,0|1,0,2]=4 445 B12R1.37 CCCCCCNC1CCCC1 MCULE-1957642519 [0,0,0,1,0,0|2,0,1]=4 446 B12R1.37 CCCCCOCC1CCNC1 MCULE-8088160320 [0,0,0,1,0,0|3,0,0]=4 447 B12R1.37 CCCCCOCC1CCNC1 MCULE-9632689543 [0,0,0,1,0,0|3,0,0]=4 448 B12R1.37 NCCCCCCN1CCCC1 MCULE-2542705076 [0,0,0,1,0,0|2,0,1]=4 449 B12R1.37 NCCCCCCN1CCCC1 MCULE-3377761564 [0,0,0,1,0,0|2,0,1]=4 450 B12R1.52 C#CCN1CCCCCCC1=O MCULE-5498585719 [0,0,0,1,0,0|1,0,2]=4 451 B12R1.52 CCOC1CCCCCCC1N MCULE-9132533980 [0,0,0,1,0,0|2,0,1]=4 452 B12R1.121 CCC1CCCCC1OCCO MCULE-2333871269 [0,0,0,1,0,0|1,0,2]=4 453 B12R1.121 CCC1CCCCN1CCCN MCULE-4667666773 [0,0,0,1,0,0|2,0,1]=4 454 B12R1.121 CCCCN1CCCCC1CN MCULE-6345040942 [0,0,0,1,0,0|2,0,1]=4 455 B12R1.169 CCCN1CCCCC1CCCl MCULE-7356825162 [0,0,0,1,0,0|2,0,1]=4 456 B12R1.215 CN1CCCCCCNCCC1 MCULE-4524414527 [0,0,0,1,0,0|3,0,0]=4 457 B12R1.215 O=C1CCNCCCCCCN1 MCULE-1263100451 [0,0,0,1,0,0|2,0,0]=3 458 B12R1.215 O=C1CCNCCCOCCN1 MCULE-2789680382 [0,0,0,1,0,0|3,0,0]=4 459 B12R1.267 CC1CCCCN1CCCCN MCULE-8278798662 [0,0,0,1,0,0|2,0,1]=4 460 B12R1.267 CCCCC=C1CCCCC1=O MCULE-6881426714 [0,0,0,1,0,0|0,0,2]=3 461 B12R1.267 CCCCCC1CCCCC1=O MCULE-3162873716 [0,0,0,1,0,0|0,0,0]=1 462 B12R1.267 CNCCCN1CCCCC1C MCULE-6495450728 [0,0,0,1,0,0|3,0,0]=4 463 B12R1.267 NCCCCN1CCCCC1=O MCULE-5609841049 [0,0,0,1,0,0|2,0,0]=3 464 B12R1.267 O=C1CCCCC1CNCCBr MCULE-7462371251 [0,0,0,1,0,0|2,0,0]=3 465 B12R1.267 O=C1CCCCC1CNCCBr MCULE-8159055342 [0,0,0,1,0,0|2,0,0]=3 466 B12R1.271 CNCCCCNCC1CC1C MCULE-7611615406 [0,0,0,1,0,0|3,0,0]=4 467 B12R1.271 CNCCCCNCC1CC1C MCULE-9251572600 [0,0,0,1,0,0|3,0,0]=4 468 B12R1.281 CCNC1CCCCCC1OC MCULE-7967143465 [0,0,0,1,0,0|3,0,0]=4 469 B12R1.281 CCOC1CCCCCC1NC MCULE-5872174102 [0,0,0,1,0,0|3,0,0]=4 470 B12R1.329 C=CCNC1CCCCCCC1 MCULE-4436940732 [0,0,0,1,0,0|2,0,0]=3 471 B12R1.329 C=CCNC1CCCCCCC1 MCULE-7467999336 [0,0,0,1,0,0|2,0,0]=3 472 B12R1.372 CCCCCCC1=CCCC1=O MCULE-1287633510 [0,0,0,1,0,0|0,0,2]=3 473 B12R1.372 CCCCCCC1CCCC1=O MCULE-9980064191 [0,0,0,1,0,0|0,0,0]=1 474 B12R1.372 CCCCCCC1CCOC1=O MCULE-7489729502 [0,0,0,1,0,0|1,0,0]=2 475 B12R1.372 CCCCCCN1CCCC1=O MCULE-1097521229 [0,0,0,1,0,0|1,0,0]=2 476 B12R1.375 CCCCCCCCC[C@@H]1CO1 MCULE-1904651720 [0,0,0,1,0,0|0,0,2]=3 477 B12R1.375 CCCCCCCOC[C@H]1CO1 MCULE-6928162982 [0,0,0,1,0,0|1,0,2]=4 478 B12R1.399 CNC1CCCCCCC1OC MCULE-3417290973 [0,0,0,1,0,0|3,0,0]=4 479 B12R1.410 CNC1CCCCCCCCC1 MCULE-9906028937 [0,0,0,1,0,0|2,0,0]=3 480 B12R1.550 C1=CCCCCCCCCCC1 MCULE-7809911769 [0,0,0,1,0,0|1,0,0]=2 481 B12R1.550 C1=CCCCCCCCCCC1 MCULE-9211992042 [0,0,0,1,0,0|1,0,0]=2 482 B12R1.550 C1CCCCCCCCCCC1 MCULE-7420288531 [0,0,0,1,0,0|1,0,1]=3 483 B12R1.1410 CCCCCC1OC1C=CC=O MCULE-4436934736 [0,0,0,1,0,0|1,0,2]=4 484 B12R1.1410 CCCCC[C@H]1O[C@@H]1C=CC=O MCULE-6093862797 [0,0,0,1,0,0|1,0,2]=4 485 B12R1.1414 C=CCCCC1CCCCCC1 MCULE-7969593113 [0,0,0,1,0,0|1,0,0]=2 486 B12R1.1414 CCCCNC1CCCCCC1 MCULE-8285970772 [0,0,0,1,0,0|2,0,1]=4 487 B12R1.1414 CCCCNC1CCCCCC1 MCULE-8620106588 [0,0,0,1,0,0|2,0,1]=4 488 B12R1.1414 CNCCCN1CCCCCC1 MCULE-6443571510 [0,0,0,1,0,0|3,0,0]=4 489 B12R1.1414 NCCCCN1CCCCCC1 MCULE-4655046662 [0,0,0,1,0,0|2,0,1]=4 490 B12R1.1414 NCCCCN1CCCCCC1 MCULE-8510990715 [0,0,0,1,0,0|2,0,1]=4 491 B12R1.1414 OCCCCN1CCCCCC1 MCULE-6965728729 [0,0,0,1,0,0|1,0,2]=4 492 B12R1.1414 OCCCOC1CCCCCC1 MCULE-9402583694 [0,0,0,1,0,0|1,0,2]=4 493 B9R0.45 BrCCCCCCCCBr MCULE-7960475988 [2,0,0,0,0,0|2,0,0]=4 494 B9R0.45 C#CCCCCCCCC MCULE-3452683648 [2,0,0,0,0,0|0,0,2]=4 495 B9R0.45 C=CCCCCCCC=O MCULE-4979248929 [2,0,0,0,0,0|0,0,2]=4 496 B9R0.45 C=CCCCCCCCBr MCULE-6324921683 [2,0,0,0,0,0|1,0,1]=4 497 B9R0.45 C=CCCCCCCCC MCULE-1391753135 [2,0,0,0,0,0|0,0,1]=3 498 B9R0.45 C=CCCCCCCCCl MCULE-3438052360 [2,0,0,0,0,0|1,0,1]=4 499 B9R0.45 C=CCCCCCCCN MCULE-5068886534 [2,0,0,0,0,0|1,0,1]=4 500 B9R0.45 C=CCCCCCCCN MCULE-7639889154 [2,0,0,0,0,0|1,0,1]=4 501 B9R0.45 C=CCCCCCCCO MCULE-9611510472 [2,0,0,0,0,0|1,0,1]=4 502 B9R0.45 CC#CCCCCCCC MCULE-9888604196 [2,0,0,0,0,0|0,0,2]=4 503 B9R0.45 CC/C=C\CCCCC=O MCULE-6517193376 [2,0,0,0,0,0|0,0,2]=4 504 B9R0.45 CC=CCCCCCCC MCULE-6461098537 [2,0,0,0,0,0|0,0,2]=4 505 B9R0.45 CCC#CCCCCCC MCULE-2394718279 [2,0,0,0,0,0|0,0,2]=4 506 B9R0.45 CCC=CCCCCC=O MCULE-5419350827 [2,0,0,0,0,0|0,0,2]=4 507 B9R0.45 CCCC#CCCCCC MCULE-7200051907 [2,0,0,0,0,0|0,0,2]=4 508 B9R0.45 CCCC/C=C/CCCC MCULE-5215613168 [2,0,0,0,0,0|0,0,2]=4 509 B9R0.45 CCCC/C=C\CCCC MCULE-7961413462 [2,0,0,0,0,0|0,0,2]=4 510 B9R0.45 CCCCC#CCCCC MCULE-8619108623 [2,0,0,0,0,0|0,0,2]=4 511 B9R0.45 CCCCC=CCCCC MCULE-4261429100 [2,0,0,0,0,0|0,0,2]=4 512 B9R0.45 CCCCCC/C=C/C=O MCULE-5281758989 [2,0,0,0,0,0|0,0,2]=4 513 B9R0.45 CCCCCCC=CC=O MCULE-8114348514 [2,0,0,0,0,0|0,0,2]=4 514 B9R0.45 CCCCCCCCC#N MCULE-9980153452 [2,0,0,0,0,0|1,0,1]=4 515 B9R0.45 CCCCCCCCC=O MCULE-9888879952 [2,0,0,0,0,0|0,0,0]=2 516 B9R0.45 CCCCCCCCCBr MCULE-1405697483 [2,0,0,0,0,0|1,0,0]=3 517 B9R0.45 CCCCCCCCCC MCULE-6071426098 [2,0,0,0,0,0|0,0,0]=2 518 B9R0.45 CCCCCCCCCCl MCULE-6711902685 [2,0,0,0,0,0|1,0,0]=3 519 B9R0.45 CCCCCCCCCF MCULE-9584148452 [2,0,0,0,0,0|1,0,0]=3 520 B9R0.45 CCCCCCCCCI MCULE-8717337450 [2,0,0,0,0,0|1,0,0]=3 521 B9R0.45 CCCCCCCCCN MCULE-5395407299 [2,0,0,0,0,0|1,0,0]=3 522 B9R0.45 CCCCCCCCCO MCULE-4020281400 [2,0,0,0,0,0|0,0,1]=3 523 B9R0.45 CCCCCCCCCS MCULE-1070515106 [2,0,0,0,0,0|0,1,0]=3 524 B9R0.45 CCCCCCCCNC MCULE-6996288442 [2,0,0,0,0,0|1,0,0]=3 525 B9R0.45 CCCCCCCCOC MCULE-4646070035 [2,0,0,0,0,0|1,0,0]=3 526 B9R0.45 CCCCCCCCSC MCULE-5517176664 [2,0,0,0,0,0|1,0,0]=3 527 B9R0.45 CCCCCCCN=C=O MCULE-8681396809 [2,0,0,0,0,0|1,0,1]=4 528 B9R0.45 CCCCCCCNC=O MCULE-7638122818 [2,0,0,0,0,0|1,0,0]=3 529 B9R0.45 CCCCCCCNCC MCULE-3055645322 [2,0,0,0,0,0|1,0,0]=3 530 B9R0.45 CCCCCCCOC=O MCULE-6396391540 [2,0,0,0,0,0|1,0,0]=3 531 B9R0.45 CCCCCCNCCN MCULE-2521807905 [2,0,0,0,0,0|2,0,0]=4 532 B9R0.45 CCCCCCNCCN MCULE-5886608711 [2,0,0,0,0,0|2,0,0]=4 533 B9R0.45 CCCCCCNCCO MCULE-6828996225 [2,0,0,0,0,0|1,0,1]=4 534 B9R0.45 CCCCCCNOCC MCULE-7230044709 [2,0,0,0,0,0|2,0,0]=4 535 B9R0.45 CCCCCCNOCC MCULE-8309226243 [2,0,0,0,0,0|2,0,0]=4 536 B9R0.45 CCCCCCOCCCl MCULE-5675234570 [2,0,0,0,0,0|2,0,0]=4 537 B9R0.45 CCCCCCOCCO MCULE-1339769602 [2,0,0,0,0,0|1,0,1]=4 538 B9R0.45 CCCCCCSCCO MCULE-3331753796 [2,0,0,0,0,0|1,0,1]=4 539 B9R0.45 CCCCCNCCCC MCULE-4324738465 [2,0,0,0,0,0|1,0,0]=3 540 B9R0.45 CCCCCNCCNC MCULE-3521145032 [2,0,0,0,0,0|2,0,0]=4 541 B9R0.45 CCCCCOCCCO MCULE-3048029561 [2,0,0,0,0,0|1,0,1]=4 542 B9R0.45 CCCCNCCCCO MCULE-1748671401 [2,0,0,0,0,0|1,0,1]=4 543 B9R0.45 CCCCNCCOCC MCULE-5585133594 [2,0,0,0,0,0|2,0,0]=4 544 B9R0.45 CCCCOCCCCO MCULE-1926189258 [2,0,0,0,0,0|1,0,1]=4 545 B9R0.45 CCCCSCCOCC