0 B10R0.91 C#CCNC(=O)CCCCC MCULE-3006294888 [0,0,0,0,0,0|1,0,2]=3 1 B10R0.91 C#CCOC(=O)NCCCC MCULE-4022249643 [0,0,0,0,0,0|1,0,2]=3 2 B10R0.91 C=CCNC(=O)NCCCC MCULE-1893923308 [0,0,0,0,0,0|2,0,2]=4 3 B10R0.91 C=CCOC(=O)CCCCC MCULE-4870253803 [0,0,0,0,0,0|0,0,2]=2 4 B10R0.91 C=CCOC(=O)NCCCN MCULE-5470077010 [0,0,0,0,0,0|2,0,2]=4 5 B10R0.91 C=CCOC(=O)NCCCN MCULE-6309694810 [0,0,0,0,0,0|2,0,2]=4 6 B10R0.91 C=CCOC(=O)NCCCO MCULE-9189671280 [0,0,0,0,0,0|2,0,2]=4 7 B10R0.91 C=CCOC(=O)NCCNC MCULE-7204437968 [0,0,0,0,0,0|2,0,2]=4 8 B10R0.91 CCCCC(C)CCCCO MCULE-9256284581 [0,0,0,0,0,0|3,0,1]=4 9 B10R0.91 CCCCCC(=O)C=CC=O MCULE-7288937112 [0,0,0,0,0,0|2,0,2]=4 10 B10R0.91 CCCCCC(=O)CCCC MCULE-4876992287 [0,0,0,0,0,0|1,0,0]=1 11 B10R0.91 CCCCCC(=O)OCCC MCULE-7665514505 [0,0,0,0,0,0|0,0,0]=0 12 B10R0.91 CCCCCC(=O)OCCCl MCULE-2724708346 [0,0,0,0,0,0|1,0,0]=1 13 B10R0.91 CCCCCC(C)CCCO MCULE-6947023752 [0,0,0,0,0,0|3,0,1]=4 14 B10R0.91 CCCCCC(O)CCCC MCULE-4028571026 [0,0,0,0,0,0|1,0,2]=3 15 B10R0.91 CCCCCN(C)CCNC MCULE-3152752935 [0,0,0,0,0,0|4,0,0]=4 16 B10R0.91 CCCCC[C@@H](C)CCCC MCULE-6344602419 [0,0,0,0,0,0|2,0,1]=3 17 B10R0.91 CCCCC[C@H](O)CCCC MCULE-3767339379 [0,0,0,0,0,0|1,0,2]=3 18 B10R0.91 CCCCC[C@H](O)CCCC MCULE-8364286143 [0,0,0,0,0,0|1,0,2]=3 19 B10R0.91 CCCCNC(=N)NCCC MCULE-5837146549 [0,0,0,0,0,0|3,0,0]=3 20 B10R0.91 CCCCNC(=O)OCCO MCULE-9010578275 [0,0,0,0,0,0|2,0,0]=2 21 B10R0.91 CCCCNC(C)CCCC MCULE-1023082742 [0,0,0,0,0,0|3,0,1]=4 22 B10R0.91 CCCCOC(=O)CCCC MCULE-2693469456 [0,0,0,0,0,0|2,0,0]=2 23 B10R0.91 CCCCOC(=O)CCCN MCULE-3820011759 [0,0,0,0,0,0|3,0,0]=3 24 B10R0.91 CCCCOC(=O)CCCN MCULE-8110705234 [0,0,0,0,0,0|3,0,0]=3 25 B10R0.91 CCCCOC(=O)CCCO MCULE-6438752500 [0,0,0,0,0,0|3,0,0]=3 26 B10R0.91 CCCNCC(=O)NCCC MCULE-2310458557 [0,0,0,0,0,0|2,0,0]=2 27 B9R0.5 C#CCCCC(=O)OCC MCULE-7331649216 [1,0,0,0,0,0|0,0,2]=3 28 B9R0.5 C/C=C/C(=O)OCCCC MCULE-3981123215 [1,0,0,0,0,0|1,0,2]=4 29 B9R0.5 C=CCCCC(=O)OCC MCULE-6747714335 [1,0,0,0,0,0|0,0,2]=3 30 B9R0.5 C=CCNCC(=O)OCC MCULE-2486419841 [1,0,0,0,0,0|1,0,2]=4 31 B9R0.5 C=CCOCC(=O)OCC MCULE-4979218308 [1,0,0,0,0,0|1,0,2]=4 32 B9R0.5 C=COC(=O)CCCCC MCULE-9610448604 [1,0,0,0,0,0|0,0,2]=3 33 B9R0.5 CC/C=C/CC(=O)OCC MCULE-7234058677 [1,0,0,0,0,0|0,0,2]=3 34 B9R0.5 CC=CC(=O)OCCCC MCULE-5053011213 [1,0,0,0,0,0|1,0,2]=4 35 B9R0.5 CCC/C=C/C(=O)OCC MCULE-4832092410 [1,0,0,0,0,0|0,0,2]=3 36 B9R0.5 CCC=CCC(=O)OCC MCULE-2895347288 [1,0,0,0,0,0|0,0,2]=3 37 B9R0.5 CCCC#CC(=O)OCC MCULE-5376486364 [1,0,0,0,0,0|0,0,2]=3 38 B9R0.5 CCCC(=O)NCCSC MCULE-3226358337 [1,0,0,0,0,0|2,0,0]=3 39 B9R0.5 CCCC=CC(=O)OCC MCULE-6059990808 [1,0,0,0,0,0|0,0,2]=3 40 B9R0.5 CCCCCC(=O)CCC MCULE-5706146235 [1,0,0,0,0,0|0,0,0]=1 41 B9R0.5 CCCCCC(=O)OCC MCULE-5403677128 [1,0,0,0,0,0|0,0,0]=1 42 B9R0.5 CCCCCC(C)CCBr MCULE-7502279942 [1,0,0,0,0,0|2,0,1]=4 43 B9R0.5 CCCCCC(C)CCC MCULE-5749911992 [1,0,0,0,0,0|1,0,1]=3 44 B9R0.5 CCCCCC(C)CCO MCULE-6787638248 [1,0,0,0,0,0|2,0,1]=4 45 B9R0.5 CCCCCC(O)CCC MCULE-8117002289 [1,0,0,0,0,0|0,0,2]=3 46 B9R0.5 CCCCCC(O)CCO MCULE-7307683143 [1,0,0,0,0,0|1,0,2]=4 47 B9R0.5 CCCCNC(=O)CC#N MCULE-1413338131 [1,0,0,0,0,0|2,0,1]=4 48 B9R0.5 CCCCNC(=O)CCBr MCULE-1774001181 [1,0,0,0,0,0|2,0,0]=3 49 B9R0.5 CCCCNC(=O)CCC MCULE-7141834161 [1,0,0,0,0,0|1,0,0]=2 50 B9R0.5 CCCCNC(=O)CCN MCULE-2531611147 [1,0,0,0,0,0|2,0,0]=3 51 B9R0.5 CCCCNC(=O)CCN MCULE-7050182017 [1,0,0,0,0,0|2,0,0]=3 52 B9R0.5 CCCCNC(=O)CNC MCULE-1485408728 [1,0,0,0,0,0|2,0,0]=3 53 B9R0.5 CCCCNC(=O)CNC MCULE-6940946322 [1,0,0,0,0,0|2,0,0]=3 54 B9R0.5 CCCCNC(=O)NCC MCULE-3629972521 [1,0,0,0,0,0|2,0,0]=3 55 B9R0.5 CCCCNC(=O)OCC MCULE-8548277091 [1,0,0,0,0,0|1,0,0]=2 56 B9R0.5 CCCCOC(=O)CC#N MCULE-1510363972 [1,0,0,0,0,0|2,0,1]=4 57 B9R0.5 CCCCOC(=O)CCC MCULE-3979612740 [1,0,0,0,0,0|1,0,0]=2 58 B9R0.5 CCCCOC(=O)CCS MCULE-4889334808 [1,0,0,0,0,0|2,0,0]=3 59 B9R0.5 CCCCOC(=O)CON MCULE-1664882724 [1,0,0,0,0,0|3,0,0]=4 60 B9R0.5 CCCCOC(C)OCC MCULE-5544493274 [1,0,0,0,0,0|2,0,1]=4 61 B9R0.5 CCCNCC(=O)OCC MCULE-1614665340 [1,0,0,0,0,0|1,0,0]=2 62 B9R0.5 CCNC(=O)CCCCO MCULE-9325293372 [1,0,0,0,0,0|2,0,0]=3 63 B9R0.5 CCNC(=O)NCCCO MCULE-9582031605 [1,0,0,0,0,0|3,0,0]=4 64 B9R0.5 CCNCCC(=O)NCC MCULE-6441681901 [1,0,0,0,0,0|2,0,0]=3 65 B9R0.5 CCNCCC(=O)OCC MCULE-5511872214 [1,0,0,0,0,0|1,0,0]=2 66 B9R0.5 CCO/C=C/C(=O)OCC MCULE-1507361975 [1,0,0,0,0,0|1,0,2]=4 67 B9R0.5 CCO/N=C/C(=O)OCC MCULE-5936482731 [1,0,0,0,0,0|2,0,1]=4 68 B9R0.5 CCO/N=C/C(=O)OCC MCULE-6380511451 [1,0,0,0,0,0|2,0,1]=4 69 B9R0.5 CCOC(=N)CCCCBr MCULE-4651734827 [1,0,0,0,0,0|2,0,0]=3 70 B9R0.5 CCOC(=O)C=CCCBr MCULE-9357314783 [1,0,0,0,0,0|1,0,2]=4 71 B9R0.5 CCOC(=O)C=CCCO MCULE-2905144053 [1,0,0,0,0,0|1,0,2]=4 72 B9R0.5 CCOC(=O)CCCC#N MCULE-3543261727 [1,0,0,0,0,0|1,0,1]=3 73 B9R0.5 CCOC(=O)CCCC=O MCULE-3082074155 [1,0,0,0,0,0|1,0,1]=3 74 B9R0.5 CCOC(=O)CCCCBr MCULE-9188586817 [1,0,0,0,0,0|1,0,0]=2 75 B9R0.5 CCOC(=O)CCCCCl MCULE-8211485770 [1,0,0,0,0,0|1,0,0]=2 76 B9R0.5 CCOC(=O)CCCCI MCULE-9427602912 [1,0,0,0,0,0|1,0,0]=2 77 B9R0.5 CCOC(=O)CCCCN MCULE-3254365356 [1,0,0,0,0,0|1,0,0]=2 78 B9R0.5 CCOC(=O)CCCCN MCULE-6113178932 [1,0,0,0,0,0|1,0,0]=2 79 B9R0.5 CCOC(=O)CCCCO MCULE-3157415426 [1,0,0,0,0,0|1,0,0]=2 80 B9R0.5 CCOC(=O)CCN=C=O MCULE-3031378141 [1,0,0,0,0,0|2,0,1]=4 81 B9R0.5 CCOC(=O)CCN=C=S MCULE-7398251181 [1,0,0,0,0,0|2,0,1]=4 82 B9R0.5 CCOC(=O)CCN=N#N MCULE-7249809526 [1,0,0,0,0,0|3,0,0]=4 83 B9R0.5 CCOC(=O)CNCCN MCULE-5162250475 [1,0,0,0,0,0|2,0,0]=3 84 B9R0.5 CCOC(=O)CNCCN MCULE-6793281928 [1,0,0,0,0,0|2,0,0]=3 85 B9R0.5 CCOC(=O)COCCBr MCULE-4604862482 [1,0,0,0,0,0|2,0,0]=3 86 B9R0.5 CCOC(=O)COCCCl MCULE-9218281344 [1,0,0,0,0,0|2,0,0]=3 87 B9R0.5 CCOC(=O)COCCI MCULE-7705777158 [1,0,0,0,0,0|2,0,0]=3 88 B9R0.5 CCOC(=O)COCCN MCULE-7738890913 [1,0,0,0,0,0|2,0,0]=3 89 B9R0.5 CCOC(=O)COCCN MCULE-8436568303 [1,0,0,0,0,0|2,0,0]=3 90 B9R0.5 CCOC(=O)COCOC MCULE-9141216887 [1,0,0,0,0,0|2,0,0]=3 91 B9R0.5 CCOC(=O)CSCC#N MCULE-8300453649 [1,0,0,0,0,0|2,0,1]=4 92 B9R0.5 CCOC(=O)CSCCN MCULE-9316167874 [1,0,0,0,0,0|2,0,0]=3 93 B9R0.5 CCOC=CC(=O)OCC MCULE-6557988220 [1,0,0,0,0,0|1,0,2]=4 94 B9R0.5 CCOCCC(=O)OCC MCULE-8331611688 [1,0,0,0,0,0|1,0,0]=2 95 B9R0.5 CNCC(=O)NCCCO MCULE-5031724612 [1,0,0,0,0,0|3,0,0]=4 96 B9R0.5 CNCC(=O)NCCCO MCULE-6380131589 [1,0,0,0,0,0|3,0,0]=4 97 B9R0.5 CNCC(=O)NCCOC MCULE-1027964944 [1,0,0,0,0,0|3,0,0]=4 98 B9R0.5 CNCC(=O)NCCOC MCULE-5354979122 [1,0,0,0,0,0|3,0,0]=4 99 B9R0.5 COCCNC(=O)CCN MCULE-7739987456 [1,0,0,0,0,0|3,0,0]=4 100 B9R0.5 COCCNC(=O)CCN MCULE-7996276176 [1,0,0,0,0,0|3,0,0]=4 101 B9R0.5 NCCC(=O)NCCCO MCULE-1806258951 [1,0,0,0,0,0|3,0,0]=4 102 B9R0.5 NCCC(=O)NCCCO MCULE-8748864023 [1,0,0,0,0,0|3,0,0]=4 103 B9R0.18 C=CCOC(=O)CCCBr MCULE-8146290867 [1,0,0,0,0,0|1,0,2]=4 104 B9R0.18 CCCCC(=O)CCCC MCULE-6886826396 [1,0,0,0,0,0|1,0,0]=2 105 B9R0.18 CCCCC(=O)OCCC MCULE-9801353359 [1,0,0,0,0,0|0,0,0]=1 106 B9R0.18 CCCCC(C)CCCC MCULE-8127947187 [1,0,0,0,0,0|2,0,1]=4 107 B9R0.18 CCCCC(N)CCCC MCULE-6345811578 [1,0,0,0,0,0|2,0,1]=4 108 B9R0.18 CCCCC(O)CCCC MCULE-4443702940 [1,0,0,0,0,0|1,0,2]=4 109 B9R0.18 CCCCN(C)CCCC MCULE-3403478694 [1,0,0,0,0,0|3,0,0]=4 110 B9R0.18 CCCCP(=O)CCCC MCULE-5667541179 [1,0,0,0,0,0|2,0,0]=3 111 B9R0.18 CCCCS(=O)CCCC MCULE-7738371145 [1,0,0,0,0,0|2,0,0]=3 112 B9R0.18 CCCNC(=O)CCCCl MCULE-1473811039 [1,0,0,0,0,0|2,0,0]=3 113 B9R0.18 CCCNC(=O)NCCC MCULE-6353018646 [1,0,0,0,0,0|2,0,0]=3 114 B9R0.18 CCCNC(=S)NCCC MCULE-1162997436 [1,0,0,0,0,0|2,1,0]=4 115 B9R0.18 CCCOC(=O)OCCC MCULE-9166999585 [1,0,0,0,0,0|1,0,0]=2 116 B9R0.18 CCCOC(C)OCCC MCULE-5937479015 [1,0,0,0,0,0|2,0,1]=4 117 B9R0.18 CCCOP(O)OCCC MCULE-5332440386 [1,0,0,0,0,0|2,0,1]=4 118 B9R0.18 CCCOS(=O)OCCC MCULE-3361401597 [1,0,0,0,0,0|2,0,0]=3 119 B9R0.18 CCOCC(=O)NCCN MCULE-1190675248 [1,0,0,0,0,0|3,0,0]=4 120 B9R0.18 CCOCC(=O)NCCN MCULE-7659515529 [1,0,0,0,0,0|3,0,0]=4 121 B9R0.18 CCOCC(=O)NCCN MCULE-9688091053 [1,0,0,0,0,0|3,0,0]=4 122 B9R0.18 O=C(CCCCl)CCCCl MCULE-7659668518 [1,0,0,0,0,0|3,0,0]=4 123 B9R0.18 O=C(CCCO)NCCO MCULE-3037964082 [1,0,0,0,0,0|3,0,0]=4 124 B9R0.18 O=C(NCCCl)OCCCl MCULE-4847419924 [1,0,0,0,0,0|3,0,0]=4 125 B9R0.18 O=C(OCCCl)OCCCl MCULE-1847610200 [1,0,0,0,0,0|3,0,0]=4 126 B9R0.45 CCC#CCCCCCC MCULE-2394718279 [1,0,0,0,0,0|1,0,2]=4 127 B9R0.45 CCCC#CCCCCC MCULE-7200051907 [1,0,0,0,0,0|1,0,1]=3 128 B9R0.45 CCCC/C=C/CCCC MCULE-5215613168 [1,0,0,0,0,0|1,0,1]=3 129 B9R0.45 CCCC/C=C\CCCC MCULE-7961413462 [1,0,0,0,0,0|1,0,1]=3 130 B9R0.45 CCCCC#CCCCC MCULE-8619108623 [1,0,0,0,0,0|1,0,2]=4 131 B9R0.45 CCCCC/C=C\CCO MCULE-4434068395 [1,0,0,0,0,0|2,0,0]=3 132 B9R0.45 CCCCC=CCCCC MCULE-4261429100 [1,0,0,0,0,0|1,0,1]=3 133 B9R0.45 CCCCCC#CCCO MCULE-7189083538 [1,0,0,0,0,0|2,0,1]=4 134 B9R0.45 CCCCCC=CCCO MCULE-4969061256 [1,0,0,0,0,0|2,0,0]=3 135 B9R0.45 CCCCCCCCCBr MCULE-1405697483 [1,0,0,0,0,0|2,0,1]=4 136 B9R0.45 CCCCCCCCCC MCULE-6071426098 [1,0,0,0,0,0|1,0,1]=3 137 B9R0.45 CCCCCCCCCCl MCULE-6711902685 [1,0,0,0,0,0|2,0,1]=4 138 B9R0.45 CCCCCCCCCF MCULE-9584148452 [1,0,0,0,0,0|2,0,1]=4 139 B9R0.45 CCCCCCCCCI MCULE-8717337450 [1,0,0,0,0,0|2,0,1]=4 140 B9R0.45 CCCCCCCCCN MCULE-5395407299 [1,0,0,0,0,0|2,0,1]=4 141 B9R0.45 CCCCCCCCCO MCULE-4020281400 [1,0,0,0,0,0|2,0,1]=4 142 B9R0.45 CCCCCCCCCS MCULE-1070515106 [1,0,0,0,0,0|2,0,1]=4 143 B9R0.45 CCCCCCCCNC MCULE-6996288442 [1,0,0,0,0,0|2,0,1]=4 144 B9R0.45 CCCCCCCCOC MCULE-4646070035 [1,0,0,0,0,0|2,0,1]=4 145 B9R0.45 CCCCCCCCSC MCULE-5517176664 [1,0,0,0,0,0|2,0,1]=4 146 B9R0.45 CCCCCCCNCC MCULE-3055645322 [1,0,0,0,0,0|2,0,1]=4 147 B9R0.45 CCCCCCNCCN MCULE-2521807905 [1,0,0,0,0,0|2,0,1]=4 148 B9R0.45 CCCCCCNCCN MCULE-5886608711 [1,0,0,0,0,0|2,0,1]=4 149 B9R0.45 CCCCCCNCCO MCULE-6828996225 [1,0,0,0,0,0|2,0,1]=4 150 B9R0.45 CCCCCCNOCC MCULE-7230044709 [1,0,0,0,0,0|2,0,1]=4 151 B9R0.45 CCCCCCNOCC MCULE-8309226243 [1,0,0,0,0,0|2,0,1]=4 152 B9R0.45 CCCCCCOCCCl MCULE-5675234570 [1,0,0,0,0,0|1,0,1]=3 153 B9R0.45 CCCCCCOCCO MCULE-1339769602 [1,0,0,0,0,0|1,0,1]=3 154 B9R0.45 CCCCCCSCCO MCULE-3331753796 [1,0,0,0,0,0|1,1,1]=4 155 B9R0.45 CCCCCNCCCC MCULE-4324738465 [1,0,0,0,0,0|2,0,0]=3 156 B9R0.45 CCCCCNCCNC MCULE-3521145032 [1,0,0,0,0,0|3,0,0]=4 157 B9R0.45 CCCCCOCCCO MCULE-3048029561 [1,0,0,0,0,0|3,0,0]=4 158 B9R0.45 CCCCNCCCCO MCULE-1748671401 [1,0,0,0,0,0|3,0,0]=4 159 B9R0.45 CCCCNCCOCC MCULE-5585133594 [1,0,0,0,0,0|3,0,0]=4 160 B9R0.45 CCCCOCCCCO MCULE-1926189258 [1,0,0,0,0,0|3,0,0]=4 161 B9R0.45 CCCCSCCOCC MCULE-4700764338 [1,0,0,0,0,0|3,0,0]=4 162 B9R0.45 CCCCSSCCCC MCULE-5887157893 [1,0,0,0,0,0|3,0,0]=4 163 B9R0.45 CCCC[NH2+]CCCCCl MCULE-2045714641 [1,0,0,0,0,0|3,0,0]=4 164 B9R0.45 CCCC[NH2+]CCCCCl MCULE-2222567485 [1,0,0,0,0,0|3,0,0]=4 165 B9R0.45 CCCNCCCNCC MCULE-1018165528 [1,0,0,0,0,0|2,0,1]=4 166 B9R0.45 CCCNCCNCCC MCULE-7703644113 [1,0,0,0,0,0|2,0,1]=4 167 B9R0.45 CCCNCCOCCO MCULE-9598749389 [1,0,0,0,0,0|2,0,1]=4 168 B9R0.45 CCCOCCOCCCl MCULE-1639946093 [1,0,0,0,0,0|2,0,1]=4 169 B9R0.45 CCCOCCOCCO MCULE-8416880348 [1,0,0,0,0,0|2,0,1]=4 170 B9R0.45 [NH2+](CCCC)CCCCC MCULE-5314318531 [1,0,0,0,0,0|2,0,0]=3 171 B11R0.5 CCCCC(=O)CC(=O)OCC MCULE-4230578552 [0,1,0,0,0,0|2,0,1]=4 172 B11R0.5 CCCCC(C)CC(C)CCC MCULE-3160157562 [0,1,0,0,0,0|2,0,1]=4 173 B11R0.5 CCCCS(=O)CC(O)COC MCULE-8269765154 [0,1,0,0,0,0|3,0,0]=4 174 B11R0.11 C=CCOC(=O)[C@@H](N)CCSC MCULE-5823564209 [0,1,0,0,0,0|1,0,2]=4 175 B11R0.11 C=CCOC(=O)[C@@H](N)CCSC MCULE-7442118411 [0,1,0,0,0,0|1,0,2]=4 176 B11R0.11 C=CCOC(=O)[C@@H](N)CCSC MCULE-8729684781 [0,1,0,0,0,0|1,0,2]=4 177 B11R0.11 C=CCOC(=O)[C@@H](N)CCSC MCULE-9056107478 [0,1,0,0,0,0|1,0,2]=4 178 B11R0.11 CCCCC(=O)C(O)CCCC MCULE-4001361196 [0,1,0,0,0,0|1,0,0]=2 179 B11R0.11 CCCCC(=O)N(C)CCNC MCULE-7714140355 [0,1,0,0,0,0|3,0,0]=4 180 B11R0.11 CCCCC(O)C(O)CCCC MCULE-5819860758 [0,1,0,0,0,0|1,0,2]=4 181 B11R0.11 CCCNC(=O)C(=O)NCCC MCULE-9586791204 [0,1,0,0,0,0|2,0,1]=4 182 B11R0.11 CCCOC(=O)C(=O)OCCC MCULE-6621348751 [0,1,0,0,0,0|1,0,1]=3 183 B11R0.46 CCCCCC(=O)CCC(=O)O MCULE-5964650416 [0,1,0,0,0,0|2,0,1]=4 184 B11R0.46 CCCCCC(=O)NCC(=O)O MCULE-3960557642 [0,1,0,0,0,0|2,0,1]=4 185 B11R0.46 CCCCCC(=O)OCC(C)C MCULE-1038002118 [0,1,0,0,0,0|0,0,0]=1 186 B11R0.46 CCCCOC(=O)CCC(=O)C MCULE-7095079350 [0,1,0,0,0,0|2,0,1]=4 187 B11R0.81 C=C(CCCC)CCCCCC MCULE-1300928710 [0,1,0,0,0,0|2,0,0]=3 188 B11R0.81 C=CCOC(=O)CCCCCC MCULE-3528769589 [0,1,0,0,0,0|0,0,2]=3 189 B11R0.81 C=CCOC(=O)NCCCCN MCULE-2829122630 [0,1,0,0,0,0|1,0,2]=4 190 B11R0.81 C=CCOC(=O)NCCCCN MCULE-3149407077 [0,1,0,0,0,0|1,0,2]=4 191 B11R0.81 C=CCOC(=O)NCCCCO MCULE-7383999879 [0,1,0,0,0,0|1,0,2]=4 192 B11R0.81 CCCCCCC(=O)CCCC MCULE-3791343950 [0,1,0,0,0,0|1,0,0]=2 193 B11R0.81 CCCCCCC(=O)NCCO MCULE-7382167098 [0,1,0,0,0,0|2,0,0]=3 194 B11R0.81 CCCCCCC(=O)OCCC MCULE-6309887109 [0,1,0,0,0,0|0,0,0]=1 195 B11R0.81 CCCCCCC(C)OCCCl MCULE-5692239728 [0,1,0,0,0,0|2,0,1]=4 196 B11R0.81 CCCCCCC(C)OCCO MCULE-2974953071 [0,1,0,0,0,0|2,0,1]=4 197 B11R0.81 CCCCCCC(O)CCCC MCULE-1549907527 [0,1,0,0,0,0|1,0,2]=4 198 B11R0.81 CCCCCOC(=O)CCCC MCULE-4804815950 [0,1,0,0,0,0|1,0,0]=2 199 B11R0.81 CCCCS(=O)CCCCCO MCULE-1757503463 [0,1,0,0,0,0|2,0,0]=3 200 B11R0.81 NCCCCCC(=O)NCCO MCULE-1491906118 [0,1,0,0,0,0|2,0,0]=3 201 B11R0.81 O=C(CCCO)OCCCCCl MCULE-6327788570 [0,1,0,0,0,0|3,0,0]=4 202 B11R0.140 CCC=CCC(=O)OCCCC MCULE-9849455435 [0,1,0,0,0,0|0,0,2]=3 203 B11R0.140 CCCCCC(=O)CCCCC MCULE-5966055848 [0,1,0,0,0,0|1,0,0]=2 204 B11R0.140 CCCCCC(=O)OCCCC MCULE-7438606212 [0,1,0,0,0,0|0,0,0]=1 205 B11R0.140 CCCCCC(N)CCCCC MCULE-7357551566 [0,1,0,0,0,0|2,0,1]=4 206 B11R0.140 CCCCCC(O)CCCCC MCULE-6556320478 [0,1,0,0,0,0|1,0,2]=4 207 B11R0.140 CCCCCN(C)CCCCC MCULE-7558760842 [0,1,0,0,0,0|3,0,0]=4 208 B11R0.140 CCCCNC(=N)NCCCC MCULE-3404422959 [0,1,0,0,0,0|3,0,0]=4 209 B11R0.140 CCCCNC(=O)NCCCC MCULE-4175580584 [0,1,0,0,0,0|2,0,0]=3 210 B11R0.140 CCCCNC(=O)OC#CCI MCULE-6089634060 [0,1,0,0,0,0|1,0,2]=4 211 B11R0.140 CCCCNC(=O)OCC#CI MCULE-7832679591 [0,1,0,0,0,0|1,0,2]=4 212 B11R0.140 CCCCNC(=S)NCCCC MCULE-5273696075 [0,1,0,0,0,0|2,1,0]=4 213 B11R0.140 CCCCOC(=O)OCCCC MCULE-2535127433 [0,1,0,0,0,0|1,0,0]=2 214 B11R0.140 CCCCOC(C)OCCCC MCULE-9835180544 [0,1,0,0,0,0|2,0,1]=4 215 B11R0.140 CCCCOP(=O)OCCCC MCULE-2699825876 [0,1,0,0,0,0|2,0,0]=3 216 B11R0.140 CCCCOP(O)OCCCC MCULE-9191548043 [0,1,0,0,0,0|2,0,1]=4 217 B11R0.140 CCCCOS(=O)OCCCC MCULE-9194420119 [0,1,0,0,0,0|2,0,0]=3 218 B11R0.140 CCOCNC(=O)NCOCC MCULE-5984747846 [0,1,0,0,0,0|3,0,0]=4 219 B11R0.140 CCSCNC(=O)NCSCC MCULE-3054591856 [0,1,0,0,0,0|3,0,0]=4 220 B11R0.140 COCCOC(=O)OCCOC MCULE-1716902242 [0,1,0,0,0,0|2,0,0]=3 221 B11R0.140 NCCCNC(=O)CCCCO MCULE-2137798143 [0,1,0,0,0,0|2,0,0]=3 222 B11R0.140 O=C(NCCCO)NCCCO MCULE-2420821778 [0,1,0,0,0,0|3,0,0]=4 223 B11R0.147 CCCCC(=O)CCCC(=O)O MCULE-4828153043 [0,1,0,0,0,0|2,0,1]=4 224 B11R0.147 CCCCC(=O)OCCC(C)C MCULE-6555868856 [0,1,0,0,0,0|2,0,0]=3 225 B11R0.147 CCCNC(=O)CCCC(=O)O MCULE-5121990390 [0,1,0,0,0,0|2,0,1]=4 226 B11R0.152 CCCCN(CCCCO)N=O MCULE-6299257136 [0,1,0,0,0,0|3,0,0]=4 227 B11R0.154 CCCCCC(=O)CC(=O)OC MCULE-9153189731 [0,1,0,0,0,0|2,0,1]=4 228 B11R0.155 CCCC(N)C(=O)NCCOC MCULE-4198453553 [0,1,0,0,0,0|3,0,0]=4 229 B11R0.155 CCCC(N)C(=O)NCCOC MCULE-7314607935 [0,1,0,0,0,0|3,0,0]=4 230 B11R0.155 CCCCCC(=O)C(=O)OCC MCULE-6264599402 [0,1,0,0,0,0|2,0,0]=3 231 B11R0.155 CCCCCC(=O)C(C)CCC MCULE-1482856846 [0,1,0,0,0,0|1,0,0]=2 232 B11R0.155 CCCCNC(=O)C(=O)NCC MCULE-7458551905 [0,1,0,0,0,0|3,0,0]=4 233 B11R0.155 CCCCOC(=O)C(C)CCC MCULE-9107727586 [0,1,0,0,0,0|2,0,0]=3 234 B11R0.155 CCC[C@H](N)C(=O)NCCOC MCULE-4215391360 [0,1,0,0,0,0|3,0,0]=4 235 B11R0.155 CCC[C@H](N)C(=O)NCCOC MCULE-6219294007 [0,1,0,0,0,0|3,0,0]=4 236 B11R0.155 CCOC(=O)C(=O)CCCCCl MCULE-2730081165 [0,1,0,0,0,0|3,0,0]=4 237 B11R0.321 CCCCS(=O)(=O)CCCCCl MCULE-1456446008 [0,1,0,0,0,0|3,0,0]=4 238 B11R0.321 CCCCS(=O)(=O)CCCCN MCULE-1843754325 [0,1,0,0,0,0|3,0,0]=4 239 B11R1.5 C#CCN1CCCCCC1=O MCULE-4157890671 [0,0,0,1,0,0|1,0,2]=4 240 B11R1.5 CCCC1CCCCNC1=O MCULE-1989909498 [0,0,0,1,0,0|2,0,0]=3 241 B11R1.5 CCCN1CCCNCC1=O MCULE-8150823911 [0,0,0,1,0,0|2,0,0]=3 242 B11R1.5 CCCN1CCNCCC1=O MCULE-1036321145 [0,0,0,1,0,0|2,0,0]=3 243 B11R1.5 CCCN1CCNCCC1=O MCULE-8130444004 [0,0,0,1,0,0|2,0,0]=3 244 B11R1.5 NCCN1CCCCCC1=O MCULE-6085364731 [0,0,0,1,0,0|2,0,0]=3 245 B11R1.5 O=C1CCCCCN1CCO MCULE-2748237095 [0,0,0,1,0,0|2,0,0]=3 246 B11R1.5 O=C1CCOCCN1CCO MCULE-4962884762 [0,0,0,1,0,0|3,0,0]=4 247 B11R1.17 CCCCC1CCCCC1O MCULE-7002165342 [0,0,0,1,0,0|1,0,2]=4 248 B11R1.17 CCCCC1NCCNC1=O MCULE-8504158690 [0,0,0,1,0,0|2,0,0]=3 249 B11R1.17 CCCCN1CCNCC1=O MCULE-4836745667 [0,0,0,1,0,0|3,0,0]=4 250 B11R1.17 CNCCN1CCCCC1=O MCULE-2748762852 [0,0,0,1,0,0|3,0,0]=4 251 B11R1.17 CNCCN1CCCCC1=O MCULE-6209260920 [0,0,0,1,0,0|3,0,0]=4 252 B11R1.17 N#CCCC1CCCCC1=O MCULE-6518120828 [0,0,0,1,0,0|2,0,1]=4 253 B11R1.17 NCCCN1CCCCC1=O MCULE-3264201427 [0,0,0,1,0,0|3,0,0]=4 254 B11R1.17 NCCCN1CCCNC1=O MCULE-1366217387 [0,0,0,1,0,0|3,0,0]=4 255 B11R1.17 O=C1CCCCC1CCCO MCULE-6491492717 [0,0,0,1,0,0|2,0,0]=3 256 B11R1.17 O=C1CCCCN1CCCO MCULE-3358401474 [0,0,0,1,0,0|3,0,0]=4 257 B11R1.24 CCCNC1CCCC(C1)C MCULE-4241130418 [0,0,0,1,0,0|2,0,1]=4 258 B11R1.24 CCCNC1CCCC(C1)C MCULE-6544197444 [0,0,0,1,0,0|2,0,1]=4 259 B11R1.27 CCCCCC1OCC(O1)C MCULE-9583652455 [0,0,0,1,0,0|0,0,2]=3 260 B11R1.28 CCCCCC1=CCNCC1 MCULE-3759142054 [0,0,0,1,0,0|3,0,0]=4 261 B11R1.28 CCCCCC1CCCCC1 MCULE-8832032133 [0,0,0,1,0,0|2,0,1]=4 262 B11R1.28 CCCCCC1CCCCN1 MCULE-4218318893 [0,0,0,1,0,0|2,0,1]=4 263 B11R1.28 CCCCCN1CCCCC1 MCULE-1046315865 [0,0,0,1,0,0|3,0,0]=4 264 B11R1.28 CCCCC[NH+]1CCCCC1 MCULE-1462611325 [0,0,0,1,0,0|3,0,0]=4 265 B11R1.28 CCCCOC1CCCCO1 MCULE-5619472922 [0,0,0,1,0,0|2,0,1]=4 266 B11R1.28 CCCNCC1CCCCO1 MCULE-6602583901 [0,0,0,1,0,0|2,0,1]=4 267 B11R1.28 CCNCCC1=CCCCC1 MCULE-8775802793 [0,0,0,1,0,0|3,0,0]=4 268 B11R1.28 CCNCCC1=CCCCC1 MCULE-9487350468 [0,0,0,1,0,0|3,0,0]=4 269 B11R1.28 OCCCCC1=CCCCC1 MCULE-2186207882 [0,0,0,1,0,0|3,0,0]=4 270 B11R1.29 C#CCCC(=O)C1CCCC1 MCULE-9611362726 [0,0,0,1,0,0|1,0,2]=4 271 B11R1.29 C=CCNC(=O)C1CCCC1 MCULE-6766998118 [0,0,0,1,0,0|1,0,2]=4 272 B11R1.29 CCCCC(=O)C1CCCC1 MCULE-1868643843 [0,0,0,1,0,0|1,0,0]=2 273 B11R1.29 CCCNC(=O)C1CCCN1 MCULE-8784818288 [0,0,0,1,0,0|2,0,0]=3 274 B11R1.29 CCCNC(=O)C1CCCN1 MCULE-9216142514 [0,0,0,1,0,0|2,0,0]=3 275 B11R1.29 CCCNC(=O)C1CCCO1 MCULE-3657202661 [0,0,0,1,0,0|2,0,0]=3 276 B11R1.29 CCCNC(=O)[C@@H]1CCNC1 MCULE-6162121801 [0,0,0,1,0,0|2,0,0]=3 277 B11R1.29 CCCNC(=O)[C@@H]1CCNC1 MCULE-8604093358 [0,0,0,1,0,0|2,0,0]=3 278 B11R1.29 CCCNC(=O)[C@H]1CCNC1 MCULE-2102176876 [0,0,0,1,0,0|2,0,0]=3 279 B11R1.29 CCCNC(=O)[C@H]1CCNC1 MCULE-3942489922 [0,0,0,1,0,0|2,0,0]=3 280 B11R1.29 CNCCC(=O)N1CCCC1 MCULE-1960613005 [0,0,0,1,0,0|3,0,0]=4 281 B11R1.29 NCCNC(=O)C1CCCC1 MCULE-1685609750 [0,0,0,1,0,0|2,0,0]=3 282 B11R1.29 NCCNC(=O)C1CCCC1 MCULE-6083328043 [0,0,0,1,0,0|2,0,0]=3 283 B11R1.29 O=C(NCCCl)C1CCCC1 MCULE-9862592905 [0,0,0,1,0,0|2,0,0]=3 284 B11R1.29 O=C(NCCO)C1CCCN1 MCULE-4716312926 [0,0,0,1,0,0|3,0,0]=4 285 B11R1.29 O=C(NCCO)C1CCCN1 MCULE-6766652201 [0,0,0,1,0,0|3,0,0]=4 286 B11R1.29 O=C(NCCO)[C@@H]1CCNC1 MCULE-5572015752 [0,0,0,1,0,0|3,0,0]=4 287 B11R1.29 O=C(NCCO)[C@@H]1CCNC1 MCULE-8791661682 [0,0,0,1,0,0|3,0,0]=4 288 B11R1.29 O=C(NCCO)[C@H]1CCNC1 MCULE-8342621061 [0,0,0,1,0,0|3,0,0]=4 289 B11R1.29 O=C(NCCO)[C@H]1CCNC1 MCULE-9931217716 [0,0,0,1,0,0|3,0,0]=4 290 B11R1.101 NC1CCCCCCCCC1 MCULE-7140828852 [0,0,0,1,0,0|2,0,1]=4 291 B11R1.101 NC1CCCCCCCCC1 MCULE-9762725860 [0,0,0,1,0,0|2,0,1]=4 292 B11R1.101 O=C1CCCCCCCCC1 MCULE-7431354983 [0,0,0,1,0,0|1,0,0]=2 293 B11R1.101 O=C1CCCCCCCCN1 MCULE-4805310836 [0,0,0,1,0,0|1,0,0]=2 294 B11R1.101 O=C1CCNCCCCCN1 MCULE-1892904766 [0,0,0,1,0,0|2,0,0]=3 295 B11R1.101 O=C1CCNCCOCCN1 MCULE-3042541612 [0,0,0,1,0,0|3,0,0]=4 296 B11R1.110 NCCC1CCCCC(=O)N1 MCULE-2147581863 [0,0,0,1,0,0|3,0,0]=4 297 B11R1.110 NCCC1CCCCC(=O)N1 MCULE-8292359667 [0,0,0,1,0,0|3,0,0]=4 298 B11R1.203 CCCNC1CCCCCC1 MCULE-1802038783 [0,0,0,1,0,0|2,0,1]=4 299 B11R1.203 CCCNC1CCCCCC1 MCULE-6514815926 [0,0,0,1,0,0|2,0,1]=4 300 B11R1.203 CCCOC1CCCNCC1 MCULE-8800488790 [0,0,0,1,0,0|2,0,1]=4 301 B11R1.203 ClCCOC1CCCCCC1 MCULE-5770313338 [0,0,0,1,0,0|2,0,1]=4 302 B11R1.203 NCCOC1CCCCCC1 MCULE-2079787273 [0,0,0,1,0,0|2,0,1]=4 303 B11R1.203 OCCOC1CCCCCC1 MCULE-7377327373 [0,0,0,1,0,0|2,0,1]=4 304 B11R1.284 CCCNC(=O)NC1CCC1 MCULE-2027864910 [0,0,0,1,0,0|2,0,0]=3 305 B11R1.285 CCCCC(=O)OC[C@H]1CO1 MCULE-8441193923 [0,0,0,1,0,0|3,0,0]=4 306 B11R1.299 NCCCNC(=O)C1CCC1 MCULE-6761680645 [0,0,0,1,0,0|3,0,0]=4 307 