0 B9R0.5 C#CCCCC(=O)OCC MCULE-7331649216 [0,0,0,0,0,0|0,0,4]=4 1 B9R0.5 C(=C/C=C/C(=O)OCC)\C MCULE-3576105065 [0,0,0,0,0,0|0,0,2]=2 2 B9R0.5 C/C=C/C(=O)OCCCC MCULE-3981123215 [0,0,0,0,0,0|2,0,2]=4 3 B9R0.5 C=CCCCC(=O)OCC MCULE-6747714335 [0,0,0,0,0,0|0,0,4]=4 4 B9R0.5 C=CCNCC(=O)OCC MCULE-2486419841 [0,0,0,0,0,0|1,0,3]=4 5 B9R0.5 C=CCOCC(=O)OCC MCULE-4979218308 [0,0,0,0,0,0|1,0,3]=4 6 B9R0.5 C=COC(=O)CCCCC MCULE-9610448604 [0,0,0,0,0,0|0,0,4]=4 7 B9R0.5 CC/C=C/CC(=O)OCC MCULE-7234058677 [0,0,0,0,0,0|0,0,2]=2 8 B9R0.5 CC=CC(=O)OCCCC MCULE-5053011213 [0,0,0,0,0,0|2,0,2]=4 9 B9R0.5 CC=CC=CC(=O)OCC MCULE-7644578303 [0,0,0,0,0,0|0,0,2]=2 10 B9R0.5 CCC/C=C/C(=O)OCC MCULE-4832092410 [0,0,0,0,0,0|0,0,0]=0 11 B9R0.5 CCC=CCC(=O)OCC MCULE-2895347288 [0,0,0,0,0,0|0,0,2]=2 12 B9R0.5 CCCC#CC(=O)OCC MCULE-5376486364 [0,0,0,0,0,0|0,0,2]=2 13 B9R0.5 CCCC(=O)NCCSC MCULE-3226358337 [0,0,0,0,0,0|3,0,1]=4 14 B9R0.5 CCCC=CC(=O)OCC MCULE-6059990808 [0,0,0,0,0,0|0,0,0]=0 15 B9R0.5 CCCCCC(=O)CCC MCULE-5706146235 [0,0,0,0,0,0|1,0,2]=3 16 B9R0.5 CCCCCC(=O)OCC MCULE-5403677128 [0,0,0,0,0,0|0,0,2]=2 17 B9R0.5 CCCCNC(=O)CCBr MCULE-1774001181 [0,0,0,0,0,0|3,0,1]=4 18 B9R0.5 CCCCNC(=O)CCC MCULE-7141834161 [0,0,0,0,0,0|2,0,1]=3 19 B9R0.5 CCCCNC(=O)CCN MCULE-2531611147 [0,0,0,0,0,0|3,0,1]=4 20 B9R0.5 CCCCNC(=O)CCN MCULE-7050182017 [0,0,0,0,0,0|3,0,1]=4 21 B9R0.5 CCCCNC(=O)CNC MCULE-1485408728 [0,0,0,0,0,0|3,0,1]=4 22 B9R0.5 CCCCNC(=O)CNC MCULE-6940946322 [0,0,0,0,0,0|3,0,1]=4 23 B9R0.5 CCCCNC(=O)NCC MCULE-3629972521 [0,0,0,0,0,0|2,0,1]=3 24 B9R0.5 CCCCNC(=O)OCC MCULE-8548277091 [0,0,0,0,0,0|1,0,1]=2 25 B9R0.5 CCCCOC(=O)CCC MCULE-3979612740 [0,0,0,0,0,0|2,0,1]=3 26 B9R0.5 CCCCOC(=O)CCS MCULE-4889334808 [0,0,0,0,0,0|3,0,1]=4 27 B9R0.5 CCCCOC(C)OCC MCULE-5544493274 [0,0,0,0,0,0|2,0,2]=4 28 B9R0.5 CCCNCC(=O)OCC MCULE-1614665340 [0,0,0,0,0,0|1,0,1]=2 29 B9R0.5 CCNC(=O)CCCCO MCULE-9325293372 [0,0,0,0,0,0|2,0,2]=4 30 B9R0.5 CCNC(=O)NCCCO MCULE-9582031605 [0,0,0,0,0,0|3,0,1]=4 31 B9R0.5 CCNCCC(=O)NCC MCULE-6441681901 [0,0,0,0,0,0|2,0,2]=4 32 B9R0.5 CCNCCC(=O)OCC MCULE-5511872214 [0,0,0,0,0,0|1,0,2]=3 33 B9R0.5 CCO/C=C/C(=O)OCC MCULE-1507361975 [0,0,0,0,0,0|1,0,0]=1 34 B9R0.5 CCO/N=C/C(=O)OCC MCULE-5936482731 [0,0,0,0,0,0|2,0,0]=2 35 B9R0.5 CCO/N=C/C(=O)OCC MCULE-6380511451 [0,0,0,0,0,0|2,0,0]=2 36 B9R0.5 CCOC(=N)CCCCBr MCULE-4651734827 [0,0,0,0,0,0|2,0,2]=4 37 B9R0.5 CCOC(=O)C=CCCBr MCULE-9357314783 [0,0,0,0,0,0|1,0,0]=1 38 B9R0.5 CCOC(=O)C=CCCO MCULE-2905144053 [0,0,0,0,0,0|1,0,0]=1 39 B9R0.5 CCOC(=O)CCCC#N MCULE-3543261727 [0,0,0,0,0,0|1,0,3]=4 40 B9R0.5 CCOC(=O)CCCC=O MCULE-3082074155 [0,0,0,0,0,0|1,0,3]=4 41 B9R0.5 CCOC(=O)CCCCBr MCULE-9188586817 [0,0,0,0,0,0|1,0,2]=3 42 B9R0.5 CCOC(=O)CCCCCl MCULE-8211485770 [0,0,0,0,0,0|1,0,2]=3 43 B9R0.5 CCOC(=O)CCCCI MCULE-9427602912 [0,0,0,0,0,0|1,0,2]=3 44 B9R0.5 CCOC(=O)CCCCN MCULE-3254365356 [0,0,0,0,0,0|1,0,2]=3 45 B9R0.5 CCOC(=O)CCCCN MCULE-6113178932 [0,0,0,0,0,0|1,0,2]=3 46 B9R0.5 CCOC(=O)CCCCO MCULE-3157415426 [0,0,0,0,0,0|1,0,2]=3 47 B9R0.5 CCOC(=O)CNCCN MCULE-5162250475 [0,0,0,0,0,0|2,0,1]=3 48 B9R0.5 CCOC(=O)CNCCN MCULE-6793281928 [0,0,0,0,0,0|2,0,1]=3 49 B9R0.5 CCOC(=O)COCCBr MCULE-4604862482 [0,0,0,0,0,0|2,0,1]=3 50 B9R0.5 CCOC(=O)COCCCl MCULE-9218281344 [0,0,0,0,0,0|2,0,1]=3 51 B9R0.5 CCOC(=O)COCCI MCULE-7705777158 [0,0,0,0,0,0|2,0,1]=3 52 B9R0.5 CCOC(=O)COCCN MCULE-7738890913 [0,0,0,0,0,0|2,0,1]=3 53 B9R0.5 CCOC(=O)COCCN MCULE-8436568303 [0,0,0,0,0,0|2,0,1]=3 54 B9R0.5 CCOC(=O)COCOC MCULE-9141216887 [0,0,0,0,0,0|2,0,1]=3 55 B9R0.5 CCOC(=O)CSCC#N MCULE-8300453649 [0,0,0,0,0,0|2,0,2]=4 56 B9R0.5 CCOC(=O)CSCCN MCULE-9316167874 [0,0,0,0,0,0|2,0,1]=3 57 B9R0.5 CCOC(=O)N/N=C/CBr MCULE-7589794945 [0,0,0,0,0,0|3,0,1]=4 58 B9R0.5 CCOC(=O)N/N=C/CCl MCULE-9783343469 [0,0,0,0,0,0|3,0,1]=4 59 B9R0.5 CCOC(=O)NN=CCBr MCULE-1888599462 [0,0,0,0,0,0|3,0,1]=4 60 B9R0.5 CCOC(=O)NN=CCCl MCULE-2402821386 [0,0,0,0,0,0|3,0,1]=4 61 B9R0.5 CCOC=CC(=O)OCC MCULE-6557988220 [0,0,0,0,0,0|1,0,0]=1 62 B9R0.5 CCOCCC(=O)OCC MCULE-8331611688 [0,0,0,0,0,0|1,0,2]=3 63 B8R0.1 C#CCCC(=O)OCC MCULE-9456160977 [1,0,0,0,0,0|0,0,3]=4 64 B8R0.1 C/C=C/C(=O)CCCC MCULE-6753420308 [1,0,0,0,0,0|1,0,2]=4 65 B8R0.1 C=CC=CC(=O)OCC MCULE-4508819548 [1,0,0,0,0,0|0,0,2]=3 66 B8R0.1 C=CCCC(=O)OCC MCULE-4147956319 [1,0,0,0,0,0|0,0,3]=4 67 B8R0.1 C=CCOC(=O)OCC MCULE-4897941593 [1,0,0,0,0,0|1,0,2]=4 68 B8R0.1 CC#CCC(=O)OCC MCULE-3108892964 [1,0,0,0,0,0|0,0,3]=4 69 B8R0.1 CC/C=C/C(=O)OCC MCULE-6281513551 [1,0,0,0,0,0|0,0,0]=1 70 B8R0.1 CC=CC(=O)CCCC MCULE-2281679965 [1,0,0,0,0,0|1,0,2]=4 71 B8R0.1 CCC#CC(=O)OCC MCULE-2785923283 [1,0,0,0,0,0|0,0,2]=3 72 B8R0.1 CCC=CC(=O)OCC MCULE-2840510617 [1,0,0,0,0,0|0,0,0]=1 73 B8R0.1 CCCC(=O)NCCN MCULE-1372911866 [1,0,0,0,0,0|3,0,0]=4 74 B8R0.1 CCCC(=O)OCCCl MCULE-8469083528 [1,0,0,0,0,0|3,0,0]=4 75 B8R0.1 CCCC(=O)OCCO MCULE-5942976945 [1,0,0,0,0,0|3,0,0]=4 76 B8R0.1 CCCCC(=N)OCC MCULE-3866961773 [1,0,0,0,0,0|1,0,1]=3 77 B8R0.1 CCCCC(=N)OCC MCULE-6116145724 [1,0,0,0,0,0|1,0,1]=3 78 B8R0.1 CCCCC(=O)CCC MCULE-5459540473 [1,0,0,0,0,0|1,0,1]=3 79 B8R0.1 CCCCC(=O)COC MCULE-7059597173 [1,0,0,0,0,0|2,0,1]=4 80 B8R0.1 CCCCC(=O)OCC MCULE-1219537918 [1,0,0,0,0,0|0,0,1]=2 81 B8R0.1 CCCCC(=O)OCCl MCULE-1974449433 [1,0,0,0,0,0|1,0,1]=3 82 B8R0.1 CCCNC(=O)CCC MCULE-2578933218 [1,0,0,0,0,0|2,0,0]=3 83 B8R0.1 CCCNC(=O)CCN MCULE-9343291828 [1,0,0,0,0,0|3,0,0]=4 84 B8R0.1 CCCNC(=O)CCN MCULE-9397624395 [1,0,0,0,0,0|3,0,0]=4 85 B8R0.1 CCCNC(=O)CNC MCULE-3183907339 [1,0,0,0,0,0|3,0,0]=4 86 B8R0.1 CCCNC(=O)CNC MCULE-9204845590 [1,0,0,0,0,0|3,0,0]=4 87 B8R0.1 CCCNC(=O)NCC MCULE-5842395608 [1,0,0,0,0,0|2,0,0]=3 88 B8R0.1 CCCOC(=O)CCC MCULE-7673125406 [1,0,0,0,0,0|2,0,0]=3 89 B8R0.1 CCCOC(=O)CCN MCULE-1345071747 [1,0,0,0,0,0|3,0,0]=4 90 B8R0.1 CCCOC(=O)CCN MCULE-3861690448 [1,0,0,0,0,0|3,0,0]=4 91 B8R0.1 CCCOC(=O)CCO MCULE-7390309329 [1,0,0,0,0,0|3,0,0]=4 92 B8R0.1 CCCOC(=O)OCCl MCULE-7435813375 [1,0,0,0,0,0|2,0,0]=3 93 B8R0.1 CCNC(=O)NCCN MCULE-2782056393 [1,0,0,0,0,0|3,0,0]=4 94 B8R0.1 CCNC(=O)NCCN MCULE-3018091453 [1,0,0,0,0,0|3,0,0]=4 95 B8R0.1 CCNC(=O)NCCO MCULE-1039035778 [1,0,0,0,0,0|3,0,0]=4 96 B8R0.1 CCNCC(=O)NCC MCULE-2852589977 [1,0,0,0,0,0|2,0,1]=4 97 B8R0.1 CCNCC(=O)OCC MCULE-7972358572 [1,0,0,0,0,0|1,0,1]=3 98 B8R0.1 CCNCC(=O)OCC MCULE-8893227629 [1,0,0,0,0,0|1,0,1]=3 99 B8R0.1 CCOC(=N)CCCBr MCULE-1694733128 [1,0,0,0,0,0|2,0,1]=4 100 B8R0.1 CCOC(=N)CCCBr MCULE-5188406239 [1,0,0,0,0,0|2,0,1]=4 101 B8R0.1 CCOC(=N)CCCCl MCULE-2912870166 [1,0,0,0,0,0|2,0,1]=4 102 B8R0.1 CCOC(=N)CCCCl MCULE-6562903266 [1,0,0,0,0,0|2,0,1]=4 103 B8R0.1 CCOC(=N)CCOC MCULE-8187493489 [1,0,0,0,0,0|2,0,1]=4 104 B8R0.1 CCOC(=N)CCOC MCULE-9185956666 [1,0,0,0,0,0|2,0,1]=4 105 B8R0.1 CCOC(=O)/C=C/C=O MCULE-9219622537 [1,0,0,0,0,0|1,0,1]=3 106 B8R0.1 CCOC(=O)/C=C/CBr MCULE-5352661836 [1,0,0,0,0,0|1,0,0]=2 107 B8R0.1 CCOC(=O)/C=C/CO MCULE-7879343808 [1,0,0,0,0,0|1,0,0]=2 108 B8R0.1 CCOC(=O)/C=C\C#N MCULE-4457021806 [1,0,0,0,0,0|1,0,1]=3 109 B8R0.1 CCOC(=O)/C=N/NC MCULE-1711872477 [1,0,0,0,0,0|2,0,0]=3 110 B8R0.1 CCOC(=O)/C=N/OC MCULE-3959533877 [1,0,0,0,0,0|2,0,0]=3 111 B8R0.1 CCOC(=O)C#CCO MCULE-5094094961 [1,0,0,0,0,0|1,0,2]=4 112 B8R0.1 CCOC(=O)C=CC#N MCULE-2321976691 [1,0,0,0,0,0|1,0,1]=3 113 B8R0.1 CCOC(=O)C=CC=O MCULE-7165096046 [1,0,0,0,0,0|1,0,1]=3 114 B8R0.1 CCOC(=O)C=CCBr MCULE-6455444227 [1,0,0,0,0,0|1,0,0]=2 115 B8R0.1 CCOC(=O)C=CCCl MCULE-7995326623 [1,0,0,0,0,0|1,0,0]=2 116 B8R0.1 CCOC(=O)C=CCN MCULE-4129018658 [1,0,0,0,0,0|1,0,0]=2 117 B8R0.1 CCOC(=O)C=CCN MCULE-5635501690 [1,0,0,0,0,0|1,0,0]=2 118 B8R0.1 CCOC(=O)C=CCN MCULE-9641729290 [1,0,0,0,0,0|1,0,0]=2 119 B8R0.1 CCOC(=O)C=CCO MCULE-7710620250 [1,0,0,0,0,0|1,0,0]=2 120 B8R0.1 CCOC(=O)CCC#N MCULE-9221721525 [1,0,0,0,0,0|1,0,2]=4 121 B8R0.1 CCOC(=O)CCC=O MCULE-2891201608 [1,0,0,0,0,0|1,0,2]=4 122 B8R0.1 CCOC(=O)CCCBr MCULE-5001503693 [1,0,0,0,0,0|1,0,1]=3 123 B8R0.1 CCOC(=O)CCCCl MCULE-4945067440 [1,0,0,0,0,0|1,0,1]=3 124 B8R0.1 CCOC(=O)CCCI MCULE-3229549270 [1,0,0,0,0,0|1,0,1]=3 125 B8R0.1 CCOC(=O)CCCN MCULE-3396270547 [1,0,0,0,0,0|1,0,1]=3 126 B8R0.1 CCOC(=O)CCCO MCULE-6165580365 [1,0,0,0,0,0|1,0,1]=3 127 B8R0.1 CCOC(=O)CCCS MCULE-6616511520 [1,0,0,0,0,0|1,0,1]=3 128 B8R0.1 CCOC(=O)CCC[NH3+] MCULE-4462126494 [1,0,0,0,0,0|1,0,1]=3 129 B8R0.1 CCOC(=O)CCNC MCULE-2052970996 [1,0,0,0,0,0|1,0,1]=3 130 B8R0.1 CCOC(=O)CCNC MCULE-5442289273 [1,0,0,0,0,0|1,0,1]=3 131 B8R0.1 CCOC(=O)CCNN MCULE-6880821012 [1,0,0,0,0,0|2,0,1]=4 132 B8R0.1 CCOC(=O)CCNN MCULE-9638408107 [1,0,0,0,0,0|2,0,1]=4 133 B8R0.1 CCOC(=O)CCOC MCULE-5983048130 [1,0,0,0,0,0|1,0,1]=3 134 B8R0.1 CCOC(=O)CCSC MCULE-6834820952 [1,0,0,0,0,0|1,0,1]=3 135 B8R0.1 CCOC(=O)CSCC MCULE-5930366300 [1,0,0,0,0,0|1,0,1]=3 136 B8R0.1 CCOC(=O)NCC#N MCULE-3639279920 [1,0,0,0,0,0|2,0,1]=4 137 B8R0.1 CCOC(=O)NCCBr MCULE-4386850032 [1,0,0,0,0,0|2,0,0]=3 138 B8R0.1 CCOC(=O)NCCCl MCULE-5545666176 [1,0,0,0,0,0|2,0,0]=3 139 B8R0.1 CCOC(=O)NCCN MCULE-1497223307 [1,0,0,0,0,0|2,0,0]=3 140 B8R0.1 CCOC(=O)NCCN MCULE-3733943315 [1,0,0,0,0,0|2,0,0]=3 141 B8R0.1 CCOC(=O)NCCO MCULE-7625780069 [1,0,0,0,0,0|2,0,0]=3 142 B8R0.1 CCOC(=O)OCCBr MCULE-4627499799 [1,0,0,0,0,0|2,0,0]=3 143 B8R0.1 CCOCC(=O)OCC MCULE-5439289896 [1,0,0,0,0,0|1,0,1]=3 144 B8R0.4 CCC/C=C/C=C/C=O MCULE-8835013975 [1,0,0,0,0,0|2,0,1]=4 145 B8R0.4 CCC/C=C/C=C/CO MCULE-9104000035 [1,0,0,0,0,0|2,0,0]=3 146 B8R0.4 CCC/C=C\CCCC MCULE-1534641855 [1,0,0,0,0,0|1,0,1]=3 147 B8R0.4 CCCC/C=C\CCO MCULE-5021089657 [1,0,0,0,0,0|2,0,1]=4 148 B8R0.4 CCCC=CC=CC=O MCULE-2921829928 [1,0,0,0,0,0|2,0,1]=4 149 B8R0.4 CCCC=CC=CCO MCULE-7221329169 [1,0,0,0,0,0|2,0,0]=3 150 B8R0.4 CCCC=CCCCC MCULE-6609949802 [1,0,0,0,0,0|1,0,1]=3 151 B8R0.4 CCCCC=CCCO MCULE-5187523035 [1,0,0,0,0,0|2,0,1]=4 152 B8R0.4 CCCCCNOCC MCULE-5426574695 [1,0,0,0,0,0|1,0,2]=4 153 B8R0.4 CCCCCNOCC MCULE-6155853359 [1,0,0,0,0,0|1,0,2]=4 154 B8R0.6 C/C=C/C=C/C(=O)OC MCULE-2985403088 [1,0,0,0,0,0|0,0,2]=3 155 B8R0.6 CC=CC=CC(=O)OC MCULE-4040454111 [1,0,0,0,0,0|0,0,2]=3 156 B8R0.6 CCC/C=C/C(=O)OC MCULE-6273561448 [1,0,0,0,0,0|0,0,0]=1 157 B8R0.6 CCC=CCC(=O)OC MCULE-6432541061 [1,0,0,0,0,0|0,0,2]=3 158 B8R0.6 CCCC#CC(=O)OC MCULE-1573744334 [1,0,0,0,0,0|0,0,2]=3 159 B8R0.6 CCCC=CC(=O)OC MCULE-1227063444 [1,0,0,0,0,0|0,0,0]=1 160 B8R0.6 CCCCCC(=O)CBr MCULE-6642335283 [1,0,0,0,0,0|1,0,2]=4 161 B8R0.6 CCCCCC(=O)CC MCULE-2012071553 [1,0,0,0,0,0|0,0,2]=3 162 B8R0.6 CCCCCC(=O)OC MCULE-2317616388 [1,0,0,0,0,0|0,0,2]=3 163 B8R0.6 CCCCNC(=O)CBr MCULE-4128795630 [1,0,0,0,0,0|2,0,1]=4 164 B8R0.6 CCCCNC(=O)CC MCULE-3176114265 [1,0,0,0,0,0|1,0,1]=3 165 B8R0.6 CCCCNC(=O)CCl MCULE-6162581938 [1,0,0,0,0,0|2,0,1]=4 166 B8R0.6 CCCCNC(=O)CN MCULE-2730890796 [1,0,0,0,0,0|2,0,1]=4 167 B8R0.6 CCCCNC(=O)CN MCULE-8794795131 [1,0,0,0,0,0|2,0,1]=4 168 B8R0.6 CCCCNC(=O)NC MCULE-7920588549 [1,0,0,0,0,0|2,0,1]=4 169 B8R0.6 CCCCOC(=O)CBr MCULE-8883996630 [1,0,0,0,0,0|2,0,1]=4 170 B8R0.6 CCCCOC(=O)CC MCULE-4622389592 [1,0,0,0,0,0|1,0,1]=3 171 B8R0.6 CCCCOC(=O)CCl MCULE-1608118057 [1,0,0,0,0,0|2,0,1]=4 172 B8R0.6 CCCCOC(=O)CF MCULE-1355274212 [1,0,0,0,0,0|2,0,1]=4 173 B8R0.6 CCCCOC(=O)CN MCULE-9168260466 [1,0,0,0,0,0|2,0,1]=4 174 B8R0.6 CCCCOC(=O)CN MCULE-9585888268 [1,0,0,0,0,0|2,0,1]=4 175 B8R0.6 CCCCOC(=O)CO MCULE-4016266350 [1,0,0,0,0,0|2,0,1]=4 176 B8R0.6 CCCCOC(=O)CS MCULE-4331308025 [1,0,0,0,0,0|2,0,1]=4 177 B8R0.6 CCCNCC(=O)NC MCULE-4750972571 [1,0,0,0,0,0|2,0,1]=4 178 B8R0.6 CCCNCC(=O)OC MCULE-3321545319 [1,0,0,0,0,0|1,0,1]=3 179 B8R0.6 CCCNCC(=O)OC MCULE-5989619684 [1,0,0,0,0,0|1,0,1]=3 180 B8R0.6 CCCSCC(=O)OC MCULE-3865642484 [1,0,0,0,0,0|1,0,1]=3 181 B8R0.6 CCNCCC(=O)OC MCULE-4846173976 [1,0,0,0,0,0|1,0,2]=4 182 B8R0.6 CCSCCC(=O)OC MCULE-5773388371 [1,0,0,0,0,0|1,0,2]=4 183 B8R0.6 CNCCCC(=O)OC MCULE-2437073705 [1,0,0,0,0,0|1,0,2]=4 184 B8R0.6 CNCCCC(=O)OC MCULE-6776715081 [1,0,0,0,0,0|1,0,2]=4 185 B8R0.6 COC(=O)CCCCBr MCULE-8354790214 [1,0,0,0,0,0|1,0,2]=4 186 B8R0.6 COC(=O)CCCCCl MCULE-7057883989 [1,0,0,0,0,0|1,0,2]=4 187 B8R0.6 COC(=O)CCCCI MCULE-1527923255 [1,0,0,0,0,0|1,0,2]=4 188 B8R0.6 COC(=O)CCCCN MCULE-3452725442 [1,0,0,0,0,0|1,0,2]=4 189 B8R0.6 COC(=O)CCCCN MCULE-8816545129 [1,0,0,0,0,0|1,0,2]=4 190 B8R0.6 COC(=O)CCCCO MCULE-2443996181 [1,0,0,0,0,0|1,0,2]=4 191 B8R0.6 COC(=O)CCCCS MCULE-5194099368 [1,0,0,0,0,0|1,0,2]=4 192 