MCULE-4700764338 [2,0,0,0,0,0|2,0,0]=4 546 B9R0.45 CCCCSSCCCC MCULE-5887157893 [2,0,0,0,0,0|2,0,0]=4 547 B9R0.45 CCCC[NH2+]CCCCCl MCULE-2045714641 [2,0,0,0,0,0|2,0,0]=4 548 B9R0.45 CCCC[NH2+]CCCCCl MCULE-2222567485 [2,0,0,0,0,0|2,0,0]=4 549 B9R0.45 CCCNCCCNCC MCULE-1018165528 [2,0,0,0,0,0|2,0,0]=4 550 B9R0.45 CCCNCCNCCC MCULE-7703644113 [2,0,0,0,0,0|2,0,0]=4 551 B9R0.45 CCOCCCCOCC MCULE-5008558328 [2,0,0,0,0,0|2,0,0]=4 552 B9R0.45 CCSCCCCSCC MCULE-9432415547 [2,0,0,0,0,0|2,0,0]=4 553 B9R0.45 CNCCCCCCNC MCULE-8440815147 [2,0,0,0,0,0|2,0,0]=4 554 B9R0.45 COCCCCCCOC MCULE-8796987038 [2,0,0,0,0,0|2,0,0]=4 555 B9R0.45 ClCCCCCCCCCl MCULE-7522868799 [2,0,0,0,0,0|2,0,0]=4 556 B9R0.45 ICCCCCCCCI MCULE-6544838106 [2,0,0,0,0,0|2,0,0]=4 557 B9R0.45 NCCCCCCCCBr MCULE-6623783968 [2,0,0,0,0,0|2,0,0]=4 558 B9R0.45 NCCCCCCCCBr MCULE-9911947498 [2,0,0,0,0,0|2,0,0]=4 559 B9R0.45 NCCCCCCCCN MCULE-1106731228 [2,0,0,0,0,0|2,0,0]=4 560 B9R0.45 NCCCCCCCCN MCULE-9889097856 [2,0,0,0,0,0|2,0,0]=4 561 B9R0.45 NCCCCCCCCO MCULE-1230018398 [2,0,0,0,0,0|1,0,1]=4 562 B9R0.45 O=CCCCCCCC=O MCULE-6545234470 [2,0,0,0,0,0|1,0,1]=4 563 B9R0.45 OCCCCCCCCBr MCULE-2005797184 [2,0,0,0,0,0|1,0,1]=4 564 B9R0.45 OCCCCCCCCCl MCULE-8776830410 [2,0,0,0,0,0|1,0,1]=4 565 B9R0.45 OCCCCCCCCI MCULE-7793639517 [2,0,0,0,0,0|1,0,1]=4 566 B9R0.45 OCCCCCCCCO MCULE-7897417838 [2,0,0,0,0,0|1,0,1]=4 567 B9R0.45 OCCCCCCCCS MCULE-8372814979 [2,0,0,0,0,0|1,0,1]=4 568 B9R0.45 SCCCCCCCCS MCULE-5325130158 [2,0,0,0,0,0|1,1,0]=4 569 B9R0.45 [NH2+](CCCC)CCCCC MCULE-5314318531 [2,0,0,0,0,0|1,0,0]=3 570 B11R0.4 C=CCC(C)CCCCCCC MCULE-9517976108 [1,1,0,0,0,0|0,0,1]=3 571 B11R0.4 CCCCCCCC(=O)CCC MCULE-1180729281 [1,1,0,0,0,0|0,0,2]=4 572 B11R0.4 CCCCCCCC(C)N=C=O MCULE-4548041791 [1,1,0,0,0,0|1,0,1]=4 573 B11R0.4 CCCCCCCC(O)CCC MCULE-3007528112 [1,1,0,0,0,0|0,0,1]=3 574 B11R0.4 CCCCCCC[C@H](C)N=C=O MCULE-3759555717 [1,1,0,0,0,0|1,0,1]=4 575 B11R0.4 CCCCCCC[NH+](C)CCCl MCULE-1778694202 [1,1,0,0,0,0|2,0,0]=4 576 B11R0.4 CCCCCCC[NH+](C)CCCl MCULE-8009615139 [1,1,0,0,0,0|2,0,0]=4 577 B11R0.4 CCOC(=O)CCCCCC=O MCULE-8029913259 [1,1,0,0,0,0|1,0,1]=4 578 B11R0.40 C=C(C=O)CCCCCCCC MCULE-1736101056 [1,1,0,0,0,0|0,0,1]=3 579 B11R0.40 C=CCCCCCCC(O)CN MCULE-2780524307 [1,1,0,0,0,0|1,0,1]=4 580 B11R0.40 C=CS(=O)CCCCCCCC MCULE-1360438768 [1,1,0,0,0,0|1,0,1]=4 581 B11R0.40 CCCCCCCCC(=O)C=O MCULE-2896760493 [1,1,0,0,0,0|0,0,1]=3 582 B11R0.40 CCCCCCCCC(=O)CC MCULE-9958837588 [1,1,0,0,0,0|0,0,2]=4 583 B11R0.40 CCCCCCCCC(Br)CBr MCULE-7825522302 [1,1,0,0,0,0|1,0,0]=3 584 B11R0.40 CCCCCCCCC(C)C#N MCULE-1011753357 [1,1,0,0,0,0|1,0,1]=4 585 B11R0.40 CCCCCCCCC(C)C=O MCULE-9301043210 [1,1,0,0,0,0|0,0,0]=2 586 B11R0.40 CCCCCCCCC(C)CO MCULE-6530142953 [1,1,0,0,0,0|0,0,1]=3 587 B11R0.40 CCCCCCCCC(Cl)CCl MCULE-6741925726 [1,1,0,0,0,0|1,0,0]=3 588 B11R0.40 CCCCCCCCC(N)CO MCULE-3838512887 [1,1,0,0,0,0|0,0,1]=3 589 B11R0.40 CCCCCCCCC(O)CC MCULE-7447063642 [1,1,0,0,0,0|0,0,1]=3 590 B11R0.40 CCCCCCCCC(O)CN MCULE-1386452336 [1,1,0,0,0,0|1,0,0]=3 591 B11R0.40 CCCCCCCCC(O)CO MCULE-4401791520 [1,1,0,0,0,0|0,0,1]=3 592 B11R0.40 CCCCCCCCC([NH3+])CO MCULE-9745638839 [1,1,0,0,0,0|0,0,1]=3 593 B11R0.40 CCCCCCCC[C@@H](Br)C=O MCULE-3823724408 [1,1,0,0,0,0|0,0,0]=2 594 B11R0.40 CCCCCCCC[C@@H](O)CO MCULE-3097644735 [1,1,0,0,0,0|0,0,1]=3 595 B11R0.40 CCCCCCCC[C@@H](O)CO MCULE-9306542938 [1,1,0,0,0,0|0,0,1]=3 596 B11R0.40 CCCCCCCC[C@H](C)C=O MCULE-7337993182 [1,1,0,0,0,0|0,0,0]=2 597 B11R0.40 CCCCCCOCC(O)CCl MCULE-9400857337 [1,1,0,0,0,0|2,0,0]=4 598 B11R0.40 CCCCCCOCC(O)CO MCULE-6836288154 [1,1,0,0,0,0|1,0,1]=4 599 B11R0.40 COC(=O)CCCCCCC=O MCULE-8693929860 [1,1,0,0,0,0|1,0,1]=4 600 B11R0.40 OCCCCCCCC(O)CO MCULE-9195681013 [1,1,0,0,0,0|1,0,1]=4 601 B11R0.81 C=C(CCCC)CCCCCC MCULE-1300928710 [1,1,0,0,0,0|0,0,2]=4 602 B11R0.81 CCCCCCC(=O)CCCC MCULE-3791343950 [1,1,0,0,0,0|0,0,2]=4 603 B11R0.81 CCCCCCC(C)OCCCl MCULE-5692239728 [1,1,0,0,0,0|2,0,0]=4 604 B11R0.81 CCCCCCC(C)OCCO MCULE-2974953071 [1,1,0,0,0,0|1,0,1]=4 605 B11R0.81 CCCCCCC(O)CCCC MCULE-1549907527 [1,1,0,0,0,0|0,0,1]=3 606 B11R0.81 CCCCS(=O)CCCCCO MCULE-1757503463 [1,1,0,0,0,0|1,0,1]=4 607 B11R0.140 CCCCCC(=O)CCCCC MCULE-5966055848 [1,1,0,0,0,0|0,0,2]=4 608 B11R0.140 CCCCCC(N)CCCCC MCULE-7357551566 [1,1,0,0,0,0|0,0,1]=3 609 B11R0.140 CCCCCC(O)CCCCC MCULE-6556320478 [1,1,0,0,0,0|0,0,1]=3 610 B11R0.140 CCCCCN(C)CCCCC MCULE-7558760842 [1,1,0,0,0,0|1,0,1]=4 611 B11R0.148 C#CCCCCCCCC(=O)O MCULE-1292545040 [1,1,0,0,0,0|0,0,2]=4 612 B11R0.148 C=C(Br)CCCCCCCCC MCULE-3332268450 [1,1,0,0,0,0|0,0,1]=3 613 B11R0.148 C=C(C)CCCCCCCCC MCULE-1709497926 [1,1,0,0,0,0|0,0,1]=3 614 B11R0.148 C=C(Cl)CCCCCCCCC MCULE-9304719526 [1,1,0,0,0,0|0,0,1]=3 615 B11R0.148 C=CCCCCCCCC(=C)C MCULE-4065354989 [1,1,0,0,0,0|0,0,2]=4 616 B11R0.148 C=CCCCCCCCC(=O)O MCULE-3892173219 [1,1,0,0,0,0|0,0,2]=4 617 B11R0.148 CC(=O)CCCCCCCCBr MCULE-8502798206 [1,1,0,0,0,0|1,0,0]=3 618 B11R0.148 CC(=O)OCCCCCCC=O MCULE-8513857573 [1,1,0,0,0,0|1,0,1]=4 619 B11R0.148 CC(C)CCCCCCCCO MCULE-9926933955 [1,1,0,0,0,0|0,0,1]=3 620 B11R0.148 CC(C)CCNCCCCCN MCULE-6716499597 [1,1,0,0,0,0|2,0,0]=4 621 B11R0.148 CC(C)CCNCCCCCN MCULE-9913240863 [1,1,0,0,0,0|2,0,0]=4 622 B11R0.148 CC(O)CCCCCCCCO MCULE-6820244164 [1,1,0,0,0,0|0,0,1]=3 623 B11R0.148 CCCCC/C=C/CCC(=O)O MCULE-1356880290 [1,1,0,0,0,0|0,0,2]=4 624 B11R0.148 CCCCCC/C=C/CC(=O)O MCULE-1834860815 [1,1,0,0,0,0|0,0,2]=4 625 B11R0.148 CCCCCC=CCCC(=O)O MCULE-1637451620 [1,1,0,0,0,0|0,0,2]=4 626 B11R0.148 CCCCCCC/C=C/C(=O)O MCULE-3189731619 [1,1,0,0,0,0|0,0,2]=4 627 B11R0.148 CCCCCCC/C=C\C(=O)O MCULE-5508964733 [1,1,0,0,0,0|0,0,2]=4 628 B11R0.148 CCCCCCC=CCC(=O)O MCULE-5816262119 [1,1,0,0,0,0|0,0,2]=4 629 B11R0.148 CCCCCCCC=CC(=O)O MCULE-9648702049 [1,1,0,0,0,0|0,0,2]=4 630 B11R0.148 CCCCCCCCCC(=N)N MCULE-6113298447 [1,1,0,0,0,0|1,0,0]=3 631 B11R0.148 CCCCCCCCCC(=N)N MCULE-7599360964 [1,1,0,0,0,0|1,0,0]=3 632 B11R0.148 CCCCCCCCCC(=O)C MCULE-6858373499 [1,1,0,0,0,0|0,0,0]=2 633 B11R0.148 CCCCCCCCCC(=O)Cl MCULE-4226412977 [1,1,0,0,0,0|0,0,0]=2 634 B11R0.148 CCCCCCCCCC(=O)F MCULE-1839398331 [1,1,0,0,0,0|0,0,0]=2 635 B11R0.148 CCCCCCCCCC(=O)N MCULE-1159230758 [1,1,0,0,0,0|0,0,0]=2 636 B11R0.148 CCCCCCCCCC(=O)O MCULE-3914949169 [1,1,0,0,0,0|0,0,0]=2 637 B11R0.148 CCCCCCCCCC(=O)O MCULE-7204730113 [1,1,0,0,0,0|0,0,0]=2 638 B11R0.148 CCCCCCCCCC(=O)[O-] MCULE-2720595773 [1,1,0,0,0,0|0,0,0]=2 639 B11R0.148 CCCCCCCCCC(=O)[O-] MCULE-7398604282 [1,1,0,0,0,0|0,0,0]=2 640 B11R0.148 CCCCCCCCCC(C)C MCULE-1079534714 [1,1,0,0,0,0|0,0,1]=3 641 B11R0.148 CCCCCCCCCC(C)N MCULE-8277808063 [1,1,0,0,0,0|0,0,1]=3 642 B11R0.148 CCCCCCCCCC(C)O MCULE-8628471202 [1,1,0,0,0,0|0,0,1]=3 643 B11R0.148 CCCCCCCCCC(S)S