B11R1.299 NCCCNC(=O)C1CCC1 MCULE-8756303776 [0,0,0,1,0,0|3,0,0]=4 308 B11R1.301 CCCC=CC(=O)NC1CC1 MCULE-7982447678 [0,0,0,1,0,0|1,0,2]=4 309 B11R1.301 O=C(CCCCO)NC1CC1 MCULE-5604668009 [0,0,0,1,0,0|2,0,0]=3 310 B11R1.465 CCCCC1=C(CCC1=O)C MCULE-3854801059 [0,0,0,1,0,0|1,0,2]=4 311 B11R1.605 COCC1C(=O)CCCC1C MCULE-4444498649 [0,0,0,1,0,0|2,0,0]=3 312 B11R1.756 CCCCCC1(CCCC1)O MCULE-8743277419 [0,0,0,1,0,0|1,0,2]=4 313 B11R1.900 CCCCC1(CCCCC1)O MCULE-1667452450 [0,0,0,1,0,0|1,0,2]=4 314 B11R1.900 CCCC[N+]1(CCCCC1)C MCULE-2359586854 [0,0,0,1,0,0|3,0,0]=4 315 B11R1.900 CCCC[N+]1(CCCCC1)C MCULE-4342879139 [0,0,0,1,0,0|3,0,0]=4 316 B11R1.900 CCCC[N+]1(CCCCC1)C MCULE-7291533826 [0,0,0,1,0,0|3,0,0]=4 317 B8R0.1 C#CCCC(=O)OCC MCULE-9456160977 [2,0,0,0,0,0|0,0,2]=4 318 B8R0.1 C/C=C/C(=O)CCCC MCULE-6753420308 [2,0,0,0,0,0|0,0,2]=4 319 B8R0.1 C=CCC(=O)CCCC MCULE-4100882049 [2,0,0,0,0,0|0,0,2]=4 320 B8R0.1 C=CCCC(=O)CCC MCULE-9846709255 [2,0,0,0,0,0|0,0,2]=4 321 B8R0.1 C=CCCC(=O)OCC MCULE-4147956319 [2,0,0,0,0,0|0,0,2]=4 322 B8R0.1 C=CCOC(=O)CCC MCULE-7209016839 [2,0,0,0,0,0|0,0,2]=4 323 B8R0.1 CC#CCC(=O)OCC MCULE-3108892964 [2,0,0,0,0,0|0,0,2]=4 324 B8R0.1 CC/C=C/C(=O)OCC MCULE-6281513551 [2,0,0,0,0,0|0,0,2]=4 325 B8R0.1 CC=CC(=O)CCCC MCULE-2281679965 [2,0,0,0,0,0|0,0,2]=4 326 B8R0.1 CCC#CC(=O)OCC MCULE-2785923283 [2,0,0,0,0,0|0,0,2]=4 327 B8R0.1 CCC=CC(=O)OCC MCULE-2840510617 [2,0,0,0,0,0|0,0,2]=4 328 B8R0.1 CCCC(=O)NCCN MCULE-1372911866 [2,0,0,0,0,0|2,0,0]=4 329 B8R0.1 CCCC(=O)OCCCl MCULE-8469083528 [2,0,0,0,0,0|1,0,0]=3 330 B8R0.1 CCCC(=O)OCCO MCULE-5942976945 [2,0,0,0,0,0|1,0,0]=3 331 B8R0.1 CCCCC(=N)OCC MCULE-3866961773 [2,0,0,0,0,0|1,0,0]=3 332 B8R0.1 CCCCC(=N)OCC MCULE-6116145724 [2,0,0,0,0,0|1,0,0]=3 333 B8R0.1 CCCCC(=O)CCC MCULE-5459540473 [2,0,0,0,0,0|0,0,0]=2 334 B8R0.1 CCCCC(=O)COC MCULE-7059597173 [2,0,0,0,0,0|1,0,0]=3 335 B8R0.1 CCCCC(=O)OCC MCULE-1219537918 [2,0,0,0,0,0|0,0,0]=2 336 B8R0.1 CCCCC(=O)OCCl MCULE-1974449433 [2,0,0,0,0,0|1,0,0]=3 337 B8R0.1 CCCCC(Br)CCC MCULE-1998636531 [2,0,0,0,0,0|1,0,1]=4 338 B8R0.1 CCCCC(N)CCC MCULE-5245074866 [2,0,0,0,0,0|1,0,1]=4 339 B8R0.1 CCCCC(O)CCC MCULE-6030672439 [2,0,0,0,0,0|0,0,2]=4 340 B8R0.1 CCCCS(=O)CCO MCULE-9422446521 [2,0,0,0,0,0|2,0,0]=4 341 B8R0.1 CCCNC(=O)CCC MCULE-2578933218 [2,0,0,0,0,0|1,0,0]=3 342 B8R0.1 CCCNC(=O)CCN MCULE-9343291828 [2,0,0,0,0,0|2,0,0]=4 343 B8R0.1 CCCNC(=O)CCN MCULE-9397624395 [2,0,0,0,0,0|2,0,0]=4 344 B8R0.1 CCCNC(=O)CNC MCULE-3183907339 [2,0,0,0,0,0|2,0,0]=4 345 B8R0.1 CCCNC(=O)CNC MCULE-9204845590 [2,0,0,0,0,0|2,0,0]=4 346 B8R0.1 CCCNC(=O)NCC MCULE-5842395608 [2,0,0,0,0,0|2,0,0]=4 347 B8R0.1 CCCOC(=O)CC#N MCULE-6051640060 [2,0,0,0,0,0|1,0,1]=4 348 B8R0.1 CCCOC(=O)CCC MCULE-7673125406 [2,0,0,0,0,0|0,0,0]=2 349 B8R0.1 CCCOC(=O)CCN MCULE-1345071747 [2,0,0,0,0,0|1,0,0]=3 350 B8R0.1 CCCOC(=O)CCN MCULE-3861690448 [2,0,0,0,0,0|1,0,0]=3 351 B8R0.1 CCCOC(=O)CCO MCULE-7390309329 [2,0,0,0,0,0|1,0,0]=3 352 B8R0.1 CCCOC(=O)OCCl MCULE-7435813375 [2,0,0,0,0,0|2,0,0]=4 353 B8R0.1 CCNCC(=O)NCC MCULE-2852589977 [2,0,0,0,0,0|2,0,0]=4 354 B8R0.1 CCNCC(=O)OCC MCULE-7972358572 [2,0,0,0,0,0|1,0,0]=3 355 B8R0.1 CCNCC(=O)OCC MCULE-8893227629 [2,0,0,0,0,0|1,0,0]=3 356 B8R0.1 CCOC(=N)CCCBr MCULE-1694733128 [2,0,0,0,0,0|2,0,0]=4 357 B8R0.1 CCOC(=N)CCCBr MCULE-5188406239 [2,0,0,0,0,0|2,0,0]=4 358 B8R0.1 CCOC(=N)CCCCl MCULE-2912870166 [2,0,0,0,0,0|2,0,0]=4 359 B8R0.1 CCOC(=N)CCCCl MCULE-6562903266 [2,0,0,0,0,0|2,0,0]=4 360 B8R0.1 CCOC(=N)CCOC MCULE-8187493489 [2,0,0,0,0,0|2,0,0]=4 361 B8R0.1 CCOC(=N)CCOC MCULE-9185956666 [2,0,0,0,0,0|2,0,0]=4 362 B8R0.1 CCOC(=O)CCC#N MCULE-9221721525 [2,0,0,0,0,0|1,0,1]=4 363 B8R0.1 CCOC(=O)CCC=O MCULE-2891201608 [2,0,0,0,0,0|1,0,1]=4 364 B8R0.1 CCOC(=O)CCCBr MCULE-5001503693 [2,0,0,0,0,0|1,0,0]=3 365 B8R0.1 CCOC(=O)CCCCl MCULE-4945067440 [2,0,0,0,0,0|1,0,0]=3 366 B8R0.1 CCOC(=O)CCCI MCULE-3229549270 [2,0,0,0,0,0|1,0,0]=3 367 B8R0.1 CCOC(=O)CCCN MCULE-3396270547 [2,0,0,0,0,0|1,0,0]=3 368 B8R0.1 CCOC(=O)CCCO MCULE-6165580365 [2,0,0,0,0,0|1,0,0]=3 369 B8R0.1 CCOC(=O)CCCS MCULE-6616511520 [2,0,0,0,0,0|1,0,0]=3 370 B8R0.1 CCOC(=O)CCC[NH3+] MCULE-4462126494 [2,0,0,0,0,0|1,0,0]=3 371 B8R0.1 CCOC(=O)CCNC MCULE-2052970996 [2,0,0,0,0,0|1,0,0]=3 372 B8R0.1 CCOC(=O)CCNC MCULE-5442289273 [2,0,0,0,0,0|1,0,0]=3 373 B8R0.1 CCOC(=O)CCNN MCULE-6880821012 [2,0,0,0,0,0|2,0,0]=4 374 B8R0.1 CCOC(=O)CCNN MCULE-9638408107 [2,0,0,0,0,0|2,0,0]=4 375 B8R0.1 CCOC(=O)CCOC MCULE-5983048130 [2,0,0,0,0,0|1,0,0]=3 376 B8R0.1 CCOC(=O)CCSC MCULE-6834820952 [2,0,0,0,0,0|1,0,0]=3 377 B8R0.1 CCOC(=O)CSCC MCULE-5930366300 [2,0,0,0,0,0|1,0,0]=3 378 B8R0.1 CCOC(=O)NCCBr MCULE-4386850032 [2,0,0,0,0,0|2,0,0]=4 379 B8R0.1 CCOC(=O)NCCCl MCULE-5545666176 [2,0,0,0,0,0|2,0,0]=4 380 B8R0.1 CCOC(=O)NCCN MCULE-1497223307 [2,0,0,0,0,0|2,0,0]=4 381 B8R0.1 CCOC(=O)NCCN MCULE-3733943315 [2,0,0,0,0,0|2,0,0]=4 382 B8R0.1 CCOC(=O)NCCO MCULE-7625780069 [2,0,0,0,0,0|2,0,0]=4 383 B8R0.1 CCOC(=O)OCCBr MCULE-4627499799 [2,0,0,0,0,0|2,0,0]=4 384 B8R0.1 CCOCC(=O)OCC MCULE-5439289896 [2,0,0,0,0,0|1,0,0]=3 385 B8R0.1 COCCC(=O)COC MCULE-3111860636 [2,0,0,0,0,0|2,0,0]=4 386 B8R0.1 O=C(CCS)OCCO MCULE-8554625892 [2,0,0,0,0,0|2,0,0]=4 387 B8R0.4 CCC#CCCCCC MCULE-3250800871 [2,0,0,0,0,0|0,0,2]=4 388 B8R0.4 CCC/C=C\CCCC MCULE-1534641855 [2,0,0,0,0,0|0,0,1]=3 389 B8R0.4 CCC=CCCCCO MCULE-2496486842 [2,0,0,0,0,0|1,0,1]=4 390 B8R0.4 CCCC/C=C\CCO MCULE-5021089657 [2,0,0,0,0,0|1,0,1]=4 391 B8R0.4 CCCC=CCCCC MCULE-6609949802 [2,0,0,0,0,0|0,0,1]=3 392 B8R0.4 CCCCBCCCC MCULE-3163100787 [2,0,0,0,0,0|1,0,1]=4 393 B8R0.4 CCCCBCCCC MCULE-6578781762 [2,0,0,0,0,0|1,0,1]=4 394 B8R0.4 CCCCC/C=C/CO MCULE-2538979274 [2,0,0,0,0,0|1,0,1]=4 395 B8R0.4 CCCCC=CCCO MCULE-5187523035 [2,0,0,0,0,0|1,0,1]=4 396 B8R0.4 CCCCCC=CCO MCULE-7026544339 [2,0,0,0,0,0|1,0,1]=4 397 B8R0.4 CCCCCCCCBr MCULE-7484248707 [2,0,0,0,0,0|1,0,1]=4 398 B8R0.4 CCCCCCCCC MCULE-1865327912 [2,0,0,0,0,0|0,0,1]=3 399 B8R0.4 CCCCCCCCCl MCULE-5953637232 [2,0,0,0,0,0|1,0,1]=4 400 B8R0.4 CCCCCCCCF MCULE-5641912511 [2,0,0,0,0,0|1,0,1]=4 401 B8R0.4 CCCCCCCCI MCULE-7304806902 [2,0,0,0,0,0|1,0,1]=4 402 B8R0.4 CCCCCCCCN MCULE-6095227778 [2,0,0,0,0,0|1,0,1]=4 403 B8R0.4 CCCCCCCCN MCULE-7012389700 [2,0,0,0,0,0|1,0,1]=4 404 B8R0.4 CCCCCCCCN MCULE-7076053015 [2,0,0,0,0,0|1,0,1]=4 405 B8R0.4 CCCCCCCCO MCULE-2656577895 [2,0,0,0,0,0|1,0,1]=4 406 B8R0.4 CCCCCCCCS MCULE-5212273874 [2,0,0,0,0,0|1,0,1]=4 407 B8R0.4 CCCCCCCNC MCULE-1143610772 [2,0,0,0,0,0|1,0,1]=4 408 B8R0.4 CCCCCCCSC MCULE-5211260102 [2,0,0,0,0,0|1,0,1]=4 409 B8R0.4 CCCCCCSCC MCULE-1449428108 [2,0,0,0,0,0|0,1,1]=4 410 B8R0.4 CCCCCNCCC MCULE-7697830316 [2,0,0,0,0,0|1,0,0]=3 411 B8R0.4 CCCCCNCCN MCULE-5873419228 [2,0,0,0,0,0|2,0,0]=4 412 B8R0.4 CCCCCNCCO MCULE-7662965930 [2,0,0,0,0,0|2,0,0]=4 413 B8R0.4 CCCCCNOCC MCULE-5426574695 [2,0,0,0,0,0|1,0,0]=3 414 B8R0.4 