B8R0.6 COC(=O)CCCSC MCULE-7320944174 [1,0,0,0,0,0|1,0,2]=4 193 B8R0.6 COC(=O)COCCCl MCULE-4344602258 [1,0,0,0,0,0|2,0,1]=4 194 B8R0.6 COC(=O)COCCN MCULE-5090944064 [1,0,0,0,0,0|2,0,1]=4 195 B8R0.6 COC(=O)COCCN MCULE-6748820855 [1,0,0,0,0,0|2,0,1]=4 196 B8R0.6 COC(=O)COCCO MCULE-7869619911 [1,0,0,0,0,0|2,0,1]=4 197 B8R0.6 COC(=O)CSCCN MCULE-5578128958 [1,0,0,0,0,0|2,0,1]=4 198 B8R0.6 COC(=O)CSCCN MCULE-6891143571 [1,0,0,0,0,0|2,0,1]=4 199 B8R0.6 COC(=O)SSCCN MCULE-2854223096 [1,0,0,0,0,0|3,0,0]=4 200 B8R0.6 COC/C=C/C(=O)OC MCULE-5611593935 [1,0,0,0,0,0|1,0,0]=2 201 B8R0.6 COCC=CC(=O)OC MCULE-1098723055 [1,0,0,0,0,0|1,0,0]=2 202 B8R0.6 COCCCC(=O)OC MCULE-4109110804 [1,0,0,0,0,0|1,0,2]=4 203 B10R0.1 C#CCCCCC(=O)OCC MCULE-4159925776 [0,1,0,0,0,0|0,0,3]=4 204 B10R0.1 C=C(C=NCCCC)OCC MCULE-5629491103 [0,1,0,0,0,0|1,0,1]=3 205 B10R0.1 C=CCCCCC(=O)OCC MCULE-4796834258 [0,1,0,0,0,0|0,0,3]=4 206 B10R0.1 C=CCCNCC(=O)OCC MCULE-1904056256 [0,1,0,0,0,0|1,0,2]=4 207 B10R0.1 C=CCCNCC(=O)OCC MCULE-7266083662 [0,1,0,0,0,0|1,0,2]=4 208 B10R0.1 CC=CC=NNC(=O)OCC MCULE-3223643715 [0,1,0,0,0,0|1,0,2]=4 209 B10R0.1 CC=CCCCC(=O)OCC MCULE-9997629917 [0,1,0,0,0,0|0,0,3]=4 210 B10R0.1 CCCC(=O)OCCCCCl MCULE-1685252152 [0,1,0,0,0,0|2,0,1]=4 211 B10R0.1 CCCC(=O)OCCCCO MCULE-5551819643 [0,1,0,0,0,0|2,0,1]=4 212 B10R0.1 CCCC(=O)OCCCSC MCULE-9257783110 [0,1,0,0,0,0|2,0,1]=4 213 B10R0.1 CCCCC#CC(=O)OCC MCULE-4077079917 [0,1,0,0,0,0|0,0,2]=3 214 B10R0.1 CCCCCCC(=O)CCC MCULE-1716736963 [0,1,0,0,0,0|1,0,2]=4 215 B10R0.1 CCCCCCC(=O)OCC MCULE-9137582636 [0,1,0,0,0,0|0,0,2]=3 216 B10R0.1 CCCCCNC(=O)CCC MCULE-7374835979 [0,1,0,0,0,0|1,0,2]=4 217 B10R0.1 CCCCCOC(=O)CCC MCULE-8850994391 [0,1,0,0,0,0|1,0,2]=4 218 B10R0.1 CCCCNCC(=O)OCC MCULE-9216905823 [0,1,0,0,0,0|0,0,2]=3 219 B10R0.1 CCCNCCC(=O)NCC MCULE-2244073736 [0,1,0,0,0,0|1,0,2]=4 220 B10R0.1 CCCNCCC(=O)OCC MCULE-7490328359 [0,1,0,0,0,0|0,0,2]=3 221 B10R0.1 CCOC(=O)C=CCCCCl MCULE-5025299599 [0,1,0,0,0,0|0,0,0]=1 222 B10R0.1 CCOC(=O)CCCCC#N MCULE-4576520215 [0,1,0,0,0,0|0,0,3]=4 223 B10R0.1 CCOC(=O)CCCCC=O MCULE-7732334617 [0,1,0,0,0,0|0,0,3]=4 224 B10R0.1 CCOC(=O)CCCCCBr MCULE-8003265411 [0,1,0,0,0,0|0,0,2]=3 225 B10R0.1 CCOC(=O)CCCCCCl MCULE-4088253059 [0,1,0,0,0,0|0,0,2]=3 226 B10R0.1 CCOC(=O)CCCCCI MCULE-9635955061 [0,1,0,0,0,0|0,0,2]=3 227 B10R0.1 CCOC(=O)CCCCCN MCULE-3923374138 [0,1,0,0,0,0|0,0,2]=3 228 B10R0.1 CCOC(=O)CCCCCN MCULE-5512054492 [0,1,0,0,0,0|0,0,2]=3 229 B10R0.1 CCOC(=O)CCCCCO MCULE-3245932025 [0,1,0,0,0,0|0,0,2]=3 230 B10R0.1 CCOC(=O)CCSCCO MCULE-8638992281 [0,1,0,0,0,0|1,0,2]=4 231 B10R0.1 CCOC(=O)CNCCC#N MCULE-2662749759 [0,1,0,0,0,0|1,0,2]=4 232 B10R0.1 CCOC(=O)CNCCC#N MCULE-4394204356 [0,1,0,0,0,0|1,0,2]=4 233 B10R0.1 CCOC(=O)CNCCOC MCULE-2646976797 [0,1,0,0,0,0|1,0,1]=3 234 B10R0.1 CCOC(=O)COCCCCl MCULE-4550907435 [0,1,0,0,0,0|1,0,1]=3 235 B10R0.1 CCOC(=O)COCCCO MCULE-9785348075 [0,1,0,0,0,0|1,0,1]=3 236 B10R0.1 CCOCCCC(=O)OCC MCULE-9855302324 [0,1,0,0,0,0|0,0,2]=3 237 B10R0.2 C/C=C/C(=O)CC(=O)OCC MCULE-7377247665 [0,1,0,0,0,0|0,0,3]=4 238 B10R0.2 CC=CC(=O)CC(=O)OCC MCULE-5963718553 [0,1,0,0,0,0|0,0,3]=4 239 B10R0.2 CCC/C(=C\C(=O)OCC)/C MCULE-1371307128 [0,1,0,0,0,0|0,0,0]=1 240 B10R0.2 CCCC(=CC(=O)OCC)C MCULE-1645946260 [0,1,0,0,0,0|0,0,0]=1 241 B10R0.2 CCCC(=CC(=O)OCC)N MCULE-2436190261 [0,1,0,0,0,0|0,0,0]=1 242 B10R0.2 CCCC(=O)CC(=O)CCC MCULE-3312674708 [0,1,0,0,0,0|1,0,1]=3 243 B10R0.2 CCCC(=O)CC(=O)OCC MCULE-5166823353 [0,1,0,0,0,0|0,0,1]=2 244 B10R0.2 CCCC(=O)OC(=O)CCC MCULE-7605031104 [0,1,0,0,0,0|2,0,0]=3 245 B10R0.2 CCCC(C)CC(=O)OCC MCULE-8935140518 [0,1,0,0,0,0|0,0,2]=3 246 B10R0.2 CCCC(N)CC(=O)OCC MCULE-1001870682 [0,1,0,0,0,0|0,0,2]=3 247 B10R0.2 CCCC(N)CC(=O)OCC MCULE-1944209512 [0,1,0,0,0,0|0,0,2]=3 248 B10R0.2 CCCC(O)CC(=O)OCC MCULE-5905342292 [0,1,0,0,0,0|0,0,2]=3 249 B10R0.2 CCC[C@H](O)CC(=O)OCC MCULE-9017403904 [0,1,0,0,0,0|0,0,2]=3 250 B10R0.2 CCNC(=O)CC(=O)NCC MCULE-1948274737 [0,1,0,0,0,0|2,0,1]=4 251 B10R0.2 CCNC(C)CC(=O)OCC MCULE-2058750344 [0,1,0,0,0,0|1,0,2]=4 252 B10R0.2 CCOC(=N)CC(=N)OCC MCULE-7132414424 [0,1,0,0,0,0|2,0,1]=4 253 B10R0.2 CCOC(=N)CC(=N)OCC MCULE-7179128793 [0,1,0,0,0,0|2,0,1]=4 254 B10R0.2 CCOC(=N)CC(=N)OCC MCULE-8815758909 [0,1,0,0,0,0|2,0,1]=4 255 B10R0.2 CCOC(=N)CC(=O)OCC MCULE-2177167654 [0,1,0,0,0,0|1,0,1]=3 256 B10R0.2 CCOC(=N)CC(=O)OCC MCULE-4553821564 [0,1,0,0,0,0|1,0,1]=3 257 B10R0.2 CCOC(=O)/C=C(\C)/OCC MCULE-6259165657 [0,1,0,0,0,0|1,0,0]=2 258 B10R0.2 CCOC(=O)/C=C(\N)/OCC MCULE-7041419087 [0,1,0,0,0,0|1,0,0]=2 259 B10R0.2 CCOC(=O)/C=C(\N)/OCC MCULE-7783188784 [0,1,0,0,0,0|1,0,0]=2 260 B10R0.2 CCOC(=O)C=C(C)OCC MCULE-2282182488 [0,1,0,0,0,0|1,0,0]=2 261 B10R0.2 CCOC(=O)C=C(N)OCC MCULE-4853126909 [0,1,0,0,0,0|1,0,0]=2 262 B10R0.2 CCOC(=O)C=C(N)OCC MCULE-8880328888 [0,1,0,0,0,0|1,0,0]=2 263 B10R0.2 CCOC(=O)CC(=O)COC MCULE-9085340611 [0,1,0,0,0,0|1,0,1]=3 264 B10R0.2 CCOC(=O)CC(=O)OCC MCULE-8243470790 [0,1,0,0,0,0|1,0,1]=3 265 B10R0.2 CCOC(=O)CC(C)SCC MCULE-2636596878 [0,1,0,0,0,0|1,0,2]=4 266 B10R0.2 CCOC(=O)CC(O)CCN MCULE-1248900915 [0,1,0,0,0,0|1,0,2]=4 267 B10R0.2 CCOC(=O)CC(O)CCN MCULE-3855586387 [0,1,0,0,0,0|1,0,2]=4 268 B10R0.2 CCOC(=O)CN(C)CCN MCULE-2610844903 [0,1,0,0,0,0|2,0,1]=4 269 B10R0.2 CCOC(=O)CN(C)CCN MCULE-8760269076 [0,1,0,0,0,0|2,0,1]=4 270 B10R0.2 CCOC(=O)C[C@H](O)CCN MCULE-2186128767 [0,1,0,0,0,0|1,0,2]=4 271 B10R0.2 CCOC(=O)C[C@H](O)CCN MCULE-2862289323 [0,1,0,0,0,0|1,0,2]=4 272 B10R0.2 CCOC(=O)NC(=O)CC#N MCULE-7260608731 [0,1,0,0,0,0|2,0,1]=4 273 B10R0.2 CCOC(=O)NC(=O)OCC MCULE-1234983548 [0,1,0,0,0,0|2,0,0]=3 274 B10R0.2 CCOC(=O)NC(=S)OCC MCULE-9903785516 [0,1,0,0,0,0|2,0,0]=3 275 B10R0.2 CCOC(=O)OC(=O)OCC MCULE-5668620613 [0,1,0,0,0,0|2,0,0]=3 276 B10R0.2 [C@@H](O)(CCN)CC(=O)OCC MCULE-5946205626 [0,1,0,0,0,0|1,0,2]=4 277 B10R0.2 [C@@H](O)(CCN)CC(=O)OCC MCULE-8503181083 [0,1,0,0,0,0|1,0,2]=4 278 B10R0.3 C=C(C)CCCC(=O)OCC MCULE-8269913859 [0,1,0,0,0,0|0,0,3]=4 279 B10R0.3 CC(C)CCCC(=O)OCCl MCULE-8902704823 [0,1,0,0,0,0|1,0,2]=4 280 B10R0.3 CCCC(=O)OCCC(C)C MCULE-8558213018 [0,1,0,0,0,0|2,0,1]=4 281 B10R0.3 CCOC(=O)/C=C/CN(C)C MCULE-6894599734 [0,1,0,0,0,0|1,0,0]=2 282 B10R0.3 CCOC(=O)C=CCC(C)C MCULE-1502115003 [0,1,0,0,0,0|0,0,0]=1 283 B10R0.3 CCOC(=O)C=CCN(C)C MCULE-3988263103 [0,1,0,0,0,0|1,0,0]=2 284 B10R0.3 CCOC(=O)CCCC(=O)C MCULE-7629371322 [0,1,0,0,0,0|0,0,3]=4 285 B10R0.3 CCOC(=O)CCCC(C)C MCULE-5911402423 [0,1,0,0,0,0|0,0,2]=3 286 B10R0.3 CCOC(=O)CCCC(C)O MCULE-4085625939 [0,1,0,0,0,0|0,0,2]=3 287 B10R0.3 CCOC(=O)CCCN(C)C MCULE-7611481357 [0,1,0,0,0,0|1,0,2]=4 288 B10R0.3 CCOC(=O)CCNC(C)C MCULE-3306500848 [0,1,0,0,0,0|1,0,2]=4 289 B10R0.3 CCOC(=O)CCNC(C)C MCULE-7144839681 [0,1,0,0,0,0|1,0,2]=4 290 B10R0.3 CCOC(=O)CNCC(C)C MCULE-6992318383 [0,1,0,0,0,0|1,0,1]=3 291 B10R0.3 CCOC(=O)CNCC(C)C MCULE-7092441665 [0,1,0,0,0,0|1,0,1]=3 292 B10R0.3 CCOC(=O)COCC(C)C MCULE-2087571280 [0,1,0,0,0,0|1,0,1]=3 293 B10R0.3 CCOC(=O)CSCC(=O)C MCULE-7116933404 [0,1,0,0,0,0|1,0,2]=4 294 B10R0.6 CC(C)OC(=O)CSCCO MCULE-4737068485 [0,1,0,0,0,0|2,0,1]=4 295 B10R0.6 CCCCCC(=O)OC(C)C MCULE-8358011398 [0,1,0,0,0,0|0,0,2]=3 296 B10R0.6 CCCCOC(=O)CC(C)C MCULE-9654609926 [0,1,0,0,0,0|2,0,1]=4 297 B10R0.6 CCCOCC(=O)OC(C)C MCULE-1754769634 [0,1,0,0,0,0|1,0,1]=3 298 B10R0.19 C=CCNC(=O)C(=O)OCC MCULE-3576046582 [0,1,0,0,0,0|1,0,2]=4 299 B10R0.19 CCCCC(=O)C(=O)OCC MCULE-8276085890 [0,1,0,0,0,0|0,0,1]=2 300 B10R0.19 CCCCC(Br)C(=O)OCC MCULE-3410486181 [0,1,0,0,0,0|0,0,2]=3 301 B10R0.19 CCCCC(N)C(=O)OCC MCULE-5403085036 [0,1,0,0,0,0|0,0,2]=3 302 B10R0.19 CCCCC(O)C(=O)OCC MCULE-4503955337 [0,1,0,0,0,0|0,0,2]=3 303 B10R0.19 CCCNC(=O)C(=O)NCC MCULE-2442306979 [0,1,0,0,0,0|2,0,0]=3 304 B10R0.19 CCCNC(=O)C(=O)OCC MCULE-9964881273 [0,1,0,0,0,0|1,0,0]=2 305 B10R0.19 CCNC(=O)C(=O)NCCO MCULE-9694929326 [0,1,0,0,0,0|3,0,0]=4 306 B10R0.19 CCO/C=C(\C)/C(=O)OCC MCULE-3285358145 [0,1,0,0,0,0|1,0,0]=2 307 B10R0.19 CCOC(=O)C(=O)CCC#N MCULE-6951259135 [0,1,0,0,0,0|1,0,2]=4 308 B10R0.19 CCOC(=O)C(=O)NCOC MCULE-2485816788 [0,1,0,0,0,0|2,0,0]=3 309 B10R0.19 CCOC(=O)C(Br)CCCBr MCULE-3762513838 [0,1,0,0,0,0|1,0,2]=4 310 B10R0.19 CCOC(=O)C(N)CCCN MCULE-2555939527 [0,1,0,0,0,0|1,0,2]=4 311 B10R0.19 CCOC(=O)C(N)CCCN MCULE-4082808351 [0,1,0,0,0,0|1,0,2]=4 312 B10R0.19 CCOC(=O)C(N)CCCN MCULE-5372876457 [0,1,0,0,0,0|1,0,2]=4 313 B10R0.19 CCOC(=O)C(N)CCCN MCULE-8592429166 [0,1,0,0,0,0|1,0,2]=4 314 B10R0.19 CCOC(=O)C(N)CCSC MCULE-3027327514 [0,1,0,0,0,0|1,0,2]=4 315 B10R0.19 CCOC(=O)C(N)CCSC MCULE-5873613959 [0,1,0,0,0,0|1,0,2]=4 316 B10R0.19 CCOC(=O)C(N)CCSC MCULE-6683307625 [0,1,0,0,0,0|1,0,2]=4 317 B10R0.19 CCOC(=O)C(N)CCSC MCULE-9963255300 [0,1,0,0,0,0|1,0,2]=4 318 B10R0.19 CCOC(=O)C(O)CCSC MCULE-5087273039 [0,1,0,0,0,0|1,0,2]=4 319 B10R0.19 CCOC(=O)[C@@H](N)CCCN MCULE-1256058333 [0,1,0,0,0,0|1,0,2]=4 320 B10R0.19 CCOC(=O)[C@@H](N)CCCN MCULE-1955429029 [0,1,0,0,0,0|1,0,2]=4 321 B10R0.19 CCOC(=O)[C@@H](N)CCCN MCULE-5817990493 [0,1,0,0,0,0|1,0,2]=4 322 B10R0.19 CCOC(=O)[C@@H](N)CCCN MCULE-6543729272 [0,1,0,0,0,0|1,0,2]=4 323 B10R0.19 CCOC(=O)[C@@H](N)CCCN MCULE-6712624243 [0,1,0,0,0,0|1,0,2]=4 324 B10R0.19 CCOC(=O)[C@H](N)CCSC MCULE-2603296581 [0,1,0,0,0,0|1,0,2]=4 325 B10R0.19 CCOC(=O)[C@H](N)CCSC MCULE-6126904564 [0,1,0,0,0,0|1,0,2]=4 326 B10R0.19 CCOC(=O)[C@H](N)CCSC MCULE-6254414481 [0,1,0,0,0,0|1,0,2]=4 327 B10R0.19 CCOC(=O)[C@H](N)CCSC MCULE-6350339090 [0,1,0,0,0,0|1,0,2]=4 328 B10R0.19 CCOC=C(C)C(=O)OCC MCULE-1075672413 [0,1,0,0,0,0|1,0,0]=2 329 B10R0.19 [C@H](N)(CCSC)C(=O)OCC MCULE-4024487209 [0,1,0,0,0,0|1,0,2]=4 330 B10R0.19 [C@H](N)(CCSC)C(=O)OCC MCULE-4906972094 [0,1,0,0,0,0|1,0,2]=4 331 B10R0.19 [C@H](N)(CCSC)C(=O)OCC MCULE-5780620225 [0,1,0,0,0,0|1,0,2]=4 332 B10R0.19 [C@H](N)(CCSC)C(=O)OCC MCULE-6331108043 [0,1,0,0,0,0|1,0,2]=4 333 B10R0.83 CCCCCC(=O)C(C)CC MCULE-8709917766 [0,1,0,0,0,0|1,0,2]=4 334 B10R0.83 CCCCNC(=O)C(Br)CC MCULE-3578309145 [0,1,0,0,0,0|2,0,1]=4 335 B10R0.83 CCCCOC(=O)C(C)CC MCULE-2060140981 [0,1,0,0,0,0|2,0,1]=4 336 B10R0.83 CCCCOC(=O)C(O)CC MCULE-9177969209 [0,1,0,0,0,0|2,0,1]=4 337 B10R0.83 CCCCOC(=O)[C@@H](O)CC MCULE-3356665164 [0,1,0,0,0,0|2,0,1]=4 338 B10R0.83 CCCCOC(=O)[C@@H](O)CC MCULE-5141009962 [0,1,0,0,0,0|2,0,1]=4 339 B10R0.91 C#CCOC(=O)NCCCC MCULE-4022249643 [0,1,0,0,0,0|1,0,2]=4 340 B10R0.91 C=CCOC(=O)CCCCC MCULE-4870253803 [0,1,0,0,0,0|0,0,3]=4 341 B10R0.91 CCCCCC(=O)CCCC MCULE-4876992287 [0,1,0,0,0,0|1,0,2]=4 342 B10R0.91 CCCCCC(=O)OCCC MCULE-7665514505 [0,1,0,0,0,0|0,0,2]=3 343 B10R0.91 CCCCCC(=O)OCCCl MCULE-2724708346 [0,1,0,0,0,0|0,0,2]=3 344 B10R0.91 CCCCNC(=O)OCCO MCULE-9010578275 [0,1,0,0,0,0|1,0,1]=3 345 B10R0.91 CCCCOC(=O)CCCC MCULE-2693469456 [0,1,0,0,0,0|2,0,1]=4 346 B10R0.91 CCCCOC(=O)CCCN MCULE-3820011759 [0,1,0,0,0,0|2,0,1]=4 347 B10R0.91 CCCCOC(=O)CCCN MCULE-8110705234 [0,1,0,0,0,0|2,0,1]=4 348 B10R0.91 CCCCOC(=O)CCCO MCULE-6438752500 [0,1,0,0,0,0|2,0,1]=4 349 B10R0.91 CCCNCC(=O)NCCC MCULE-2310458557 [0,1,0,0,0,0|2,0,1]=4 350 B10R0.108 CCOC(=O)CCC(=O)CC MCULE-8002220473 [0,1,0,0,0,0|0,0,3]=4 351 B10R0.108 CCOC(=O)CNC(=O)CC MCULE-5953118002 [0,1,0,0,0,0|1,0,2]=4 352 B10R1.10 CCCC1=CC(=O)NC=N1 MCULE-1230437619 [0,0,0,1,0,0|2,0,1]=4 353 B10R1.10 CCCC1CCCC(=O)C1 MCULE-7668769463 [0,0,0,1,0,0|1,0,2]=4 354 B10R1.10 CCCC1CCCC(=O)O1 MCULE-9181432444 [0,0,0,1,0,0|2,0,1]=4 355 B10R1.10 CCCC1CCNC(=O)C1 MCULE-2999950135 [0,0,0,1,0,0|1,0,2]=4 356 B10R1.10 CCOC1=CC(=O)CCC1 MCULE-8212624809 [0,0,0,1,0,0|2,0,0]=3 357 B10R1.10 CCOC1=CC=CC(=C1)C MCULE-3762844024 [0,0,0,1,0,0|1,0,2]=4 358 B10R1.10 CCOC1=CC=NC(=C1)C MCULE-9868516263 [0,0,0,1,0,0|2,0,1]=4 359 B10R1.10 CCOC1=CC=NC(=N1)C MCULE-6647352947 [0,0,0,1,0,0|2,0,1]=4 360 B10R1.11 CCCC(=O)C1CCCC1 MCULE-4828860258 [0,0,0,1,0,0|1,0,2]=4 361 B10R1.11 CCNC(=O)C1CCCN1 MCULE-8506501038 [0,0,0,1,0,0|2,0,1]=4 362 B10R1.11 CCNC(=O)C1CCCN1 MCULE-9698842836 [0,0,0,1,0,0|2,0,1]=4 363 B10R1.11 CCNC(=O)[C@@H]1CCCN1 MCULE-3926288586 [0,0,0,1,0,0|2,0,1]=4 364 B10R1.11 CCNC(=O)[C@@H]1CCCN1 MCULE-4770991359 [0,0,0,1,0,0|2,0,1]=4 365 B10R1.11 CCNC(=O)[C@@H]1CCCN1 MCULE-8041890978 [0,0,0,1,0,0|2,0,1]=4 366 B10R1.11 CCNC(=O)[C@@H]1CCCN1 MCULE-9049907771 [0,0,0,1,0,0|2,0,1]=4 367 B10R1.11 CCOC(=O)C1=CC=CN1 MCULE-8658466323 [0,0,0,1,0,0|1,0,2]=4 368 B10R1.11 CCOC(=O)C1=CC=CO1 MCULE-5049309997 [0,0,0,1,0,0|1,0,2]=4 369 B10R1.11 CCOC(=O)C1=CC=CS1 