MCULE-7049062381 [1,1,0,0,0,0|0,1,0]=3 644 B11R0.148 CCCCCCCCCN(=O)=O MCULE-5909474153 [1,1,0,0,0,0|1,0,0]=3 645 B11R0.148 CCCCCCCCN=C(N)N MCULE-8281267777 [1,1,0,0,0,0|2,0,0]=4 646 B11R0.148 CCCCCCCCN=C(N)N MCULE-9658902055 [1,1,0,0,0,0|2,0,0]=4 647 B11R0.148 CCCCCCCCNC(=O)N MCULE-1005292011 [1,1,0,0,0,0|1,0,0]=3 648 B11R0.148 CCCCCCCCNC(=S)N MCULE-3981792857 [1,1,0,0,0,0|1,1,0]=4 649 B11R0.148 CCCCCCCCOC(=O)C MCULE-8590238161 [1,1,0,0,0,0|1,0,0]=3 650 B11R0.148 CCCCCCCCOC(=O)Cl MCULE-2623966790 [1,1,0,0,0,0|1,0,0]=3 651 B11R0.148 CCCCCCCCOC(=S)[S-] MCULE-4226166972 [1,1,0,0,0,0|1,1,0]=4 652 B11R0.148 CCCCCCCCOC(=S)[S-] MCULE-7459596444 [1,1,0,0,0,0|1,1,0]=4 653 B11R0.148 CCCCCCCNCC(=O)O MCULE-2155508761 [1,1,0,0,0,0|1,0,0]=3 654 B11R0.148 CCCCCCCNCC(=O)O MCULE-8805007132 [1,1,0,0,0,0|1,0,0]=3 655 B11R0.148 CCCCCCCSCC(=O)O MCULE-7218313490 [1,1,0,0,0,0|1,0,0]=3 656 B11R0.148 CCCCOCCOCC(=O)O MCULE-3118678736 [1,1,0,0,0,0|2,0,0]=4 657 B11R0.148 CCCCSCCCCC(=O)O MCULE-1665011362 [1,1,0,0,0,0|1,0,0]=3 658 B11R0.148 CCOCCOCCCC(=O)O MCULE-5210306588 [1,1,0,0,0,0|2,0,0]=4 659 B11R0.148 CN(C)CCCCCCCCN MCULE-6651981566 [1,1,0,0,0,0|2,0,0]=4 660 B11R0.148 CN(C)CCCCCCCCO MCULE-5273481320 [1,1,0,0,0,0|1,0,1]=4 661 B11R0.148 NC(=O)CCCCCCCCCl MCULE-4533445908 [1,1,0,0,0,0|1,0,0]=3 662 B11R0.148 NCCCCCCCCC(=O)O MCULE-9064856591 [1,1,0,0,0,0|1,0,0]=3 663 B11R0.148 O=C(O)CCCCCCCCBr MCULE-2459167157 [1,1,0,0,0,0|1,0,0]=3 664 B11R0.148 O=C(O)CCCCCCCCCl MCULE-9010808862 [1,1,0,0,0,0|1,0,0]=3 665 B11R0.148 O=C(O)CCCCCCCCO MCULE-6121514710 [1,1,0,0,0,0|1,0,0]=3 666 B11R0.148 O=CCCCCCCCC(=O)O MCULE-8345312745 [1,1,0,0,0,0|1,0,1]=4 667 B11R0.148 O=N(=O)CCCCCCCCBr MCULE-5806801538 [1,1,0,0,0,0|2,0,0]=4 668 B11R0.148 O=N(=O)CCCCCCCCO MCULE-3641883800 [1,1,0,0,0,0|2,0,0]=4 669 B13R0.2 C=CCCCCCCCC(=O)OCC MCULE-7330309912 [0,2,0,0,0,0|1,0,1]=4 670 B13R0.2 C=COC(=O)CCCCCCCCC MCULE-6857715884 [0,2,0,0,0,0|1,0,1]=4 671 B13R0.2 CCCCCCCCC/C(=C/CBr)/C MCULE-3162465870 [0,2,0,0,0,0|1,0,1]=4 672 B13R0.2 CCCCCCCCCC(=O)CCC MCULE-7843912102 [0,2,0,0,0,0|1,0,1]=4 673 B13R0.2 CCCCCCCCCC(C)CCBr MCULE-9823733593 [0,2,0,0,0,0|1,0,1]=4 674 B13R0.2 CCCCCCCCCC(O)CCO MCULE-6275560025 [0,2,0,0,0,0|0,0,2]=4 675 B13R0.66 C=CCOC(=O)CCCCCCCC MCULE-4814095857 [0,2,0,0,0,0|1,0,1]=4 676 B13R0.66 CCCCCCCCC(=O)CCCC MCULE-3156876863 [0,2,0,0,0,0|1,0,1]=4 677 B13R0.66 CCCCCCCCC(O)CCCC MCULE-2796916892 [0,2,0,0,0,0|1,0,1]=4 678 B13R0.66 CCCCCCCCS(=O)CCCO MCULE-2280372695 [0,2,0,0,0,0|0,0,2]=4 679 B13R0.88 CCCC(=O)CCCCCCC(=O)O MCULE-7655272143 [0,2,0,0,0,0|0,0,1]=3 680 B13R0.88 CCOC(=O)CCCCCCC(=O)O MCULE-5379886661 [0,2,0,0,0,0|1,0,1]=4 681 B13R0.282 CCCC(CC)CCCCCCCN MCULE-1239478204 [0,2,0,0,0,0|1,0,1]=4 682 B13R0.335 C=C(C)CC(C)CCCCCCCC MCULE-5619106321 [0,2,0,0,0,0|1,0,0]=3 683 B13R0.335 CC(CCCCCCCN)CC(=O)O MCULE-2748735108 [0,2,0,0,0,0|1,0,0]=3 684 B13R0.335 CC(CCCCCCCN)CC(=O)O MCULE-8926877324 [0,2,0,0,0,0|1,0,0]=3 685 B13R0.335 CCCCCCCCC(C)CC(=O)O MCULE-1071013190 [0,2,0,0,0,0|0,0,0]=2 686 B13R0.335 CCCCCCCCC(O)CC(=O)O MCULE-3464929288 [0,2,0,0,0,0|0,0,0]=2 687 B13R0.335 CCCCCCCOC(=O)CC(=O)C MCULE-3029543829 [0,2,0,0,0,0|1,0,1]=4 688 B13R0.54 C#CCCCCCCCCCC(=O)O MCULE-3493346393 [0,2,0,0,0,0|0,0,1]=3 689 B13R0.54 C(=CCCCCOC(=O)C)CCCC MCULE-1642216097 [0,2,0,0,0,0|0,0,2]=4 690 B13R0.54 C=C(C)CCCCCCCCCCC MCULE-6486590493 [0,2,0,0,0,0|1,0,0]=3 691 B13R0.54 C=CCCCCCCCCCC(=C)C MCULE-9813642699 [0,2,0,0,0,0|1,0,0]=3 692 B13R0.54 C=CCCCCCCCCCC(=O)C MCULE-5730123957 [0,2,0,0,0,0|0,0,1]=3 693 B13R0.54 C=CCCCCCCCCCC(=O)O MCULE-6330367894 [0,2,0,0,0,0|0,0,1]=3 694 B13R0.54 C=CCCCCCCCCCN(=O)=O MCULE-7314787792 [0,2,0,0,0,0|1,0,1]=4 695 B13R0.54 C=CCCCCCCCCOC(=O)C MCULE-3987813819 [0,2,0,0,0,0|0,0,2]=4 696 B13R0.54 CC(C)CCCCCCCCCCO MCULE-3770739954 [0,2,0,0,0,0|0,0,2]=4 697 B13R0.54 CCCC/C=C\CCCCOC(=O)C MCULE-9938541488 [0,2,0,0,0,0|0,0,2]=4 698 B13R0.54 CCCCCC/C=C\CCCC(=O)O MCULE-9454929405 [0,2,0,0,0,0|0,0,1]=3 699 B13R0.54 CCCCCCC=CCCCC(=O)O MCULE-1299148519 [0,2,0,0,0,0|0,0,1]=3 700 B13R0.54 CCCCCCCC=CCOC(=O)C MCULE-7547263092 [0,2,0,0,0,0|0,0,2]=4 701 B13R0.54 CCCCCCCCC/C=C/C(=O)O MCULE-8068052432 [0,2,0,0,0,0|0,0,1]=3 702 B13R0.54 CCCCCCCCCC=CC(=O)O MCULE-5397880976 [0,2,0,0,0,0|0,0,1]=3 703 B13R0.54 CCCCCCCCCCCC(=N)N MCULE-2355708247 [0,2,0,0,0,0|1,0,0]=3 704 B13R0.54 CCCCCCCCCCCC(=O)C MCULE-9311016763 [0,2,0,0,0,0|0,0,0]=2 705 B13R0.54 CCCCCCCCCCCC(=O)Cl MCULE-9866142193 [0,2,0,0,0,0|0,0,0]=2 706 B13R0.54 CCCCCCCCCCCC(=O)N MCULE-2324074583 [0,2,0,0,0,0|0,0,0]=2 707 B13R0.54 CCCCCCCCCCCC(=O)O MCULE-2795129925 [0,2,0,0,0,0|0,0,0]=2 708 B13R0.54 CCCCCCCCCCCC(=O)[O-] MCULE-4306276668 [0,2,0,0,0,0|0,0,0]=2 709 B13R0.54 CCCCCCCCCCCC(=O)[O-] MCULE-5989799433 [0,2,0,0,0,0|0,0,0]=2 710 B13R0.54 CCCCCCCCCCCC(=O)[O-] MCULE-7873290711 [0,2,0,0,0,0|0,0,0]=2 711 B13R0.54 CCCCCCCCCCCC(=O)[O-] MCULE-8752609733 [0,2,0,0,0,0|0,0,0]=2 712 B13R0.54 CCCCCCCCCCCC(C)N MCULE-3980418920 [0,2,0,0,0,0|1,0,1]=4 713 B13R0.54 CCCCCCCCCCCC(C)O MCULE-3181779723 [0,2,0,0,0,0|0,0,2]=4 714 B13R0.54 CCCCCCCCCCCN(=O)=O MCULE-4760203332 [0,2,0,0,0,0|0,0,1]=3 715 B13R0.54 CCCCCCCCCCCN(C)C MCULE-5478138058 [0,2,0,0,0,0|1,0,1]=4 716 B13R0.54 CCCCCCCCCCNC(=O)N MCULE-8422314743 [0,2,0,0,0,0|0,0,0]=2 717 B13R0.54 CCCCCCCCCCNC(=S)N MCULE-1226316897 [0,2,0,0,0,0|0,1,0]=3 718 B13R0.54 CCCCCCCCCCOC(=O)C MCULE-7452399897 [0,2,0,0,0,0|0,0,0]=2 719 B13R0.54 CCCCCCCCCCOC(=O)Cl MCULE-8601514194 [0,2,0,0,0,0|0,0,0]=2 720 B13R0.54 CCCCCCCCCCOC(=S)[S-] MCULE-8121799109 [0,2,0,0,0,0|0,1,0]=3 721 B13R0.54 CCCCCCCCCCOC(=S)[S-] MCULE-8750716716 [0,2,0,0,0,0|0,1,0]=3 722 B13R0.54 CCCCCCCCOCCC(=O)O MCULE-1079344518 [0,2,0,0,0,0|0,0,0]=2 723 B13R0.54 CCCCCCCCSCCC(=O)N MCULE-3514095129 [0,2,0,0,0,0|0,0,0]=2 724 B13R0.54 CCCCCCCCSCCC(=O)O MCULE-4405987007 [0,2,0,0,0,0|0,0,0]=2 725 B13R0.54 CCCCCCCCSCCC(=O)[O-] MCULE-2242790491 [0,2,0,0,0,0|0,0,0]=2 726 B13R0.54 CCCCCNCCCCCC(=O)O MCULE-7344928222 [0,2,0,0,0,0|0,0,0]=2 727 B13R0.54 CCCCOCCOCCOC(=O)C MCULE-7207932009 [0,2,0,0,0,0|2,0,0]=4 728 B13R0.54 CCCCSCCCCCCC(=O)O MCULE-8131072528 [0,2,0,0,0,0|0,0,0]=2 729 B13R0.54 COCCOCCOCCCC(=O)O MCULE-5833620933 [0,2,0,0,0,0|2,0,0]=4 730 B13R0.54 N#N=NCCCCCCCCC(=O)O MCULE-9217828089 [0,2,0,0,0,0|2,0,0]=4 731 B13R0.54 NC(=O)CCCCCCCCCCBr MCULE-6636357331 [0,2,0,0,0,0|0,0,0]=2 732 B13R0.54 NCCCCCCCCCCC(=O)O MCULE-1751028538 [0,2,0,0,0,0|0,0,0]=2 733 B13R0.54 NCCCCCCCCCCC(=O)[O-] MCULE-8171823933 [0,2,0,0,0,0|0,0,0]=2 734 B13R0.54 O=C(Cl)CCCCCCCCCCBr MCULE-9607447068 [0,2,0,0,0,0|0,0,0]=2 735 B13R0.54 O=C(O)CCCCCCC/C=C/CO MCULE-9542952039 [0,2,0,0,0,0|0,0,2]=4 736 B13R0.54 O=C(O)CCCCCCCCC#CBr MCULE-4630465471 [0,2,0,0,0,0|0,0,2]=4 