CCCCCNOCC MCULE-6155853359 [2,0,0,0,0,0|1,0,0]=3 415 B8R0.4 CCCCCOCCO MCULE-3393695257 [2,0,0,0,0,0|1,0,0]=3 416 B8R0.4 CCCCCSCCCl MCULE-7680431310 [2,0,0,0,0,0|1,1,0]=4 417 B8R0.4 CCCCCSCCO MCULE-1239137782 [2,0,0,0,0,0|1,1,0]=4 418 B8R0.4 CCCCNCCCC MCULE-1338595384 [2,0,0,0,0,0|1,0,1]=4 419 B8R0.4 CCCCNCCCC MCULE-4720016177 [2,0,0,0,0,0|1,0,1]=4 420 B8R0.4 CCCCNCCCC MCULE-6002936904 [2,0,0,0,0,0|1,0,1]=4 421 B8R0.4 CCCCNCCCC MCULE-8673755112 [2,0,0,0,0,0|1,0,1]=4 422 B8R0.4 CCCCOCCCC MCULE-8568026186 [2,0,0,0,0,0|1,0,1]=4 423 B8R0.4 CCCCSCCCC MCULE-3121918458 [2,0,0,0,0,0|1,0,1]=4 424 B8R0.4 CCCC[NH2+]CCCC MCULE-4333811997 [2,0,0,0,0,0|1,0,1]=4 425 B8R0.4 CCCC[NH2+]CCCC MCULE-8030655880 [2,0,0,0,0,0|1,0,1]=4 426 B8R0.4 CCCNCCCCN MCULE-1576152293 [2,0,0,0,0,0|2,0,0]=4 427 B8R0.4 CCCNCCCCN MCULE-2764845788 [2,0,0,0,0,0|2,0,0]=4 428 B8R0.4 CCCNCCCNC MCULE-5061364734 [2,0,0,0,0,0|2,0,0]=4 429 B8R0.4 CCCSCCCCN MCULE-7923615539 [2,0,0,0,0,0|1,1,0]=4 430 B8R0.4 CCNCCOCCN MCULE-7419143110 [2,0,0,0,0,0|2,0,0]=4 431 B8R0.4 CCNCCOCCO MCULE-3581305931 [2,0,0,0,0,0|2,0,0]=4 432 B8R0.4 CCOCCOCCBr MCULE-9030593043 [2,0,0,0,0,0|2,0,0]=4 433 B8R0.4 CCOCCOCCCl MCULE-5739255923 [2,0,0,0,0,0|2,0,0]=4 434 B8R0.4 CCOCCOCCN MCULE-5375263489 [2,0,0,0,0,0|2,0,0]=4 435 B8R0.4 CCOCCOCCN MCULE-5713936875 [2,0,0,0,0,0|2,0,0]=4 436 B8R0.4 CCOCCOCCO MCULE-8940886567 [2,0,0,0,0,0|2,0,0]=4 437 B8R0.4 CCSCCOCCO MCULE-6785870605 [2,0,0,0,0,0|2,0,0]=4 438 B8R0.4 COCCCOCCO MCULE-7280677606 [2,0,0,0,0,0|2,0,0]=4 439 B8R0.6 C#CCCCC(=O)OC MCULE-1834140672 [2,0,0,0,0,0|0,0,2]=4 440 B8R0.6 C=CC(=O)CCCCC MCULE-9094274880 [2,0,0,0,0,0|0,0,2]=4 441 B8R0.6 C=CCCCC(=O)OC MCULE-4913183131 [2,0,0,0,0,0|0,0,2]=4 442 B8R0.6 CCC/C=C/C(=O)OC MCULE-6273561448 [2,0,0,0,0,0|0,0,2]=4 443 B8R0.6 CCC=CCC(=O)OC MCULE-6432541061 [2,0,0,0,0,0|0,0,2]=4 444 B8R0.6 CCCC#CC(=O)OC MCULE-1573744334 [2,0,0,0,0,0|0,0,2]=4 445 B8R0.6 CCCC=CC(=O)OC MCULE-1227063444 [2,0,0,0,0,0|0,0,2]=4 446 B8R0.6 CCCCCC(=O)CBr MCULE-6642335283 [2,0,0,0,0,0|1,0,0]=3 447 B8R0.6 CCCCCC(=O)CC MCULE-2012071553 [2,0,0,0,0,0|0,0,0]=2 448 B8R0.6 CCCCCC(=O)NN MCULE-3138841743 [2,0,0,0,0,0|2,0,0]=4 449 B8R0.6 CCCCCC(=O)NO MCULE-8432990947 [2,0,0,0,0,0|2,0,0]=4 450 B8R0.6 CCCCCC(=O)OC MCULE-2317616388 [2,0,0,0,0,0|0,0,0]=2 451 B8R0.6 CCCCCC(C)CC MCULE-8343490845 [2,0,0,0,0,0|1,0,1]=4 452 B8R0.6 CCCCCC(O)CC MCULE-6682377557 [2,0,0,0,0,0|0,0,2]=4 453 B8R0.6 CCCCNC(=O)CBr MCULE-4128795630 [2,0,0,0,0,0|2,0,0]=4 454 B8R0.6 CCCCNC(=O)CC MCULE-3176114265 [2,0,0,0,0,0|1,0,0]=3 455 B8R0.6 CCCCNC(=O)CCl MCULE-6162581938 [2,0,0,0,0,0|2,0,0]=4 456 B8R0.6 CCCCNC(=O)CN MCULE-2730890796 [2,0,0,0,0,0|2,0,0]=4 457 B8R0.6 CCCCNC(=O)CN MCULE-8794795131 [2,0,0,0,0,0|2,0,0]=4 458 B8R0.6 CCCCNC(=O)NC MCULE-7920588549 [2,0,0,0,0,0|2,0,0]=4 459 B8R0.6 CCCCOC(=O)CBr MCULE-8883996630 [2,0,0,0,0,0|2,0,0]=4 460 B8R0.6 CCCCOC(=O)CC MCULE-4622389592 [2,0,0,0,0,0|1,0,0]=3 461 B8R0.6 CCCCOC(=O)CCl MCULE-1608118057 [2,0,0,0,0,0|2,0,0]=4 462 B8R0.6 CCCCOC(=O)CF MCULE-1355274212 [2,0,0,0,0,0|2,0,0]=4 463 B8R0.6 CCCCOC(=O)CN MCULE-9168260466 [2,0,0,0,0,0|2,0,0]=4 464 B8R0.6 CCCCOC(=O)CN MCULE-9585888268 [2,0,0,0,0,0|2,0,0]=4 465 B8R0.6 CCCCOC(=O)CO MCULE-4016266350 [2,0,0,0,0,0|2,0,0]=4 466 B8R0.6 CCCCOC(=O)CS MCULE-4331308025 [2,0,0,0,0,0|2,0,0]=4 467 B8R0.6 CCCNCC(=O)NC MCULE-4750972571 [2,0,0,0,0,0|2,0,0]=4 468 B8R0.6 CCCNCC(=O)OC MCULE-3321545319 [2,0,0,0,0,0|1,0,0]=3 469 B8R0.6 CCCNCC(=O)OC MCULE-5989619684 [2,0,0,0,0,0|1,0,0]=3 470 B8R0.6 CCCSCC(=O)OC MCULE-3865642484 [2,0,0,0,0,0|1,0,0]=3 471 B8R0.6 CCNCCC(=O)NC MCULE-8230774906 [2,0,0,0,0,0|2,0,0]=4 472 B8R0.6 CCNCCC(=O)NC MCULE-9131674592 [2,0,0,0,0,0|2,0,0]=4 473 B8R0.6 CCNCCC(=O)OC MCULE-4846173976 [2,0,0,0,0,0|1,0,0]=3 474 B8R0.6 CCOCCC(=N)OC MCULE-1143058685 [2,0,0,0,0,0|2,0,0]=4 475 B8R0.6 CCOCCC(=N)OC MCULE-1528455249 [2,0,0,0,0,0|2,0,0]=4 476 B8R0.6 CCSCCC(=O)OC MCULE-5773388371 [2,0,0,0,0,0|1,0,0]=3 477 B8R0.6 CNCCCC(=O)OC MCULE-2437073705 [2,0,0,0,0,0|1,0,0]=3 478 B8R0.6 CNCCCC(=O)OC MCULE-6776715081 [2,0,0,0,0,0|1,0,0]=3 479 B8R0.6 COC(=O)CCCC#N MCULE-9088492518 [2,0,0,0,0,0|1,0,1]=4 480 B8R0.6 COC(=O)CCCC=O MCULE-2183669341 [2,0,0,0,0,0|1,0,1]=4 481 B8R0.6 COC(=O)CCCCBr MCULE-8354790214 [2,0,0,0,0,0|1,0,0]=3 482 B8R0.6 COC(=O)CCCCCl MCULE-7057883989 [2,0,0,0,0,0|1,0,0]=3 483 B8R0.6 COC(=O)CCCCI MCULE-1527923255 [2,0,0,0,0,0|1,0,0]=3 484 B8R0.6 COC(=O)CCCCN MCULE-3452725442 [2,0,0,0,0,0|1,0,0]=3 485 B8R0.6 COC(=O)CCCCN MCULE-8816545129 [2,0,0,0,0,0|1,0,0]=3 486 B8R0.6 COC(=O)CCCCO MCULE-2443996181 [2,0,0,0,0,0|1,0,0]=3 487 B8R0.6 COC(=O)CCCCS MCULE-5194099368 [2,0,0,0,0,0|1,0,0]=3 488 B8R0.6 COC(=O)CCCON MCULE-1522874324 [2,0,0,0,0,0|2,0,0]=4 489 B8R0.6 COC(=O)CCCON MCULE-4748610058 [2,0,0,0,0,0|2,0,0]=4 490 B8R0.6 COC(=O)CCCSC MCULE-7320944174 [2,0,0,0,0,0|1,0,0]=3 491 B8R0.6 COC(=O)COCCCl MCULE-4344602258 [2,0,0,0,0,0|2,0,0]=4 492 B8R0.6 COC(=O)COCCN MCULE-5090944064 [2,0,0,0,0,0|2,0,0]=4 493 B8R0.6 COC(=O)COCCN MCULE-6748820855 [2,0,0,0,0,0|2,0,0]=4 494 B8R0.6 COC(=O)COCCO MCULE-7869619911 [2,0,0,0,0,0|2,0,0]=4 495 B8R0.6 COC(=O)CSCCN MCULE-5578128958 [2,0,0,0,0,0|2,0,0]=4 496 B8R0.6 COC(=O)CSCCN MCULE-6891143571 [2,0,0,0,0,0|2,0,0]=4 497 B8R0.6 COCCCC(=O)OC MCULE-4109110804 [2,0,0,0,0,0|1,0,0]=3 498 B8R0.6 CONCCC(=O)OC MCULE-8622619087 [2,0,0,0,0,0|2,0,0]=4 499 B8R0.6 [C@H](O)(CC)CCCCC MCULE-7121730436 [2,0,0,0,0,0|0,0,2]=4 500 B10R0.1 C#CCCCCC(=O)OCC MCULE-4159925776 [1,1,0,0,0,0|0,0,1]=3 501 B10R0.1 C=C(C=NCCCC)OCC MCULE-5629491103 [1,1,0,0,0,0|1,0,1]=4 502 B10R0.1 C=CCCCCC(=O)OCC MCULE-4796834258 [1,1,0,0,0,0|0,0,1]=3 503 B10R0.1 C=CCCNCC(=O)OCC MCULE-1904056256 [1,1,0,0,0,0|0,0,2]=4 504 B10R0.1 C=CCCNCC(=O)OCC MCULE-7266083662 [1,1,0,0,0,0|0,0,2]=4 505 B10R0.1 C=CCNCCC(=O)OCC MCULE-9029709691 [1,1,0,0,0,0|0,0,2]=4 506 B10R0.1 CC=CCCCC(=O)OCC MCULE-9997629917 [1,1,0,0,0,0|0,0,1]=3 507 B10R0.1 CCCC(=O)OCCCCCl MCULE-1685252152 [1,1,0,0,0,0|1,0,0]=3 508 B10R0.1 CCCC(=O)OCCCCO MCULE-5551819643 [1,1,0,0,0,0|1,0,0]=3 509 B10R0.1 CCCC(=O)OCCCSC MCULE-9257783110 [1,1,0,0,0,0|1,0,0]=3 510 B10R0.1 CCCCC#CC(=O)OCC MCULE-4077079917 [1,1,0,0,0,0|0,0,1]=3 511 B10R0.1 CCCCCCC(=O)CCC MCULE-1716736963 [1,1,0,0,0,0|0,0,0]=2 512 B10R0.1 CCCCCCC(=O)OCC MCULE-9137582636 [1,1,0,0,0,0|0,0,0]=2 513 B10R0.1 CCCCCCC(C)CCC MCULE-7297649998 [1,1,0,0,0,0|1,0,1]=4 514 B10R0.1 CCCCCCC(Cl)CCC MCULE-2067978007 [1,1,0,0,0,0|1,0,1]=4 515 B10R0.1 CCCCCCC(O)CCC MCULE-2307566607 [1,1,0,0,0,0|0,0,2]=4 516 B10R0.1 CCCCCC[C@H](C)CCC MCULE-5233422494 [1,1,0,0,0,0|1,0,1]=4 517 B10R0.1 CCCCCC[C@H](O)CCC MCULE-3592520258 [1,1,0,0,0,0|0,0,2]=4 518 B10R0.1 CCCCCC[C@H](O)CCC MCULE-8969624714 [1,1,0,0,0,0|0,0,2]=4 519 B10R0.1 CCCCCNC(=O)CC#N MCULE-8873285405 [1,1,0,0,0,0|1,0,1]=4 520 B10R0.1 CCCCCNC(=O)CCC MCULE-7374835979 [1,1,0,0,0,0|0,0,0]=2 521 B10R0.1 CCCCCNC(C)CCC