MCULE-4538513975 [0,0,0,1,0,0|1,0,2]=4 370 B10R1.11 CCOC(=O)C1=CC=NO1 MCULE-5986325534 [0,0,0,1,0,0|2,0,1]=4 371 B10R1.11 CCOC(=O)C1=CCCC1 MCULE-9883764892 [0,0,0,1,0,0|0,0,0]=1 372 B10R1.11 CCOC(=O)C1=CCCO1 MCULE-8425258509 [0,0,0,1,0,0|1,0,0]=2 373 B10R1.11 CCOC(=O)C1=CN=CO1 MCULE-5953159562 [0,0,0,1,0,0|2,0,1]=4 374 B10R1.11 CCOC(=O)C1=CN=CS1 MCULE-4167508977 [0,0,0,1,0,0|2,0,1]=4 375 B10R1.11 CCOC(=O)C1=CN=CS1 MCULE-7290752913 [0,0,0,1,0,0|2,0,1]=4 376 B10R1.11 CCOC(=O)C1=CN=NS1 MCULE-4602067933 [0,0,0,1,0,0|3,0,0]=4 377 B10R1.11 CCOC(=O)C1=CNC=C1 MCULE-4549962794 [0,0,0,1,0,0|1,0,2]=4 378 B10R1.11 CCOC(=O)C1=CNC=N1 MCULE-8677760402 [0,0,0,1,0,0|2,0,1]=4 379 B10R1.11 CCOC(=O)C1=CNN=C1 MCULE-2192738792 [0,0,0,1,0,0|2,0,1]=4 380 B10R1.11 CCOC(=O)C1=CNN=C1 MCULE-5895609234 [0,0,0,1,0,0|2,0,1]=4 381 B10R1.11 CCOC(=O)C1=CNN=N1 MCULE-9554217135 [0,0,0,1,0,0|3,0,0]=4 382 B10R1.11 CCOC(=O)C1=COC=C1 MCULE-6706151358 [0,0,0,1,0,0|1,0,2]=4 383 B10R1.11 CCOC(=O)C1=COC=N1 MCULE-2742503286 [0,0,0,1,0,0|2,0,1]=4 384 B10R1.11 CCOC(=O)C1=CON=C1 MCULE-2634863079 [0,0,0,1,0,0|2,0,1]=4 385 B10R1.11 CCOC(=O)C1=CSC=C1 MCULE-8933512005 [0,0,0,1,0,0|1,0,2]=4 386 B10R1.11 CCOC(=O)C1=CSC=N1 MCULE-3975882964 [0,0,0,1,0,0|2,0,1]=4 387 B10R1.11 CCOC(=O)C1=CSC=N1 MCULE-6463347917 [0,0,0,1,0,0|2,0,1]=4 388 B10R1.11 CCOC(=O)C1=CSC=N1 MCULE-8796945180 [0,0,0,1,0,0|2,0,1]=4 389 B10R1.11 CCOC(=O)C1=CSN=C1 MCULE-4507381057 [0,0,0,1,0,0|2,0,1]=4 390 B10R1.11 CCOC(=O)C1=CSN=N1 MCULE-9286295728 [0,0,0,1,0,0|3,0,0]=4 391 B10R1.11 CCOC(=O)C1=NCCO1 MCULE-5791120104 [0,0,0,1,0,0|2,0,0]=3 392 B10R1.11 CCOC(=O)C1=NNC=C1 MCULE-4192977461 [0,0,0,1,0,0|2,0,1]=4 393 B10R1.11 CCOC(=O)C1=NOC=C1 MCULE-9463580274 [0,0,0,1,0,0|2,0,1]=4 394 B10R1.11 CCOC(=O)C1=NSC=C1 MCULE-6870717669 [0,0,0,1,0,0|2,0,1]=4 395 B10R1.11 CCOC(=O)C1CCC=N1 MCULE-6045177128 [0,0,0,1,0,0|1,0,2]=4 396 B10R1.11 CCOC(=O)C1CCCC1 MCULE-2663692680 [0,0,0,1,0,0|0,0,2]=3 397 B10R1.11 CCOC(=O)C1CCCN1 MCULE-1775024232 [0,0,0,1,0,0|1,0,1]=3 398 B10R1.11 CCOC(=O)C1CCCN1 MCULE-1903883256 [0,0,0,1,0,0|1,0,1]=3 399 B10R1.11 CCOC(=O)C1CCCN1 MCULE-3451901294 [0,0,0,1,0,0|1,0,1]=3 400 B10R1.11 CCOC(=O)C1CCCN1 MCULE-7141672180 [0,0,0,1,0,0|1,0,1]=3 401 B10R1.11 CCOC(=O)C1CCCO1 MCULE-5716361491 [0,0,0,1,0,0|1,0,1]=3 402 B10R1.11 CCOC(=O)C1CCNC1 MCULE-7115213916 [0,0,0,1,0,0|1,0,2]=4 403 B10R1.11 CCOC(=O)C1CCNC1 MCULE-9152531741 [0,0,0,1,0,0|1,0,2]=4 404 B10R1.11 CCOC(=O)C1CCNC1 MCULE-9679994536 [0,0,0,1,0,0|1,0,2]=4 405 B10R1.11 CCOC(=O)C1CCNO1 MCULE-1209750622 [0,0,0,1,0,0|2,0,1]=4 406 B10R1.11 CCOC(=O)C1CCNO1 MCULE-9991760871 [0,0,0,1,0,0|2,0,1]=4 407 B10R1.11 CCOC(=O)C1CCOC1 MCULE-3052876388 [0,0,0,1,0,0|1,0,2]=4 408 B10R1.11 CCOC(=O)C1CSCN1 MCULE-6252748544 [0,0,0,1,0,0|2,0,1]=4 409 B10R1.11 CCOC(=O)C1CSCN1 MCULE-6823622066 [0,0,0,1,0,0|2,0,1]=4 410 B10R1.11 CCOC(=O)C1CSCN1 MCULE-8253189538 [0,0,0,1,0,0|2,0,1]=4 411 B10R1.11 CCOC(=O)C1CSCN1 MCULE-9110164814 [0,0,0,1,0,0|2,0,1]=4 412 B10R1.11 CCOC(=O)C1SCCS1 MCULE-2057673965 [0,0,0,1,0,0|2,0,1]=4 413 B10R1.11 CCOC(=O)N1CCCC1 MCULE-8096151948 [0,0,0,1,0,0|1,0,1]=3 414 B10R1.11 CCOC(=O)[C@@H]1CCCN1 MCULE-1006300490 [0,0,0,1,0,0|1,0,1]=3 415 B10R1.11 CCOC(=O)[C@@H]1CCCN1 MCULE-1035245823 [0,0,0,1,0,0|1,0,1]=3 416 B10R1.11 CCOC(=O)[C@@H]1CCCN1 MCULE-9416117855 [0,0,0,1,0,0|1,0,1]=3 417 B10R1.11 CCOC(=O)[C@@H]1CCCN1 MCULE-9593799755 [0,0,0,1,0,0|1,0,1]=3 418 B10R1.11 CCOC(=O)[C@@H]1CCNC1 MCULE-1030296291 [0,0,0,1,0,0|1,0,2]=4 419 B10R1.11 CCOC(=O)[C@@H]1CCNC1 MCULE-3397421108 [0,0,0,1,0,0|1,0,2]=4 420 B10R1.11 CCOC(=O)[C@@H]1CCNC1 MCULE-6990100207 [0,0,0,1,0,0|1,0,2]=4 421 B10R1.11 CCOC(=O)[C@@H]1CCNC1 MCULE-9366097368 [0,0,0,1,0,0|1,0,2]=4 422 B10R1.11 CCOC(=O)[C@@H]1CCON1 MCULE-3729113893 [0,0,0,1,0,0|2,0,1]=4 423 B10R1.11 CCOC(=O)[C@@H]1CCON1 MCULE-6736733188 [0,0,0,1,0,0|2,0,1]=4 424 B10R1.11 CCOC(=O)[C@@H]1CSCN1 MCULE-4756168618 [0,0,0,1,0,0|2,0,1]=4 425 B10R1.11 CCOC(=O)[C@@H]1CSCN1 MCULE-8756699166 [0,0,0,1,0,0|2,0,1]=4 426 B10R1.11 CCOC(=O)[C@@H]1CSCN1 MCULE-8987874947 [0,0,0,1,0,0|2,0,1]=4 427 B10R1.11 CCOC(=O)[C@@H]1CSCN1 MCULE-9514058691 [0,0,0,1,0,0|2,0,1]=4 428 B10R1.11 CCOC(=O)[C@H]1CCCN1 MCULE-2328365610 [0,0,0,1,0,0|1,0,1]=3 429 B10R1.11 CCOC(=O)[C@H]1CCCN1 MCULE-5190774028 [0,0,0,1,0,0|1,0,1]=3 430 B10R1.11 CCOC(=O)[C@H]1CCCN1 MCULE-5314111018 [0,0,0,1,0,0|1,0,1]=3 431 B10R1.11 CCOC(=O)[C@H]1CCCN1 MCULE-5778937284 [0,0,0,1,0,0|1,0,1]=3 432 B10R1.11 CCOC(=O)[C@H]1CCNC1 MCULE-6332593882 [0,0,0,1,0,0|1,0,2]=4 433 B10R1.11 CCOC(=O)[C@H]1CCNC1 MCULE-7146498882 [0,0,0,1,0,0|1,0,2]=4 434 B10R1.11 CCOC(=O)[C@H]1CCNC1 MCULE-7300719682 [0,0,0,1,0,0|1,0,2]=4 435 B10R1.11 CCOC(=O)[C@H]1CCNC1 MCULE-9965557527 [0,0,0,1,0,0|1,0,2]=4 436 B10R1.11 CCOC(=O)[C@H]1CCON1 MCULE-2197016826 [0,0,0,1,0,0|2,0,1]=4 437 B10R1.11 CCOC(=O)[C@H]1CCON1 MCULE-8879475586 [0,0,0,1,0,0|2,0,1]=4 438 B10R1.11 O=C(OCCl)C1CCCC1 MCULE-8357474598 [0,0,0,1,0,0|1,0,2]=4 439 B10R1.11 O=C(OCCl)N1CCCC1 MCULE-8634733063 [0,0,0,1,0,0|2,0,1]=4 440 B10R1.19 CCC1CCCCCC1=O MCULE-8032779658 [0,0,0,1,0,0|1,0,2]=4 441 B10R1.19 CCN1CCCNCC1=O MCULE-3571024405 [0,0,0,1,0,0|2,0,1]=4 442 B10R1.19 CCN1CCCNCC1=O MCULE-4254439389 [0,0,0,1,0,0|2,0,1]=4 443 B10R1.29 CCCCC1=CCCC1=O MCULE-3298793962 [0,0,0,1,0,0|1,0,2]=4 444 B10R1.29 CCCCC1CCCC1=O MCULE-7853231747 [0,0,0,1,0,0|1,0,2]=4 445 B10R1.29 CCCCN1CCCC1=O MCULE-4214883053 [0,0,0,1,0,0|2,0,1]=4 446 B10R1.29 NCCCC1CCOC1=O MCULE-4266690176 [0,0,0,1,0,0|1,0,2]=4 447 B10R1.29 NCCCC1CCOC1=O MCULE-9834041839 [0,0,0,1,0,0|1,0,2]=4 448 B10R1.29 NCCCN1CCOC1=O MCULE-4075677949 [0,0,0,1,0,0|2,0,1]=4 449 B10R1.29 NCCCN1CCOC1=O MCULE-6730610957 [0,0,0,1,0,0|2,0,1]=4 450 B10R1.29 O=C1OCCN1CCCBr MCULE-9124926426 [0,0,0,1,0,0|2,0,1]=4 451 B10R1.78 O=C1CCCCCCCC1 MCULE-1205201333 [0,0,0,1,0,0|1,0,2]=4 452 B10R1.78 O=C1CCCCCCCN1 MCULE-2754830482 [0,0,0,1,0,0|1,0,2]=4 453 B10R1.78 O=C1CCCCCCCO1 MCULE-8839309567 [0,0,0,1,0,0|0,0,2]=3 454 B10R1.130 CCCC1=C(OC(=O)C1)O MCULE-2182437649 [0,0,0,1,0,0|1,0,2]=4 455 B10R1.130 CCCC1=CC(=O)OC1O MCULE-8096778023 [0,0,0,1,0,0|1,0,0]=2 456 B10R1.135 CCOC(=O)C1CC1CBr MCULE-6084968129 [0,0,0,1,0,0|1,0,2]=4 457 B10R1.135 CCOC(=O)C1CC1CO MCULE-5409175813 [0,0,0,1,0,0|1,0,2]=4 458 B10R1.135 CCOC(=O)[C@@H]1C[C@@H]1CO MCULE-5599332272 [0,0,0,1,0,0|1,0,2]=4 459 B10R1.135 CCOC(=O)[C@@H]1C[C@H]1CC MCULE-8044030961 [0,0,0,1,0,0|0,0,2]=3 460 B10R1.135 CCOC(=O)[C@@H]1C[C@H]1CO MCULE-4890993826 [0,0,0,1,0,0|1,0,2]=4 461 B10R1.135 CCOC(=O)[C@H]1C[C@@H]1CN MCULE-1373238494 [0,0,0,1,0,0|1,0,2]=4 462 B10R1.135 CCOC(=O)[C@H]1C[C@@H]1CN MCULE-2443716725 [0,0,0,1,0,0|1,0,2]=4 463 B10R1.135 CCOC(=O)[C@H]1C[C@@H]1CN MCULE-4844887669 [0,0,0,1,0,0|1,0,2]=4 464 B10R1.135 CCOC(=O)[C@H]1C[C@@H]1CN MCULE-9541430173 [0,0,0,1,0,0|1,0,2]=4 465 B10R1.135 CCOC(=O)[C@H]1C[C@@H]1CO MCULE-3086555442 [0,0,0,1,0,0|1,0,2]=4 466 B10R1.135 CCOC(=O)[C@H]1C[C@@H]1CO MCULE-7050125487 [0,0,0,1,0,0|1,0,2]=4 467 B10R1.135 CCOC(=O)[C@H]1C[C@H]1CO MCULE-2707024886 [0,0,0,1,0,0|1,0,2]=4 468 B10R1.135 CCOC(=O)[C@H]1C[C@H]1CO MCULE-2769503441 [0,0,0,1,0,0|1,0,2]=4 469 B10R1.137 CCNC(=O)NC1CCC1 MCULE-6967655165 [0,0,0,1,0,0|2,0,1]=4 470 B10R1.137 CCOC(=O)C=C1CCC1 MCULE-8612971671 [0,0,0,1,0,0|0,0,0]=1 471 B10R1.137 CCOC(=O)C=C1COC1 MCULE-6928273928 [0,0,0,1,0,0|1,0,0]=2 472 B10R1.137 CCOC(=O)C=C1CSC1 MCULE-4527503645 [0,0,0,1,0,0|1,0,0]=2 473 B10R1.137 CCOC(=O)CC1CCC1 MCULE-3214468910 [0,0,0,1,0,0|0,0,2]=3 474 B10R1.137 CCOC(=O)CC1CCO1 MCULE-7631610817 [0,0,0,1,0,0|1,0,2]=4 475 B10R1.137 CCOC(=O)CC1CNC1 MCULE-2494284664 [0,0,0,1,0,0|1,0,2]=4 476 B10R1.137 CCOC(=O)CC1CNC1 MCULE-5393504475 [0,0,0,1,0,0|1,0,2]=4 477 B10R1.137 CCOC(=O)CC1CNC1 MCULE-9594842551 [0,0,0,1,0,0|1,0,2]=4 478 B10R1.137 CCOC(=O)CC1COC1 MCULE-4428687625 [0,0,0,1,0,0|1,0,2]=4 479 B10R1.138 CCOC(=O)/C=C/C1CC1 MCULE-5149227855 [0,0,0,1,0,0|0,0,0]=1 480 B10R1.138 CCOC(=O)C=CC1CC1 MCULE-5035333331 [0,0,0,1,0,0|0,0,0]=1 481 B10R1.138 CCOC(=O)CCC1CO1 MCULE-5849542527 [0,0,0,1,0,0|1,0,2]=4 482 B10R1.138 CCOC(=O)CNC1CC1 MCULE-5200789560 [0,0,0,1,0,0|1,0,1]=3 483 B10R1.197 CCC1CCCC(=O)CC1 MCULE-9268041087 [0,0,0,1,0,0|1,0,2]=4 484 B10R1.197 CCC1CCNC(=O)CC1 MCULE-8320678614 [0,0,0,1,0,0|1,0,2]=4 485 B7R0.1 CC/C=C/CCCC MCULE-7439146649 [2,0,0,0,0,0|0,0,1]=3 486 B7R0.1 CC/C=C\CCCO MCULE-7890119012 [2,0,0,0,0,0|1,0,1]=4 487 B7R0.1 CCC/C=C/CCC MCULE-4580411068 [2,0,0,0,0,0|0,0,1]=3 488 B7R0.1 CCC/C=C\CCC MCULE-3832748741 [2,0,0,0,0,0|0,0,1]=3 489 B7R0.1 CCC=CC=CCO MCULE-7908131221 [2,0,0,0,0,0|1,0,1]=4 490 B7R0.1 CCC=CCCCC MCULE-9716720293 [2,0,0,0,0,0|0,0,1]=3 491 B7R0.1 CCC=CCCCO MCULE-9620732691 [2,0,0,0,0,0|1,0,1]=4 492 B7R0.1 CCCC/C=C/CO MCULE-5404793542 [2,0,0,0,0,0|1,0,1]=4 493 B7R0.1 CCCC=CCCC MCULE-6897310592 [2,0,0,0,0,0|0,0,1]=3 494 B7R0.1 CCCC=CCCCl MCULE-5580394901 [2,0,0,0,0,0|1,0,1]=4 495 B7R0.1 CCCCC=CCBr MCULE-2427659057 [2,0,0,0,0,0|1,0,1]=4 496 B7R0.1 CCCCC=CCO MCULE-7891403223 [2,0,0,0,0,0|1,0,1]=4 497 B7R0.1 CCCCCOCC MCULE-6346670527 [2,0,0,0,0,0|0,0,2]=4 498 B7R0.3 C/C=C/CC(=O)OC MCULE-7204157194 [2,0,0,0,0,0|0,0,2]=4 499 B7R0.3 C=C(CC)CCCC MCULE-5118701402 [2,0,0,0,0,0|1,0,1]=4 500 B7R0.3 C=CC=CC(=O)OC MCULE-1940821537 [2,0,0,0,0,0|0,0,2]=4 501 B7R0.3 CC/C=C/C(=O)OC MCULE-5661442711 [2,0,0,0,0,0|0,0,0]=2 502 B7R0.3 CC/C=C/C(C)CC MCULE-2438890702 [2,0,0,0,0,0|1,0,1]=4 503 B7R0.3 CC=CCC(=O)OC MCULE-9658428283 [2,0,0,0,0,0|0,0,2]=4 504 B7R0.3 CCC(=O)/C=C/C=O MCULE-5654548275 [2,0,0,0,0,0|1,0,1]=4 505 B7R0.3 CCC(=O)C=CC=O MCULE-8246295239 [2,0,0,0,0,0|1,0,1]=4 506 B7R0.3 CCC(=O)CCCBr MCULE-3298679210 [2,0,0,0,0,0|1,0,1]=4 507 B7R0.3 CCC(=O)CCCCl MCULE-3397599793 [2,0,0,0,0,0|1,0,1]=4 508 B7R0.3 CCC(=O)NCCN MCULE-3384406070 [2,0,0,0,0,0|2,0,0]=4 509 B7R0.3 CCC(=O)NCCN MCULE-3992696592 [2,0,0,0,0,0|2,0,0]=4 510 B7R0.3 CCC(=O)NCCN MCULE-4556462042 [2,0,0,0,0,0|2,0,0]=4 511 B7R0.3 CCC(=O)NCCO MCULE-7351790148 [2,0,0,0,0,0|2,0,0]=4 512 B7R0.3 CCC(=O)OCCCl MCULE-7825392065 [2,0,0,0,0,0|2,0,0]=4 513 B7R0.3 CCC(=O)OCCO MCULE-6019276519 [2,0,0,0,0,0|2,0,0]=4 514 B7R0.3 CCC(=O)OCOC MCULE-8101176829 [2,0,0,0,0,0|2,0,0]=4 515 B7R0.3 CCC=CC(=O)OC MCULE-2390679048 [2,0,0,0,0,0|0,0,0]=2 516 B7R0.3 CCC=CC(C)CC MCULE-8910467842 [2,0,0,0,0,0|1,0,1]=4 517 B7R0.3 CCCC=C(C)CC MCULE-4699949699 [2,0,0,0,0,0|1,0,0]=3 518 B7R0.3 CCCCC(=N)OC MCULE-3917139857 [2,0,0,0,0,0|1,0,1]=4 519 B7R0.3 CCCCC(=N)OC MCULE-8394549097 [2,0,0,0,0,0|1,0,1]=4 520 B7R0.3 CCCCC(=O)CBr MCULE-5866288227 [2,0,0,0,0,0|1,0,1]=4 521 B7R0.3 CCCCC(=O)CC MCULE-7758340382 [2,0,0,0,0,0|0,0,1]=3 522 B7R0.3 CCCCC(=O)CCl MCULE-9673190063 [2,0,0,0,0,0|1,0,1]=4 523 B7R0.3 CCCCC(=O)NC MCULE-6810865419 [2,0,0,0,0,0|1,0,1]=4 524 B7R0.3 CCCCC(=O)OC MCULE-8635651818 [2,0,0,0,0,0|0,0,1]=3 525 B7R0.3 CCCNC(=O)CBr MCULE-3357000060 [2,0,0,0,0,0|2,0,0]=4 526 B7R0.3 CCCNC(=O)CCl MCULE-3171078913 [2,0,0,0,0,0|2,0,0]=4 527 B7R0.3 CCCNC(=O)CN MCULE-2964958967 [2,0,0,0,0,0|2,0,0]=4 528 B7R0.3 CCCNC(=O)CN MCULE-4880764199 [2,0,0,0,0,0|2,0,0]=4 529 B7R0.3 CCCOC(=O)CBr MCULE-9392658897 [2,0,0,0,0,0|2,0,0]=4 530 B7R0.3 CCCOC(=O)CC MCULE-2749425161 [2,0,0,0,0,0|1,0,0]=3 531 B7R0.3 CCCOC(=O)CCl MCULE-4900509903 [2,0,0,0,0,0|2,0,0]=4 532 B7R0.3 CCCOC(=O)CN MCULE-5016724090 [2,0,0,0,0,0|2,0,0]=4 533 B7R0.3 CCCOC(=O)CN MCULE-9899563764 [2,0,0,0,0,0|2,0,0]=4 534 B7R0.3 CCCOC(=O)CS MCULE-7918412380 [2,0,0,0,0,0|2,0,0]=4 535 B7R0.3 CCCOC(=O)OC MCULE-7254829881 [2,0,0,0,0,0|1,0,0]=3 536 B7R0.3 CCNCC(=O)OC MCULE-7988488004 [2,0,0,0,0,0|1,0,1]=4 537 B7R0.3 CCNCC(=O)OC MCULE-9483901468 [2,0,0,0,0,0|1,0,1]=4 538 B7R0.3 CCOCC(=O)OC MCULE-5158396979 [2,0,0,0,0,0|1,0,1]=4 539 B7R0.3 CCSCC(=O)OC MCULE-2538182357 [2,0,0,0,0,0|1,0,1]=4 540 B7R0.3 CNC(=O)C=CCN MCULE-3646722223 [2,0,0,0,0,0|2,0,0]=4 541 B7R0.3 CNC(=O)C=CCN MCULE-6988679780 [2,0,0,0,0,0|2,0,0]=4 542 B7R0.3 CNCCC(=O)OC MCULE-5657949377 [2,0,0,0,0,0|1,0,1]=4 543 B7R0.3 CNCCC(=O)OC MCULE-9145127599 [2,0,0,0,0,0|1,0,1]=4 544 B7R0.3 CO/C=C/C(=O)OC MCULE-8858181328 [2,0,0,0,0,0|1,0,0]=3 545 B7R0.3 COC(=O)/C=C/CBr MCULE-5511432414 [2,0,0,0,0,0|1,0,0]=3 546 B7R0.3 COC(=O)/C=C/CN MCULE-6249542756 [2,0,0,0,0,0|1,0,0]=3 547 B7R0.3 COC(=O)/C=C/CN MCULE-7014993899 [2,0,0,0,0,0|1,0,0]=3 548 B7R0.3 COC(=O)/C=C\CBr MCULE-5925439397 [2,0,0,0,0,0|1,0,0]=3 549 B7R0.3 COC(=O)C=CC=O MCULE-3663456611 [2,0,0,0,0,0|1,0,1]=4 