737 B13R0.54 O=C(O)CCCCCCCCCCBr MCULE-9911407009 [0,2,0,0,0,0|0,0,0]=2 738 B13R0.54 O=C(O)CCCCCCCCCCCl MCULE-7412307649 [0,2,0,0,0,0|0,0,0]=2 739 B13R0.54 O=C(O)CCCCCCCCCCO MCULE-8232897652 [0,2,0,0,0,0|0,0,0]=2 740 B13R0.54 O=C(O)CCCCCCCCCCS MCULE-9528951895 [0,2,0,0,0,0|0,0,0]=2 741 B13R0.54 O=C(O)CCCCCCCCCOO MCULE-9572784167 [0,2,0,0,0,0|1,0,0]=3 742 B13R0.54 O=N(=O)CCCCCCCCCCBr MCULE-8717758522 [0,2,0,0,0,0|1,0,0]=3 743 B13R0.54 O=N(=O)CCCCCCCCCCO MCULE-1367838470 [0,2,0,0,0,0|1,0,0]=3 744 B13R0.147 C#CCCCCCCCCC(=O)NO MCULE-1776052395 [0,2,0,0,0,0|0,0,2]=4 745 B13R0.147 C#CCCCCCCCCC(=O)OC MCULE-3643245325 [0,2,0,0,0,0|0,0,2]=4 746 B13R0.147 C=CC(=O)OCCCCCCCCC MCULE-7661811427 [0,2,0,0,0,0|1,0,0]=3 747 B13R0.147 C=CCCCCCCCCC(=O)NN MCULE-1975489838 [0,2,0,0,0,0|0,0,2]=4 748 B13R0.147 C=CCCCCCCCCC(=O)NO MCULE-4384177401 [0,2,0,0,0,0|0,0,2]=4 749 B13R0.147 C=CCCCCCCCCC(=O)OC MCULE-5551120975 [0,2,0,0,0,0|0,0,2]=4 750 B13R0.147 CCCCCCC/C=C/CC(=O)CC MCULE-1079348180 [0,2,0,0,0,0|0,0,2]=4 751 B13R0.147 CCCCCCCCC#CC(=O)OC MCULE-6573014150 [0,2,0,0,0,0|0,0,2]=4 752 B13R0.147 CCCCCCCCCCC(=N)NO MCULE-8351830126 [0,2,0,0,0,0|0,0,1]=3 753 B13R0.147 CCCCCCCCCCC(=O)NN MCULE-5566881162 [0,2,0,0,0,0|0,0,0]=2 754 B13R0.147 CCCCCCCCCCC(=O)OC MCULE-4524637821 [0,2,0,0,0,0|0,0,0]=2 755 B13R0.147 CCCCCCCCCCC(Br)CBr MCULE-9794028276 [0,2,0,0,0,0|1,0,1]=4 756 B13R0.147 CCCCCCCCCCC(C)C=O MCULE-1597303567 [0,2,0,0,0,0|0,0,0]=2 757 B13R0.147 CCCCCCCCCCC(C)CO MCULE-5502474074 [0,2,0,0,0,0|0,0,2]=4 758 B13R0.147 CCCCCCCCCCC(Cl)CCl MCULE-2606330649 [0,2,0,0,0,0|1,0,1]=4 759 B13R0.147 CCCCCCCCCCC(O)CN MCULE-5193471557 [0,2,0,0,0,0|0,0,2]=4 760 B13R0.147 CCCCCCCCCCC(O)CO MCULE-2615675340 [0,2,0,0,0,0|0,0,2]=4 761 B13R0.147 CCCCCCCCCCC([NH3+])CO MCULE-5249425084 [0,2,0,0,0,0|0,0,2]=4 762 B13R0.147 CCCCCCCCCCC([NH3+])CO MCULE-6389413958 [0,2,0,0,0,0|0,0,2]=4 763 B13R0.147 CCCCCCCCCC[C@@H](O)CO MCULE-6042369532 [0,2,0,0,0,0|0,0,2]=4 764 B13R0.147 CCCCCCCCCC[C@H](O)CO MCULE-1604714068 [0,2,0,0,0,0|0,0,2]=4 765 B13R0.147 CCCCCCCCCNC(=O)CCl MCULE-5058546046 [0,2,0,0,0,0|1,0,0]=3 766 B13R0.147 CCCCCCCCOCC(O)CCl MCULE-3663457425 [0,2,0,0,0,0|1,0,1]=4 767 B13R0.147 CCCCCCCCOCC(O)CO MCULE-3516482068 [0,2,0,0,0,0|0,0,2]=4 768 B13R0.147 CCCCCCCNCCC(=O)NC MCULE-6698644143 [0,2,0,0,0,0|1,0,0]=3 769 B13R0.147 CCCCCCCNCCC(=O)NN MCULE-6182063140 [0,2,0,0,0,0|1,0,0]=3 770 B13R0.147 CCCCCCCNCCC(=O)OC MCULE-4012206227 [0,2,0,0,0,0|1,0,0]=3 771 B13R0.147 COC(=O)CCCCCCCCC=O MCULE-9755822433 [0,2,0,0,0,0|0,0,1]=3 772 B13R0.147 COC(=O)CCCCCCCCCBr MCULE-4125973468 [0,2,0,0,0,0|1,0,0]=3 773 B13R0.147 COC(=O)CCCCCCCCCN MCULE-2996113147 [0,2,0,0,0,0|1,0,0]=3 774 B13R0.147 COC(=O)CCCCCCCCCN MCULE-5692626711 [0,2,0,0,0,0|1,0,0]=3 775 B13R0.147 COC(=O)CCCCCCCCCO MCULE-2254055588 [0,2,0,0,0,0|1,0,0]=3 776 B13R0.147 NCCCCCCCCNC(=O)CBr MCULE-3488452736 [0,2,0,0,0,0|2,0,0]=4 777 B13R0.165 C=C(CCCCCC)CCCCCC MCULE-6268601942 [0,2,0,0,0,0|1,0,1]=4 778 B13R0.165 CCCCCCC(=O)CCCCCC MCULE-9473399411 [0,2,0,0,0,0|1,0,1]=4 779 B13R0.165 CCCCCCC(C)CCCCCC MCULE-2236189519 [0,2,0,0,0,0|1,0,1]=4 780 B13R0.165 CCCCCCC(N)CCCCCC MCULE-2802579601 [0,2,0,0,0,0|1,0,1]=4 781 B13R0.165 CCCCCCC(O)CCCCCC MCULE-2797114957 [0,2,0,0,0,0|1,0,1]=4 782 B13R0.336 BrCCCCCCCCCCCCBr MCULE-6672891675 [0,2,0,0,0,0|1,0,1]=4 783 B13R0.336 C#CCCCCCCCCCCCC MCULE-4146985591 [0,2,0,0,0,0|1,0,1]=4 784 B13R0.336 C#CCCCCCCCCCCCO MCULE-9314358664 [0,2,0,0,0,0|0,0,2]=4 785 B13R0.336 C=CCCCC=CCNCCCCC MCULE-7084444487 [0,2,0,0,0,0|1,0,1]=4 786 B13R0.336 C=CCCCCCCCCCCC=C MCULE-5370372946 [0,2,0,0,0,0|1,0,0]=3 787 B13R0.336 C=CCCCCCCCCCCCBr MCULE-3110147791 [0,2,0,0,0,0|1,0,0]=3 788 B13R0.336 C=CCCCCCCCCCCCC MCULE-5148675782 [0,2,0,0,0,0|1,0,0]=3 789 B13R0.336 C=CCCCCCCCCCCCO MCULE-6006083957 [0,2,0,0,0,0|1,0,0]=3 790 B13R0.336 C=CCSCCCCCCCCCC MCULE-6078028682 [0,2,0,0,0,0|1,0,0]=3 791 B13R0.336 CCCCCC/C=C/CCCCCC MCULE-8538281163 [0,2,0,0,0,0|1,0,1]=4 792 B13R0.336 CCCCCCC#CCCCCCC MCULE-9166604950 [0,2,0,0,0,0|1,0,1]=4 793 B13R0.336 CCCCCCC=CCCCCCC MCULE-7813511359 [0,2,0,0,0,0|1,0,1]=4 794 B13R0.336 CCCCCCCCCCC=CC#N MCULE-5311798650 [0,2,0,0,0,0|1,0,0]=3 795 B13R0.336 CCCCCCCCCCC=CCO MCULE-7248316175 [0,2,0,0,0,0|0,0,1]=3 796 B13R0.336 CCCCCCCCCCCCC#N MCULE-2240447839 [0,2,0,0,0,0|1,0,1]=4 797 B13R0.336 CCCCCCCCCCCCC=O MCULE-6267230462 [0,2,0,0,0,0|0,0,0]=2 798 B13R0.336 CCCCCCCCCCCCCBr MCULE-4920949706 [0,2,0,0,0,0|1,0,1]=4 799 B13R0.336 CCCCCCCCCCCCCC MCULE-7442374993 [0,2,0,0,0,0|1,0,1]=4 800 B13R0.336 CCCCCCCCCCCCCCl MCULE-5597677663 [0,2,0,0,0,0|1,0,1]=4 801 B13R0.336 CCCCCCCCCCCCCI MCULE-8848884635 [0,2,0,0,0,0|1,0,1]=4 802 B13R0.336 CCCCCCCCCCCCCN MCULE-1771591728 [0,2,0,0,0,0|1,0,1]=4 803 B13R0.336 CCCCCCCCCCCCCO MCULE-4385103550 [0,2,0,0,0,0|0,0,2]=4 804 B13R0.336 CCCCCCCCCCCCNC MCULE-6157278006 [0,2,0,0,0,0|1,0,1]=4 805 B13R0.336 CCCCCCCCCCCCON MCULE-8050164267 [0,2,0,0,0,0|0,0,2]=4 806 B13R0.336 CCCCCCCCCCCCSC MCULE-8837710331 [0,2,0,0,0,0|0,1,1]=4 807 B13R0.336 CCCCCCCCCCCSCC MCULE-7247079771 [0,2,0,0,0,0|0,1,1]=4 808 B13R0.336 CCCCCCCCCCNCCC MCULE-5779059384 [0,2,0,0,0,0|1,0,1]=4 809 B13R0.336 CCCCCCCCCCNCCO MCULE-6579629969 [0,2,0,0,0,0|0,0,2]=4 810 B13R0.336 CCCCCCCCCCOCCCl MCULE-1526089088 [0,2,0,0,0,0|1,0,1]=4 811 B13R0.336 CCCCCCCCCCOCCO MCULE-4975665756 [0,2,0,0,0,0|0,0,2]=4 812 B13R0.336 CCCCCCCCCCSCCO MCULE-4627647142 [0,2,0,0,0,0|0,0,2]=4 813 B13R0.336 CCCCCCCCCC[NH2+]CCCl MCULE-2529658193 [0,2,0,0,0,0|1,0,1]=4 814 B13R0.336 CCCCCCCCCC[NH2+]CCCl MCULE-5824513113 [0,2,0,0,0,0|1,0,1]=4 815 B13R0.336 CCCCCCCCCNCCC#N MCULE-7229403210 [0,2,0,0,0,0|1,0,1]=4 816 B13R0.336 CCCCCCCCC[NH2+]CCCC MCULE-3004462204 [0,2,0,0,0,0|1,0,1]=4 817 B13R0.336 CCCCCCCCC[NH2+]CCCC MCULE-3338948197 [0,2,0,0,0,0|1,0,1]=4 818 B13R0.336 CCCCCCCCNCCOCC MCULE-6476025295 [0,2,0,0,0,0|1,0,1]=4 819 B13R0.336 CCCCCCCC[NH2+]CCOCC MCULE-4163142812 [0,2,0,0,0,0|1,0,1]=4 820 B13R0.336 CCCCCCCNCCCNCC MCULE-4051699159 [0,2,0,0,0,0|1,0,1]=4 821 B13R0.336 CCCCCCCOCCOCCCl MCULE-7165053997 [0,2,0,0,0,0|1,0,1]=4 822 B13R0.336 CCCCCCCSCCOCCO MCULE-9037054254 [0,2,0,0,0,0|0,0,2]=4 823 B13R0.336 CCCCCCNCCCCCCN MCULE-6843159625 [0,2,0,0,0,0|1,0,1]=4 824 B13R0.336 CCCCCCSSCCCCCC MCULE-8877459781 [0,2,0,0,0,0|1,0,1]=4 825 B13R0.336 CCCNCCCCCCNCCC MCULE-3165058793 [0,2,0,0,0,0|1,0,1]=4 826 B13R0.336 CCCOCCOCCCCCCCl MCULE-3105139015 [0,2,0,0,0,0|1,0,1]=4 827 B13R0.336 ClCCCCCCCCCCCCCl MCULE-9606409213 [0,2,0,0,0,0|1,0,1]=4 828 B13R0.336 N#CCCCCCCCCCCC#N MCULE-2498633799 [0,2,0,0,0,0|1,0,1]=4 829 B13R0.336 N#N=NCCCCCCCCCCN MCULE-1994034050 [0,2,0,0,0,0|2,0,0]=4 830 B13R0.336 N#N=NCCCCCCCCCCO MCULE-1106977345 [0,2,0,0,0,0|2,0,0]=4 831 B13R0.336 NCCCCCCCCCCCCBr MCULE-3944006044 [0,2,0,0,0,0|1,0,1]=4 832 B13R0.336 NCCCCCCCCCCCCBr MCULE-9552866350 [0,2,0,0,0,0|1,0,1]=4 833 B13R0.336 NCCCCCCCCCCCCN MCULE-7545047614 [0,2,0,0,0,0|1,0,1]=4 834 B13R0.336 NCCCCCCCCCCCCO MCULE-2914976551 [0,2,0,0,0,0|0,0,2]=4 835 B13R0.336 O=CCCCCCCCCCCC=O MCULE-9426216050 [0,2,0,0,0,0|0,0,0]=2 836 B13R0.336 O=CCCCCCCCCCCCBr MCULE-4256275371 [0,2,0,0,0,0|0,0,0]=2 837 B13R0.336 OCCCCCCCCCCCCBr MCULE-1748500310 [0,2,0,0,0,0|0,0,2]=4 838 B13R0.336 OCCCCCCCCCCCCO MCULE-7189041510 [0,2,0,0,0,0|0,0,2]=4 839 B13R0.336 OCCCCCOCCCCCCCl MCULE-1987336489 [0,2,0,0,0,0|0,0,2]=4 840 B13R0.1 CCCCCCC(=O)CCCC(=O)O MCULE-4056750992 [0,2,0,0,0,0|0,0,1]=3 841 B13R0.1 CCCCCCC(O)CCCC(=O)O MCULE-1012275180 [0,2,0,0,0,0|0,0,0]=2 842 B13R0.188 CCCCCC(=O)CCCCC(=O)O MCULE-9827668199 [0,2,0,0,0,0|0,0,1]=3 843 B13R0.1171 CCCCCCC(O)C(O)CCCC MCULE-9373507026 [0,2,0,0,0,0|1,0,1]=4 844 B13R0.1171 CCCCCC[C@H](O)[C@@H](O)CCCC MCULE-2830771514 [0,2,0,0,0,0|1,0,1]=4 845 B13R0.1171 CCCCCC[C@H](O)[C@H](O)CCCC MCULE-1920429773 [0,2,0,0,0,0|1,0,1]=4 846 B13R0.119 CCCCC(=O)CCCCCC(=O)O MCULE-7182880008 [0,2,0,0,0,0|0,0,1]=3 847 B13R0.154 CCCCCCCC(=O)CCC(=O)O MCULE-3369465256 [0,2,0,0,0,0|0,0,1]=3 848 B13R0.154 CCCCCCCC(=O)NCC(=O)O MCULE-7832794516 [0,2,0,0,0,0|1,0,1]=4 849 B13R0.154 CCCCCCCC(=O)NCC(=O)[O-] MCULE-9063422320 [0,2,0,0,0,0|1,0,1]=4 850 B13R0.154 CCCCCCCC(O)CCC(=O)[O-] MCULE-5105119706 [0,2,0,0,0,0|0,0,0]=2 851 B13R0.154 CCCCCCCC(O)CCC(=O)[O-] MCULE-6637797878 [0,2,0,0,0,0|0,0,0]=2 852 B13R0.154 CCCCCCNC(=O)CCC(=O)O MCULE-4928328474 [0,2,0,0,0,0|1,0,1]=4 853 B13R0.150 CCCCCCCCCC(C)C(=O)O MCULE-6924124828 [0,2,0,0,0,0|0,0,0]=2 854 B13R0.150 CCCCCCCCCC(N)C(=O)O MCULE-2123708638 [0,2,0,0,0,0|0,0,0]=2 855 B13R0.150 CCCCCCCCC[C@@H](N)C(=O)O MCULE-7136532768 [0,2,0,0,0,0|0,0,0]=2 856 B13R0.150 N[C@@H](CCCCNCCCO)C(=O)O MCULE-1769705869 [0,2,0,0,0,0|2,0,0]=4 857 B13R0.150 [C@H](N)(CCCCCCCCC)C(=O)O MCULE-9801560462 [0,2,0,0,0,0|0,0,0]=2 858 B13R0.179 CC(=O)CCCCCCCCC(=O)C MCULE-9381321030 [0,2,0,0,0,0|0,0,1]=3 859 B13R0.179 CC(=O)CCCCCCCCC(=O)O MCULE-3207729356 [0,2,0,0,0,0|0,0,1]=3 860 B13R0.179 CC(C)CCCCCCCCC(=O)O MCULE-3966843726 [0,2,0,0,0,0|0,0,0]=2 861 B13R0.179 CC(N)CCCCCCCCC(=O)O MCULE-2236874517 [0,2,0,0,0,0|0,0,0]=2 862 B13R0.179 CC(O)CCCC/C=C/CCC(=O)O MCULE-4184050410 [0,2,0,0,0,0|0,0,2]=4 863 B13R0.179 NC(=O)CCCCCCCCC(=O)N MCULE-4459267910 [0,2,0,0,0,0|1,0,1]=4 864 B13R0.179 NC(=O)CCCCCCCCC(=O)O MCULE-3812988206 [0,2,0,0,0,0|1,0,1]=4 865 B13R0.179 NC(=O)CCCCCCCCC(=O)[O-] MCULE-9835231552 [0,2,0,0,0,0|1,0,1]=4 866 B13R0.179 O=C(Cl)CCCCCCCCC(=O)Cl MCULE-1861027504 [0,2,0,0,0,0|1,0,1]=4 867 B13R0.179 O=C(O)CCCCCCCCC(=O)O MCULE-3460494679 [0,2,0,0,0,0|1,0,1]=4 868 B13R0.179 O=C([O-])CCCCCCCCC(=O)[O-] MCULE-6225615294 [0,2,0,0,0,0|1,0,1]=4 869 B13R0.179 O=C([O-])CCCCCCCCC(=O)[O-] MCULE-8793407892 [0,2,0,0,0,0|1,0,1]=4 870 B13R0.179 O=C([O-])CCCCCCCCC(=O)[O-] MCULE-9026337383 [0,2,0,0,0,0|1,0,1]=4 871 B13R0.202 CCC(C)CCCCCCCC(=O)O MCULE-1986520602 [0,2,0,0,0,0|0,0,0]=2 872 B13R0.202 COC(=O)CCCCCCCC(=O)O MCULE-2825137842 [0,2,0,0,0,0|1,0,1]=4 873 B13R0.280 CCCCCCCCCCP(=O)(C)C MCULE-7993897252 [0,2,0,0,0,0|1,0,0]=3 874 B13R0.280 CCCCCCCCCCP(=O)(O)O MCULE-1652235001 [0,2,0,0,0,0|1,0,0]=3 875 B13R0.280 CCCCCCCCCCS(=O)(=O)Cl MCULE-6241290151 [0,2,0,0,0,0|1,0,0]=3 876 B13R0.280 CCCCCCCCCCS(=O)(=O)N MCULE-9253411450 [0,2,0,0,0,0|1,0,0]=3 877 B13R0.280 CCCCCCCCCCS(=O)(=O)O MCULE-1242262217 [0,2,0,0,0,0|1,0,0]=3 878 B13R0.280 CCCCCCCCCCS(=O)(=O)[O-] MCULE-7783749388 [0,2,0,0,0,0|1,0,0]=3 879 B13R0.280 CCCCCCCCCC[N+](C)(C)C MCULE-3384760582 [0,2,0,0,0,0|2,0,0]=4 880 B13R0.280 CCCCCCCCCC[N+](C)(C)C MCULE-7441976704 [0,2,0,0,0,0|2,0,0]=4 881 B13R0.280 CCCCCCCCCC[N+](C)(C)C MCULE-9457271107 [0,2,0,0,0,0|2,0,0]=4 882 B13R0.280 CCCCCCCCCC[N+](C)(C)[O-] MCULE-9878706939 [0,2,0,0,0,0|1,0,1]=4 883 B13R0.280 CCCCCCCCCC[Si](C)(C)Cl MCULE-6793568340 [0,2,0,0,0,0|1,1,0]=4 884 B13R0.280 CCCCCCCCCC[Si](C)(Cl)Cl MCULE-9569407905 [0,2,0,0,0,0|1,1,0]=4 885 B13R0.280 CCCCCCCCCC[Si](Cl)(Cl)Cl MCULE-2592527518 [0,2,0,0,0,0|1,1,0]=4 886 B13R0.412 CCCCCCCCCC(C=O)CC MCULE-6879865212 [0,2,0,0,0,0|0,0,0]=2 887 B13R0.412 CCCCCCCCCC(CC)CO MCULE-4844751733 [0,2,0,0,0,0|0,0,2]=4 888 B13R0.412 CCCCCCCCCC(CO)CO MCULE-2139434580 [0,2,0,0,0,0|0,0,2]=4 889 B13R0.412 CCCCCCCCCC(OC)OC MCULE-5319229815 [0,2,0,0,0,0|2,0,0]=4 890 B13R0.1215 C#CC(C)(O)CCCCCCCCC MCULE-6195266277 [0,2,0,0,0,0|1,0,1]=4 891 B11R1.4 BrCCCCCN1CCCC1 MCULE-2569347978 [1,0,0,1,0,0|2,0,0]=4 892 B11R1.4 BrCCCCCN1CCCC1 MCULE-8853721324 [1,0,0,1,0,0|2,0,0]=4 893 B11R1.4 CCCCCCC1OCCO1 MCULE-4454812568 [1,0,0,1,0,0|1,0,1]=4 894 B11R1.4 NCCCCCN1CCCC1 MCULE-5199170638 [1,0,0,1,0,0|2,0,0]=4 895 B11R1.4 NCCCCCN1CCCC1 MCULE-5472914492 [1,0,0,1,0,0|2,0,0]=4 896 B11R1.4 OCCCCCN1CCCC1 MCULE-6150953693 [1,0,0,1,0,0|1,0,1]=4 897 B11R1.4 OCCCNCC1CCCC1 MCULE-4801540502 [1,0,0,1,0,0|1,0,1]=4 898 B11R1.4 OCCCOCC1CCCC1 MCULE-4073733141 [1,0,0,1,0,0|1,0,1]=4 899 B11R1.5 CCCC1CCCCNC1=O MCULE-1989909498 [1,0,0,1,0,0|1,0,0]=3 900 B11R1.5 CCCN1CCCNCC1=O MCULE-8150823911 [1,0,0,1,0,0|2,0,0]=4 901 B11R1.5 CCCN1CCNCCC1=O MCULE-1036321145 [1,0,0,1,0,0|2,0,0]=4 902 B11R1.5 CCCN1CCNCCC1=O MCULE-8130444004 [1,0,0,1,0,0|2,0,0]=4 903 B11R1.5 CCOC1CCCCCC1N MCULE-9256143866 [1,0,0,1,0,0|2,0,0]=4 904 B11R1.5 NCCN1CCCCCC1=O MCULE-6085364731 [1,0,0,1,0,0|2,0,0]=4 905 B11R1.5 O=C1CCCCCN1CCO MCULE-2748237095 [1,0,0,1,0,0|2,0,0]=4 906 B11R1.17 CC1CCCCC1OCCCl MCULE-9791178493 [1,0,0,1,0,0|2,0,0]=4 907 B11R1.17 CC1CCCCC1OCCN MCULE-5310119255 [1,0,0,1,0,0|2,0,0]=4 908 B11R1.17 CC1CCCCN1CCCN MCULE-2710906420 [1,0,0,1,0,0|2,0,0]=4 909 B11R1.17 CCCCC1CCCCC1O MCULE-7002165342 [1,0,0,1,0,0|0,0,1]=3 910 B11R1.17 CCCCC1NCCNC1=O MCULE-8504158690 [1,0,0,1,0,0|2,0,0]=4 911 B11R1.17 CCCCN1CCNCC1=O MCULE-4836745667 [1,0,0,1,0,0|2,0,0]=4 912 B11R1.17 CCCNC1CCCCC1O MCULE-8368765892 [1,0,0,1,0,0|1,0,1]=4 913 B11R1.17 CCCN[C@@H]1CCCC[C@H]1O MCULE-3339453217 [1,0,0,1,0,0|1,0,1]=4 914 B11R1.17 CCCN[C@@H]1CCCC[C@H]1O MCULE-8427110995 [1,0,0,1,0,0|1,0,1]=4 915 B11R1.17 CCCOC1CCCCC1Cl MCULE-4466673525 [1,0,0,1,0,0|2,0,0]=4 916 B11R1.17 CNCCN1CCCCC1=O MCULE-2748762852 [1,0,0,1,0,0|2,0,0]=4 917 B11R1.17 CNCCN1CCCCC1=O MCULE-6209260920 [1,0,0,1,0,0|2,0,0]=4 918 B11R1.17 N#CCCC1CCCCC1=O MCULE-6518120828 [1,0,0,1,0,0|1,0,1]=4 919 B11R1.17 NCCCC1CCCCC1O MCULE-4985421129 [1,0,0,1,0,0|1,0,1]=4 920 B11R1.17 NCCCN1CCCCC1=O MCULE-3264201427 [1,0,0,1,0,0|2,0,0]=4 921 B11R1.17 O=C1CCCCC1CCCO MCULE-6491492717 [1,0,0,1,0,0|1,0,0]=3 922 B11R1.17 O=C1CCCCN1CCCO MCULE-3358401474 [1,0,0,1,0,0|2,0,0]=4 923 B11R1.26 COC1CCCCCCC1N MCULE-2038984012 [1,0,0,1,0,0|2,0,0]=4 924 B11R1.28 BrCCCCC1CCCCC1 MCULE-1688175311 [1,0,0,1,0,0|1,0,0]=3 925 B11R1.28 BrCCCCC1CCNCC1 MCULE-2146881103 [1,0,0,1,0,0|2,0,0]=4 926 B11R1.28 BrCCCCC1CCNCC1 MCULE-9773440381 [1,0,0,1,0,0|2,0,0]=4 927 B11R1.28 BrCCCCC1CCOCC1 MCULE-7533322961 [1,0,0,1,0,0|2,0,0]=4 928 B11R1.28 BrCCCCN1CCCCC1 MCULE-2093904387 [1,0,0,1,0,0|2,0,0]=4 929 B11R1.28 BrCCCCN1CCCCC1 MCULE-6368651814 [1,0,0,1,0,0|2,0,0]=4 930 B11R1.28 BrCCCOC1CCCCC1 MCULE-6709385619 [1,0,0,1,0,0|2,0,0]=4 931 B11R1.28 C=CCCCC1CCCCC1 MCULE-7312271164 [1,0,0,1,0,0|0,0,1]=3 932 B11R1.28 C=CCCOC1CCCCC1 MCULE-8490111049 [1,0,0,1,0,0|1,0,1]=4 933 B11R1.28 C=CCNCC1CCCCC1 MCULE-2828762425 [1,0,0,1,0,0|1,0,1]=4 934 B11R1.28 CCCCCC1=CCNCC1 MCULE-3759142054 [1,0,0,1,0,0|1,0,1]=4 935 B11R1.28 CCCCCC1CCCCC1 MCULE-8832032133 [1,0,0,1,0,0|0,0,1]=3 936 B11R1.28 CCCCCC1CCCCN1 MCULE-4218318893 [1,0,0,1,0,0|1,0,0]=3 937 B11R1.28 CCCCCN1CCCCC1 MCULE-1046315865 [1,0,0,1,0,0|1,0,1]=4 938 B11R1.28 CCCCC[NH+]1CCCCC1 MCULE-1462611325 [1,0,0,1,0,0|1,0,1]=4 939 B11R1.28 CCCCNC1CCCCC1 MCULE-2774132748 [1,0,0,1,0,0|1,0,1]=4 940 B11R1.28 CCCCNC1CCCCC1 MCULE-7612672790 [1,0,0,1,0,0|1,0,1]=4 941 B11R1.28 CCCCOC1CCCCO1 MCULE-5619472922 [1,0,0,1,0,0|1,0,1]=4 942 B11R1.28 CCCNCC1CCCCC1 MCULE-3141764161 [1,0,0,1,0,0|1,0,1]=4 943 B11R1.28 CCCNCC1CCCCC1 MCULE-4265324682 [1,0,0,1,0,0|1,0,1]=4 944 B11R1.28 CCCNCC1CCCCO1 MCULE-6602583901 [1,0,0,1,0,0|1,0,1]=4 945 B11R1.28 CCNCCC1=CCCCC1 MCULE-8775802793 [1,0,0,1,0,0|1,0,1]=4 946 B11R1.28 CCNCCC1=CCCCC1 MCULE-9487350468 [1,0,0,1,0,0|1,0,1]=4 947 B11R1.28 CCOCCC1CCCCN1 MCULE-3526880225 [1,0,0,1,0,0|2,0,0]=4 948 B11R1.28 CCOCCC1CCCCN1 MCULE-9747276803 [1,0,0,1,0,0|2,0,0]=4 949 B11R1.28 CNCCCC1CCCCC1 MCULE-9069202916 [1,0,0,1,0,0|1,0,1]=4 950 B11R1.28 COCCCC1CCCCN1 MCULE-4074520103 [1,0,0,1,0,0|2,0,0]=4 951 B11R1.28 ClCCCOC1CCCCC1 MCULE-4603008047 [1,0,0,1,0,0|2,0,0]=4 952 B11R1.28 ICCCCC1CCCCC1 MCULE-6154026120 [1,0,0,1,0,0|1,0,0]=3 953 B11R1.28 NCCCCC1CCCCC1 MCULE-2906458062 [1,0,0,1,0,0|1,0,0]=3 954 B11R1.28 NCCCCC1CCNCC1 MCULE-3379707416 [1,0,0,1,0,0|2,0,0]=4 955 B11R1.28 NCCCCN1CCCCC1 MCULE-5864275337 [1,0,0,1,0,0|2,0,0]=4 956 B11R1.28 NCCCCN1CCCCC1 MCULE-6475626573 [1,0,0,1,0,0|2,0,0]=4 957 B11R1.28 NCCCNC1CCCCC1 MCULE-4064689865 [1,0,0,1,0,0|2,0,0]=4 958 B11R1.28 NCCCOC1CCCCC1 MCULE-3609935064 [1,0,0,1,0,0|2,0,0]=4 959 B11R1.28 NCCCSC1CCCCC1 MCULE-7953895791 [1,0,0,1,0,0|2,0,0]=4 960 B11R1.28 NCCOCC1CCCCC1 MCULE-9417766642 [1,0,0,1,0,0|2,0,0]=4 961 B11R1.28 O=CCCCC1CCCCC1 MCULE-8571570461 [1,0,0,1,0,0|0,0,0]=2 962 B11R1.28 O=CCCCN1CCOCC1 MCULE-4787055493 [1,0,0,1,0,0|2,0,0]=4 963 B11R1.28 O=CCCOC1CCCCC1 MCULE-4673250182 [1,0,0,1,0,0|1,0,0]=3 964 B11R1.28 O=CCOCC1CCCCC1 MCULE-7612102606 [1,0,0,1,0,0|1,0,0]=3 965 B11R1.28 O=CCOCC1CCOCC1 MCULE-1054046333 [1,0,0,1,0,0|2,0,0]=4 966 B11R1.28 OCCCCC1=CCCCC1 MCULE-2186207882 [1,0,0,1,0,0|1,0,1]=4 967 B11R1.28 OCCCCC1CCCCC1 MCULE-3644108501 [1,0,0,1,0,0|0,0,1]=3 968 B11R1.28 OCCCCC1CCCCN1 MCULE-3714334346 [1,0,0,1,0,0|1,0,1]=4 969 B11R1.28 OCCCCC1CCCNC1 MCULE-7769059484 [1,0,0,1,0,0|1,0,1]=4 970 B11R1.28 OCCCCC1CCNCC1 MCULE-2492519799 [1,0,0,1,0,0|1,0,1]=4 971 B11R1.28 OCCCCC1CCNCC1 MCULE-9994111075 [1,0,0,1,0,0|1,0,1]=4 972 B11R1.28 OCCCCN1CCCCC1 MCULE-7640069933 [1,0,0,1,0,0|1,0,1]=4 973 B11R1.28 OCCCCN1CCCCC1 MCULE-9734250002 [1,0,0,1,0,0|1,0,1]=4 974 B11R1.28 OCCCNC1CCCCC1 MCULE-4167772942 [1,0,0,1,0,0|1,0,1]=4 975 B11R1.28 OCCCOC1CCCCC1 MCULE-3209317348 [1,0,0,1,0,0|1,0,1]=4 976 B11R1.28 OCCNCC1CCCCC1 MCULE-1393340274 [1,0,0,1,0,0|1,0,1]=4 977 B11R1.28 OCCNCC1CCCCC1 MCULE-7217857602 [1,0,0,1,0,0|1,0,1]=4 978 B11R1.41 CCC1CCCCN1CCN MCULE-3604459788 [1,0,0,1,0,0|2,0,0]=4 979 B11R1.41 CCC1CCCCN1CCO MCULE-3619810201 [1,0,0,1,0,0|1,0,1]=4 980 B11R1.41 CCCC1CCCCC1CN MCULE-8861688157 [1,0,0,1,0,0|1,0,0]=3 981 B11R1.41 CCCN1CCCCC1CC MCULE-8487769876 [1,0,0,1,0,0|1,0,1]=4 982 B11R1.41 CCCN1CCCCC1CN MCULE-4827719162 [1,0,0,1,0,0|2,0,0]=4 983 B11R1.41 CCN1CCCCC1CCO MCULE-6546654545 [1,0,0,1,0,0|1,0,1]=4 984 B11R1.51 CCN1CCCCCC1CO MCULE-9392450597 [1,0,0,1,0,0|1,0,1]=4 985 B11R1.92 C1CCCCCCCCCC1 MCULE-6783863454 [1,0,0,1,0,0|0,0,1]=3 986 B11R1.92 C1CCCCCNCCCC1 MCULE-1671621328 [1,0,0,1,0,0|1,0,0]=3 987 B11R1.99 C=CCCCCCCC1CO1 MCULE-7968068959 [1,0,0,1,0,0|1,0,1]=4 988 B11R1.99 CCCCCCCCC1CO1 MCULE-5254067206 [1,0,0,1,0,0|0,0,1]=3 989 B11R1.99 CCCCCCCC[C@@H]1CO1 MCULE-1956936475 [1,0,0,1,0,0|0,0,1]=3 990 B11R1.99 CCCCCCOCC1CO1 MCULE-4928959956 [1,0,0,1,0,0|1,0,1]=4 991 B11R1.99 CCCCCCOC[C@H]1CO1 MCULE-7895281836 [1,0,0,1,0,0|1,0,1]=4 992 B11R1.99 O=CCOCCOCC1CC1 MCULE-4078770343 [1,0,0,1,0,0|2,0,0]=4 993 B11R1.101 NC1CCCCCCCCC1 MCULE-7140828852 [1,0,0,1,0,0|1,0,0]=3 994 B11R1.101 NC1CCCCCCCCC1 MCULE-9762725860 [1,0,0,1,0,0|1,0,0]=3 995 B11R1.101 O=C1CCCCCCCCC1 MCULE-7431354983 [1,0,0,1,0,0|0,0,0]=2 996 B11R1.101 O=C1CCCCCCCCN1 MCULE-4805310836 [1,0,0,1,0,0|1,0,0]=3 997 B11R1.101 O=C1CCNCCCCCN1 MCULE-1892904766 [1,0,0,1,0,0|2,0,0]=4 998 B11R1.117 C=CCC1CCCCCCC1 MCULE-5863038923 [1,0,0,1,0,0|0,0,1]=3 999 B11R1.117 CNCC1CCCCCCC1 MCULE-3882363434 [1,0,0,1,0,0|1,0,1]=4 1000 B11R1.117 NCCC1CCCCCCC1 MCULE-5038195827 [1,0,0,1,0,0|1,0,0]=3 1001 B11R1.117 NCCC1CCCCCCC1 MCULE-9743664308 [1,0,0,1,0,0|1,0,0]=3 1002 B11R1.180 CCCCC=C1CCCC1=O MCULE-3061361246 [1,0,0,1,0,0|0,0,2]=4 1003 B11R1.180 CCCCCC1=CCCC1=O MCULE-2643922279 [1,0,0,1,0,0|0,0,2]=4 1004 B11R1.180 CCCCCC1CCCC1=O MCULE-7048040111 [1,0,0,1,0,0|0,0,0]=2 1005 B11R1.180 CCCCCC1CCCC1O MCULE-7690407093 [1,0,0,1,0,0|0,0,1]=3 1006 B11R1.180 CCCCCN1CCCC1=O MCULE-7791437264 [1,0,0,1,0,0|1,0,0]=3 1007 B11R1.180 CCNCCN1CCCC1=O MCULE-9602250458 [1,0,0,1,0,0|2,0,0]=4 1008 B11R1.180 NCCCCN1CCCC1=O MCULE-2895726457 [1,0,0,1,0,0|2,0,0]=4 1009 B11R1.180 NCCCCN1CCCC1=O MCULE-8478246977 [1,0,0,1,0,0|2,0,0]=4 1010 B11R1.203 CCCNC1CCCCCC1 MCULE-1802038783 [1,0,0,1,0,0|1,0,1]=4 1011 B11R1.203 CCCNC1CCCCCC1 MCULE-6514815926 [1,0,0,1,0,0|1,0,1]=4 1012 B11R1.203 ClCCCN1CCCCCC1 MCULE-4446350612 [1,0,0,1,0,0|2,0,0]=4 1013 B11R1.203 ClCCCN1CCCCCC1 MCULE-5626042622 [1,0,0,1,0,0|2,0,0]=4 1014 B11R1.203 ClCCOC1CCCCCC1 MCULE-5770313338 [1,0,0,1,0,0|2,0,0]=4 1015 B11R1.203 NCCCN1CCCCCC1 MCULE-6752637133 [1,0,0,1,0,0|2,0,0]=4 1016 B11R1.203 NCCCN1CCCCCC1 MCULE-9625062423 [1,0,0,1,0,0|2,0,0]=4 1017 B11R1.203 NCCOC1CCCCCC1 MCULE-2079787273 [1,0,0,1,0,0|2,0,0]=4 1018 B11R1.203 O=CCCC1CCCCCC1 MCULE-5898493972 [1,0,0,1,0,0|0,0,0]=2 1019 B11R1.203 OCCCN1CCCCCC1 MCULE-4520769761 [1,0,0,1,0,0|1,0,1]=4 1020 B11R1.203 OCCCN1CCCCCC1 MCULE-4937889727 [1,0,0,1,0,0|1,0,1]=4 1021 B11R1.203 OCCNC1CCCCCC1 MCULE-9807195475 [1,0,0,1,0,0|1,0,1]=4 1022 B11R1.203 OCCOC1CCCCCC1 