550 B7R0.3 COC(=O)C=CCBr MCULE-1558782396 [2,0,0,0,0,0|1,0,0]=3 551 B7R0.3 COC(=O)C=CCN MCULE-4573398613 [2,0,0,0,0,0|1,0,0]=3 552 B7R0.3 COC(=O)C=CCN MCULE-4807348004 [2,0,0,0,0,0|1,0,0]=3 553 B7R0.3 COC(=O)C=CCN MCULE-7751483147 [2,0,0,0,0,0|1,0,0]=3 554 B7R0.3 COC(=O)CCCBr MCULE-3856139347 [2,0,0,0,0,0|1,0,1]=4 555 B7R0.3 COC(=O)CCCCl MCULE-9725150748 [2,0,0,0,0,0|1,0,1]=4 556 B7R0.3 COC(=O)CCCI MCULE-6607823615 [2,0,0,0,0,0|1,0,1]=4 557 B7R0.3 COC(=O)CCCN MCULE-2399653885 [2,0,0,0,0,0|1,0,1]=4 558 B7R0.3 COC(=O)CCCN MCULE-7745643244 [2,0,0,0,0,0|1,0,1]=4 559 B7R0.3 COC(=O)CCCO MCULE-6149839873 [2,0,0,0,0,0|1,0,1]=4 560 B7R0.3 COC(=O)CCCS MCULE-6897052882 [2,0,0,0,0,0|1,0,1]=4 561 B7R0.3 COC(=O)CCSC MCULE-8525618169 [2,0,0,0,0,0|1,0,1]=4 562 B7R0.3 COC(=O)NCCN MCULE-4816806580 [2,0,0,0,0,0|2,0,0]=4 563 B7R0.3 COC(=O)NCCN MCULE-9765640123 [2,0,0,0,0,0|2,0,0]=4 564 B7R0.3 COC(=O)NCCO MCULE-7141835204 [2,0,0,0,0,0|2,0,0]=4 565 B7R0.3 COC=CC(=O)OC MCULE-3167643214 [2,0,0,0,0,0|1,0,0]=3 566 B7R0.3 COCCC(=O)OC MCULE-5918489580 [2,0,0,0,0,0|1,0,1]=4 567 B7R0.7 C#CCC(=O)OCC MCULE-2012473321 [2,0,0,0,0,0|0,0,2]=4 568 B7R0.7 C/C=C/C(=O)OCC MCULE-8433823264 [2,0,0,0,0,0|0,0,0]=2 569 B7R0.7 C=C(OCC)OCC MCULE-5191107236 [2,0,0,0,0,0|2,0,0]=4 570 B7R0.7 C=C=CC(=O)OCC MCULE-9108726418 [2,0,0,0,0,0|0,0,2]=4 571 B7R0.7 C=CCC(=O)OCC MCULE-2006542536 [2,0,0,0,0,0|0,0,2]=4 572 B7R0.7 C=COC(=O)/C=C/C MCULE-3646996165 [2,0,0,0,0,0|0,0,2]=4 573 B7R0.7 C=COC(=O)C=CC MCULE-7917602280 [2,0,0,0,0,0|0,0,2]=4 574 B7R0.7 C=COC(=O)CCC MCULE-2764567967 [2,0,0,0,0,0|0,0,2]=4 575 B7R0.7 CC#CC(=O)OCC MCULE-3358315498 [2,0,0,0,0,0|0,0,2]=4 576 B7R0.7 CC=CC(=O)OCC MCULE-1904771513 [2,0,0,0,0,0|0,0,0]=2 577 B7R0.7 CCCC(=N)OCC MCULE-5551107242 [2,0,0,0,0,0|1,0,0]=3 578 B7R0.7 CCCC(=N)OCC MCULE-7790310067 [2,0,0,0,0,0|1,0,0]=3 579 B7R0.7 CCCC(=O)CCC MCULE-1621649928 [2,0,0,0,0,0|1,0,0]=3 580 B7R0.7 CCCC(=O)OCC MCULE-9977024136 [2,0,0,0,0,0|0,0,0]=2 581 B7R0.7 CCCC(=O)OCCl MCULE-5186069317 [2,0,0,0,0,0|1,0,0]=3 582 B7R0.7 CCCC(C)OCC MCULE-2678814077 [2,0,0,0,0,0|1,0,1]=4 583 B7R0.7 CCNC(=O)CCCl MCULE-3246776319 [2,0,0,0,0,0|2,0,0]=4 584 B7R0.7 CCNC(=O)CCN MCULE-2856252531 [2,0,0,0,0,0|2,0,0]=4 585 B7R0.7 CCNC(=O)CCN MCULE-3929666209 [2,0,0,0,0,0|2,0,0]=4 586 B7R0.7 CCNC(=O)CCO MCULE-3624072697 [2,0,0,0,0,0|2,0,0]=4 587 B7R0.7 CCNC(=O)CNC MCULE-1939824251 [2,0,0,0,0,0|2,0,0]=4 588 B7R0.7 CCNC(=O)CNC MCULE-2815515396 [2,0,0,0,0,0|2,0,0]=4 589 B7R0.7 CCNC(=O)NCC MCULE-2253571388 [2,0,0,0,0,0|2,0,0]=4 590 B7R0.7 CCNC(=O)OCC MCULE-3910060770 [2,0,0,0,0,0|1,0,0]=3 591 B7R0.7 CCOC(=N)CCCl MCULE-3462649487 [2,0,0,0,0,0|2,0,0]=4 592 B7R0.7 CCOC(=N)CCCl MCULE-7130199135 [2,0,0,0,0,0|2,0,0]=4 593 B7R0.7 CCOC(=N)CCO MCULE-8135932013 [2,0,0,0,0,0|2,0,0]=4 594 B7R0.7 CCOC(=N)CCO MCULE-9125708150 [2,0,0,0,0,0|2,0,0]=4 595 B7R0.7 CCOC(=N)COC MCULE-1358920023 [2,0,0,0,0,0|2,0,0]=4 596 B7R0.7 CCOC(=N)COC MCULE-8494947544 [2,0,0,0,0,0|2,0,0]=4 597 B7R0.7 CCOC(=O)/C=C/I MCULE-4105665503 [2,0,0,0,0,0|1,0,0]=3 598 B7R0.7 CCOC(=O)/C=C/O MCULE-1984925411 [2,0,0,0,0,0|1,0,0]=3 599 B7R0.7 CCOC(=O)/C=C/[O-] MCULE-5625833261 [2,0,0,0,0,0|1,0,0]=3 600 B7R0.7 CCOC(=O)/C=C\Br MCULE-7525620721 [2,0,0,0,0,0|1,0,0]=3 601 B7R0.7 CCOC(=O)/C=C\I MCULE-4741067503 [2,0,0,0,0,0|1,0,0]=3 602 B7R0.7 CCOC(=O)/C=C\N MCULE-1135242139 [2,0,0,0,0,0|1,0,0]=3 603 B7R0.7 CCOC(=O)C=CBr MCULE-3778834856 [2,0,0,0,0,0|1,0,0]=3 604 B7R0.7 CCOC(=O)C=CI MCULE-9930784067 [2,0,0,0,0,0|1,0,0]=3 605 B7R0.7 CCOC(=O)C=CO MCULE-2570791221 [2,0,0,0,0,0|1,0,0]=3 606 B7R0.7 CCOC(=O)C=C[O-] MCULE-8425740727 [2,0,0,0,0,0|1,0,0]=3 607 B7R0.7 CCOC(=O)C=NN MCULE-5132323904 [2,0,0,0,0,0|2,0,0]=4 608 B7R0.7 CCOC(=O)C=NN MCULE-5899717314 [2,0,0,0,0,0|2,0,0]=4 609 B7R0.7 CCOC(=O)C=NO MCULE-8888029932 [2,0,0,0,0,0|2,0,0]=4 610 B7R0.7 CCOC(=O)CC#N MCULE-3161671261 [2,0,0,0,0,0|1,0,1]=4 611 B7R0.7 CCOC(=O)CC=O MCULE-5042552247 [2,0,0,0,0,0|1,0,1]=4 612 B7R0.7 CCOC(=O)CCBr MCULE-1898467026 [2,0,0,0,0,0|1,0,0]=3 613 B7R0.7 CCOC(=O)CCCl MCULE-2623656770 [2,0,0,0,0,0|1,0,0]=3 614 B7R0.7 CCOC(=O)CCI MCULE-9651397551 [2,0,0,0,0,0|1,0,0]=3 615 B7R0.7 CCOC(=O)CCN MCULE-4383008445 [2,0,0,0,0,0|1,0,0]=3 616 B7R0.7 CCOC(=O)CCN MCULE-6873709061 [2,0,0,0,0,0|1,0,0]=3 617 B7R0.7 CCOC(=O)CCO MCULE-3972081033 [2,0,0,0,0,0|1,0,0]=3 618 B7R0.7 CCOC(=O)CCS MCULE-3955367746 [2,0,0,0,0,0|1,0,0]=3 619 B7R0.7 CCOC(=O)CNC MCULE-3219895330 [2,0,0,0,0,0|1,0,0]=3 620 B7R0.7 CCOC(=O)CNC MCULE-6164649520 [2,0,0,0,0,0|1,0,0]=3 621 B7R0.7 CCOC(=O)CNN MCULE-2832319636 [2,0,0,0,0,0|2,0,0]=4 622 B7R0.7 CCOC(=O)CNN MCULE-3479623348 [2,0,0,0,0,0|2,0,0]=4 623 B7R0.7 CCOC(=O)CNN MCULE-5066106273 [2,0,0,0,0,0|2,0,0]=4 624 B7R0.7 CCOC(=O)COC MCULE-7739678079 [2,0,0,0,0,0|1,0,0]=3 625 B7R0.7 CCOC(=O)CON MCULE-4924818206 [2,0,0,0,0,0|2,0,0]=4 626 B7R0.7 CCOC(=O)CSC MCULE-5199209389 [2,0,0,0,0,0|1,0,0]=3 627 B7R0.7 CCOC(=O)NCCl MCULE-9646468987 [2,0,0,0,0,0|2,0,0]=4 628 B7R0.7 CCOC(=O)NCO MCULE-1265242244 [2,0,0,0,0,0|2,0,0]=4 629 B7R0.7 CCOC(=O)NNC MCULE-8689837834 [2,0,0,0,0,0|2,0,0]=4 630 B7R0.7 CCOC(=O)NOC MCULE-2256963329 [2,0,0,0,0,0|2,0,0]=4 631 B7R0.7 CCOC(=O)OCC MCULE-1394890550 [2,0,0,0,0,0|1,0,0]=3 632 B7R0.7 CCOC(=O)OCCl MCULE-9723292956 [2,0,0,0,0,0|2,0,0]=4 633 B7R0.7 CCOC(=O)OCI MCULE-7994621582 [2,0,0,0,0,0|2,0,0]=4 634 B7R0.7 CCOC(=O)[CH-]C=O MCULE-1944484299 [2,0,0,0,0,0|1,0,1]=4 635 B7R0.7 CCOC(=O)[CH-]C=O MCULE-5022028224 [2,0,0,0,0,0|1,0,1]=4 636 B7R0.7 CCOC(=S)SCC MCULE-9637505732 [2,0,0,0,0,0|1,1,0]=4 637 B7R0.7 CCOS(=O)OCC MCULE-6252684995 [2,0,0,0,0,0|2,0,0]=4 638 B7R0.7 CCSC(=O)SCC MCULE-7783165279 [2,0,0,0,0,0|1,1,0]=4 639 B7R0.7 P(=O)(OCC)OCC MCULE-8519301551 [2,0,0,0,0,0|2,0,0]=4 640 B7R0.4 C(=C/C(=O)O)\CCC MCULE-7580507705 [2,0,0,0,0,0|0,0,0]=2 641 B7R0.4 C(=C/CC(=O)O)\CC MCULE-2731794411 [2,0,0,0,0,0|0,0,2]=4 642 B7R0.4 C/C=C/C=C/C(=O)O MCULE-5933850278 [2,0,0,0,0,0|0,0,2]=4 643 B7R0.4 C/C=C/C=C\C(=O)O MCULE-3744855708 [2,0,0,0,0,0|0,0,2]=4 644 B7R0.4 CC=CC=CC(=O)C MCULE-1781846029 [2,0,0,0,0,0|0,0,2]=4 645 B7R0.4 CC=CC=CC(=O)O MCULE-9397415946 [2,0,0,0,0,0|0,0,2]=4 646 B7R0.4 CCC/C=C/B(O)O MCULE-9613885434 [2,0,0,0,0,0|1,0,1]=4 647 B7R0.4 CCC/C=C/C(=O)C MCULE-2005171902 [2,0,0,0,0,0|0,0,0]=2 648 B7R0.4 CCC=CCC(=O)O MCULE-5031939966 [2,0,0,0,0,0|0,0,2]=4 649 B7R0.4 CCCC#CC(=O)O MCULE-1682387091 [2,0,0,0,0,0|0,0,2]=4 650 B7R0.4 CCCC=CB(O)O MCULE-4057687975 [2,0,0,0,0,0|1,0,1]=4 651 B7R0.4 CCCC=CC(=O)C MCULE-5008490883 [2,0,0,0,0,0|0,0,0]=2 652 B7R0.4 CCCC=CC(=O)Cl MCULE-6782906777 [2,0,0,0,0,0|1,0,0]=3 653 B7R0.4 CCCC=CC(=O)O MCULE-6995077492 [2,0,0,0,0,0|0,0,0]=2 654 B7R0.4 CCCC=CC(C)C MCULE-6546702510 [2,0,0,0,0,0|1,0,1]=4 655 B7R0.4 CCCCCC(=O)C MCULE-6017828463 [2,0,0,0,0,0|0,0,2]=4 656 B7R0.4 CCCCCC(=O)O MCULE-1671810139 [2,0,0,0,0,0|0,0,2]=4 657 B7R0.4 CCCCNC(=O)C MCULE-7266335096 [2,0,0,0,0,0|1,0,1]=4 658 B7R0.4 CCCCOC(=O)C MCULE-2107021121 [2,0,0,0,0,0|1,0,1]=4 659 B7R0.4 CCCCSC(=O)C MCULE-2653182488 [2,0,0,0,0,0|1,0,1]=4 660 B7R0.4 CCCNCC(=O)O MCULE-4384128915 [2,0,0,0,0,0|1,0,1]=4 661 B7R0.4 CCCNCC(=O)O MCULE-7537317046 [2,0,0,0,0,0|1,0,1]=4 662 B7R0.4 CCCOCC(=O)O MCULE-6841640058 [2,0,0,0,0,0|1,0,1]=4 663 B7R0.4 CCCSCC(=O)C MCULE-8321448629 [2,0,0,0,0,0|1,0,1]=4 664 B7R0.4 CCCSCC(=O)O MCULE-7463688573 [2,0,0,0,0,0|1,0,1]=4 665 B7R0.4 CCO/C=C/C(=O)Cl MCULE-5623807124 [2,0,0,0,0,0|2,0,0]=4 666 B7R0.4 CCO/C=C/C(=O)O MCULE-6712227034 [2,0,0,0,0,0|1,0,0]=3 667 B7R0.4 CCOC=CC(=O)Cl MCULE-1242349133 [2,0,0,0,0,0|2,0,0]=4 668 B7R0.4 CCOC=CC(=O)O MCULE-4776715351 [2,0,0,0,0,0|1,0,0]=3 669 B7R0.4 COC/C=C/C(=O)O MCULE-7555080897 [2,0,0,0,0,0|1,0,0]=3 670 B7R0.4 COCC=CC(=O)O MCULE-5702384430 [2,0,0,0,0,0|1,0,0]=3 671 B7R0.4 CSCC=CC(=O)O MCULE-8220760222 [2,0,0,0,0,0|1,0,0]=3 672 B9R0.4 CC(C)OC(=O)CCCN MCULE-4793466202 [1,1,0,0,0,0|1,0,1]=4 673 B9R0.4 CC(C)OC(=O)CCCN MCULE-9030704140 [1,1,0,0,0,0|1,0,1]=4 674 B9R0.4 CCCCC(=O)CC(C)C MCULE-5810585247 [1,1,0,0,0,0|1,0,1]=4 675 B9R0.4 CCCOC(=O)CC(C)C MCULE-5746319400 [1,1,0,0,0,0|2,0,0]=4 676 B9R0.8 CCCCC(=O)C(C)CC MCULE-4208435581 [1,1,0,0,0,0|1,0,1]=4 677 B9R0.8 CCCNC(=O)C(Br)CC MCULE-3744702710 [1,1,0,0,0,0|2,0,0]=4 678 B9R0.8 CCCNC(=O)C(N)CC MCULE-5211144002 [1,1,0,0,0,0|2,0,0]=4 679 B9R0.8 CCCNC(=O)[C@@H](N)CC MCULE-5473492504 [1,1,0,0,0,0|2,0,0]=4 680 B9R0.8 CCCNC(=O)[C@@H](N)CC MCULE-7680643292 [1,1,0,0,0,0|2,0,0]=4 681 B9R0.8 CCCOC(=O)C(C)CC MCULE-6816621931 [1,1,0,0,0,0|2,0,0]=4 682 B9R0.8 CCCOC(=O)C(Cl)CC MCULE-4551358042 [1,1,0,0,0,0|2,0,0]=4 683 B9R0.18 CCCCC(=O)CCCC MCULE-6886826396 [1,1,0,0,0,0|1,0,1]=4 684 B9R0.18 CCCCC(=O)OCCC MCULE-9801353359 [1,1,0,0,0,0|0,0,1]=3 685 B9R0.18 CCCNC(=O)CCCCl MCULE-1473811039 [1,1,0,0,0,0|2,0,0]=4 686 B9R0.18 CCCNC(=O)NCCC MCULE-6353018646 [1,1,0,0,0,0|2,0,0]=4 687 B9R0.18 CCCOC(=O)OCCC MCULE-9166999585 [1,1,0,0,0,0|1,0,0]=3 688 B9R0.18 CCCOS(=O)OCCC MCULE-3361401597 [1,1,0,0,0,0|2,0,0]=4 689 B9R0.18 CCOCC(=O)NCCN MCULE-1190675248 [1,1,0,0,0,0|2,0,0]=4 690 B9R0.18 CCOCC(=O)NCCN MCULE-7659515529 [1,1,0,0,0,0|2,0,0]=4 691 B9R0.18 CCOCC(=O)NCCN MCULE-9688091053 [1,1,0,0,0,0|2,0,0]=4 692 B9R0.18 O=C(NCCCl)OCCCl MCULE-4847419924 [1,1,0,0,0,0|2,0,0]=4 693 B9R0.18 O=C(OCCCl)OCCCl MCULE-1847610200 [1,1,0,0,0,0|2,0,0]=4 694 B9R0.34 CCCC(=O)OC(C)CC MCULE-2445269271 [1,1,0,0,0,0|2,0,0]=4 695 B9R0.34 CCOC(=O)/C=C(/C)\CBr MCULE-5435506921 [1,1,0,0,0,0|1,0,0]=3 696 B9R0.34 CCOC(=O)/C=C(/C)\NC MCULE-6271790714 [1,1,0,0,0,0|1,0,0]=3 697 B9R0.34 CCOC(=O)/C=C(\C)/C=O MCULE-1211370029 [1,1,0,0,0,0|1,0,1]=4 698 B9R0.34 CCOC(=O)/C=C(\C)/CBr MCULE-5022962932 [1,1,0,0,0,0|1,0,0]=3 699 B9R0.34 CCOC(=O)/C=C(\C)/CC MCULE-9989234580 [1,1,0,0,0,0|0,0,0]=2 700 B9R0.34 CCOC(=O)/C=C(\C)/CO MCULE-8707746016 [1,1,0,0,0,0|1,0,0]=3 701 B9R0.34 CCOC(=O)/C=C(\N)/CC MCULE-1218147100 [1,1,0,0,0,0|0,0,0]=2 702 B9R0.34 CCOC(=O)C=C(C)C=O MCULE-9091554191 [1,1,0,0,0,0|1,0,1]=4 703 B9R0.34 CCOC(=O)C=C(C)CBr MCULE-9716367840 [1,1,0,0,0,0|1,0,0]=3 704 B9R0.34 CCOC(=O)C=C(C)CC MCULE-6939013516 [1,1,0,0,0,0|0,0,0]=2 705 B9R0.34 CCOC(=O)C=C(C)CO MCULE-6339947781 [1,1,0,0,0,0|1,0,0]=3 706 B9R0.34 CCOC(=O)C=C(C)NC MCULE-6643100611 [1,1,0,0,0,0|1,0,0]=3 707 B9R0.34 CCOC(=O)C=C(N)CC MCULE-1320898760 [1,1,0,0,0,0|0,0,0]=2 708 B9R0.34 CCOC(=O)CC(=N)NC MCULE-6792073655 [1,1,0,0,0,0|1,0,1]=4 709 B9R0.34 CCOC(=O)CC(=O)CBr MCULE-4119338402 [1,1,0,0,0,0|1,0,1]=4 710 B9R0.34 CCOC(=O)CC(=O)CC MCULE-8189546247 [1,1,0,0,0,0|0,0,1]=3 711 B9R0.34 CCOC(=O)CC(=O)CCl MCULE-4527441021 [1,1,0,0,0,0|1,0,1]=4 712 B9R0.34 CCOC(=O)CC(=O)CF MCULE-7604443769 [1,1,0,0,0,0|1,0,1]=4 713 B9R0.34 CCOC(=O)CC(=O)CN MCULE-4190018259 [1,1,0,0,0,0|1,0,1]=4 714 B9R0.34 CCOC(=O)CC(=O)CN MCULE-5377403286 [1,1,0,0,0,0|1,0,1]=4 715 B9R0.34 CCOC(=O)CC(=O)CO MCULE-2594117173 [1,1,0,0,0,0|1,0,1]=4 716 B9R0.34 CCOC(=O)CC(=O)CS MCULE-6738191063 [1,1,0,0,0,0|1,0,1]=4 717 B9R0.34 CCOC(=O)CC(=O)NC MCULE-8763136380 [1,1,0,0,0,0|1,0,1]=4 718 B9R0.34 CCOC(=O)CC(=O)OC MCULE-4720438339 [1,1,0,0,0,0|1,0,1]=4 719 B9R0.34 CCOC(=O)CC(C)CC MCULE-4014035383 [1,1,0,0,0,0|0,0,1]=3 720 B9R0.34 CCOC(=O)CC(C)NC MCULE-1705889583 [1,1,0,0,0,0|1,0,1]=4 721 B9R0.34 CCOC(=O)CC(F)CI MCULE-8570199151 [1,1,0,0,0,0|1,0,1]=4 722 B9R0.34 CCOC(=O)CC(N)CO MCULE-1698986423 [1,1,0,0,0,0|1,0,1]=4 723 B9R0.34 CCOC(=O)CC(N)CO MCULE-3133814849 [1,1,0,0,0,0|1,0,1]=4 724 B9R0.34 CCOC(=O)CC(O)CC MCULE-1917822917 [1,1,0,0,0,0|0,0,1]=3 725 B9R0.34 CCOC(=O)CC(O)CCl MCULE-2262718063 [1,1,0,0,0,0|1,0,1]=4 726 B9R0.34 CCOC(=O)CC(O)CCl MCULE-5360276844 [1,1,0,0,0,0|1,0,1]=4 727 B9R0.34 CCOC(=O)CC(O)CI MCULE-6198631807 [1,1,0,0,0,0|1,0,1]=4 728 B9R0.34 CCOC(=O)CC(O)CO MCULE-8896194093 [1,1,0,0,0,0|1,0,1]=4 729 B9R0.34 CCOC(=O)C[C@@H](O)CBr MCULE-5715312033 [1,1,0,0,0,0|1,0,1]=4 730 B9R0.34 CCOC(=O)C[C@@H](O)CBr MCULE-5871241096 [1,1,0,0,0,0|1,0,1]=4 731 B9R0.34 CCOC(=O)C[C@@H](O)CCl MCULE-7631433830 [1,1,0,0,0,0|1,0,1]=4 732 B9R0.34 CCOC(=O)C[C@@H](O)CCl MCULE-9413705440 [1,1,0,0,0,0|1,0,1]=4 733 B9R0.34 CCOC(=O)C[C@H](O)CBr MCULE-3856953058 [1,1,0,0,0,0|1,0,1]=4 734 B9R0.34 CCOC(=O)C[C@H](O)CBr MCULE-8467993550 [1,1,0,0,0,0|1,0,1]=4 735 B9R0.34 CCOC(=O)C[C@H](O)CCl MCULE-2512912579 [1,1,0,0,0,0|1,0,1]=4 736 B9R0.34 CCOC(=O)C[C@H](O)CCl MCULE-4665153523 [1,1,0,0,0,0|1,0,1]=4 737 B9R0.34 CCOC(=O)C[C@H](O)CI MCULE-7954654327 [1,1,0,0,0,0|1,0,1]=4 738 B9R0.34 CCOC(=O)NC(=O)CCl MCULE-9107585869 [1,1,0,0,0,0|2,0,0]=4 739 B9R0.34 CCOC(=O)NC(=S)NC MCULE-6847356801 [1,1,0,0,0,0|2,0,0]=4 740 B9R0.35 C=C(CCC)C(=O)OCC MCULE-6119854466 [1,1,0,0,0,0|0,0,0]=2 741 B9R0.35 C=C(OCC)C(=O)OCC MCULE-9191149585 [1,1,0,0,0,0|1,0,0]=3 742 B9R0.35 C=CC=C(C)C(=O)OCC MCULE-8012059875 [1,1,0,0,0,0|0,0,2]=4 743 B9R0.35 CC=CC(C)C(=O)OCC MCULE-8266401208 [1,1,0,0,0,0|0,0,2]=4 744 B9R0.35 CCCC(=O)C(=O)OCC MCULE-2397358060 [1,1,0,0,0,0|0,0,0]=2 745 B9R0.35 CCCC(=O)C(O)CCC MCULE-8800884172 [1,1,0,0,0,0|1,0,1]=4 746 B9R0.35 CCCC(Br)C(=O)OCC MCULE-1641585625 [1,1,0,0,0,0|0,0,1]=3 747 B9R0.35 CCCC(C)C(=O)OCC MCULE-6427957662 [1,1,0,0,0,0|0,0,1]=3 748 B9R0.35 CCCC(Cl)C(=O)OCC MCULE-2230642797 [1,1,0,0,0,0|0,0,1]=3 749 B9R0.35 CCCC(N)C(=O)OCC MCULE-2079160613 [1,1,0,0,0,0|0,0,1]=3 750 B9R0.35 CCCC(N)C(=O)OCC MCULE-2244229552 [1,1,0,0,0,0|0,0,1]=3 751 B9R0.35 CCCC(N)C(=O)OCC MCULE-3263328358 [1,1,0,0,0,0|0,0,1]=3 752 B9R0.35 CCCC(N)C(=O)OCC MCULE-7880644615 [1,1,0,0,0,0|0,0,1]=3 753 B9R0.35 CCCC(O)C(=O)OCC MCULE-6556101983 [1,1,0,0,0,0|0,0,1]=3 754 B9R0.35 CCCN(N)C(=O)OCC MCULE-9670705824 [1,1,0,0,0,0|1,0,0]=3 755 B9R0.35 CCC[C@@H](N)C(=O)OCC MCULE-1531063816 [1,1,0,0,0,0|0,0,1]=3 756 B9R0.35 CCC[C@@H](N)C(=O)OCC MCULE-7568828812 [1,1,0,0,0,0|0,0,1]=3 757 B9R0.35 CCC[C@H](N)C(=O)OCC MCULE-3035934367 [1,1,0,0,0,0|0,0,1]=3 758 B9R0.35 CCC[C@H](N)C(=O)OCC MCULE-4542516474 [1,1,0,0,0,0|0,0,1]=3 759 B9R0.35 CCC[C@H](N)C(=O)OCC MCULE-6667556654 [1,1,0,0,0,0|0,0,1]=3 760 B9R0.35 CCC[C@H](N)C(=O)OCC MCULE-8895399157 [1,1,0,0,0,0|0,0,1]=3 761 B9R0.35 CCNC(=O)C(=O)NCC MCULE-9926141786 [1,1,0,0,0,0|2,0,0]=4 762 B9R0.35 CCNC(=O)C(=O)OCC MCULE-4356943049 [1,1,0,0,0,0|1,0,0]=3 763 B9R0.35 CCOC(=N)C(=O)OCC MCULE-5378944597 [1,1,0,0,0,0|1,0,0]=3 764 B9R0.35 CCOC(=N)C(=O)OCC MCULE-6324621139 [1,1,0,0,0,0|1,0,0]=3 765 B9R0.35 CCOC(=O)/C(=N/OC)/Cl MCULE-3830200421 [1,1,0,0,0,0|2,0,0]=4 766 B9R0.35 CCOC(=O)C(=CC#N)C MCULE-8357455103 [1,1,0,0,0,0|1,0,1]=4 767 B9R0.35 CCOC(=O)C(=CC#N)[O-] MCULE-5265196487 [1,1,0,0,0,0|1,0,1]=4 768 B9R0.35 CCOC(=O)C(=CC#N)[O-] MCULE-5764703316 [1,1,0,0,0,0|1,0,1]=4 769 B9R0.35 CCOC(=O)C(=CC#N)[O-] MCULE-8461513404 [1,1,0,0,0,0|1,0,1]=4 770 B9R0.35 CCOC(=O)C(=CCCl)C MCULE-3127553451 [1,1,0,0,0,0|1,0,0]=3 771 B9R0.35 CCOC(=O)C(=O)CC#N MCULE-4240802181 [1,1,0,0,0,0|1,0,1]=4 772 B9R0.35 CCOC(=O)C(=O)OCC MCULE-5264218494 [1,1,0,0,0,0|1,0,0]=3 773 B9R0.35 CCOC(=O)C(Br)CCBr MCULE-7116141170 [1,1,0,0,0,0|1,0,1]=4 774 B9R0.35 CCOC(=O)C(C)CNC MCULE-7751336299 [1,1,0,0,0,0|1,0,1]=4 775 B9R0.35 CCOC(=O)C(Cl)OCC MCULE-5407634230 [1,1,0,0,0,0|1,0,1]=4 776 B9R0.35 CCOC(=O)C(N)CCF MCULE-2487544760 [1,1,0,0,0,0|1,0,1]=4 777 B9R0.35 CCOC(=O)C(N)CCF MCULE-6489878876 [1,1,0,0,0,0|1,0,1]=4 778 B9R0.35 CCOC(=O)C(N)CSC MCULE-2209633449 [1,1,0,0,0,0|1,0,1]=4 779 B9R0.35 CCOC(=O)C(N)CSC MCULE-8867028850 [1,1,0,0,0,0|1,0,1]=4 780 B9R0.35 CCOC(=O)C(O)COC MCULE-5467138480 [1,1,0,0,0,0|1,0,1]=4 781 B9R0.35 CCOC(=O)N(C)CCO MCULE-4943831031 [1,1,0,0,0,0|2,0,0]=4 782 B9R0.35 CCOC(=O)[C@@H](N)CSC MCULE-5964178887 [1,1,0,0,0,0|1,0,1]=4 783 B9R0.35 CCOC(=O)[C@@H](N)CSC MCULE-6298472660 [1,1,0,0,0,0|1,0,1]=4 784 B9R0.48 C=C(C)C=CC(=O)OCC MCULE-4545651414 [1,1,0,0,0,0|0,0,1]=3 785 B9R0.48 C=C(C)CCC(=O)OCC MCULE-1518145690 [1,1,0,0,0,0|0,0,2]=4 786 B9R0.48 CCCC(=O)OCC(C)C MCULE-5762939087 [1,1,0,0,0,0|2,0,0]=4 787 B9R0.48 CCOC(=O)/C=C/C(=O)C MCULE-1277426448 [1,1,0,0,0,0|0,0,1]=3 788 B9R0.48 CCOC(=O)/C=C/C(=O)O MCULE-2354207944 [1,1,0,0,0,0|1,0,1]=4 789 B9R0.48 CCOC(=O)/C=C/C(C)C MCULE-3748857850 [1,1,0,0,0,0|0,0,0]=2 790 B9R0.48 CCOC(=O)/C=C/C(F)F MCULE-5843813125 [1,1,0,0,0,0|1,0,0]=3 791 B9R0.48 CCOC(=O)/C=C/N(=O)=O MCULE-2776366889 [1,1,0,0,0,0|2,0,0]=4 792 B9R0.48 CCOC(=O)/C=C/N(C)C MCULE-7397270661 [1,1,0,0,0,0|1,0,0]=3 793 B9R0.48 CCOC(=O)/C=C\C(=O)O MCULE-9139116808 [1,1,0,0,0,0|1,0,1]=4 794 B9R0.48 CCOC(=O)C#CC(C)O MCULE-7395914005 [1,1,0,0,0,0|0,0,2]=4 795 B9R0.48 CCOC(=O)C=CB(O)O MCULE-3769461803 [1,1,0,0,0,0|2,0,0]=4 796 B9R0.48 CCOC(=O)C=CC(=O)C MCULE-7029387078 [1,1,0,0,0,0|0,0,1]=3 797 B9R0.48 CCOC(=O)C=CC(=O)Cl MCULE-9896065168 [1,1,0,0,0,0|1,0,1]=4 798 B9R0.48 CCOC(=O)C=CC(=O)O MCULE-7475947730 [1,1,0,0,0,0|1,0,1]=4 799 B9R0.48 CCOC(=O)C=CC(=O)[O-] MCULE-3490373917 [1,1,0,0,0,0|1,0,1]=4 800 B9R0.48 CCOC(=O)C=CC(C)C MCULE-5475079081 [1,1,0,0,0,0|0,0,0]=2 801 B9R0.48 CCOC(=O)C=CC(F)F MCULE-6161599045 [1,1,0,0,0,0|1,0,0]=3 802 B9R0.48 CCOC(=O)C=CN(C)C MCULE-6805314088 [1,1,0,0,0,0|1,0,0]=3 803 B9R0.48 CCOC(=O)CCC(=O)C MCULE-1970388037 [1,1,0,0,0,0|0,0,2]=4 804 B9R0.48 CCOC(=O)CCC(C)Br MCULE-4073335261 [1,1,0,0,0,0|0,0,1]=3 805 B9R0.48 CCOC(=O)CCC(C)C MCULE-1386486394 [1,1,0,0,0,0|0,0,1]=3 806 B9R0.48 CCOC(=O)CCC(C)Cl MCULE-8909380760 [1,1,0,0,0,0|0,0,1]=3 807 B9R0.48 CCOC(=O)CCC(C)N MCULE-5773909999 [1,1,0,0,0,0|0,0,1]=3 808 B9R0.48 CCOC(=O)CCC(C)N MCULE-5870649436 [1,1,0,0,0,0|0,0,1]=3 809 B9R0.48 CCOC(=O)CCC(F)F MCULE-9637395604 [1,1,0,0,0,0|1,0,1]=4 810 B9R0.48 CCOC(=O)CCN(C)C MCULE-6461752502 [1,1,0,0,0,0|1,0,1]=4 811 B9R0.48 CCOC(=O)CNC(C)C MCULE-2512915227 [1,1,0,0,0,0|1,0,1]=4 812 B9R0.48 CCOC(=O)CNC(C)C MCULE-6227741071 [1,1,0,0,0,0|1,0,1]=4 813 B9R0.48 CCOC(=O)COC(C)C MCULE-9941341849 [1,1,0,0,0,0|1,0,1]=4 814 B9R0.48 CCOC(=O)NCC(C)O MCULE-7884037300 [1,1,0,0,0,0|1,0,0]=3 815 B9R0.48 CCOC(=O)OCC(C)C MCULE-5874029260 [1,1,0,0,0,0|1,0,0]=3 816 B9R0.48 CCOC(=O)OCC(F)F MCULE-3788806882 [1,1,0,0,0,0|2,0,0]=4 817 B9R0.2 C(=C/COC(=O)C)\CCC MCULE-6477561163 [1,1,0,0,0,0|0,0,2]=4 818 B9R0.2 CCCC=CCOC(=O)C MCULE-1950142599 [1,1,0,0,0,0|0,0,2]=4 819 B9R0.45 CCC=CCC=CCCO MCULE-8061689428 [1,1,0,0,0,0|2,0,0]=4 820 B9R0.45 CCCC/C=C/CCCC MCULE-5215613168 [1,1,0,0,0,0|1,0,1]=4 821 B9R0.45 CCCC/C=C\CCCC MCULE-7961413462 [1,1,0,0,0,0|1,0,1]=4 822 B9R0.45 CCCCC=CCCCC MCULE-4261429100 [1,1,0,0,0,0|1,0,1]=4 823 B9R0.45 CCNCC=CCNCC MCULE-8435967986 [1,1,0,0,0,0|1,0,1]=4 824 B9R0.1 CCC(=O)OCCC(C)C MCULE-3753568890 [1,1,0,0,0,0|1,0,1]=4 825 B9R0.1 COC(=O)/C=C/CC(C)C MCULE-1903765303 [1,1,0,0,0,0|0,0,0]=2 826 B9R0.1 COC(=O)/C=C/CN(C)C MCULE-1840410919 [1,1,0,0,0,0|1,0,0]=3 827 B9R0.1 COC(=O)C=CCC(C)C MCULE-4145879256 [1,1,0,0,0,0|0,0,0]=2 828 B9R0.1 COC(=O)C=CCN(C)C MCULE-2809192245 [1,1,0,0,0,0|1,0,0]=3 829 B9R0.1 COC(=O)CNCC(C)C MCULE-6522627999 [1,1,0,0,0,0|1,0,1]=4 830 B9R0.24 C(=C\C(=O)OC)\C(=O)OC MCULE-9787020384 [1,1,0,0,0,0|1,0,1]=4 831 B9R0.24 CCC(C)C#CC(=O)OC MCULE-5356018366 [1,1,0,0,0,0|0,0,2]=4 832 B9R0.24 CCC(C)NCC(=O)OC MCULE-5997453349 [1,1,0,0,0,0|1,0,1]=4 833 B9R0.24 CCC(C)SCC(=O)OC MCULE-7927875176 [1,1,0,0,0,0|1,0,1]=4 834 B9R0.24 CCC(N)CCC(=O)OC MCULE-8096200173 [1,1,0,0,0,0|0,0,2]=4 835 B9R0.24 CCC(N)CCC(=O)OC MCULE-9735533305 [1,1,0,0,0,0|0,0,2]=4 836 B9R0.24 CCC(O)C#CC(=O)OC MCULE-8230920349 [1,1,0,0,0,0|0,0,2]=4 837 B9R0.24 COC(=O)/C=C/C(=O)OC MCULE-4208733984 [1,1,0,0,0,0|1,0,1]=4 838 B9R0.24 COC(=O)C=CC(=O)OC MCULE-8277820773 [1,1,0,0,0,0|1,0,1]=4 839 B9R0.24 COC(=O)C=CC(O)CO MCULE-8824735317 [1,1,0,0,0,0|1,0,0]=3 840 B9R0.47 CCCCNC(=O)C(C)Cl MCULE-2719675622 [1,1,0,0,0,0|1,0,1]=4 841 B9R0.47 CCCCNC(=O)C(C)N MCULE-4253248059 [1,1,0,0,0,0|1,0,1]=4 842 B9R0.47 CCCCNC(=O)C(C)N MCULE-8572862511 [1,1,0,0,0,0|1,0,1]=4 843 B9R0.47 CCCCOC(=O)C(C)Br MCULE-6889056012 [1,1,0,0,0,0|1,0,1]=4 844 B9R0.47 CCCCOC(=O)C(C)C MCULE-8044191721 [1,1,0,0,0,0|1,0,1]=4 845 B9R0.47 CCCCOC(=O)C(C)Cl MCULE-6249824991 [1,1,0,0,0,0|1,0,1]=4 846 B9R0.47 CCCCOC(=O)C(C)N MCULE-6698387089 [1,1,0,0,0,0|1,0,1]=4 847 B9R0.47 CCCCOC(=O)C(C)N MCULE-7945035592 [1,1,0,0,0,0|1,0,1]=4 848 B9R0.47 CCCCOC(=O)C(C)O MCULE-5462693192 [1,1,0,0,0,0|1,0,1]=4 849 B9R0.47 CCCCOC(=O)[C@H](C)N MCULE-2792391954 [1,1,0,0,0,0|1,0,1]=4 850 B9R0.47 CCCCOC(=O)[C@H](C)N MCULE-6349393296 [1,1,0,0,0,0|1,0,1]=4 851 B9R0.47 CCCCOC(=O)[C@H](C)N MCULE-8849216267 [1,1,0,0,0,0|1,0,1]=4 852 B9R0.47 CCCCOC(=O)[C@H](C)N MCULE-9489465885 [1,1,0,0,0,0|1,0,1]=4 853 B9R0.47 CCCCOC(=O)[C@H](C)O MCULE-5423028657 [1,1,0,0,0,0|1,0,1]=4 854 B9R0.47 CCCCOC(=O)[C@H](C)O MCULE-8076552166 [1,1,0,0,0,0|1,0,1]=4 855 B9R0.47 CCO/C=C/C(=O)C(F)F MCULE-5085511708 [1,1,0,0,0,0|2,0,0]=4 856 B9R0.47 CCOC=CC(=O)C(F)F MCULE-5166610939 [1,1,0,0,0,0|2,0,0]=4 857 B11R0.2 CC(C)OC(=O)CCCCCBr MCULE-5192424932 [0,2,0,0,0,0|0,0,2]=4 858 B11R0.4 C(=CC(=O)OCC)CCCCC MCULE-4171275205 [0,2,0,0,0,0|0,0,0]=2 859 B11R0.4 C=CCCCCCC(=O)OCC MCULE-7006723315 [0,2,0,0,0,0|0,0,2]=4 860 B11R0.4 CCC/C=C/COC(=O)CCC MCULE-6588919367 [0,2,0,0,0,0|1,0,0]=3 861 B11R0.4 CCCC=CCCC(=O)OCC MCULE-9126448594 [0,2,0,0,0,0|0,0,0]=2 862 B11R0.4 CCCC=CCOC(=O)CCC MCULE-6083586714 [0,2,0,0,0,0|1,0,0]=3 863 B11R0.4 CCCCC/C=C/C(=O)OCC MCULE-5442918020 [0,2,0,0,0,0|0,0,0]=2 864 B11R0.4 CCCCCC#CC(=O)OCC MCULE-5790220243 [0,2,0,0,0,0|0,0,2]=4 865 B11R0.4 CCCCCCCC(=O)OCC MCULE-2970505348 [0,2,0,0,0,0|0,0,2]=4 866 B11R0.4 CCCCNCCC(=O)OCC MCULE-5853777478 [0,2,0,0,0,0|0,0,2]=4 867 B11R0.4 CCCCSCCC(=O)OCC MCULE-6074500572 [0,2,0,0,0,0|0,0,2]=4 868 B11R0.4 CCOC(=O)/C=C/CCCCCl MCULE-6128979271 [0,2,0,0,0,0|0,0,0]=2 869 B11R0.4 CCOC(=O)C=CCCCCCl MCULE-4585677614 [0,2,0,0,0,0|0,0,0]=2 870 B11R0.4 CCOC(=O)CCCCCC=O MCULE-8029913259 [0,2,0,0,0,0|0,0,2]=4 871 B11R0.4 CCOC(=O)CCCCCCBr MCULE-6438098940 [0,2,0,0,0,0|0,0,2]=4 872 B11R0.4 CCOC(=O)CCCCCCCl MCULE-2985397172 [0,2,0,0,0,0|0,0,2]=4 873 B11R0.4 CCOC(=O)CCCCCCI MCULE-6134074150 [0,2,0,0,0,0|0,0,2]=4 874 B11R0.4 CCOC(=O)CCCCCCN MCULE-5019264359 [0,2,0,0,0,0|0,0,2]=4 875 B11R0.4 CCOC(=O)CCCCCCN MCULE-8921407508 [0,2,0,0,0,0|0,0,2]=4 876 B11R0.4 CCOC(=O)CCCCCNC MCULE-3880282111 [0,2,0,0,0,0|0,0,2]=4 877 B11R0.4 CCOC(=O)CCCCCNC MCULE-5211183009 [0,2,0,0,0,0|0,0,2]=4 878 B11R0.4 CCOC(=O)CCNCCCO MCULE-6911342581 [0,2,0,0,0,0|0,0,2]=4 879 B11R0.4 CCOC(=O)CCNCCOC MCULE-2066847830 [0,2,0,0,0,0|0,0,2]=4 880 B11R0.4 CCOC(=O)NCCCCCO MCULE-3754810142 [0,2,0,0,0,0|0,0,2]=4 881 B11R0.5 C#CCCC(=O)CC(=O)OCC MCULE-3307918259 [0,2,0,0,0,0|0,0,2]=4 882 B11R0.5 C=CCCC(=O)CC(=O)OCC MCULE-2994774008 [0,2,0,0,0,0|0,0,2]=4 883 B11R0.5 CCCCC(=O)CC(=O)OCC MCULE-4230578552 [0,2,0,0,0,0|0,0,1]=3 884 B11R0.5 CCCCC(N)CC(=O)OCC MCULE-2649536123 [0,2,0,0,0,0|0,0,2]=4 885 B11R0.5 CCCCC(N)CC(=O)OCC MCULE-6648259380 [0,2,0,0,0,0|0,0,2]=4 886 B11R0.5 CCCCC(O)CC(=O)OCC MCULE-1375788706 [0,2,0,0,0,0|0,0,2]=4 887 B11R0.5 CCOC(=O)CC(=NCCO)C MCULE-4139214455 [0,2,0,0,0,0|1,0,1]=4 888 B11R0.5 CCOC(=O)CC(=O)CCOC MCULE-1660267189 [0,2,0,0,0,0|0,0,1]=3 889 B11R0.5 CCOC(=O)CN(C)CCOC MCULE-9740232501 [0,2,0,0,0,0|1,0,1]=4 890 B11R0.5 CCOC(=O)C[C@H](C)CCCO MCULE-7777596847 [0,2,0,0,0,0|0,0,2]=4 891 B11R0.5 CCOC(=O)NC(=S)NCCO MCULE-9100233102 [0,2,0,0,0,0|2,0,0]=4 892 B11R0.5 CCOCC(=O)CC(=O)OCC MCULE-6712148047 [0,2,0,0,0,0|0,0,1]=3 893 B11R0.62 CCCC(=O)CCC(=O)OCC MCULE-3394958382 [0,2,0,0,0,0|0,0,1]=3 894 B11R0.62 CCCC(=O)NNC(=O)CCC MCULE-3001379600 [0,2,0,0,0,0|2,0,0]=4 895 B11R0.62 CCCC(C)CCC(=O)OCC MCULE-9209148912 [0,2,0,0,0,0|0,0,2]=4 896 B11R0.62 CCOC(=N)CCC(=O)OCC MCULE-2866157811 [0,2,0,0,0,0|1,0,1]=4 897 B11R0.62 CCOC(=N)CCC(=O)OCC MCULE-7732810249 [0,2,0,0,0,0|1,0,1]=4 898 B11R0.62 CCOC(=O)/C=C/C(=O)OCC MCULE-3355274756 [0,2,0,0,0,0|0,0,1]=3 899 B11R0.62 CCOC(=O)/C=C\C(=O)OCC MCULE-1444251835 [0,2,0,0,0,0|0,0,1]=3 900 B11R0.62 CCOC(=O)/N=N/C(=O)OCC MCULE-6117954757 [0,2,0,0,0,0|2,0,0]=4 901 B11R0.62 CCOC(=O)C#CC(=O)OCC MCULE-2562892497 [0,2,0,0,0,0|1,0,1]=4 902 B11R0.62 CCOC(=O)C=CC(=O)OCC MCULE-3418342624 [0,2,0,0,0,0|0,0,1]=3 903 B11R0.62 CCOC(=O)CCC(=O)OCC MCULE-1960920420 [0,2,0,0,0,0|1,0,1]=4 904 B11R0.62 CCOC(=O)CNC(=O)OCC MCULE-9172661656 [0,2,0,0,0,0|1,0,1]=4 905 B11R0.62 CCOC(=O)CSC(=O)OCC MCULE-4049916777 [0,2,0,0,0,0|1,0,1]=4 906 B11R0.62 CCOC(=O)CSC(=S)OCC MCULE-4458786711 [0,2,0,0,0,0|1,0,1]=4 907 B11R0.62 CCOC(=O)N=NC(=O)OCC MCULE-9741196270 [0,2,0,0,0,0|2,0,0]=4 908 B11R0.62 CCOC(=O)NN=C(C)OCC MCULE-8611322176 [0,2,0,0,0,0|2,0,0]=4 909 B11R0.62 CCOC(=O)NNC(=O)OCC MCULE-6009171446 [0,2,0,0,0,0|2,0,0]=4 910 B11R0.81 CCCCCCC(=O)OCCC MCULE-6309887109 [0,2,0,0,0,0|0,0,2]=4 911 B11R0.155 CCCCCC(=O)C(=O)OCC MCULE-6264599402 [0,2,0,0,0,0|0,0,1]=3 912 B11R0.155 CCCCCC(Br)C(=O)OCC MCULE-5071739287 [0,2,0,0,0,0|0,0,2]=4 913 B11R0.155 CCCCNC(=O)C(=O)NCC MCULE-7458551905 [0,2,0,0,0,0|1,0,1]=4 914 B11R0.155 CCNC(=O)C(=O)NCCOC MCULE-3895037018 [0,2,0,0,0,0|2,0,0]=4 915 B11R0.155 CCO/C=C/C(=O)C(=O)OCC MCULE-8669095551 [0,2,0,0,0,0|0,0,1]=3 916 B11R0.155 CCOC(=O)C(=O)CCCC#N MCULE-4317374856 [0,2,0,0,0,0|0,0,2]=4 917 B11R0.155 CCOC(=O)C(=O)CCCCCl MCULE-2730081165 [0,2,0,0,0,0|0,0,1]=3 918 B11R0.155 CCOC(=O)C(=O)NCCOC MCULE-2506561736 [0,2,0,0,0,0|1,0,0]=3 919 B11R0.155 CCOC(=O)C(N)CCCCN MCULE-6161225514 [0,2,0,0,0,0|0,0,2]=4 920 B11R0.155 CCOC(=O)C(N)CCCCN MCULE-6784052563 [0,2,0,0,0,0|0,0,2]=4 921 B11R0.155 CCOC(=O)C(N)CCCCN MCULE-7207725681 [0,2,0,0,0,0|0,0,2]=4 922 B11R0.155 CCOC(=O)C(N)CCCCN MCULE-8403724896 [0,2,0,0,0,0|0,0,2]=4 923 B11R0.155 CCOC(=O)C(N)CCCOC MCULE-5689363804 [0,2,0,0,0,0|0,0,2]=4 924 B11R0.155 CCOC(=O)[C@@H](N)CCCCN MCULE-1818096073 [0,2,0,0,0,0|0,0,2]=4 925 B11R0.155 CCOC(=O)[C@@H](N)CCCCN MCULE-3988865124 [0,2,0,0,0,0|0,0,2]=4 926 B11R0.155 CCOC(=O)[C@@H](N)CCCCN MCULE-5713269112 [0,2,0,0,0,0|0,0,2]=4 927 B11R0.155 CCOC=CC(=O)C(=O)OCC MCULE-1205526936 [0,2,0,0,0,0|0,0,1]=3 928 B11R0.155 [C@H](N)(CCCCN)C(=O)OCC MCULE-3847914782 [0,2,0,0,0,0|0,0,2]=4 929 B11R0.155 [C@H](N)(CCCCN)C(=O)OCC MCULE-6370873846 [0,2,0,0,0,0|0,0,2]=4 930 B11R0.174 CCOC(=O)CCC=C(C)CC MCULE-6307043891 [0,2,0,0,0,0|0,0,2]=4 931 B11R0.174 CCOC(=O)CCCC(=O)CC MCULE-7206281460 [0,2,0,0,0,0|0,0,2]=4 932 B11R0.174 CCOC(=O)CCNC(C)CC MCULE-1121544810 [0,2,0,0,0,0|0,0,2]=4 933 B11R0.176 C=C(C)CCCCC(=O)OCC MCULE-7155352281 [0,2,0,0,0,0|0,0,2]=4 934 B11R0.176 CCOC(=O)CCCCC(C)C MCULE-1122758538 [0,2,0,0,0,0|0,0,2]=4 935 B11R0.176 CCOC(=O)CCCCN(C)C MCULE-3964441840 [0,2,0,0,0,0|0,0,2]=4 936 B11R0.176 CCOC(=O)CCCCN(C)C MCULE-9060441726 [0,2,0,0,0,0|0,0,2]=4 937 B11R0.176 CCOC(=O)CCNCC(C)C MCULE-7863091825 [0,2,0,0,0,0|0,0,2]=4 938 B11R0.176 CCOC(=O)NCCCN(C)C MCULE-3997315924 [0,2,0,0,0,0|1,0,1]=4 939 B11R0.1 CCOC(=O)/C=C(\C)/NC(=O)C MCULE-5426409664 [0,2,0,0,0,0|1,0,1]=4 940 B11R0.1 CCOC(=O)C=C(C)NC(=O)C MCULE-1416897736 [0,2,0,0,0,0|1,0,1]=4 941 B11R0.1 CCOC(=O)CC(=O)CC(=O)C MCULE-8257218671 [0,2,0,0,0,0|0,0,2]=4 942 B11R0.1 CCOC(=O)CC(=O)CC(C)C MCULE-3386128300 [0,2,0,0,0,0|0,0,1]=3 943 B11R0.1 CCOC(=O)CC(=O)CN(C)C MCULE-8800491933 [0,2,0,0,0,0|1,0,1]=4 944 B11R0.1 CCOC(=O)CC(=O)CN(C)C MCULE-8956665596 [0,2,0,0,0,0|1,0,1]=4 945 B11R0.1 CCOC(=O)CC(N)CC(C)C MCULE-8386000655 [0,2,0,0,0,0|0,0,2]=4 946 B11R0.1 CCOC(=O)CC(N)CC(C)C MCULE-9263963058 [0,2,0,0,0,0|0,0,2]=4 947 B11R0.1 CCOC(=O)CC(O)CC(C)C MCULE-3681036810 [0,2,0,0,0,0|0,0,2]=4 948 B11R0.1 CCOC(=O)NC(=O)CC(=O)C MCULE-5467026441 [0,2,0,0,0,0|1,0,1]=4 949 B11R0.177 C=C(C(=O)OCC)C(=O)OCC MCULE-5039132795 [0,2,0,0,0,0|1,0,0]=3 950 B11R0.177 CCCC(=O)C(C)C(=O)OCC MCULE-7516501427 [0,2,0,0,0,0|0,0,1]=3 951 B11R0.177 CCCC(=O)C(Cl)C(=O)OCC MCULE-1745688970 [0,2,0,0,0,0|0,0,1]=3 952 B11R0.177 CCOC(=O)C(=O)C(=O)OCC MCULE-5765984476 [0,2,0,0,0,0|1,0,0]=3 953 B11R0.177 CCOC(=O)C(Br)C(=O)OCC MCULE-6155474654 [0,2,0,0,0,0|1,0,1]=4 954 B11R0.177 CCOC(=O)C(C)C(=O)OCC MCULE-2534634993 [0,2,0,0,0,0|1,0,1]=4 955 B11R0.177 CCOC(=O)C(Cl)C(=O)OCC MCULE-7689614221 [0,2,0,0,0,0|1,0,1]=4 956 B11R0.177 CCOC(=O)C(F)C(=O)OCC MCULE-9368393150 [0,2,0,0,0,0|1,0,1]=4 957 B11R0.177 CCOC(=O)C(N)C(=O)OCC MCULE-1941458958 [0,2,0,0,0,0|1,0,1]=4 958 B11R0.177 CCOC(=O)C(N)C(=O)OCC MCULE-6067313718 [0,2,0,0,0,0|1,0,1]=4 959 B11R0.177 CCOC(=O)C(O)C(=O)OCC MCULE-1700693177 [0,2,0,0,0,0|1,0,1]=4 960 B11R0.182 CCCC(CC)CC(=O)OCC MCULE-4166129159 [0,2,0,0,0,0|0,0,2]=4 961 B11R0.182 CCOC(=O)C=C(CBr)OCC MCULE-9427166800 [0,2,0,0,0,0|1,0,0]=3 962 B11R0.182 CCOC(=O)C=C(CCl)OCC MCULE-5673773620 [0,2,0,0,0,0|1,0,0]=3 963 B11R0.187 CCOC(=O)C=C(N)C(=O)NC MCULE-4521156390 [0,2,0,0,0,0|1,0,1]=4 964 B11R0.187 CCOC(=O)CC(=O)C(Br)CC MCULE-9280415225 [0,2,0,0,0,0|0,0,1]=3 965 B11R0.187 CCOC(=O)CC(=O)C(C)CC MCULE-1128254320 [0,2,0,0,0,0|0,0,1]=3 966 B11R0.353 CCCC(F)(F)CC(=O)OCC MCULE-8497066785 [0,2,0,0,0,0|0,0,2]=4 967 B11R0.59 CCOC(=O)C(=O)/C=C/N(C)C MCULE-7885783781 [0,2,0,0,0,0|1,0,1]=4 968 B11R0.59 CCOC(=O)C(=O)/C=N/C(C)C MCULE-7440640667 [0,2,0,0,0,0|1,0,0]=3 969 B11R0.59 CCOC(=O)C(=O)C=CN(C)C MCULE-3508488432 [0,2,0,0,0,0|1,0,1]=4 970 B11R0.59 CCOC(=O)C(=O)CCC(C)C MCULE-6372484335 [0,2,0,0,0,0|0,0,1]=3 971 B11R0.59 CCOC(=O)C(=O)NCC(=O)C MCULE-1436916696 [0,2,0,0,0,0|1,0,1]=4 972 B11R0.59 CCOC(=O)C(=O)NCC(C)C MCULE-5612658405 [0,2,0,0,0,0|1,0,0]=3 973 B11R0.141 CCOC(=O)CCC(N)C(C)C MCULE-4590441756 [0,2,0,0,0,0|0,0,2]=4 974 B11R0.141 CCOC(=O)CCC(N)C(C)C MCULE-5488552127 [0,2,0,0,0,0|0,0,2]=4 975 B11R0.141 CCOC(=O)CC[C@@H](N)C(C)C MCULE-3313095016 [0,2,0,0,0,0|0,0,2]=4 976 B11R0.141 CCOC(=O)CC[C@@H](N)C(C)C MCULE-5804567104 [0,2,0,0,0,0|0,0,2]=4 977 B11R0.141 CCOC(=O)CC[C@H](N)C(C)C MCULE-2397063913 [0,2,0,0,0,0|0,0,2]=4 978 B11R0.141 CCOC(=O)CC[C@H](N)C(C)C MCULE-5542689073 [0,2,0,0,0,0|0,0,2]=4 979 B11R0.180 CCOC(=O)/C=C/CC(F)(F)F MCULE-7932913303 [0,2,0,0,0,0|1,0,0]=3 980 B11R0.180 CCOC(=O)CCCC(C)(C)C MCULE-1861999091 [0,2,0,0,0,0|0,0,2]=4 981 B11R0.165 CCCCCC(=O)OC(C)(C)C MCULE-2750801375 [0,2,0,0,0,0|0,0,2]=4 982 B11R0.165 CCCNCC(=O)OC(C)(C)C MCULE-9242866024 [0,2,0,0,0,0|1,0,1]=4 983 B11R0.165 CCO/C=C/C(=O)OC(C)(C)C MCULE-5888195286 [0,2,0,0,0,0|1,0,0]=3 984 B11R0.11 CCCNC(=O)C(=O)NCCC MCULE-9586791204 [0,2,0,0,0,0|2,0,0]=4 985 B11R0.11 CCCNC(=O)C(=O)NCCO MCULE-7328064928 [0,2,0,0,0,0|2,0,0]=4 986 B11R0.11 CCCOC(=O)C(=O)OCCC MCULE-6621348751 [0,2,0,0,0,0|1,0,0]=3 987 B11R0.43 CCOC(=O)C(=O)CC(=O)CC MCULE-7503341598 [0,2,0,0,0,0|0,0,2]=4 988 B11R0.43 CCOC(=O)C(=O)NC(C)CC MCULE-7241285801 [0,2,0,0,0,0|1,0,0]=3 989 B11R0.43 CCOC(=O)C(N)CC(C)CC MCULE-4805179368 [0,2,0,0,0,0|0,0,2]=4 990 B11R0.191 CCCC=C(C#N)C(=O)OCC MCULE-6892816836 [0,2,0,0,0,0|0,0,0]=2 991 B11R0.191 CCCCC(C#N)C(=O)OCC MCULE-1166635943 [0,2,0,0,0,0|0,0,2]=4 992 B11R0.191 CCCCC(CC)C(=O)OCC MCULE-2605373518 [0,2,0,0,0,0|0,0,2]=4 993 B11R0.191 CCCCC(CN)C(=O)OCC MCULE-1000947252 [0,2,0,0,0,0|0,0,2]=4 994 B11R0.191 CCCNC(CC)C(=O)OCC MCULE-8021574427 [0,2,0,0,0,0|1,0,1]=4 995 B11R0.191 CCCNC(CC)C(=O)OCC MCULE-9789732039 [0,2,0,0,0,0|1,0,1]=4 996 B11R0.191 CCO/C=C(/C#N)\C(=O)OCC MCULE-4851653495 [0,2,0,0,0,0|1,0,0]=3 997 B11R0.191 CCO/C=C(\C#N)/C(=O)OCC MCULE-4879129047 [0,2,0,0,0,0|1,0,0]=3 998 B11R0.191 CCOC=C(C#N)C(=O)OCC MCULE-1978305439 [0,2,0,0,0,0|1,0,0]=3 999 B11R0.247 CCCCC(C)(C)C(=O)OCC MCULE-5129863144 [0,2,0,0,0,0|0,0,2]=4 1000 B11R0.247 CCCCC(F)(F)C(=O)OCC MCULE-6628469877 [0,2,0,0,0,0|0,0,2]=4 1001 B11R0.80 CCC/C=C/C(OCC)OCC MCULE-4291739185 [0,2,0,0,0,0|0,0,2]=4 1002 B11R0.80 CCCC=CC(OCC)OCC MCULE-9680838444 [0,2,0,0,0,0|0,0,2]=4 1003 B11R0.46 CCCCCC(=O)OCC(C)C MCULE-1038002118 [0,2,0,0,0,0|0,0,2]=4 1004 B11R0.140 C/C=C/C=C/C(=O)OCCCC MCULE-7596477709 [0,2,0,0,0,0|0,0,2]=4 1005 B11R0.140 CC=CC=CC(=O)OCCCC MCULE-6356312398 [0,2,0,0,0,0|0,0,2]=4 1006 B11R0.140 CCC=CCC(=O)OCCCC MCULE-9849455435 [0,2,0,0,0,0|0,0,2]=4 1007 B11R0.140 CCCCCC(=O)OCCCC MCULE-7438606212 [0,2,0,0,0,0|0,0,2]=4 1008 B11R0.140 CCCCOC(=O)OCCCC MCULE-2535127433 [0,2,0,0,0,0|1,0,1]=4 1009 B11R0.9 CCOC(=O)/C=C/C(OC)OC MCULE-3055059197 [0,2,0,0,0,0|1,0,0]=3 1010 B11R0.9 CCOC(=O)C=CC(OC)OC MCULE-7915706291 [0,2,0,0,0,0|1,0,0]=3 1011 B11R0.9 CCOC(=O)C=CN(CC)CC MCULE-6125043302 [0,2,0,0,0,0|1,0,0]=3 1012 B9R1.2 CCC1=CC(=O)CCC1 MCULE-3934640256 [1,0,0,1,0,0|1,0,0]=3 1013 B9R1.2 CCC1CCCC(=O)C1 MCULE-2309757845 [1,0,0,1,0,0|1,0,1]=4 1014 B9R1.2 CCC1CCCC(=O)N1 MCULE-7034650517 [1,0,0,1,0,0|2,0,0]=4 1015 B9R1.2 CCC1CCNC(=O)C1 MCULE-7827721769 [1,0,0,1,0,0|1,0,1]=4 1016 B9R1.2 CC[C@@H]1CCCC(=O)C1 MCULE-3781767777 [1,0,0,1,0,0|1,0,1]=4 1017 B9R1.2 CC[C@H]1CCCC(=O)C1 MCULE-5055612080 [1,0,0,1,0,0|1,0,1]=4 1018 B9R1.2 COC1=CC(=O)CCC1 MCULE-7315684808 [1,0,0,1,0,0|2,0,0]=4 1019 B9R1.2 O=C1C=C(CCO1)CO MCULE-1101464960 [1,0,0,1,0,0|1,0,0]=3 1020 B9R1.8 CCOC1=NCCCC1 MCULE-7930041125 [1,0,0,1,0,0|1,0,1]=4 1021 B9R1.12 CCCCC1=NCCO1 MCULE-6606126914 [1,0,0,1,0,0|1,0,1]=4 1022 B9R1.15 CCC1CCCCC1=O MCULE-2493543558 [1,0,0,1,0,0|1,0,1]=4 1023 B9R1.15 CCC1CCCNC1=O MCULE-9899311713 [1,0,0,1,0,0|2,0,0]=4 1024 B9R1.15 CCC1CCCOC1=O MCULE-7711682964 [1,0,0,1,0,0|2,0,0]=4 1025 B9R1.15 CCN1CCCNC1=O MCULE-6927699575 [1,0,0,1,0,0|2,0,0]=4 1026 B9R1.27 CCC1C(=O)NCC1C MCULE-6984020668 [1,0,0,1,0,0|2,0,0]=4 1027 B9R1.33 CCCC1CCCC1=O MCULE-6186440440 [1,0,0,1,0,0|1,0,1]=4 1028 B9R1.33 CCCN1CCCC1=O MCULE-4645322719 [1,0,0,1,0,0|2,0,0]=4 1029 B9R1.33 CCSC1CCOC1=O MCULE-2036311028 [1,0,0,1,0,0|1,0,1]=4 1030 B9R1.33 NCCN1CCOC1=O MCULE-2249111154 [1,0,0,1,0,0|2,0,0]=4 1031 B9R1.33 NCCN1CCOC1=O MCULE-5564763400 [1,0,0,1,0,0|2,0,0]=4 1032 B9R1.33 O=C1OCCC1CCBr MCULE-8450575724 [1,0,0,1,0,0|1,0,1]=4 1033 B9R1.33 O=C1OCCN1CCBr MCULE-7101781971 [1,0,0,1,0,0|2,0,0]=4 1034 B9R1.33 O=C1OCCN1CCCl MCULE-4112525203 [1,0,0,1,0,0|2,0,0]=4 1035 B9R1.33 O=C1OCCN1CCO MCULE-9126918441 [1,0,0,1,0,0|2,0,0]=4 1036 B9R1.48 CC1CCCCC(=O)C1 MCULE-5791948972 [1,0,0,1,0,0|1,0,1]=4 1037 B9R1.48 CC1CCCCC(=O)N1 MCULE-8985894348 [1,0,0,1,0,0|1,0,1]=4 1038 B9R1.49 CC1CCCC(=O)CC1 MCULE-8026581790 [1,0,0,1,0,0|1,0,1]=4 1039 B9R1.49 CC1CCNC(=O)CC1 MCULE-4158970437 [1,0,0,1,0,0|1,0,1]=4 1040 B9R1.50 BrC1=CCCCCCC1 MCULE-5795272491 [1,0,0,1,0,0|2,0,0]=4 1041 B9R1.50 BrC1=CCCCCCC1 MCULE-6505985509 [1,0,0,1,0,0|2,0,0]=4 1042 B9R1.50 O=C1C=CCCCCC1 MCULE-8923461119 [1,0,0,1,0,0|1,0,0]=3 1043 B9R1.50 O=C1CCCCCCC1 MCULE-1352803313 [1,0,0,1,0,0|1,0,1]=4 1044 B9R1.50 O=C1CCCCCCN1 MCULE-4051743080 [1,0,0,1,0,0|1,0,1]=4 1045 B9R1.50 O=C1CCCCCCO1 MCULE-5149380112 [1,0,0,1,0,0|0,0,1]=3 1046 B9R1.50 O=C1NCCCCCN1 MCULE-7237090911 [1,0,0,1,0,0|2,0,0]=4 1047 B9R1.69 CC1CCC(=O)CC1C MCULE-5304188182 [1,0,0,1,0,0|1,0,1]=4 1048 B9R1.73 CCCC(=O)C1CCC1 MCULE-2367300877 [1,0,0,1,0,0|1,0,1]=4 1049 B9R1.73 CCNC(=O)C1CCC1 MCULE-3367663751 [1,0,0,1,0,0|1,0,1]=4 1050 B9R1.73 CCOC(=N)C1CCC1 MCULE-1701816329 [1,0,0,1,0,0|1,0,1]=4 1051 B9R1.73 CCOC(=N)C1CCC1 MCULE-2263383572 [1,0,0,1,0,0|1,0,1]=4 1052 B9R1.73 CCOC(=O)C1CCC1 MCULE-2074507123 [1,0,0,1,0,0|0,0,1]=3 1053 B9R1.73 CCOC(=O)C1CCN1 MCULE-2154170730 [1,0,0,1,0,0|1,0,1]=4 1054 B9R1.73 CCOC(=O)C1CCN1 MCULE-9650503817 [1,0,0,1,0,0|1,0,1]=4 1055 B9R1.73 CCOC(=O)C1CNC1 MCULE-2002633512 [1,0,0,1,0,0|1,0,1]=4 1056 B9R1.73 CCOC(=O)C1CNC1 MCULE-5876184955 [1,0,0,1,0,0|1,0,1]=4 1057 B9R1.73 CCOC(=O)C1COC1 MCULE-6651672783 [1,0,0,1,0,0|1,0,1]=4 1058 B9R1.73 CCOC(=O)[C@@H]1CCN1 MCULE-1229649824 [1,0,0,1,0,0|1,0,1]=4 1059 B9R1.73 CCOC(=O)[C@@H]1CCN1 MCULE-1578041771 [1,0,0,1,0,0|1,0,1]=4 1060 B9R1.73 CCOC(=O)[C@@H]1CCN1 MCULE-9890639333 [1,0,0,1,0,0|1,0,1]=4 1061 B9R1.75 CCOC(=O)C=C1CC1 MCULE-5440757168 [1,0,0,1,0,0|0,0,0]=2 1062 B9R1.75 CCOC(=O)CC1CC1 MCULE-9024556716 [1,0,0,1,0,0|0,0,1]=3 1063 B9R1.75 CCOC(=O)CC1CO1 MCULE-5041196331 [1,0,0,1,0,0|1,0,1]=4 1064 B9R1.75 CCOC(=O)C[C@@H]1CO1 MCULE-1826398861 [1,0,0,1,0,0|1,0,1]=4 1065 B9R1.75 CCOC(=O)NC1CC1 MCULE-3717404078 [1,0,0,1,0,0|1,0,0]=3 1066 B9R1.100 CCCNC(=O)C1CC1 MCULE-8406372716 [1,0,0,1,0,0|2,0,0]=4 1067 B9R1.183 CCOC(=O)C1CC1Br MCULE-4913940963 [1,0,0,1,0,0|1,0,1]=4 1068 B9R1.183 CCOC(=O)C1CC1C MCULE-6519430807 [1,0,0,1,0,0|0,0,1]=3 1069 B9R1.183 CCOC(=O)C1CC1F MCULE-3123741278 [1,0,0,1,0,0|1,0,1]=4 1070 B9R1.183 CCOC(=O)C1CC1N MCULE-7903771143 [1,0,0,1,0,0|1,0,1]=4 1071 B9R1.183 CCOC(=O)[C@@H]1C[C@@H]1F MCULE-2485566056 [1,0,0,1,0,0|1,0,1]=4 1072 B9R1.183 CCOC(=O)[C@@H]1C[C@@H]1F MCULE-9125601352 [1,0,0,1,0,0|1,0,1]=4 1073 B9R1.183 CCOC(=O)[C@@H]1C[C@@H]1N MCULE-1652009668 [1,0,0,1,0,0|1,0,1]=4 1074 B9R1.183 CCOC(=O)[C@@H]1C[C@H]1Br MCULE-4605217848 [1,0,0,1,0,0|1,0,1]=4 1075 B9R1.183 CCOC(=O)[C@@H]1C[C@H]1F MCULE-6893582073 [1,0,0,1,0,0|1,0,1]=4 1076 B9R1.183 CCOC(=O)[C@@H]1C[C@H]1N MCULE-5572905674 [1,0,0,1,0,0|1,0,1]=4 1077 B9R1.183 CCOC(=O)[C@@H]1O[C@@H]1C MCULE-8324482372 [1,0,0,1,0,0|1,0,1]=4 1078 B9R1.183 CCOC(=O)[C@@H]1O[C@H]1C MCULE-8977844733 [1,0,0,1,0,0|1,0,1]=4 1079 B9R1.183 CCOC(=O)[C@H]1C[C@@H]1N MCULE-5022190919 [1,0,0,1,0,0|1,0,1]=4 1080 B9R1.183 CCOC(=O)[C@H]1C[C@H]1Br MCULE-1948805727 [1,0,0,1,0,0|1,0,1]=4 1081 B9R1.183 CCOC(=O)[C@H]1C[C@H]1F MCULE-4561276454 [1,0,0,1,0,0|1,0,1]=4 1082 B9R1.183 CCOC(=O)[C@H]1C[C@H]1F MCULE-8065432187 [1,0,0,1,0,0|1,0,1]=4 1083 B9R1.183 CCOC(=O)[C@H]1C[C@H]1N MCULE-2532829337 [1,0,0,1,0,0|1,0,1]=4 1084 B9R1.1 CCC1CCC(=O)CC1 MCULE-4419010963 [1,0,0,1,0,0|0,0,2]=4 1085 B9R1.3 CC1CCCC(=O)C1C MCULE-1705022712 [1,0,0,1,0,0|0,0,2]=4 1086 B9R1.11 CCC(=O)C1=NCCC1 