MCULE-7377327373 [1,0,0,1,0,0|1,0,1]=4 1023 B13R1.6 CCCCCCC1CCCC(=O)O1 MCULE-7844383556 [0,1,0,1,0,0|0,0,0]=2 1024 B13R1.6 N#CCCCCC1CCCC(=O)C1 MCULE-6540271443 [0,1,0,1,0,0|1,0,1]=4 1025 B13R1.119 CNCCCCCCN1CCCC1 MCULE-8799015618 [0,1,0,1,0,0|2,0,0]=4 1026 B13R1.119 NCCCCCCCN1CCCC1 MCULE-9384996396 [0,1,0,1,0,0|1,0,1]=4 1027 B13R1.279 C=C1CCCCCCCCCCC1 MCULE-1393925319 [0,1,0,1,0,0|1,0,0]=3 1028 B13R1.279 NC1CCCCCCCCCCC1 MCULE-2290888255 [0,1,0,1,0,0|1,0,1]=4 1029 B13R1.279 NC1CCCCCCCCCCC1 MCULE-4286699290 [0,1,0,1,0,0|1,0,1]=4 1030 B13R1.279 O=C1CCCCCCCCCCC1 MCULE-8431279332 [0,1,0,1,0,0|0,0,0]=2 1031 B13R1.279 O=C1CCCCCCCCCCN1 MCULE-7739147292 [0,1,0,1,0,0|0,0,0]=2 1032 B13R1.279 O=C1CCCCCCCCCCO1 MCULE-5646678690 [0,1,0,1,0,0|0,0,0]=2 1033 B13R1.279 OC1CCCCCCCCCCC1 MCULE-4246723921 [0,1,0,1,0,0|0,0,2]=4 1034 B13R1.279 SC1CCCCCCCCCCC1 MCULE-1071128546 [0,1,0,1,0,0|0,1,1]=4 1035 B13R1.463 CCOC(=O)C1CCCCCC1=O MCULE-8781094992 [0,1,0,1,0,0|1,0,1]=4 1036 B13R1.470 CCOC(=O)CC1CCCCC1=O MCULE-9467254413 [0,1,0,1,0,0|1,0,1]=4 1037 B13R1.654 CCCCCCCC1CCCC1=O MCULE-6699941490 [0,1,0,1,0,0|0,0,0]=2 1038 B13R1.654 NCCCCCCN1CCCC1=O MCULE-3326150174 [0,1,0,1,0,0|1,0,0]=3 1039 B13R1.28 BrCCCCCCN1CCCCC1 MCULE-6011701351 [0,1,0,1,0,0|1,0,1]=4 1040 B13R1.28 BrCCCCCCN1CCCCC1 MCULE-9810821767 [0,1,0,1,0,0|1,0,1]=4 1041 B13R1.28 C=CCCCOCC1CCCNC1 MCULE-1388192137 [0,1,0,1,0,0|2,0,0]=4 1042 B13R1.28 C=CCCCOCC1CCCNC1 MCULE-2475035835 [0,1,0,1,0,0|2,0,0]=4 1043 B13R1.28 C=CCCCOCC1CCNCC1 MCULE-2419701468 [0,1,0,1,0,0|2,0,0]=4 1044 B13R1.28 C=CCCCOCC1CCNCC1 MCULE-9126072209 [0,1,0,1,0,0|2,0,0]=4 1045 B13R1.28 CCCCCCCC1CCCCC1 MCULE-5431487347 [0,1,0,1,0,0|1,0,1]=4 1046 B13R1.28 CCCCCCNC1CCCCC1 MCULE-6789452864 [0,1,0,1,0,0|1,0,1]=4 1047 B13R1.28 CCCCCOCC1CCCNC1 MCULE-3693003650 [0,1,0,1,0,0|2,0,0]=4 1048 B13R1.28 CCCCCOCC1CCCNC1 MCULE-9088432986 [0,1,0,1,0,0|2,0,0]=4 1049 B13R1.28 CCCCOCCC1CCCCN1 MCULE-1782187856 [0,1,0,1,0,0|1,0,1]=4 1050 B13R1.28 CCCCOCCC1CCCCN1 MCULE-9531880120 [0,1,0,1,0,0|1,0,1]=4 1051 B13R1.28 CCCCOCCC1CCCNC1 MCULE-1520952561 [0,1,0,1,0,0|2,0,0]=4 1052 B13R1.28 CCCCOCCC1CCCNC1 MCULE-5024842978 [0,1,0,1,0,0|2,0,0]=4 1053 B13R1.28 ClCCCCCCN1CCCCC1 MCULE-6200665496 [0,1,0,1,0,0|1,0,1]=4 1054 B13R1.28 ClCCCCCCN1CCCCC1 MCULE-8895316075 [0,1,0,1,0,0|1,0,1]=4 1055 B13R1.28 NCCCCCCN1CCCCC1 MCULE-9114143742 [0,1,0,1,0,0|1,0,1]=4 1056 B13R1.28 NCCCCCOC1CCCCC1 MCULE-3129190368 [0,1,0,1,0,0|1,0,1]=4 1057 B13R1.28 OCCCCCCN1CCCCC1 MCULE-2495960726 [0,1,0,1,0,0|0,0,2]=4 1058 B13R1.28 OCCCOCCC1CCCCC1 MCULE-7506426792 [0,1,0,1,0,0|0,0,2]=4 1059 B13R1.28 OCCNCCCC1CCCCC1 MCULE-8626697968 [0,1,0,1,0,0|0,0,2]=4 1060 B13R1.34 CCOCCN1CCNCCC1=O MCULE-3608170032 [0,1,0,1,0,0|2,0,0]=4 1061 B13R1.34 CCOCCN1CCNCCC1=O MCULE-6065051100 [0,1,0,1,0,0|2,0,0]=4 1062 B13R1.84 CCC1CCCCN1CCCCN MCULE-5318305041 [0,1,0,1,0,0|1,0,1]=4 1063 B13R1.137 CCCCCCC1CCCC1=NO MCULE-2071942896 [0,1,0,1,0,0|0,0,1]=3 1064 B13R1.207 CCNC1CCCCCCC1OC MCULE-7916661103 [0,1,0,1,0,0|2,0,0]=4 1065 B13R1.207 CCOC1CCCCCCC1NC MCULE-2927737246 [0,1,0,1,0,0|2,0,0]=4 1066 B13R1.555 CCCCCCC1CCCCC1=O MCULE-7562924636 [0,1,0,1,0,0|0,0,0]=2 1067 B13R1.560 CCCCCCCCOC1CNC1 MCULE-1753228172 [0,1,0,1,0,0|2,0,0]=4 1068 B13R1.623 COC1=NCCCCCCCCC1 MCULE-8082869157 [0,1,0,1,0,0|1,0,1]=4 1069 B13R1.659 BrCCCCCCCCCC1CC1 MCULE-7543642317 [0,1,0,1,0,0|1,0,1]=4 1070 B13R1.659 CCCCCCCCCCC1CO1 MCULE-4819613479 [0,1,0,1,0,0|0,0,2]=4 1071 B13R1.659 CCCCCCCCCC[C@@H]1CO1 MCULE-4884564986 [0,1,0,1,0,0|0,0,2]=4 1072 B13R1.659 CCCCCCCCOCC1CO1 MCULE-8564069898 [0,1,0,1,0,0|0,0,2]=4 1073 B13R1.1150 COCCNC1CCCCCCC1 MCULE-1887963695 [0,1,0,1,0,0|2,0,0]=4 1074 B13R1.1150 N#CCCNC1CCCCCCC1 MCULE-6159962391 [0,1,0,1,0,0|1,0,1]=4 1075 B13R1.1887 CCCCCCC1CCCCCN1 MCULE-6689022953 [0,1,0,1,0,0|1,0,1]=4 1076 B13R1.1887 NCCCCCN1CCCCCC1 MCULE-9706592733 [0,1,0,1,0,0|1,0,1]=4 1077 B13R1.1887 NCCCCOC1CCCCCC1 MCULE-7191830940 [0,1,0,1,0,0|1,0,1]=4 1078 B13R1.2883 C1CCCCCCNCCCCC1 MCULE-9792674396 [0,1,0,1,0,0|1,0,1]=4 1079 B13R1.48 CCCCCCC(O)C1CCCC1 MCULE-1863396889 [0,1,0,1,0,0|1,0,1]=4 1080 B13R1.725 CCCCOC(=O)C1CCCC1=O MCULE-9918071269 [0,1,0,1,0,0|1,0,1]=4 1081 B13R1.27 CCCCCCCC1CCC(=O)O1 MCULE-9018416843 [0,1,0,1,0,0|0,0,0]=2 1082 B13R1.27 CCCCCCC[C@H]1CCC(=O)O1 MCULE-5815442718 [0,1,0,1,0,0|0,0,0]=2 1083 B13R1.90 CCC1CCCCC1OCC(=O)O MCULE-4174544329 [0,1,0,1,0,0|1,0,0]=3 1084 B13R1.90 CCC1CCCCN1CCC(=O)O MCULE-7797119414 [0,1,0,1,0,0|1,0,0]=3 1085 B13R1.90 CCC1CCCCN1CCC(=O)O MCULE-8806588553 [0,1,0,1,0,0|1,0,0]=3 1086 B13R1.90 COC1CCCCC1NCC(=O)N MCULE-8300149781 [0,1,0,1,0,0|2,0,0]=4 1087 B13R1.90 COC1CCCCC1NCC(=O)O MCULE-8478049629 [0,1,0,1,0,0|2,0,0]=4 1088 B13R1.158 CC1CCCCN1CCCC(=O)O MCULE-2658022342 [0,1,0,1,0,0|1,0,0]=3 1089 B13R1.158 CC1CCCCN1CCCC(=O)O MCULE-3288150889 [0,1,0,1,0,0|1,0,0]=3 1090 B13R1.158 CN1CCCCC1CNCC(=O)O MCULE-2171668896 [0,1,0,1,0,0|2,0,0]=4 1091 B13R1.158 CN1CCCCC1COCC(=O)O MCULE-3673631668 [0,1,0,1,0,0|2,0,0]=4 1092 B13R1.337 C=C(C)CCCCC1CCCCC1 MCULE-8165088148 [0,1,0,1,0,0|1,0,0]=3 1093 B13R1.337 CC(=O)OCCCC1CCCCN1 MCULE-1444724209 [0,1,0,1,0,0|2,0,0]=4 1094 B13R1.337 CC(=O)OCCCC1CCCCN1 MCULE-4206471088 [0,1,0,1,0,0|2,0,0]=4 1095 B13R1.337 CC(=O)OCCCC1CCCNC1 MCULE-4591243184 [0,1,0,1,0,0|2,0,0]=4 1096 B13R1.337 CC(=O)OCCCC1CCCNC1 MCULE-7140721019 [0,1,0,1,0,0|2,0,0]=4 1097 B13R1.337 CC(=O)OCCCC1CCNCC1 MCULE-2323487501 [0,1,0,1,0,0|2,0,0]=4 1098 B13R1.337 CC(=O)OCCCC1CCNCC1 MCULE-4105549584 [0,1,0,1,0,0|2,0,0]=4 1099 B13R1.337 CC(=O)OCCCN1CCCCC1 MCULE-7448871413 [0,1,0,1,0,0|2,0,0]=4 1100 B13R1.337 CC(=O)OCCCN1CCCCC1 MCULE-7777165052 [0,1,0,1,0,0|2,0,0]=4 1101 B13R1.337 NC(=O)CNCCC1CCCCC1 MCULE-1811204198 [0,1,0,1,0,0|1,0,0]=3 1102 B13R1.337 O=C(O)CCCCC1CCCCC1 MCULE-8624525968 [0,1,0,1,0,0|0,0,0]=2 1103 B13R1.337 O=C(O)CCCCC1CCNCC1 MCULE-9807076317 [0,1,0,1,0,0|1,0,0]=3 1104 B13R1.337 O=C(O)CCCCN1CCCCC1 MCULE-1700384136 [0,1,0,1,0,0|1,0,0]=3 1105 B13R1.337 O=C(O)CCCCN1CCCCC1 MCULE-3436222840 [0,1,0,1,0,0|1,0,0]=3 1106 B13R1.337 O=C(O)CCCCN1CCOCC1 MCULE-2036644380 [0,1,0,1,0,0|2,0,0]=4 1107 B13R1.337 O=C(O)CCCCN1CCOCC1 MCULE-4425234754 [0,1,0,1,0,0|2,0,0]=4 1108 B13R1.337 O=C(O)CCCOC1CCCCO1 MCULE-8336941826 [0,1,0,1,0,0|2,0,0]=4 1109 B13R1.337 O=C(O)CCCOC1CCOCC1 MCULE-9068336054 [0,1,0,1,0,0|2,0,0]=4 1110 B13R1.337 O=C(O)CCCSC1CCCCC1 MCULE-1908047550 [0,1,0,1,0,0|1,0,0]=3 1111 B13R1.337 O=C(O)CCNCC1CCCCC1 MCULE-3522959414 [0,1,0,1,0,0|1,0,0]=3 1112 B13R1.337 O=C(O)CCNCC1CCCCC1 MCULE-9583021057 [0,1,0,1,0,0|1,0,0]=3 1113 B13R1.337 O=C(O)CCOCC1CCCCC1 MCULE-1183191547 [0,1,0,1,0,0|1,0,0]=3 1114 B13R1.337 O=C(O)CCSCC1CCCCC1 MCULE-3460268969 [0,1,0,1,0,0|1,0,0]=3 1115 B13R1.380 