MCULE-4283707985 [1,0,0,1,0,0|1,0,0]=3 1087 B9R1.11 CCC(=O)C1=NCCS1 MCULE-9042053227 [1,0,0,1,0,0|2,0,0]=4 1088 B9R1.11 CCC(=O)C1CCCC1 MCULE-4431631098 [1,0,0,1,0,0|0,0,2]=4 1089 B9R1.11 CCC(=O)[C@@H]1CCCN1 MCULE-1661804964 [1,0,0,1,0,0|1,0,1]=4 1090 B9R1.11 CCC(=O)[C@@H]1CCCN1 MCULE-8456135152 [1,0,0,1,0,0|1,0,1]=4 1091 B9R1.11 COC(=O)C1=CCCC1 MCULE-3606282792 [1,0,0,1,0,0|0,0,0]=2 1092 B9R1.11 COC(=O)C1=CCSC1 MCULE-2255227686 [1,0,0,1,0,0|1,0,0]=3 1093 B9R1.11 COC(=O)C1=COCC1 MCULE-7180516511 [1,0,0,1,0,0|1,0,0]=3 1094 B9R1.11 COC(=O)C1CCCC1 MCULE-6212031690 [1,0,0,1,0,0|0,0,2]=4 1095 B9R1.11 COC(=O)C1CCCN1 MCULE-3132842932 [1,0,0,1,0,0|1,0,1]=4 1096 B9R1.11 COC(=O)C1CCCN1 MCULE-5268897425 [1,0,0,1,0,0|1,0,1]=4 1097 B9R1.11 COC(=O)C1CCCN1 MCULE-6168730709 [1,0,0,1,0,0|1,0,1]=4 1098 B9R1.11 COC(=O)C1CCCN1 MCULE-8316785654 [1,0,0,1,0,0|1,0,1]=4 1099 B9R1.11 COC(=O)C1CCCO1 MCULE-2538391455 [1,0,0,1,0,0|1,0,1]=4 1100 B9R1.11 COC(=O)C1CCCS1 MCULE-8875125328 [1,0,0,1,0,0|1,0,1]=4 1101 B9R1.11 COC(=O)N1CCCC1 MCULE-1240116216 [1,0,0,1,0,0|1,0,1]=4 1102 B9R1.11 COC(=O)[C@@H]1CCCN1 MCULE-1981658590 [1,0,0,1,0,0|1,0,1]=4 1103 B9R1.11 COC(=O)[C@@H]1CCCN1 MCULE-6907716746 [1,0,0,1,0,0|1,0,1]=4 1104 B9R1.11 COC(=O)[C@@H]1CCCN1 MCULE-8031793722 [1,0,0,1,0,0|1,0,1]=4 1105 B9R1.11 COC(=O)[C@@H]1CCCN1 MCULE-9787777328 [1,0,0,1,0,0|1,0,1]=4 1106 B9R1.11 COC(=O)[C@H]1CCCN1 MCULE-1925865650 [1,0,0,1,0,0|1,0,1]=4 1107 B9R1.11 COC(=O)[C@H]1CCCN1 MCULE-3950222089 [1,0,0,1,0,0|1,0,1]=4 1108 B9R1.11 COC(=O)[C@H]1CCCN1 MCULE-4251030243 [1,0,0,1,0,0|1,0,1]=4 1109 B9R1.11 COC(=O)[C@H]1CCCN1 MCULE-8974101732 [1,0,0,1,0,0|1,0,1]=4 1110 B9R1.11 O=C(NO)C1=CCCC1 MCULE-3789818826 [1,0,0,1,0,0|2,0,0]=4 1111 B9R1.21 CCC1=CC=C(N1)CC MCULE-1056958054 [1,0,0,1,0,0|1,0,1]=4 1112 B9R1.21 CCC1=CC=C(O1)CC MCULE-4867442821 [1,0,0,1,0,0|0,0,2]=4 1113 B9R1.21 CCC1=CC=C(S1)CC MCULE-7354262914 [1,0,0,1,0,0|0,1,1]=4 1114 B9R1.21 CCC1=NN(C=C1)CC MCULE-1260135084 [1,0,0,1,0,0|2,0,0]=4 1115 B9R1.79 COC(=O)C=C1CCC1 MCULE-7476214558 [1,0,0,1,0,0|0,0,0]=2 1116 B9R1.79 COC(=O)C=C1COC1 MCULE-1345836806 [1,0,0,1,0,0|1,0,0]=3 1117 B9R1.79 COC(=O)C=C1CSC1 MCULE-6325683340 [1,0,0,1,0,0|1,0,0]=3 1118 B9R1.79 COC(=O)CC1CCC1 MCULE-7297223119 [1,0,0,1,0,0|0,0,2]=4 1119 B9R1.80 COC(=O)/C=C/C1CC1 MCULE-1092004421 [1,0,0,1,0,0|0,0,0]=2 1120 B9R1.80 COC(=O)C#CC1CC1 MCULE-2423537926 [1,0,0,1,0,0|0,0,2]=4 1121 B9R1.80 COC(=O)C=CC1CC1 MCULE-6495899864 [1,0,0,1,0,0|0,0,0]=2 1122 B9R1.80 COC(=O)CNC1CC1 MCULE-9357505044 [1,0,0,1,0,0|1,0,1]=4 1123 B9R1.80 COC(=O)CNC1CC1 MCULE-9589370378 [1,0,0,1,0,0|1,0,1]=4 1124 B11R1.16 C1(CCCNC1)C(=O)OCC MCULE-7218455020 [0,1,0,1,0,0|0,0,2]=4 1125 B11R1.16 CCOC(=O)C1=CCCNC1 MCULE-2494881503 [0,1,0,1,0,0|0,0,0]=2 1126 B11R1.16 CCOC(=O)C1=CCCNC1 MCULE-9977440197 [0,1,0,1,0,0|0,0,0]=2 1127 B11R1.16 CCOC(=O)C1=CCCOC1 MCULE-5684493828 [0,1,0,1,0,0|0,0,0]=2 1128 B11R1.16 CCOC(=O)C1=CCNCC1 MCULE-3550900853 [0,1,0,1,0,0|0,0,0]=2 1129 B11R1.16 CCOC(=O)C1=CCNCC1 MCULE-6019226182 [0,1,0,1,0,0|0,0,0]=2 1130 B11R1.16 CCOC(=O)C1=CNCCC1 MCULE-9071812580 [0,1,0,1,0,0|0,0,0]=2 1131 B11R1.16 CCOC(=O)C1=CNCCS1 MCULE-6640913067 [0,1,0,1,0,0|1,0,0]=3 1132 B11R1.16 CCOC(=O)C1=COCCC1 MCULE-8401522266 [0,1,0,1,0,0|0,0,0]=2 1133 B11R1.16 CCOC(=O)C1C=NCCS1 MCULE-6887232678 [0,1,0,1,0,0|1,0,1]=4 1134 B11R1.16 CCOC(=O)C1CC=CCC1 MCULE-1210480263 [0,1,0,1,0,0|0,0,2]=4 1135 B11R1.16 CCOC(=O)C1CCC=CO1 MCULE-7499289285 [0,1,0,1,0,0|0,0,2]=4 1136 B11R1.16 CCOC(=O)C1CCCCC1 MCULE-9489706932 [0,1,0,1,0,0|0,0,2]=4 1137 B11R1.16 CCOC(=O)C1CCCCN1 MCULE-3387848530 [0,1,0,1,0,0|0,0,2]=4 1138 B11R1.16 CCOC(=O)C1CCCCN1 MCULE-6852631244 [0,1,0,1,0,0|0,0,2]=4 1139 B11R1.16 CCOC(=O)C1CCCCN1 MCULE-7008895744 [0,1,0,1,0,0|0,0,2]=4 1140 B11R1.16 CCOC(=O)C1CCCCN1 MCULE-8548542082 [0,1,0,1,0,0|0,0,2]=4 1141 B11R1.16 CCOC(=O)C1CCCCO1 MCULE-6947775878 [0,1,0,1,0,0|0,0,2]=4 1142 B11R1.16 CCOC(=O)C1CCCNC1 MCULE-3675023359 [0,1,0,1,0,0|0,0,2]=4 1143 B11R1.16 CCOC(=O)C1CCCNC1 MCULE-4746135984 [0,1,0,1,0,0|0,0,2]=4 1144 B11R1.16 CCOC(=O)C1CCCNC1 MCULE-8856518925 [0,1,0,1,0,0|0,0,2]=4 1145 B11R1.16 CCOC(=O)C1CCCOC1 MCULE-7996513426 [0,1,0,1,0,0|0,0,2]=4 1146 B11R1.16 CCOC(=O)C1CCNCC1 MCULE-1027841713 [0,1,0,1,0,0|0,0,2]=4 1147 B11R1.16 CCOC(=O)C1CCNCC1 MCULE-4502754234 [0,1,0,1,0,0|0,0,2]=4 1148 B11R1.16 CCOC(=O)C1CCOCC1 MCULE-6838508341 [0,1,0,1,0,0|0,0,2]=4 1149 B11R1.16 CCOC(=O)C1CNCCN1 MCULE-2206886293 [0,1,0,1,0,0|1,0,1]=4 1150 B11R1.16 CCOC(=O)C1CNCCN1 MCULE-6219416292 [0,1,0,1,0,0|1,0,1]=4 1151 B11R1.16 CCOC(=O)C1CNCCO1 MCULE-3813416121 [0,1,0,1,0,0|1,0,1]=4 1152 B11R1.16 CCOC(=O)C1CNCCO1 MCULE-4556889516 [0,1,0,1,0,0|1,0,1]=4 1153 B11R1.16 CCOC(=O)C1CNCCO1 MCULE-7807962708 [0,1,0,1,0,0|1,0,1]=4 1154 B11R1.16 CCOC(=O)C1CNCCS1 MCULE-5596720547 [0,1,0,1,0,0|1,0,1]=4 1155 B11R1.16 CCOC(=O)C1CNCCS1 MCULE-7516167282 [0,1,0,1,0,0|1,0,1]=4 1156 B11R1.16 CCOC(=O)C1COCCN1 MCULE-4544792215 [0,1,0,1,0,0|1,0,1]=4 1157 B11R1.16 CCOC(=O)C1COCCN1 MCULE-5098841572 [0,1,0,1,0,0|1,0,1]=4 1158 B11R1.16 CCOC(=O)C1COCCN1 MCULE-7977008329 [0,1,0,1,0,0|1,0,1]=4 1159 B11R1.16 CCOC(=O)C1COCCN1 MCULE-8786998804 [0,1,0,1,0,0|1,0,1]=4 1160 B11R1.16 CCOC(=O)C1CSCCN1 MCULE-5092594438 [0,1,0,1,0,0|1,0,1]=4 1161 B11R1.16 CCOC(=O)C1CSCCN1 MCULE-5956138488 [0,1,0,1,0,0|1,0,1]=4 1162 B11R1.16 CCOC(=O)C1OCCCO1 MCULE-9864156382 [0,1,0,1,0,0|1,0,1]=4 1163 B11R1.16 CCOC(=O)C1SCCCS1 MCULE-4987840430 [0,1,0,1,0,0|1,0,1]=4 1164 B11R1.16 CCOC(=O)N1C=CCCC1 MCULE-2782539090 [0,1,0,1,0,0|0,0,0]=2 1165 B11R1.16 CCOC(=O)N1CCCCC1 MCULE-9100997547 [0,1,0,1,0,0|0,0,2]=4 1166 B11R1.16 CCOC(=O)N1CCNCC1 MCULE-3621512585 [0,1,0,1,0,0|1,0,1]=4 1167 B11R1.16 CCOC(=O)N1CCOCC1 MCULE-2835623669 [0,1,0,1,0,0|1,0,1]=4 1168 B11R1.16 CCOC(=O)[C@@H]1CCC=CO1 MCULE-9101599393 [0,1,0,1,0,0|0,0,2]=4 1169 B11R1.16 CCOC(=O)[C@@H]1CCCCN1 MCULE-1748361632 [0,1,0,1,0,0|0,0,2]=4 1170 B11R1.16 CCOC(=O)[C@@H]1CCCCN1 MCULE-2693297322 [0,1,0,1,0,0|0,0,2]=4 1171 B11R1.16 CCOC(=O)[C@@H]1CCCCN1 MCULE-5302379375 [0,1,0,1,0,0|0,0,2]=4 1172 B11R1.16 CCOC(=O)[C@@H]1CCCCN1 MCULE-6361807016 [0,1,0,1,0,0|0,0,2]=4 1173 B11R1.16 CCOC(=O)[C@@H]1CCCNC1 MCULE-1359008002 [0,1,0,1,0,0|0,0,2]=4 1174 B11R1.16 CCOC(=O)[C@@H]1CCCNC1 MCULE-3017848023 [0,1,0,1,0,0|0,0,2]=4 1175 B11R1.16 CCOC(=O)[C@@H]1CCCNC1 MCULE-3626074988 [0,1,0,1,0,0|0,0,2]=4 1176 B11R1.16 CCOC(=O)[C@@H]1CCCNC1 MCULE-4968733918 [0,1,0,1,0,0|0,0,2]=4 1177 B11R1.16 CCOC(=O)[C@@H]1CCCNC1 MCULE-8465407593 [0,1,0,1,0,0|0,0,2]=4 1178 B11R1.16 CCOC(=O)[C@@H]1CCCNC1 MCULE-9622641716 [0,1,0,1,0,0|0,0,2]=4 1179 B11R1.16 CCOC(=O)[C@@H]1COCCN1 MCULE-3192032854 [0,1,0,1,0,0|1,0,1]=4 1180 B11R1.16 CCOC(=O)[C@@H]1COCCN1 MCULE-3475970595 [0,1,0,1,0,0|1,0,1]=4 1181 B11R1.16 CCOC(=O)[C@@H]1COCCN1 MCULE-6499252353 [0,1,0,1,0,0|1,0,1]=4 1182 B11R1.16 CCOC(=O)[C@@H]1COCCN1 MCULE-9799550356 [0,1,0,1,0,0|1,0,1]=4 1183 B11R1.16 CCOC(=O)[C@H]1CCCCN1 MCULE-1831173115 [0,1,0,1,0,0|0,0,2]=4 1184 B11R1.16 CCOC(=O)[C@H]1CCCCN1 MCULE-3506778792 [0,1,0,1,0,0|0,0,2]=4 1185 B11R1.16 CCOC(=O)[C@H]1CCCCN1 MCULE-4098494223 [0,1,0,1,0,0|0,0,2]=4 1186 B11R1.16 CCOC(=O)[C@H]1CCCCN1 MCULE-7328799091 [0,1,0,1,0,0|0,0,2]=4 1187 B11R1.16 CCOC(=O)[C@H]1CCCNC1 MCULE-2736748797 [0,1,0,1,0,0|0,0,2]=4 1188 B11R1.16 CCOC(=O)[C@H]1CCCNC1 MCULE-3698900770 [0,1,0,1,0,0|0,0,2]=4 1189 B11R1.16 CCOC(=O)[C@H]1CCCNC1 MCULE-6641118890 [0,1,0,1,0,0|0,0,2]=4 1190 B11R1.16 CCOC(=O)[C@H]1CCCNC1 MCULE-7157160072 [0,1,0,1,0,0|0,0,2]=4 1191 B11R1.16 CCOC(=O)[C@H]1CCCNC1 MCULE-7599426784 [0,1,0,1,0,0|0,0,2]=4 1192 B11R1.16 CCOC(=O)[C@H]1CCCNC1 MCULE-9165782492 [0,1,0,1,0,0|0,0,2]=4 1193 B11R1.16 CCOC(=O)[C@H]1CNCCO1 MCULE-2826637726 [0,1,0,1,0,0|1,0,1]=4 1194 B11R1.16 CCOC(=O)[C@H]1CNCCO1 MCULE-5977561991 [0,1,0,1,0,0|1,0,1]=4 1195 B11R1.16 CCOC(=O)[C@H]1CNCCO1 MCULE-9147321196 [0,1,0,1,0,0|1,0,1]=4 1196 B11R1.16 CCOC(=O)[C@H]1CNCCO1 MCULE-9852355835 [0,1,0,1,0,0|1,0,1]=4 1197 B11R1.16 N1CCCC(C1)C(=O)OCC MCULE-7955165183 [0,1,0,1,0,0|0,0,2]=4 1198 B11R1.24 CCCCC1=CC(=O)CCC1 MCULE-9500356684 [0,1,0,1,0,0|1,0,0]=3 1199 B11R1.30 CCOC(=O)/C=C\1/CCNC1 MCULE-1201234748 [0,1,0,1,0,0|0,0,0]=2 1200 B11R1.30 CCOC(=O)/C=C\1/CCNC1 MCULE-6253274076 [0,1,0,1,0,0|0,0,0]=2 1201 B11R1.30 CCOC(=O)C=C1CCCC1 MCULE-7811515870 [0,1,0,1,0,0|0,0,0]=2 1202 B11R1.30 CCOC(=O)C=C1CCNC1 MCULE-3577381412 [0,1,0,1,0,0|0,0,0]=2 1203 B11R1.30 CCOC(=O)CC1C=CCC1 MCULE-1441581580 [0,1,0,1,0,0|0,0,2]=4 1204 B11R1.30 CCOC(=O)CC1CCCC1 MCULE-2844673391 [0,1,0,1,0,0|0,0,2]=4 1205 B11R1.30 CCOC(=O)CC1CCCN1 MCULE-5947811140 [0,1,0,1,0,0|0,0,2]=4 1206 B11R1.30 CCOC(=O)CC1CCCN1 MCULE-7326766201 [0,1,0,1,0,0|0,0,2]=4 1207 B11R1.30 CCOC(=O)CC1CCCO1 MCULE-6422962356 [0,1,0,1,0,0|0,0,2]=4 1208 B11R1.30 CCOC(=O)CC1CCNC1 MCULE-1123765721 [0,1,0,1,0,0|0,0,2]=4 1209 B11R1.30 CCOC(=O)CC1CCNC1 MCULE-5502932086 [0,1,0,1,0,0|0,0,2]=4 1210 B11R1.30 CCOC(=O)CC1CCOC1 MCULE-3816959960 [0,1,0,1,0,0|0,0,2]=4 1211 B11R1.30 CCOC(=O)CN1CCCC1 MCULE-6950382542 [0,1,0,1,0,0|0,0,2]=4 1212 B11R1.30 CCOC(=O)C[C@H]1CCNC1 MCULE-1209534740 [0,1,0,1,0,0|0,0,2]=4 1213 B11R1.30 CCOC(=O)C[C@H]1CCNC1 MCULE-2515107565 [0,1,0,1,0,0|0,0,2]=4 1214 B11R1.30 CCOC(=O)C[C@H]1CCNC1 MCULE-4863211163 [0,1,0,1,0,0|0,0,2]=4 1215 B11R1.30 CCOC(=O)C[C@H]1CCNC1 MCULE-5115028770 [0,1,0,1,0,0|0,0,2]=4 1216 B11R1.107 O=C1CCCCCCC(=O)O1 MCULE-6826256328 [0,1,0,1,0,0|2,0,0]=4 1217 B11R1.110 CCOC1=CC(=O)NCCC1 MCULE-2422351248 [0,1,0,1,0,0|2,0,0]=4 1218 B11R1.180 CCCCC=C1CCCC1=O MCULE-3061361246 [0,1,0,1,0,0|1,0,0]=3 1219 B11R1.199 CCOC(=O)C1=C(C=CN1)C MCULE-2421285074 [0,1,0,1,0,0|0,0,2]=4 1220 B11R1.199 CCOC(=O)C1=C(C=CO1)C MCULE-1038316547 [0,1,0,1,0,0|0,0,2]=4 1221 B11R1.199 CCOC(=O)C1=C(C=CS1)C MCULE-8441897168 [0,1,0,1,0,0|0,0,2]=4 1222 B11R1.199 CCOC(=O)C1=C(CCC1)N MCULE-4791177664 [0,1,0,1,0,0|0,0,0]=2 1223 B11R1.199 CCOC(=O)C1=C(N=CO1)C MCULE-6527200738 [0,1,0,1,0,0|1,0,1]=4 1224 B11R1.199 CCOC(=O)C1=C(N=CS1)C MCULE-2534053947 [0,1,0,1,0,0|1,0,1]=4 1225 B11R1.199 CCOC(=O)C1=C(NC=C1)C MCULE-1724082384 [0,1,0,1,0,0|0,0,2]=4 1226 B11R1.199 CCOC(=O)C1=C(NC=N1)C MCULE-1021181130 [0,1,0,1,0,0|1,0,1]=4 1227 B11R1.199 CCOC(=O)C1=C(NN=C1)C MCULE-3719608129 [0,1,0,1,0,0|1,0,1]=4 1228 B11R1.199 CCOC(=O)C1=C(OC=C1)C MCULE-1307039775 [0,1,0,1,0,0|0,0,2]=4 1229 B11R1.199 CCOC(=O)C1=C(OC=N1)C MCULE-1363421074 [0,1,0,1,0,0|1,0,1]=4 1230 B11R1.199 CCOC(=O)C1=C(ON=C1)C MCULE-4222113835 [0,1,0,1,0,0|1,0,1]=4 1231 B11R1.199 CCOC(=O)C1=C(SC=C1)C MCULE-1010932990 [0,1,0,1,0,0|0,0,2]=4 1232 B11R1.199 CCOC(=O)C1=C(SC=N1)C MCULE-3999692352 [0,1,0,1,0,0|1,0,1]=4 1233 B11R1.199 CCOC(=O)C1=CC=CN1C MCULE-1349103997 [0,1,0,1,0,0|0,0,2]=4 1234 B11R1.199 CCOC(=O)C1=CC=NN1C MCULE-7228376978 [0,1,0,1,0,0|1,0,1]=4 1235 B11R1.199 CCOC(=O)C1=CN=CN1C MCULE-2139996936 [0,1,0,1,0,0|1,0,1]=4 1236 B11R1.199 CCOC(=O)C1=CNC=C1C MCULE-5868735974 [0,1,0,1,0,0|0,0,2]=4 1237 B11R1.199 CCOC(=O)C1=CON=C1C MCULE-8787011253 [0,1,0,1,0,0|1,0,1]=4 1238 B11R1.199 CCOC(=O)C1=CSN=C1C MCULE-5104260784 [0,1,0,1,0,0|1,0,1]=4 1239 B11R1.199 CCOC(=O)C1=NC=CN1C MCULE-7061185987 [0,1,0,1,0,0|1,0,1]=4 1240 B11R1.199 CCOC(=O)C1=NC=NN1C MCULE-1356814676 [0,1,0,1,0,0|2,0,0]=4 1241 B11R1.199 CCOC(=O)C1CCCC1=N MCULE-2329553083 [0,1,0,1,0,0|0,0,1]=3 1242 B11R1.199 CCOC(=O)C1CCCC1=O MCULE-9312844968 [0,1,0,1,0,0|0,0,1]=3 1243 B11R1.199 CCOC(=O)C1CCCC1N MCULE-4744440276 [0,1,0,1,0,0|0,0,2]=4 1244 B11R1.199 CCOC(=O)C1CCCC1N MCULE-9857282632 [0,1,0,1,0,0|0,0,2]=4 1245 B11R1.199 CCOC(=O)C1CCCC1O MCULE-9155260134 [0,1,0,1,0,0|0,0,2]=4 1246 B11R1.199 CCOC(=O)C1CCNC1=O MCULE-2474310630 [0,1,0,1,0,0|1,0,1]=4 1247 B11R1.199 CCOC(=O)C1CCNC1C MCULE-1824974216 [0,1,0,1,0,0|0,0,2]=4 1248 B11R1.199 CCOC(=O)C1CCOC1=O MCULE-8719926744 [0,1,0,1,0,0|1,0,1]=4 1249 B11R1.199 CCOC(=O)C1CNCC1=O MCULE-2182845067 [0,1,0,1,0,0|1,0,1]=4 1250 B11R1.199 CCOC(=O)C1CNCC1=O MCULE-9860947823 [0,1,0,1,0,0|1,0,1]=4 1251 B11R1.199 CCOC(=O)C1CNCC1C MCULE-8063603247 [0,1,0,1,0,0|0,0,2]=4 1252 B11R1.199 CCOC(=O)C1COCC1=O MCULE-3396435313 [0,1,0,1,0,0|1,0,1]=4 1253 B11R1.199 CCOC(=O)C1CSCC1=O MCULE-9271955839 [0,1,0,1,0,0|1,0,1]=4 1254 B11R1.199 CCOC(=O)C1NCCC1C MCULE-2070726860 [0,1,0,1,0,0|0,0,2]=4 1255 B11R1.199 CCOC(=O)C1NCCC1N MCULE-1964554174 [0,1,0,1,0,0|1,0,1]=4 1256 B11R1.199 CCOC(=O)C1NCCC1N MCULE-9592027718 [0,1,0,1,0,0|1,0,1]=4 1257 B11R1.199 CCOC(=O)[C@@H]1CCC[C@@H]1N MCULE-4132662846 [0,1,0,1,0,0|0,0,2]=4 1258 B11R1.199 CCOC(=O)[C@@H]1CCC[C@@H]1N MCULE-5969287271 [0,1,0,1,0,0|0,0,2]=4 1259 B11R1.199 CCOC(=O)[C@@H]1CCC[C@@H]1N MCULE-6169423843 [0,1,0,1,0,0|0,0,2]=4 1260 B11R1.199 CCOC(=O)[C@@H]1CCC[C@@H]1N MCULE-9324644701 [0,1,0,1,0,0|0,0,2]=4 1261 B11R1.199 CCOC(=O)[C@@H]1CCC[C@@H]1O MCULE-1732093217 [0,1,0,1,0,0|0,0,2]=4 1262 B11R1.199 CCOC(=O)[C@@H]1CCC[C@@H]1O MCULE-2867532959 [0,1,0,1,0,0|0,0,2]=4 1263 B11R1.199 CCOC(=O)[C@@H]1CCC[C@H]1N MCULE-2186277279 [0,1,0,1,0,0|0,0,2]=4 1264 B11R1.199 CCOC(=O)[C@@H]1CCC[C@H]1N MCULE-3939519217 [0,1,0,1,0,0|0,0,2]=4 1265 B11R1.199 CCOC(=O)[C@@H]1CCC[C@H]1N MCULE-5751284317 [0,1,0,1,0,0|0,0,2]=4 1266 B11R1.199 CCOC(=O)[C@@H]1CCC[C@H]1N MCULE-7151904075 [0,1,0,1,0,0|0,0,2]=4 1267 B11R1.199 CCOC(=O)[C@@H]1CCC[C@H]1N MCULE-8585923007 [0,1,0,1,0,0|0,0,2]=4 1268 B11R1.199 CCOC(=O)[C@@H]1CCC[C@H]1O MCULE-1459601802 [0,1,0,1,0,0|0,0,2]=4 1269 B11R1.199 CCOC(=O)[C@@H]1CCC[C@H]1O MCULE-6974814890 [0,1,0,1,0,0|0,0,2]=4 1270 B11R1.199 CCOC(=O)[C@@H]1CCNC1=O MCULE-6649415490 [0,1,0,1,0,0|1,0,1]=4 1271 B11R1.199 CCOC(=O)[C@@H]1CCN[C@@H]1C MCULE-2354452497 [0,1,0,1,0,0|0,0,2]=4 1272 B11R1.199 CCOC(=O)[C@@H]1CCN[C@H]1C MCULE-5969475192 [0,1,0,1,0,0|0,0,2]=4 1273 B11R1.199 CCOC(=O)[C@@H]1CNC[C@H]1C MCULE-7965699372 [0,1,0,1,0,0|0,0,2]=4 1274 B11R1.199 CCOC(=O)[C@@H]1NCC[C@@H]1C MCULE-1666171700 [0,1,0,1,0,0|0,0,2]=4 1275 B11R1.199 CCOC(=O)[C@@H]1NCC[C@@H]1C MCULE-7247848958 [0,1,0,1,0,0|0,0,2]=4 1276 B11R1.199 CCOC(=O)[C@@H]1NCC[C@@H]1O MCULE-5773156171 [0,1,0,1,0,0|1,0,1]=4 1277 B11R1.199 CCOC(=O)[C@@H]1NCC[C@H]1C MCULE-6177092493 [0,1,0,1,0,0|0,0,2]=4 1278 B11R1.199 CCOC(=O)[C@@H]1NCC[C@H]1O MCULE-4055670433 [0,1,0,1,0,0|1,0,1]=4 1279 B11R1.199 CCOC(=O)[C@H]1CCC[C@@H]1N MCULE-3601767113 [0,1,0,1,0,0|0,0,2]=4 1280 B11R1.199 CCOC(=O)[C@H]1CCC[C@@H]1N MCULE-6957813411 [0,1,0,1,0,0|0,0,2]=4 1281 B11R1.199 CCOC(=O)[C@H]1CCC[C@H]1N MCULE-1305947087 [0,1,0,1,0,0|0,0,2]=4 1282 B11R1.199 CCOC(=O)[C@H]1CCC[C@H]1N MCULE-1727343030 [0,1,0,1,0,0|0,0,2]=4 1283 B11R1.199 CCOC(=O)[C@H]1CCC[C@H]1N MCULE-3606897920 [0,1,0,1,0,0|0,0,2]=4 1284 B11R1.199 CCOC(=O)[C@H]1CCC[C@H]1N MCULE-4139911354 [0,1,0,1,0,0|0,0,2]=4 1285 B11R1.199 CCOC(=O)[C@H]1CCC[C@H]1N MCULE-4274273299 [0,1,0,1,0,0|0,0,2]=4 1286 B11R1.199 CCOC(=O)[C@H]1CCC[C@H]1N MCULE-4654939022 [0,1,0,1,0,0|0,0,2]=4 1287 B11R1.199 CCOC(=O)[C@H]1CCN[C@@H]1C MCULE-5767802234 [0,1,0,1,0,0|0,0,2]=4 1288 B11R1.199 CCOC(=O)[C@H]1CCN[C@H]1C MCULE-2196272727 [0,1,0,1,0,0|0,0,2]=4 1289 B11R1.199 CCOC(=O)[C@H]1CNC[C@@H]1C MCULE-1336913244 [0,1,0,1,0,0|0,0,2]=4 1290 B11R1.199 CCOC(=O)[C@H]1CNC[C@@H]1C MCULE-2896751298 [0,1,0,1,0,0|0,0,2]=4 1291 B11R1.199 CCOC(=O)[C@H]1NCCC1N MCULE-2293563970 [0,1,0,1,0,0|1,0,1]=4 1292 B11R1.199 CCOC(=O)[C@H]1NCCC1N MCULE-8168827259 [0,1,0,1,0,0|1,0,1]=4 1293 B11R1.199 CCOC(=O)[C@H]1NCC[C@@H]1C MCULE-9098112527 [0,1,0,1,0,0|0,0,2]=4 1294 B11R1.199 CCOC(=O)[C@H]1NCC[C@H]1C MCULE-4833931996 [0,1,0,1,0,0|0,0,2]=4 1295 B11R1.199 CCOC(=O)[C@H]1NCC[C@H]1C MCULE-8712554117 [0,1,0,1,0,0|0,0,2]=4 1296 B11R1.288 CCOC(=O)C=CC1OC1C MCULE-1126587814 [0,1,0,1,0,0|0,0,0]=2 1297 B11R1.289 CCOC(=O)/C=C/C1CCC1 MCULE-3685223647 [0,1,0,1,0,0|0,0,0]=2 1298 B11R1.289 CCOC(=O)C#CC1COC1 MCULE-9718646874 [0,1,0,1,0,0|0,0,2]=4 1299 B11R1.289 CCOC(=O)C=CC1CCC1 MCULE-7861856483 [0,1,0,1,0,0|0,0,0]=2 1300 B11R1.289 CCOC(=O)CCC1CCC1 MCULE-8865347499 [0,1,0,1,0,0|0,0,2]=4 1301 B11R1.289 CCOC(=O)CCN1CCC1 MCULE-7384324736 [0,1,0,1,0,0|0,0,2]=4 1302 B11R1.289 CCOC(=O)CNC1CCC1 MCULE-7494502106 [0,1,0,1,0,0|0,0,2]=4 1303 B11R1.290 CCOC(=O)CCNC1CC1 MCULE-3399465340 [0,1,0,1,0,0|0,0,2]=4 1304 B11R1.290 CCOC(=O)CNCC1CC1 MCULE-8908855539 [0,1,0,1,0,0|0,0,2]=4 1305 B11R1.290 CCOC(=O)COCC1CC1 MCULE-9684603130 [0,1,0,1,0,0|0,0,2]=4 1306 B11R1.34 CCOC1=CC(=O)CC(C1)C MCULE-1404411359 [0,1,0,1,0,0|1,0,0]=3 1307 B11R1.201 CCOC(=O)CC1CC(C1)O MCULE-9838310446 [0,1,0,1,0,0|0,0,2]=4 1308 B11R1.201 [C@@H]1(C[C@@H](C1)CC(=O)OCC)O MCULE-8785786432 [0,1,0,1,0,0|0,0,2]=4 1309 B11R1.201 [C@@H]1(C[C@H](C1)CC(=O)OCC)O MCULE-1148813365 [0,1,0,1,0,0|0,0,2]=4 1310 B11R1.334 CCOC(=O)CC(=O)C1CC1 MCULE-7797350812 [0,1,0,1,0,0|0,0,1]=3 1311 B11R1.334 CCOC(=O)CC(N)C1CC1 MCULE-4985681736 [0,1,0,1,0,0|0,0,2]=4 1312 B11R1.334 CCOC(=O)CC(N)C1CC1 MCULE-5321912386 [0,1,0,1,0,0|0,0,2]=4 1313 B11R1.334 CCOC(=O)CC(O)C1CC1 MCULE-2153454761 [0,1,0,1,0,0|0,0,2]=4 1314 B11R1.840 CCOC(=O)CC1(CCC1)F MCULE-5914451214 [0,1,0,1,0,0|0,0,2]=4 1315 B11R1.840 CCOC(=O)CC1(CCC1)N MCULE-2219607686 [0,1,0,1,0,0|0,0,2]=4 1316 B11R1.840 CCOC(=O)CC1(CCC1)O MCULE-7706569331 [0,1,0,1,0,0|0,0,2]=4 1317 B11R1.15 CCOC(=O)C1=CC(=O)CC1 MCULE-5046245234 [0,1,0,1,0,0|0,0,1]=3 1318 B11R1.15 CCOC(=O)C1=CC=C(N1)C MCULE-1774226284 [0,1,0,1,0,0|0,0,2]=4 1319 B11R1.15 CCOC(=O)C1=CC=C(O1)C MCULE-3346853980 [0,1,0,1,0,0|0,0,2]=4 1320 B11R1.15 CCOC(=O)C1=CC=C(S1)C MCULE-3765062359 [0,1,0,1,0,0|0,0,2]=4 1321 B11R1.15 CCOC(=O)C1=CCC(C1)N MCULE-1092619547 [0,1,0,1,0,0|0,0,0]=2 1322 B11R1.15 CCOC(=O)C1=CCC(C1)N MCULE-4562555606 [0,1,0,1,0,0|0,0,0]=2 1323 B11R1.15 CCOC(=O)C1=CN(C=C1)C MCULE-9526276740 [0,1,0,1,0,0|1,0,1]=4 1324 B11R1.15 CCOC(=O)C1=CN(N=C1)C MCULE-5145947381 [0,1,0,1,0,0|2,0,0]=4 1325 B11R1.15 CCOC(=O)C1=CN=C(O1)C MCULE-7360159194 [0,1,0,1,0,0|1,0,1]=4 1326 B11R1.15 CCOC(=O)C1=CN=C(S1)C MCULE-7927588772 [0,1,0,1,0,0|1,0,1]=4 1327 B11R1.15 CCOC(=O)C1=CNC(=C1)C MCULE-8419128359 [0,1,0,1,0,0|1,0,1]=4 1328 B11R1.15 CCOC(=O)C1=CNC(=N1)C MCULE-3910243966 [0,1,0,1,0,0|1,0,1]=4 1329 B11R1.15 CCOC(=O)C1=COC(=C1)C MCULE-5250351251 [0,1,0,1,0,0|1,0,1]=4 1330 B11R1.15 CCOC(=O)C1=COC(=N1)C MCULE-6690431960 [0,1,0,1,0,0|1,0,1]=4 1331 B11R1.15 CCOC(=O)C1=CSC(=N1)C MCULE-9962588046 [0,1,0,1,0,0|1,0,1]=4 1332 B11R1.15 CCOC(=O)C1=NN(C=C1)C MCULE-1288818696 [0,1,0,1,0,0|1,0,1]=4 1333 B11R1.15 CCOC(=O)C1CC(CN1)C MCULE-3875172966 [0,1,0,1,0,0|1,0,1]=4 1334 B11R1.15 CCOC(=O)C1CC(CN1)C MCULE-4042846078 [0,1,0,1,0,0|1,0,1]=4 1335 B11R1.15 CCOC(=O)C1CC(CN1)F MCULE-5288164254 [0,1,0,1,0,0|1,0,1]=4 1336 B11R1.15 CCOC(=O)C1CC(CN1)O MCULE-5538690539 [0,1,0,1,0,0|1,0,1]=4 1337 B11R1.15 CCOC(=O)C1CC(CO1)O MCULE-8930811806 [0,1,0,1,0,0|1,0,1]=4 1338 B11R1.15 CCOC(=O)C1CCC(C1)F MCULE-2013179429 [0,1,0,1,0,0|0,0,2]=4 1339 B11R1.15 CCOC(=O)C1CCC(C1)N MCULE-5526949759 [0,1,0,1,0,0|0,0,2]=4 1340 B11R1.15 CCOC(=O)C1CCC(C1)N MCULE-7663378947 [0,1,0,1,0,0|0,0,2]=4 1341 B11R1.15 CCOC(=O)C1CCC(C1)O MCULE-6096775153 [0,1,0,1,0,0|0,0,2]=4 1342 B11R1.15 CCOC(=O)N1CCC(C1)N MCULE-2824871045 [0,1,0,1,0,0|1,0,1]=4 1343 B11R1.15 CCOC(=O)N1CCC(C1)N MCULE-6830025483 [0,1,0,1,0,0|1,0,1]=4 1344 B11R1.15 CCOC(=O)[C@@H]1CC[C@@H](C1)N MCULE-1718691646 [0,1,0,1,0,0|0,0,2]=4 1345 B11R1.15 CCOC(=O)[C@@H]1CC[C@@H](C1)N MCULE-7986492324 [0,1,0,1,0,0|0,0,2]=4 1346 B11R1.15 CCOC(=O)[C@@H]1CC[C@@H](N1)C MCULE-2046219360 [0,1,0,1,0,0|0,0,2]=4 1347 B11R1.15 CCOC(=O)[C@@H]1CC[C@@H](N1)C MCULE-5191078810 [0,1,0,1,0,0|0,0,2]=4 1348 B11R1.15 CCOC(=O)[C@@H]1CC[C@@H](N1)C MCULE-8247267024 [0,1,0,1,0,0|0,0,2]=4 1349 B11R1.15 CCOC(=O)[C@@H]1C[C@H](CN1)C MCULE-5865491518 [0,1,0,1,0,0|1,0,1]=4 1350 B11R1.15 CCOC(=O)[C@@H]1C[C@H](CN1)C MCULE-7667159720 [0,1,0,1,0,0|1,0,1]=4 1351 B11R1.15 CCOC(=O)[C@@H]1C[C@H](CN1)C MCULE-8052330663 [0,1,0,1,0,0|1,0,1]=4 1352 B11R1.15 CCOC(=O)[C@@H]1C[C@H](CN1)C MCULE-9681214021 [0,1,0,1,0,0|1,0,1]=4 1353 B11R1.15 CCOC(=O)[C@@H]1C[C@H](CN1)O MCULE-1347029109 [0,1,0,1,0,0|1,0,1]=4 1354 B11R1.15 CCOC(=O)[C@@H]1C[C@H](CN1)O MCULE-3430696999 [0,1,0,1,0,0|1,0,1]=4 1355 B11R1.15 CCOC(=O)[C@@H]1C[C@H](CN1)O MCULE-5862721976 [0,1,0,1,0,0|1,0,1]=4 1356 B11R1.15 CCOC(=O)[C@@H]1C[C@H](CN1)O MCULE-5966513116 [0,1,0,1,0,0|1,0,1]=4 1357 B11R1.15 CCOC(=O)[C@@H]1C[C@H](CN1)O MCULE-7220071114 [0,1,0,1,0,0|1,0,1]=4 1358 B11R1.15 CCOC(=O)[C@@H]1C[C@H](CN1)O MCULE-8522141762 [0,1,0,1,0,0|1,0,1]=4 1359 B11R1.15 CCOC(=O)[C@H]1C[C@@H](CN1)C MCULE-3522163045 [0,1,0,1,0,0|1,0,1]=4 1360 B11R1.15 CCOC(=O)[C@H]1C[C@@H](CN1)F MCULE-6715751434 [0,1,0,1,0,0|1,0,1]=4 1361 B11R1.15 CCOC(=O)[C@H]1C[C@@H](CN1)F MCULE-7008683187 [0,1,0,1,0,0|1,0,1]=4 1362 B11R1.15 CCOC(=O)[C@H]1C[C@@H](CN1)F MCULE-8131644663 [0,1,0,1,0,0|1,0,1]=4 1363 B11R1.15 [NH2+]1CC(CC1C(=O)OCC)O MCULE-6930432950 [0,1,0,1,0,0|1,0,1]=4 1364 B11R1.77 CC(C)OC(=O)[C@@H]1CCCN1 MCULE-1820411827 [0,1,0,1,0,0|1,0,1]=4 1365 B11R1.77 CC(C)OC(=O)[C@H]1CCCN1 MCULE-2054417002 [0,1,0,1,0,0|1,0,1]=4 1366 B11R1.77 CC(C)OC(=O)[C@H]1CCCN1 MCULE-3399993830 [0,1,0,1,0,0|1,0,1]=4 1367 B11R1.301 CCCC=CC(=O)NC1CC1 MCULE-7982447678 [0,1,0,1,0,0|1,0,0]=3 1368 B11R1.72 CCN1C(=O)C(=O)NC[C@H]1C MCULE-8024116989 [0,1,0,1,0,0|2,0,0]=4 1369 B11R1.185 CCOC1=NN(C=C1Br)CC MCULE-7240976506 [0,1,0,1,0,0|2,0,0]=4 1370 B11R1.185 CCOC1=NN(C=C1N)CC MCULE-2497588799 [0,1,0,1,0,0|2,0,0]=4 1371 B11R1.185 CCOC1=NN(C=C1N)CC MCULE-3934763181 [0,1,0,1,0,0|2,0,0]=4 1372 B11R1.349 CCOC(=O)C(=C1CCC1)C MCULE-6744761947 [0,1,0,1,0,0|0,0,0]=2 1373 B11R1.349 CCOC(=O)C(=C1COC1)C MCULE-6356720547 [0,1,0,1,0,0|1,0,0]=3 1374 B11R1.349 CCOC(=O)C(=O)C1CCC1 MCULE-5450769175 [0,1,0,1,0,0|0,0,1]=3 1375 B11R1.349 CCOC(=O)C(Br)C1CCC1 MCULE-6502193467 [0,1,0,1,0,0|0,0,2]=4 1376 B11R1.349 CCOC(=O)C(C)C1CCC1 MCULE-2720966590 [0,1,0,1,0,0|0,0,2]=4 1377 B11R1.349 CCOC(=O)C(N)C1CCC1 MCULE-3013347046 [0,1,0,1,0,0|0,0,2]=4 1378 B11R1.349 CCOC(=O)C(N)C1CCC1 MCULE-5103014293 [0,1,0,1,0,0|0,0,2]=4 1379 B11R1.351 CCOC(=O)/C(=C\C1CC1)/C MCULE-5165880667 [0,1,0,1,0,0|0,0,0]=2 1380 B11R1.351 CCOC(=O)C(=O)CC1CC1 MCULE-6434034556 [0,1,0,1,0,0|0,0,1]=3 1381 B11R1.351 CCOC(=O)C(=O)NC1CC1 MCULE-9960994917 [0,1,0,1,0,0|1,0,0]=3 1382 B11R1.351 CCOC(=O)C(N)CC1CC1 MCULE-9111044349 [0,1,0,1,0,0|0,0,2]=4 1383 B11R1.351 CCOC(=O)C(N)CC1CC1 MCULE-9333264999 [0,1,0,1,0,0|0,0,2]=4 1384 B11R1.819 CCOC(=O)C1(CCCC1)Br MCULE-6795532059 [0,1,0,1,0,0|0,0,2]=4 1385 B11R1.819 CCOC(=O)C1(CCCC1)C MCULE-3454924880 [0,1,0,1,0,0|0,0,2]=4 1386 B11R1.819 CCOC(=O)C1(CCCC1)N MCULE-2293395114 [0,1,0,1,0,0|0,0,2]=4 1387 B11R1.819 CCOC(=O)C1(CCCC1)N MCULE-3483813751 [0,1,0,1,0,0|0,0,2]=4 1388 B11R1.819 CCOC(=O)C1(CCCC1)O MCULE-9145127134 [0,1,0,1,0,0|0,0,2]=4 1389 B11R1.819 CCOC(=O)C1(CCCO1)C MCULE-1835403918 [0,1,0,1,0,0|1,0,1]=4 1390 B11R1.819 CCOC(=O)[C@@]1(CCCN1)C MCULE-9499721672 [0,1,0,1,0,0|1,0,1]=4 1391 B11R1.834 CCOC(=O)C1(CC1CC)N MCULE-5429816481 [0,1,0,1,0,0|0,0,2]=4 1392 B11R1.834 CCOC(=O)C1(CC1CC)N MCULE-7617822499 [0,1,0,1,0,0|0,0,2]=4 1393 B11R1.834 CCOC(=O)[C@]1(C[C@H]1CC)N MCULE-3287564047 [0,1,0,1,0,0|0,0,2]=4 1394 B11R1.834 CCOC(=O)[C@]1(C[C@H]1CC)N MCULE-9874290560 [0,1,0,1,0,0|0,0,2]=4 1395 B11R1.83 CCOC1=CC=C(C=C1)CC MCULE-6057980190 [0,1,0,1,0,0|1,0,1]=4 1396 B11R1.186 CCCC1=CC(=O)C(C1O)O MCULE-1671554697 [0,1,0,1,0,0|2,0,0]=4 1397 B11R1.280 CCC1OC(C=CC1=O)OC MCULE-9673180232 [0,1,0,1,0,0|2,0,0]=4 1398 B11R1.214 CCOCC1=NN(C=C1)CC MCULE-1090447824 [0,1,0,1,0,0|2,0,0]=4 1399 B11R1.465 CCCCC1=C(CCC1=O)C MCULE-3854801059 [0,1,0,1,0,0|1,0,1]=4 1400 B11R1.817 CCOC(=O)C1OC1(C)CC MCULE-3303591553 [0,1,0,1,0,0|1,0,1]=4 1401 B11R2.36 O=C1CNC2CCCC2O1 MCULE-1521022657 [0,0,0,2,0,0|1,0,1]=4 1402 B11R2.106 O=C1OCCC2C1NCC2 MCULE-3577635422 [0,0,0,2,0,0|1,0,1]=4 1403 B11R2.106 O=C1OCCC2C1NCC2 MCULE-9963938069 [0,0,0,2,0,0|1,0,1]=4 1404 B11R2.678 [C@H]12CCC[C@H](C1)NC(=O)O2 MCULE-1098666712 [0,0,0,2,0,0|1,0,1]=4 1405 B11R2.678 [C@H]12CCC[C@H](C1)OC(=O)N2 MCULE-2754928602 [0,0,0,2,0,0|1,0,1]=4 1406 B11R2.3 O=C1OCCC12CCCN2 MCULE-6180378660 [0,0,0,2,0,0|1,0,1]=4 1407 B11R2.3 O=C1OCCC12CCCN2 MCULE-8136172928 [0,0,0,2,0,0|1,0,1]=4 1408 B11R2.202 O=C1OC(=O)C2=C1CCC2 MCULE-6315971440 [0,0,0,2,0,0|1,0,1]=4 1409 B11R2.1 O=C1OCC2C1CCCC2 MCULE-3625572177 [0,0,0,2,0,0|0,0,2]=4 1410 B11R2.1 O=C1OCC2N1CCCC2 MCULE-7447605306 [0,0,0,2,0,0|1,0,1]=4 1411 B11R2.1 [C@H]12CCCC[C@H]1COC2=O MCULE-7096465884 [0,0,0,2,0,0|0,0,2]=4 1412 B11R2.10 O=C1C=C2CCCCC2C1 MCULE-4374730563 [0,0,0,2,0,0|1,0,0]=3 1413 B11R2.10 O=C1C=C2CNCCC2S1 MCULE-3124302392 [0,0,0,2,0,0|1,1,0]=4 1414 B11R2.10 O=C1C=C2CNCCC2S1 MCULE-3424771012 [0,0,0,2,0,0|1,1,0]=4 1415 B11R2.10 O=C1C=C2CNCC[C@@H]2S1 MCULE-3073696114 [0,0,0,2,0,0|1,1,0]=4 1416 B11R2.10 O=C1OC2CCCCC2O1 MCULE-7459022606 [0,0,0,2,0,0|1,0,1]=4 1417 B11R2.879 CCOC(=O)C1CC12CC2 MCULE-6512697507 [0,0,0,2,0,0|0,0,2]=4