CCNC1CCCCC1NC(=O)C MCULE-2777817007 [0,1,0,1,0,0|2,0,0]=4 1116 B13R1.380 CCOC1COCCC1CC(=O)O MCULE-7139932596 [0,1,0,1,0,0|2,0,0]=4 1117 B13R1.380 COCC1CCCCN1CC(=O)O MCULE-9363416940 [0,1,0,1,0,0|2,0,0]=4 1118 B13R1.392 CCCC1SCCN1CCC(=O)N MCULE-6907563146 [0,1,0,1,0,0|2,0,0]=4 1119 B13R1.572 CCNCC1CCCCN1C(=O)C MCULE-9510324212 [0,1,0,1,0,0|2,0,0]=4 1120 B13R1.610 CCC1CCCCCC1NC(=O)C MCULE-1382386726 [0,1,0,1,0,0|1,0,0]=3 1121 B13R1.1022 O=C(O)CCN1CCCCCCC1 MCULE-3702984614 [0,1,0,1,0,0|1,0,0]=3 1122 B13R1.1022 O=C(O)CCN1CCCCCCC1 MCULE-4571415668 [0,1,0,1,0,0|1,0,0]=3 1123 B13R1.1988 C=C(C)CCCC1CCCCCC1 MCULE-6488235518 [0,1,0,1,0,0|1,0,0]=3 1124 B13R1.1988 O=C(O)CCCN1CCCCCC1 MCULE-5500239831 [0,1,0,1,0,0|1,0,0]=3 1125 B13R1.1988 O=C(O)CCCN1CCCCCC1 MCULE-9998662967 [0,1,0,1,0,0|1,0,0]=3 1126 B13R1.527 COC(=O)CC1CCCCCC1=O MCULE-7980040182 [0,1,0,1,0,0|1,0,1]=4 1127 B13R1.528 COC(=O)CCC1CCCCC1=O MCULE-6511835645 [0,1,0,1,0,0|1,0,1]=4 1128 B13R1.546 COC(=O)C1CCCCCCC1=O MCULE-2058547373 [0,1,0,1,0,0|1,0,1]=4 1129 B13R2.3 C1CCC(CC1)C2CCCCC2 MCULE-3955736498 [0,0,0,2,0,0|1,0,1]=4 1130 B13R2.3 C1CCC(CC1)C2CCCCN2 MCULE-5710151824 [0,0,0,2,0,0|1,0,1]=4 1131 B13R2.3 C1CCC(CC1)C2CCCCN2 MCULE-6824813188 [0,0,0,2,0,0|1,0,1]=4 1132 B13R2.3 C1CCC(CC1)C2CCCCN2 MCULE-8267202784 [0,0,0,2,0,0|1,0,1]=4 1133 B13R2.3 C1CCC(CC1)C2CCCNC2 MCULE-9079263956 [0,0,0,2,0,0|2,0,0]=4 1134 B13R2.3 C1CCC(CC1)C2CCCNC2 MCULE-9195309970 [0,0,0,2,0,0|2,0,0]=4 1135 B13R2.3 C1CCC(CC1)C2CCCSC2 MCULE-5671757281 [0,0,0,2,0,0|2,0,0]=4 1136 B13R2.14 O=C1CCCCC12CCCCC2 MCULE-9031710972 [0,0,0,2,0,0|0,0,0]=2 1137 B13R2.14 O=C1CCCOC12CCNCC2 MCULE-1781779092 [0,0,0,2,0,0|2,0,0]=4 1138 B13R2.14 O=C1CCCOC12CCNCC2 MCULE-2706958110 [0,0,0,2,0,0|2,0,0]=4 1139 B13R2.14 O=C1CCOCC12CCCCC2 MCULE-4656627576 [0,0,0,2,0,0|1,0,0]=3 1140 B13R2.14 O=C1NCCCC12CCCCC2 MCULE-9410883978 [0,0,0,2,0,0|1,0,0]=3 1141 B13R2.14 O=C1NCCCC12CCCCN2 MCULE-8565666930 [0,0,0,2,0,0|2,0,0]=4 1142 B13R2.14 O=C1NCCCC12CCCNC2 MCULE-5484725972 [0,0,0,2,0,0|2,0,0]=4 1143 B13R2.14 O=C1NCCCC12CCCNC2 MCULE-9858906467 [0,0,0,2,0,0|2,0,0]=4 1144 B13R2.14 O=C1NCCCC12CCNCC2 MCULE-7551811135 [0,0,0,2,0,0|2,0,0]=4 1145 B13R2.14 O=C1NCCCC12CCNCC2 MCULE-8183318641 [0,0,0,2,0,0|2,0,0]=4 1146 B13R2.14 O=C1NCCCC12CCOCC2 MCULE-2179374202 [0,0,0,2,0,0|2,0,0]=4 1147 B13R2.14 O=C1NCCNC12CCCCC2 MCULE-2688193565 [0,0,0,2,0,0|2,0,0]=4 1148 B13R2.14 O=C1NCCNC12CCCCC2 MCULE-9589331885 [0,0,0,2,0,0|2,0,0]=4 1149 B13R2.15 O=C1CCCC1N2CCOCC2 MCULE-5472498714 [0,0,0,2,0,0|2,0,0]=4 1150 B13R2.15 O=C1CCCN1C2CCCCC2 MCULE-9796139449 [0,0,0,2,0,0|1,0,0]=3 1151 B13R2.15 O=C1CCCN1C2CCCNC2 MCULE-8909185406 [0,0,0,2,0,0|2,0,0]=4 1152 B13R2.15 O=C1CCCN1C2CCCNC2 MCULE-9641796487 [0,0,0,2,0,0|2,0,0]=4 1153 B13R2.15 O=C1CCCN1C2CCNCC2 MCULE-1811615734 [0,0,0,2,0,0|2,0,0]=4 1154 B13R2.15 O=C1CCCN1C2CCNCC2 MCULE-4887737376 [0,0,0,2,0,0|2,0,0]=4 1155 B13R2.15 O=C1CCCN1[C@@H]2CCCNC2 MCULE-2483473644 [0,0,0,2,0,0|2,0,0]=4 1156 B13R2.15 O=C1CCCN1[C@@H]2CCCNC2 MCULE-5463939993 [0,0,0,2,0,0|2,0,0]=4 1157 B13R2.15 O=C1CCCN1[C@H]2CCCNC2 MCULE-2912340625 [0,0,0,2,0,0|2,0,0]=4 1158 B13R2.15 O=C1CCCN1[C@H]2CCCNC2 MCULE-9829202366 [0,0,0,2,0,0|2,0,0]=4 1159 B13R2.15 O=C1NCCC1C2CCCCC2 MCULE-7608087186 [0,0,0,2,0,0|1,0,0]=3 1160 B13R2.15 O=C1NCCC1C2CCOCC2 MCULE-1683923429 [0,0,0,2,0,0|2,0,0]=4 1161 B13R2.64 C1CCC(CC1)CC2CCCN2 MCULE-4110736499 [0,0,0,2,0,0|1,0,1]=4 1162 B13R2.64 C1CCC(CC1)CC2CCNC2 MCULE-5164616185 [0,0,0,2,0,0|2,0,0]=4 1163 B13R2.8001 C1CCC2(CC1)CCCCNC2 MCULE-1708351964 [0,0,0,2,0,0|2,0,0]=4 1164 B13R2.8001 C1CCC2(CC1)CCCCNC2 MCULE-8192915776 [0,0,0,2,0,0|2,0,0]=4 1165 B13R2.8001 C1CCCC2(CC1)CCCNC2 MCULE-3162105786 [0,0,0,2,0,0|2,0,0]=4 1166 B13R2.208 O=C1CCCCCC12CCCC2 MCULE-8639165491 [0,0,0,2,0,0|0,0,0]=2 1167 B13R2.3045 O=C1CCNCCN1CC2CC2 MCULE-1059788088 [0,0,0,2,0,0|2,0,0]=4 1168 B13R2.3045 O=C1CCNCCN1CC2CC2 MCULE-6541863093 [0,0,0,2,0,0|2,0,0]=4 1169 B13R2.18 O=C1CCCCC1C2CCCN2 MCULE-7054451001 [0,0,0,2,0,0|1,0,0]=3 1170 B13R2.18 O=C1CCCCC1C2CCCO2 MCULE-8833551403 [0,0,0,2,0,0|1,0,0]=3 1171 B13R2.18 O=C1CCCCC1C2CCOC2 MCULE-8025715501 [0,0,0,2,0,0|1,0,0]=3 1172 B13R2.18 O=C1CCCCN1C2CCNC2 MCULE-3413401919 [0,0,0,2,0,0|2,0,0]=4 1173 B13R2.18 O=C1CCCCN1C2CCNC2 MCULE-3796707520 [0,0,0,2,0,0|2,0,0]=4 1174 B13R2.18 O=C1CNCCN1C2CCCC2 MCULE-6064368434 [0,0,0,2,0,0|2,0,0]=4 1175 B13R2.18 O=C1CNCCN1C2CCCC2 MCULE-6595805343 [0,0,0,2,0,0|2,0,0]=4 1176 B13R2.18 O=C1CNCCN1C2CCCC2 MCULE-7029104390 [0,0,0,2,0,0|2,0,0]=4 1177 B13R2.18 O=C1NCCCC1N2CCCC2 MCULE-8875095933 [0,0,0,2,0,0|2,0,0]=4 1178 B13R2.29 O=C1CCCN1CC2CCNC2 MCULE-1369302046 [0,0,0,2,0,0|2,0,0]=4 1179 B13R2.29 O=C1CCCN1CC2CCNC2 MCULE-8012190676 [0,0,0,2,0,0|2,0,0]=4 1180 B13R2.677 C1CCNC(CC1)C2CCCC2 MCULE-7086128858 [0,0,0,2,0,0|1,0,1]=4 1181 B13R2.677 C1CCNC(CC1)C2CCCC2 MCULE-7471191977 [0,0,0,2,0,0|1,0,1]=4 1182 B13R2.32 CN1C(=O)CCC2C1CCNC2 MCULE-1193131747 [0,0,0,2,0,0|2,0,0]=4 1183 B13R2.32 CN1C(=O)CCC2C1CCNC2 MCULE-4231550993 [0,0,0,2,0,0|2,0,0]=4 1184 B13R2.32 CN1C(=O)CC[C@@H]2[C@H]1CCNC2 MCULE-1423832232 [0,0,0,2,0,0|2,0,0]=4 1185 B13R2.32 CN1C(=O)CC[C@@H]2[C@H]1CCNC2 MCULE-3424380637 [0,0,0,2,0,0|2,0,0]=4 1186 B13R2.32 CN1C(=O)CC[C@H]2[C@@H]1CCNC2 MCULE-9042118388 [0,0,0,2,0,0|2,0,0]=4 1187 B13R2.32 CN1C(=O)CC[C@H]2[C@H]1CCNC2 MCULE-1139873395 [0,0,0,2,0,0|2,0,0]=4 1188 B13R2.32 CN1C(=O)CC[C@H]2[C@H]1CCNC2 MCULE-2163393274 [0,0,0,2,0,0|2,0,0]=4 1189 B13R2.32 CN1C(=O)CO[C@H]2[C@H]1CCCC2 MCULE-5690879850 [0,0,0,2,0,0|2,0,0]=4 1190 B13R2.32 [C@@H]12CCC(=O)N([C@H]1CCNC2)C MCULE-7954702833 [0,0,0,2,0,0|2,0,0]=4 1191 B13R2.32 [C@@H]12CCC(=O)N([C@H]1CCNC2)C MCULE-9752493826 [0,0,0,2,0,0|2,0,0]=4 1192 B13R2.32 [C@@H]12CCCC[C@H]1N(C(=O)CO2)C MCULE-4913694211 [0,0,0,2,0,0|2,0,0]=4 1193 B13R2.32 [C@H]12CCCC[C@@H]1N(C(=O)CO2)C MCULE-1581075018 [0,0,0,2,0,0|2,0,0]=4 1194 B13R2.32 [C@H]12CCCC[C@@H]1N(C(=O)CO2)C MCULE-1754746136 [0,0,0,2,0,0|2,0,0]=4 1195 B13R2.32 [C@H]12CCCC[C@@H]1N(C(=O)CO2)C MCULE-2790991716 [0,0,0,2,0,0|2,0,0]=4 1196 B13R2.32 [C@H]12CCCC[C@@H]1N(C(=O)CO2)C MCULE-9168589558 [0,0,0,2,0,0|2,0,0]=4 1197 B13R2.57 CCC1CCC2CCCCC2C1 MCULE-5856063294 [0,0,0,2,0,0|1,0,1]=4 1198 B13R2.369 O=C1CC2CCCCC2CC1Br MCULE-1955855679 [0,0,0,2,0,0|1,0,0]=3 1199 B13R2.369 O=C1NC2CCCCC2CC1Cl MCULE-7045142671 [0,0,0,2,0,0|2,0,0]=4 1200 B13R2.218 [C@H]12CCN[C@@H]1CCCCC(=O)N2 MCULE-9200443505 [0,0,0,2,0,0|2,0,0]=4 1201 B13R2.393 O=C1CCCCC2OC2CCC1 MCULE-3625027376 [0,0,0,2,0,0|1,0,0]=3 1202 B13R2.4820 O=C1NCCN2C1CCCCC2 MCULE-8739804132 [0,0,0,2,0,0|2,0,0]=4 1203 B13R2.342 O=C1CCCC2C1CCCC2=O MCULE-3119005296 [0,0,0,2,0,0|1,0,1]=4 1204 B13R2.181 O=C1CCCC1C2CCCC2=O MCULE-4860075128 [0,0,0,2,0,0|1,0,1]=4