MCULE-9526667622 [1,1,0,0,0,0|1,0,1]=4 522 B10R0.1 CCCCCOC(=O)CC#N MCULE-2626707454 [1,1,0,0,0,0|1,0,1]=4 523 B10R0.1 CCCCCOC(=O)CCC MCULE-8850994391 [1,1,0,0,0,0|0,0,0]=2 524 B10R0.1 CCCCNCC(=O)OCC MCULE-9216905823 [1,1,0,0,0,0|0,0,0]=2 525 B10R0.1 CCCNCCC(=O)NCC MCULE-2244073736 [1,1,0,0,0,0|1,0,0]=3 526 B10R0.1 CCCNCCC(=O)OCC MCULE-7490328359 [1,1,0,0,0,0|0,0,0]=2 527 B10R0.1 CCOC(=O)C=CCCCCl MCULE-5025299599 [1,1,0,0,0,0|0,0,2]=4 528 B10R0.1 CCOC(=O)CCCCC#N MCULE-4576520215 [1,1,0,0,0,0|0,0,1]=3 529 B10R0.1 CCOC(=O)CCCCC=O MCULE-7732334617 [1,1,0,0,0,0|0,0,1]=3 530 B10R0.1 CCOC(=O)CCCCCBr MCULE-8003265411 [1,1,0,0,0,0|0,0,0]=2 531 B10R0.1 CCOC(=O)CCCCCCl MCULE-4088253059 [1,1,0,0,0,0|0,0,0]=2 532 B10R0.1 CCOC(=O)CCCCCI MCULE-9635955061 [1,1,0,0,0,0|0,0,0]=2 533 B10R0.1 CCOC(=O)CCCCCN MCULE-3923374138 [1,1,0,0,0,0|0,0,0]=2 534 B10R0.1 CCOC(=O)CCCCCN MCULE-5512054492 [1,1,0,0,0,0|0,0,0]=2 535 B10R0.1 CCOC(=O)CCCCCO MCULE-3245932025 [1,1,0,0,0,0|0,0,0]=2 536 B10R0.1 CCOC(=O)CCCN=C=O MCULE-8599519587 [1,1,0,0,0,0|1,0,1]=4 537 B10R0.1 CCOC(=O)CCCN=C=S MCULE-1375982762 [1,1,0,0,0,0|1,0,1]=4 538 B10R0.1 CCOC(=O)CCCN=N#N MCULE-5071405888 [1,1,0,0,0,0|2,0,0]=4 539 B10R0.1 CCOC(=O)CCSCCO MCULE-8638992281 [1,1,0,0,0,0|1,0,0]=3 540 B10R0.1 CCOC(=O)CNCCC#N MCULE-2662749759 [1,1,0,0,0,0|1,0,1]=4 541 B10R0.1 CCOC(=O)CNCCC#N MCULE-4394204356 [1,1,0,0,0,0|1,0,1]=4 542 B10R0.1 CCOC(=O)CNCCOC MCULE-2646976797 [1,1,0,0,0,0|1,0,0]=3 543 B10R0.1 CCOC(=O)COCCCCl MCULE-4550907435 [1,1,0,0,0,0|1,0,0]=3 544 B10R0.1 CCOC(=O)COCCCO MCULE-9785348075 [1,1,0,0,0,0|1,0,0]=3 545 B10R0.1 CCOCCCC(=O)OCC MCULE-9855302324 [1,1,0,0,0,0|0,0,0]=2 546 B10R0.1 CCOCCOC(=O)CCCl MCULE-2438998187 [1,1,0,0,0,0|2,0,0]=4 547 B10R0.1 CNCC(=O)NCCCOC MCULE-3699108834 [1,1,0,0,0,0|2,0,0]=4 548 B10R0.1 CNCC(=O)NCCCOC MCULE-9386928345 [1,1,0,0,0,0|2,0,0]=4 549 B10R0.1 COCCCNC(=O)CCN MCULE-6662323746 [1,1,0,0,0,0|2,0,0]=4 550 B10R0.1 COCCCNC(=O)CCN MCULE-8531003255 [1,1,0,0,0,0|2,0,0]=4 551 B10R0.2 C(O)(CC#N)CC(=O)OCC MCULE-5483855073 [1,1,0,0,0,0|1,0,1]=4 552 B10R0.2 CCC/C(=C\C(=O)OCC)/C MCULE-1371307128 [1,1,0,0,0,0|0,0,2]=4 553 B10R0.2 CCCC(=CC(=O)OCC)C MCULE-1645946260 [1,1,0,0,0,0|0,0,2]=4 554 B10R0.2 CCCC(=CC(=O)OCC)N MCULE-2436190261 [1,1,0,0,0,0|0,0,2]=4 555 B10R0.2 CCCC(=O)CC(=O)CCC MCULE-3312674708 [1,1,0,0,0,0|0,0,1]=3 556 B10R0.2 CCCC(=O)CC(=O)OCC MCULE-5166823353 [1,1,0,0,0,0|0,0,1]=3 557 B10R0.2 CCCC(=O)OC(=O)CCC MCULE-7605031104 [1,1,0,0,0,0|1,0,1]=4 558 B10R0.2 CCCC(C)CC(=O)OCC MCULE-8935140518 [1,1,0,0,0,0|0,0,0]=2 559 B10R0.2 CCCC(N)CC(=O)OCC MCULE-1001870682 [1,1,0,0,0,0|0,0,0]=2 560 B10R0.2 CCCC(N)CC(=O)OCC MCULE-1944209512 [1,1,0,0,0,0|0,0,0]=2 561 B10R0.2 CCCC(O)CC(=O)OCC MCULE-5905342292 [1,1,0,0,0,0|0,0,0]=2 562 B10R0.2 CCC[C@H](O)CC(=O)OCC MCULE-9017403904 [1,1,0,0,0,0|0,0,0]=2 563 B10R0.2 CCNC(C)CC(=O)OCC MCULE-2058750344 [1,1,0,0,0,0|1,0,0]=3 564 B10R0.2 CCOC(=N)CC(=O)OCC MCULE-2177167654 [1,1,0,0,0,0|1,0,1]=4 565 B10R0.2 CCOC(=N)CC(=O)OCC MCULE-4553821564 [1,1,0,0,0,0|1,0,1]=4 566 B10R0.2 CCOC(=O)CC(=O)COC MCULE-9085340611 [1,1,0,0,0,0|1,0,1]=4 567 B10R0.2 CCOC(=O)CC(=O)OCC MCULE-8243470790 [1,1,0,0,0,0|1,0,1]=4 568 B10R0.2 CCOC(=O)CC(C)SCC MCULE-2636596878 [1,1,0,0,0,0|1,0,0]=3 569 B10R0.2 CCOC(=O)CC(O)CC#N MCULE-9363444606 [1,1,0,0,0,0|1,0,1]=4 570 B10R0.2 CCOC(=O)CC(O)CCN MCULE-1248900915 [1,1,0,0,0,0|1,0,0]=3 571 B10R0.2 CCOC(=O)CC(O)CCN MCULE-3855586387 [1,1,0,0,0,0|1,0,0]=3 572 B10R0.2 CCOC(=O)CN(C)CCN MCULE-2610844903 [1,1,0,0,0,0|2,0,0]=4 573 B10R0.2 CCOC(=O)CN(C)CCN MCULE-8760269076 [1,1,0,0,0,0|2,0,0]=4 574 B10R0.2 CCOC(=O)C[C@@H](O)CC#N MCULE-4667394999 [1,1,0,0,0,0|1,0,1]=4 575 B10R0.2 CCOC(=O)C[C@@H](O)CC#N MCULE-9681130700 [1,1,0,0,0,0|1,0,1]=4 576 B10R0.2 CCOC(=O)C[C@H](O)CC#N MCULE-3083626263 [1,1,0,0,0,0|1,0,1]=4 577 B10R0.2 CCOC(=O)C[C@H](O)CC#N MCULE-4541282394 [1,1,0,0,0,0|1,0,1]=4 578 B10R0.2 CCOC(=O)C[C@H](O)CCN MCULE-2186128767 [1,1,0,0,0,0|1,0,0]=3 579 B10R0.2 CCOC(=O)C[C@H](O)CCN MCULE-2862289323 [1,1,0,0,0,0|1,0,0]=3 580 B10R0.2 [C@@H](O)(CCN)CC(=O)OCC MCULE-5946205626 [1,1,0,0,0,0|1,0,0]=3 581 B10R0.2 [C@@H](O)(CCN)CC(=O)OCC MCULE-8503181083 [1,1,0,0,0,0|1,0,0]=3 582 B10R0.3 C=C(Br)CCCC(=O)OCC MCULE-1392736167 [1,1,0,0,0,0|0,0,2]=4 583 B10R0.3 C=C(C)CCCC(=O)OCC MCULE-8269913859 [1,1,0,0,0,0|0,0,1]=3 584 B10R0.3 C=C(Cl)CCCC(=O)OCC MCULE-5869761221 [1,1,0,0,0,0|0,0,2]=4 585 B10R0.3 CC(C)CCCC(=O)OCCl MCULE-8902704823 [1,1,0,0,0,0|1,0,0]=3 586 B10R0.3 CC(C)CCOC(=O)CCCl MCULE-2125847369 [1,1,0,0,0,0|2,0,0]=4 587 B10R0.3 CC(O)CCNC(=O)CCN MCULE-4946608332 [1,1,0,0,0,0|2,0,0]=4 588 B10R0.3 CC(O)CCNC(=O)CCN MCULE-6288966938 [1,1,0,0,0,0|2,0,0]=4 589 B10R0.3 CCCC(=O)CCCC(=O)O MCULE-5554652459 [1,1,0,0,0,0|1,0,1]=4 590 B10R0.3 CCCC(=O)OCCC(C)C MCULE-8558213018 [1,1,0,0,0,0|1,0,0]=3 591 B10R0.3 CCCC(C)CCCC(C)C MCULE-5494511129 [1,1,0,0,0,0|1,0,1]=4 592 B10R0.3 CCNC(=O)CCNC(C)C MCULE-6472583133 [1,1,0,0,0,0|2,0,0]=4 593 B10R0.3 CCOC(=O)C=CCC(C)C MCULE-1502115003 [1,1,0,0,0,0|0,0,2]=4 594 B10R0.3 CCOC(=O)CCC=C(C)C MCULE-5818108388 [1,1,0,0,0,0|0,0,2]=4 595 B10R0.3 CCOC(=O)CCCC(=O)C MCULE-7629371322 [1,1,0,0,0,0|0,0,1]=3 596 B10R0.3 CCOC(=O)CCCC(=O)Cl MCULE-7647030650 [1,1,0,0,0,0|1,0,1]=4 597 B10R0.3 CCOC(=O)CCCC(=O)O MCULE-2798972740 [1,1,0,0,0,0|1,0,1]=4 598 B10R0.3 CCOC(=O)CCCC(C)C MCULE-5911402423 [1,1,0,0,0,0|0,0,0]=2 599 B10R0.3 CCOC(=O)CCCC(C)O MCULE-4085625939 [1,1,0,0,0,0|0,0,0]=2 600 B10R0.3 CCOC(=O)CCCN(=O)=O MCULE-9709858397 [1,1,0,0,0,0|2,0,0]=4 601 B10R0.3 CCOC(=O)CCCN(C)C MCULE-7611481357 [1,1,0,0,0,0|1,0,0]=3 602 B10R0.3 CCOC(=O)CCNC(C)C MCULE-3306500848 [1,1,0,0,0,0|1,0,0]=3 603 B10R0.3 CCOC(=O)CCNC(C)C MCULE-7144839681 [1,1,0,0,0,0|1,0,0]=3 604 B10R0.3 CCOC(=O)CNCC(C)C MCULE-6992318383 [1,1,0,0,0,0|1,0,0]=3 605 B10R0.3 CCOC(=O)CNCC(C)C MCULE-7092441665 [1,1,0,0,0,0|1,0,0]=3 606 B10R0.3 CCOC(=O)COCC(C)C MCULE-2087571280 [1,1,0,0,0,0|1,0,0]=3 607 B10R0.3 CCOC(=O)CSCC(=O)C MCULE-7116933404 [1,1,0,0,0,0|1,0,1]=4 608 B10R0.3 CNCC(=O)NCCC(C)O MCULE-2682293113 [1,1,0,0,0,0|2,0,0]=4 609 B10R0.3 CNCC(=O)NCCC(C)O MCULE-4076662639 [1,1,0,0,0,0|2,0,0]=4 610 B10R0.6 CC(C)NC(=O)CCCCO MCULE-3606379707 [1,1,0,0,0,0|2,0,0]=4 611 B10R0.6 CC(C)OC(=O)CSCCO MCULE-4737068485 [1,1,0,0,0,0|2,0,0]=4 612 B10R0.6 CCCCCC(=O)CC(=O)C MCULE-8236892696 [1,1,0,0,0,0|0,0,1]=3 613 B10R0.6 CCCCCC(=O)OC(C)C MCULE-8358011398 [1,1,0,0,0,0|0,0,0]=2 614 B10R0.6 CCCCNC(=O)CC(=O)C MCULE-6483428410 [1,1,0,0,0,0|1,0,1]=4 615 B10R0.6 CCCCOC(=O)CC(=O)C MCULE-4579556378 [1,1,0,0,0,0|1,0,1]=4 616 B10R0.6 CCCCOC(=O)CC(C)C MCULE-9654609926 [1,1,0,0,0,0|1,0,0]=3 617 B10R0.6 CCCCOC(=O)CN(C)C MCULE-8422129490 [1,1,0,0,0,0|2,0,0]=4 618 B10R0.6 CCCOCC(=O)OC(C)C MCULE-1754769634 [1,1,0,0,0,0|1,0,0]=3 619 B10R0.19 C=CCCC(N)C(=O)OCC MCULE-9483839800 [1,1,0,0,0,0|0,0,2]=4 620 B10R0.19 CC=CCC(C)C(=O)OCC MCULE-3134707390 [1,1,0,0,0,0|0,0,2]=4 621 B10R0.19 CCCCC(=O)C(=O)OCC MCULE-8276085890 [1,1,0,0,0,0|0,0,1]=3 622 B10R0.19 CCCCC(Br)C(=O)OCC MCULE-3410486181 [1,1,0,0,0,0|0,0,0]=2 623 B10R0.19 CCCCC(N)C(=O)OCC MCULE-5403085036 [1,1,0,0,0,0|0,0,0]=2 624 B10R0.19 CCCCC(O)C(=O)OCC MCULE-4503955337 [1,1,0,0,0,0|0,0,0]=2 625 B10R0.19 CCCCC(O)C(C)CCC MCULE-3330326729 [1,1,0,0,0,0|1,0,1]=4 626 B10R0.19 CCCCN(C)C(=O)CCN MCULE-2562698746 [1,1,0,0,0,0|2,0,0]=4 627 B10R0.19 CCCCN(C)C(=O)CCN MCULE-5645200969 [1,1,0,0,0,0|2,0,0]=4 628 B10R0.19 CCCCN(C)C(=O)CNC MCULE-6642252315 [1,1,0,0,0,0|2,0,0]=4 629 B10R0.19 CCCCN(C)C(=O)CNC MCULE-9667165591 [1,1,0,0,0,0|2,0,0]=4 630 B10R0.19 CCCNC(=O)C(=O)OCC MCULE-9964881273 [1,1,0,0,0,0|1,0,1]=4 631 B10R0.19 CCOC(=O)C(Br)CCCBr MCULE-3762513838 [1,1,0,0,0,0|1,0,0]=3 632 B10R0.19 CCOC(=O)C(C)CCC#N MCULE-6430803412 [1,1,0,0,0,0|1,0,1]=4 633 B10R0.19 CCOC(=O)C(N)CCCN MCULE-2555939527 [1,1,0,0,0,0|1,0,0]=3 634 B10R0.19 CCOC(=O)C(N)CCCN MCULE-4082808351 [1,1,0,0,0,0|1,0,0]=3 635 B10R0.19 CCOC(=O)C(N)CCCN MCULE-5372876457 [1,1,0,0,0,0|1,0,0]=3 636 B10R0.19 CCOC(=O)C(N)CCCN MCULE-8592429166 [1,1,0,0,0,0|1,0,0]=3 637 B10R0.19 CCOC(=O)C(N)CCSC MCULE-3027327514 [1,1,0,0,0,0|1,0,0]=3 638 B10R0.19 CCOC(=O)C(N)CCSC MCULE-5873613959 [1,1,0,0,0,0|1,0,0]=3 639 B10R0.19 CCOC(=O)C(N)CCSC MCULE-6683307625 [1,1,0,0,0,0|1,0,0]=3 640 B10R0.19 CCOC(=O)C(N)CCSC MCULE-9963255300 [1,1,0,0,0,0|1,0,0]=3 641 B10R0.19 CCOC(=O)C(O)CCSC MCULE-5087273039 [1,1,0,0,0,0|1,0,0]=3 642 B10R0.19 CCOC(=O)[C@@H](N)CCCN MCULE-1256058333 [1,1,0,0,0,0|1,0,0]=3 643 B10R0.19 CCOC(=O)[C@@H](N)CCCN MCULE-1955429029 [1,1,0,0,0,0|1,0,0]=3 644 B10R0.19 CCOC(=O)[C@@H](N)CCCN MCULE-5817990493 [1,1,0,0,0,0|1,0,0]=3 645 B10R0.19 CCOC(=O)[C@@H](N)CCCN MCULE-6543729272 [1,1,0,0,0,0|1,0,0]=3 646 B10R0.19 CCOC(=O)[C@@H](N)CCCN MCULE-6712624243 [1,1,0,0,0,0|1,0,0]=3 647 B10R0.19 CCOC(=O)[C@H](N)CCSC MCULE-2603296581 [1,1,0,0,0,0|1,0,0]=3 648 B10R0.19 CCOC(=O)[C@H](N)CCSC MCULE-6126904564 [1,1,0,0,0,0|1,0,0]=3 649 B10R0.19 CCOC(=O)[C@H](N)CCSC MCULE-6254414481 [1,1,0,0,0,0|1,0,0]=3 650 B10R0.19 CCOC(=O)[C@H](N)CCSC MCULE-6350339090 [1,1,0,0,0,0|1,0,0]=3 651 B10R0.19 [C@H](N)(CCSC)C(=O)OCC MCULE-4024487209 [1,1,0,0,0,0|1,0,0]=3 652 B10R0.19 [C@H](N)(CCSC)C(=O)OCC MCULE-4906972094 [1,1,0,0,0,0|1,0,0]=3 653 B10R0.19 [C@H](N)(CCSC)C(=O)OCC MCULE-5780620225 [1,1,0,0,0,0|1,0,0]=3 654 B10R0.19 [C@H](N)(CCSC)C(=O)OCC MCULE-6331108043 [1,1,0,0,0,0|1,0,0]=3 655 B10R0.24 CCCCCC(CO)CCC MCULE-6284162552 [1,1,0,0,0,0|0,0,2]=4 656 B10R0.83 CCC(Br)C(=O)NCCOC MCULE-5688171174 [1,1,0,0,0,0|2,0,0]=4 657 B10R0.83 CCC(N)C(=O)NCCOC MCULE-5889050655 [1,1,0,0,0,0|2,0,0]=4 658 B10R0.83 CCCCCC(=O)C(C)CC MCULE-8709917766 [1,1,0,0,0,0|0,0,0]=2 659 B10R0.83 CCCCCC(=O)C(N)CO MCULE-3102740681 [1,1,0,0,0,0|1,0,0]=3 660 B10R0.83 CCCCCC(=O)C(N)CO MCULE-5960330140 [1,1,0,0,0,0|1,0,0]=3 661 B10R0.83 CCCCCC(=O)N(C)OC MCULE-5249894432 [1,1,0,0,0,0|2,0,0]=4 662 B10R0.83 CCCCNC(=O)C(Br)CC MCULE-3578309145 [1,1,0,0,0,0|1,0,0]=3 663 B10R0.83 CCCCOC(=O)C(Br)CBr MCULE-8776886510 [1,1,0,0,0,0|2,0,0]=4 664 B10R0.83 CCCCOC(=O)C(C)CC MCULE-2060140981 [1,1,0,0,0,0|1,0,0]=3 665 B10R0.83 CCCCOC(=O)C(O)CC MCULE-9177969209 [1,1,0,0,0,0|1,0,0]=3 666 B10R0.83 CCCCOC(=O)[C@@H](O)CC MCULE-3356665164 [1,1,0,0,0,0|1,0,0]=3 667 B10R0.83 CCCCOC(=O)[C@@H](O)CC MCULE-5141009962 [1,1,0,0,0,0|1,0,0]=3 668 B10R0.83 CC[C@H](N)C(=O)NCCOC MCULE-1647425515 [1,1,0,0,0,0|2,0,0]=4 669 B10R0.108 CCCC(=O)OCC(O)CO MCULE-4269121827 [1,1,0,0,0,0|2,0,0]=4 670 B10R0.108 CCCC(=O)OC[C@@H](O)CO MCULE-8353916476 [1,1,0,0,0,0|2,0,0]=4 671 B10R0.108 CCOC(=O)CCC(=O)CBr MCULE-4688931545 [1,1,0,0,0,0|1,0,1]=4 672 B10R0.108 CCOC(=O)CCC(=O)CC MCULE-8002220473 [1,1,0,0,0,0|0,0,1]=3 673 B10R0.108 CCOC(=O)CCC(=O)CCl MCULE-7997526168 [1,1,0,0,0,0|1,0,1]=4 674 B10R0.108 CCOC(=O)CCC(=O)OC MCULE-6912505912 [1,1,0,0,0,0|1,0,1]=4 675 B10R0.108 CCOC(=O)CNC(=O)CC MCULE-5953118002 [1,1,0,0,0,0|1,0,1]=4 676 B10R0.156 CCCCCC(C)(O)CCC MCULE-5266896365 [1,1,0,0,0,0|0,0,2]=4 677 B10R0.156 CCCCCS(=O)(=O)CCCl MCULE-2373492326 [1,1,0,0,0,0|2,0,0]=4 678 B10R0.156 CCCS(=O)(=O)CCCCN MCULE-9984098044 [1,1,0,0,0,0|2,0,0]=4 679 B10R0.16 CCCCN(C=O)CCCC MCULE-3891457757 [1,1,0,0,0,0|2,0,0]=4 680 B10R0.16 CCCCN(CCCC)N=O MCULE-1738030260 [1,1,0,0,0,0|2,0,0]=4 681 B10R0.18 CCOCC(=O)NC(O)CC MCULE-9464907976 [1,1,0,0,0,0|2,0,0]=4 682 B10R0.78 CC(C)CNC(=O)CCCCl MCULE-4568678212 [1,1,0,0,0,0|2,0,0]=4 683 B10R0.78 CCCCC(=O)OCC(C)C MCULE-8939238983 [1,1,0,0,0,0|0,0,0]=2 684 B10R0.78 CCCOC(=O)CCC(=O)C MCULE-7738434916 [1,1,0,0,0,0|0,0,1]=3 685 B10R0.116 CCCCP(=O)(O)CCCC MCULE-9757433875 [1,1,0,0,0,0|2,0,0]=4 686 B10R0.116 CCCCS(=O)(=O)CCCC MCULE-3370660331 [1,1,0,0,0,0|2,0,0]=4 687 B10R0.116 CCCOP(=O)(Cl)OCCC MCULE-6713329439 [1,1,0,0,0,0|2,0,0]=4 688 B10R0.116 CCCOS(=O)(=O)OCCC MCULE-4657458669 [1,1,0,0,0,0|2,0,0]=4 689 B10R0.4 CCCCCCCCC(C)C MCULE-3505579656 [1,1,0,0,0,0|1,0,1]=4 690 B10R0.4 CCCCCCCCC(C)O MCULE-3577613701 [1,1,0,0,0,0|1,0,1]=4 691 B10R0.4 CCCCCCCC[C@@H](C)Br MCULE-8624556030 [1,1,0,0,0,0|1,0,1]=4 692 B10R0.4 CCCCCCCC[C@@H](C)O MCULE-6511994487 [1,1,0,0,0,0|1,0,1]=4 693 B10R0.4 CCCCCCCC[C@H](C)O MCULE-7200709868 [1,1,0,0,0,0|1,0,1]=4 694 B10R0.4 CCCCCCNCC(C)O MCULE-5617215322 [1,1,0,0,0,0|1,0,1]=4 695 B10R0.4 [C@H](C)(O)CCCCCCCC MCULE-7849954701 [1,1,0,0,0,0|1,0,1]=4 696 B10R0.71 C(=CCCCCO)CCCC MCULE-5192933185 [1,1,0,0,0,0|1,0,1]=4 697 B10R0.71 CCCC/C=C/CCCCO MCULE-8537897542 [1,1,0,0,0,0|1,0,1]=4 698 B10R0.71 CCCC/C=C\CCCCO MCULE-8382129018 [1,1,0,0,0,0|1,0,1]=4 699 B10R0.71 CCCCC#CCCCCC MCULE-9228856431 [1,1,0,0,0,0|1,0,1]=4 700 B10R0.71 CCCCC/C=C/CCC=O MCULE-6310350913 [1,1,0,0,0,0|1,0,1]=4 701 B10R0.71 CCCCC/C=C\CCC=O MCULE-2454675705 [1,1,0,0,0,0|1,0,1]=4 702 B10R0.71 CCCCC/C=C\CCCO MCULE-5673742797 [1,1,0,0,0,0|1,0,0]=3 703 B10R0.71 CCCCCC=CCCC=O MCULE-4591548304 [1,1,0,0,0,0|1,0,1]=4 704 B10R0.71 CCCCCC=CCCCO MCULE-4774794120 [1,1,0,0,0,0|1,0,0]=3 705 B10R0.71 CCCCCCC=CCCO MCULE-7637000822 [1,1,0,0,0,0|2,0,0]=4 706 B10R0.71 CCCCCCCCCCBr MCULE-1805531766 [1,1,0,0,0,0|1,0,1]=4 707 B10R0.71 CCCCCCCCCCC MCULE-7319807036 [1,1,0,0,0,0|1,0,1]=4 708 B10R0.71 CCCCCCCCCCCl MCULE-7602190189 [1,1,0,0,0,0|1,0,1]=4 709 B10R0.71 CCCCCCCCCCF MCULE-6490238051 [1,1,0,0,0,0|1,0,1]=4 710 B10R0.71 CCCCCCCCCCI MCULE-6718970716 [1,1,0,0,0,0|1,0,1]=4 711 B10R0.71 CCCCCCCCCCN MCULE-3389198970 [1,1,0,0,0,0|1,0,1]=4 712 B10R0.71 CCCCCCCCCCO MCULE-7579570663 [1,1,0,0,0,0|1,0,1]=4 713 B10R0.71 CCCCCCCCCCS MCULE-5945458624 [1,1,0,0,0,0|1,0,1]=4 714 B10R0.71 CCCCCCCCCNC MCULE-3969866054 [1,1,0,0,0,0|1,0,1]=4 715 B10R0.71 CCCCCCCCCNC MCULE-6631883657 [1,1,0,0,0,0|1,0,1]=4 716 B10R0.71 CCCCCCCCCOC MCULE-3906263885 [1,1,0,0,0,0|1,0,1]=4 717 B10R0.71 CCCCCCCCCSC MCULE-9001057781 [1,1,0,0,0,0|1,0,1]=4 718 B10R0.71 CCCCCCCCOCC MCULE-7803614357 [1,1,0,0,0,0|1,0,1]=4 719 B10R0.71 CCCCCCCOCCCl MCULE-9608529645 [1,1,0,0,0,0|1,0,1]=4 720 B10R0.71 CCCCCCCOCCO MCULE-4391734532 [1,1,0,0,0,0|1,0,1]=4 721 B10R0.71 CCCCCCCOCCS MCULE-8215096371 [1,1,0,0,0,0|1,0,1]=4 722 B10R0.71 CCCCCCNCCCC MCULE-1698769182 [1,1,0,0,0,0|1,0,1]=4 723 B10R0.71 CCCCCCNCCCCl MCULE-2065775862 [1,1,0,0,0,0|1,0,1]=4 724 B10R0.71 CCCCCCNCCCN MCULE-7482733368 [1,1,0,0,0,0|1,0,1]=4 725 B10R0.71 CCCCCC[NH2+]CCCCl MCULE-1476963531 [1,1,0,0,0,0|1,0,1]=4 726 B10R0.71 CCCCCNCCCCC MCULE-6460289904 [1,1,0,0,0,0|1,0,1]=4 727 B10R0.71 CCCCCNCCCCC MCULE-7466612345 [1,1,0,0,0,0|1,0,1]=4 728 B10R0.71 CCCCCNCCCOC MCULE-8182280213 [1,1,0,0,0,0|2,0,0]=4 729 B10R0.71 CCCCCOCCCCC MCULE-2510849143 [1,1,0,0,0,0|1,0,1]=4 730 B10R0.71 CCCCCSCCCCC MCULE-3839664161 [1,1,0,0,0,0|1,0,1]=4 731 B10R0.71 CCCCNCCOCCO MCULE-6722908845 [1,1,0,0,0,0|1,0,1]=4 732 B10R0.71 CCCCOCCOCCCl MCULE-8993573654 [1,1,0,0,0,0|1,0,1]=4 733 B10R0.71 CCCCOCCOCCN MCULE-5064402317 [1,1,0,0,0,0|1,0,1]=4 734 B10R0.71 CCCCOCCOCCO MCULE-9776383171 [1,1,0,0,0,0|1,0,1]=4 735 B10R0.71 CCCCOCCOCCS MCULE-8185433281 [1,1,0,0,0,0|1,0,1]=4 736 B10R0.71 CCCCOCOCCCC MCULE-5701893914 [1,1,0,0,0,0|1,0,1]=4 737 B10R0.71 CCCCSCCOCCO MCULE-8485842279 [1,1,0,0,0,0|1,0,1]=4 738 B10R0.71 OCCCCCCOCCO MCULE-5642986797 [1,1,0,0,0,0|1,0,1]=4 739 B10R0.71 OCCOCCCCCCCl MCULE-3240737723 [1,1,0,0,0,0|1,0,1]=4 740 B10R0.71 [NH2+](CCCC)CCCCCC MCULE-8926764515 [1,1,0,0,0,0|1,0,1]=4 741 B10R0.74 CCCCCCCC(N)CC MCULE-5023964032 [1,1,0,0,0,0|1,0,1]=4 742 B10R0.74 CCCCCCCC(O)CC MCULE-5420300699 [1,1,0,0,0,0|1,0,1]=4 743 B10R0.74 CCCCCCC[C@@H](C)CC MCULE-8718967535 [1,1,0,0,0,0|1,0,1]=4 744 B10R0.74 CCCCCCOC(=O)CC MCULE-7750085667 [1,1,0,0,0,0|0,0,2]=4 745 B12R0.103 CCCCC(=O)OC(=O)CCCC MCULE-2570411475 [0,2,0,0,0,0|1,0,1]=4 746 B12R0.103 CCCCS(=O)CC(O)COCC MCULE-1956705911 [0,2,0,0,0,0|2,0,0]=4 747 B12R0.103 CCCNC(=O)CC(=O)NCCC MCULE-2149653607 [0,2,0,0,0,0|1,0,1]=4 748 B12R0.103 CCCOC(=O)CC(=O)OCCC MCULE-9263956737 [0,2,0,0,0,0|0,0,1]=3 749 B12R0.239 CCCCCC(=O)CC(=O)OCC MCULE-5338610169 [0,2,0,0,0,0|1,0,1]=4 750 B12R0.239 CCCCCC(C)OC(=O)CCC MCULE-5985723386 [0,2,0,0,0,0|1,0,1]=4 751 B12R0.239 CCCCOC(=O)CC(=O)OCC MCULE-2106345446 [0,2,0,0,0,0|1,0,1]=4 752 B12R0.351 CCCCC(CC)C(=O)NCCO MCULE-9301952330 [0,2,0,0,0,0|2,0,0]=4 753 B12R0.351 CCCCC(CC)C(=O)OCCC MCULE-1852439276 [0,2,0,0,0,0|0,0,0]=2 754 B12R0.351 CCCCC(CC)C(=O)OCCO MCULE-9179912722 [0,2,0,0,0,0|1,0,0]=3 755 B12R0.351 CCCCN(CC)C(=O)SCCC MCULE-6410417918 [0,2,0,0,0,0|1,1,0]=4 756 B12R0.648 NCCCCC(N)C(=O)OCCN MCULE-2011773374 [0,2,0,0,0,0|1,0,0]=3 757 B12R0.648 NCCCCC(N)C(=O)OCCN MCULE-8369070558 [0,2,0,0,0,0|1,0,0]=3 758 B12R0.255 CCCCCCC(=O)OCC(C)C MCULE-8336851336 [0,2,0,0,0,0|0,0,0]=2 759 B12R0.255 CCCCOCC(C)OCC(C)O MCULE-4397681306 [0,2,0,0,0,0|1,0,1]=4 760 B12R0.649 CCCCNC(=O)OCC(F)(F)F MCULE-4214012019 [0,2,0,0,0,0|2,0,0]=4 761 B12R0.101 CCCCC(=O)CCC(=O)OCC MCULE-1267611941 [0,2,0,0,0,0|1,0,1]=4 762 B12R0.47 CCCCCCC(=O)CCCCC MCULE-2532885187 [0,2,0,0,0,0|1,0,0]=3 763 B12R0.47 CCCCCCC(=O)OCCCC MCULE-4457155333 [0,2,0,0,0,0|0,0,0]=2 764 B12R0.47 CCCCCNC(=O)CCCCC MCULE-5372642883 [0,2,0,0,0,0|1,0,0]=3 765 B12R0.47 CCCCCOC(=O)CCCCC MCULE-4135523920 [0,2,0,0,0,0|0,0,0]=2 766 B12R0.47 CCCCNCC(=O)NCCCC MCULE-5618439996 [0,2,0,0,0,0|1,0,0]=3 767 B12R0.95 C=CCOC(=O)COCCC(C)C MCULE-3900495779 [0,2,0,0,0,0|0,0,2]=4 768 B12R0.95 CCCCC(=O)CCCCC(=O)O MCULE-6207970958 [0,2,0,0,0,0|1,0,1]=4 769 B12R0.95 CCCCC(=O)NCCCN(C)C MCULE-1822046750 [0,2,0,0,0,0|2,0,0]=4 770 B12R0.95 CCCCC(=O)NCCCN(C)C MCULE-6676827597 [0,2,0,0,0,0|2,0,0]=4 771 B12R0.95 CCCOC(=O)NCCCN(C)C MCULE-8599507654 [0,2,0,0,0,0|1,0,0]=3 772 B12R0.95 CCCOC(=O)NCCCN(C)C MCULE-9177623403 [0,2,0,0,0,0|1,0,0]=3 773 B12R0.95 O=C(O)CCCCC(=O)OCCO MCULE-1346681356 [0,2,0,0,0,0|1,0,1]=4 774 B12R0.111 CCCCC/C=C(\C=O)/CCCC MCULE-7619150531 [0,2,0,0,0,0|1,0,0]=3 775 B12R0.111 CCCCCC=C(C=O)CCCC MCULE-9092365556 [0,2,0,0,0,0|1,0,0]=3 776 B12R0.114 CCOC(=O)C(=O)CCCCCCl MCULE-5451364428 [0,2,0,0,0,0|2,0,0]=4 777 B12R0.206 C=CCOC(=O)NCCCCCN MCULE-8155188853 [0,2,0,0,0,0|0,0,2]=4 778 B12R0.206 C=CCOC(=O)NCCCCCN MCULE-9515737783 [0,2,0,0,0,0|0,0,2]=4 779 B12R0.206 C=CCOC(=O)NCCCCCO MCULE-4464976861 [0,2,0,0,0,0|0,0,2]=4 780 B12R0.206 CCC=CCCOC(=O)CCCC MCULE-6814187041 [0,2,0,0,0,0|1,0,1]=4 781 B12R0.206 CCCC=CCOC(=O)CCCC MCULE-8437069176 [0,2,0,0,0,0|1,0,1]=4 782 B12R0.206 CCCCCCCC(=O)CCCC MCULE-8871455068 [0,2,0,0,0,0|1,0,0]=3 783 B12R0.206 CCCCCCCC(=O)NCCO MCULE-8854560543 [0,2,0,0,0,0|2,0,0]=4 784 B12R0.206 CCCCCCCC(=O)OCCC MCULE-5108681764 [0,2,0,0,0,0|0,0,0]=2 785 B12R0.206 CCCCCCCC(=O)SCCO MCULE-1605041145 [0,2,0,0,0,0|1,1,0]=4 786 B12R0.585 CCCCS(=O)(=O)CCCCCCl MCULE-4025809290 [0,2,0,0,0,0|2,0,0]=4 787 B12R0.585 CCCCS(=O)(=O)CCCCCN MCULE-3539677372 [0,2,0,0,0,0|2,0,0]=4 788 B12R0.585 CCCCS(=O)(=O)CCCCCO MCULE-2307842979 [0,2,0,0,0,0|2,0,0]=4 789 B12R0.233 CCCCCC(=O)CCCC(=O)O MCULE-7183792222 [0,2,0,0,0,0|1,0,1]=4 790 B12R0.233 CCCCCC(=O)NCCC(=O)O MCULE-7265291580 [0,2,0,0,0,0|1,0,1]=4 791 B12R0.233 CCCCCC(=O)OCCC(C)C MCULE-8207163347 [0,2,0,0,0,0|0,0,0]=2 792 B12R0.634 CCCCCS(=O)(=O)CCCCN MCULE-3299950975 [0,2,0,0,0,0|2,0,0]=4 793 B12R0.634 CCCCOP(=O)(C)OCCCC MCULE-3344736841 [0,2,0,0,0,0|2,0,0]=4 794 B12R0.634 CCCCOP(=O)(O)OCCCC MCULE-2587309708 [0,2,0,0,0,0|2,0,0]=4 795 B12R0.634 CCCCOP(=O)([S-])OCCCC MCULE-8051885290 [0,2,0,0,0,0|2,0,0]=4 796 B12R0.634 CCCCOS(=O)(=O)OCCCC MCULE-1750950740 [0,2,0,0,0,0|2,0,0]=4 797 B12R0.110 CCCCNC(=O)C(N)C(C)CC MCULE-8808106459 [0,2,0,0,0,0|2,0,0]=4 798 B12R0.110 CCCCNC(=O)[C@@H](N)[C@@H](C)CC MCULE-6389887127 [0,2,0,0,0,0|2,0,0]=4 799 B10R1.10 CCCC1CC(=O)CCN1 MCULE-1509807204 [1,0,0,1,0,0|1,0,0]=3 800 B10R1.10 CCCC1CC(=O)CCN1 MCULE-1669137140 [1,0,0,1,0,0|1,0,0]=3 801 B10R1.10 CCCC1CC(=O)CCO1 MCULE-7566764510 [1,0,0,1,0,0|1,0,0]=3 802 B10R1.10 CCCC1CCCC(=O)C1 MCULE-7668769463 [1,0,0,1,0,0|0,0,0]=2 803 B10R1.10 CCCC1CCCC(=O)O1 MCULE-9181432444 [1,0,0,1,0,0|1,0,0]=3 804 B10R1.10 CCCC1CCCC(C1)O MCULE-6301598723 [1,0,0,1,0,0|0,0,2]=4 805 B10R1.10 CCCC1CCNC(=O)C1 MCULE-2999950135 [1,0,0,1,0,0|1,0,0]=3 806 B10R1.10 CCOC1CCCC(=O)C1 MCULE-1985935662 [1,0,0,1,0,0|1,0,0]=3 807 B10R1.10 COCC1CCCC(=O)C1 MCULE-5201599537 [1,0,0,1,0,0|1,0,0]=3 808 B10R1.10 O=C1CCCC(O1)CCBr MCULE-4728327671 [1,0,0,1,0,0|2,0,0]=4 809 B10R1.11 CCCC(=O)C1CCCC1 MCULE-4828860258 [1,0,0,1,0,0|0,0,0]=2 810 B10R1.11 CCCC(N)C1CCCC1 MCULE-5066983455 [1,0,0,1,0,0|1,0,1]=4 811 B10R1.11 CCNC(=O)C1CCCN1 MCULE-8506501038 [1,0,0,1,0,0|2,0,0]=4 812 B10R1.11 CCNC(=O)C1CCCN1 MCULE-9698842836 [1,0,0,1,0,0|2,0,0]=4 813 B10R1.11 CCNC(=O)C1CCNC1 MCULE-6586262124 [1,0,0,1,0,0|2,0,0]=4 814 B10R1.11 CCNC(=O)[C@@H]1CCCN1 MCULE-3926288586 [1,0,0,1,0,0|2,0,0]=4 815 B10R1.11 CCNC(=O)[C@@H]1CCCN1 MCULE-4770991359 [1,0,0,1,0,0|2,0,0]=4 816 B10R1.11 CCNC(=O)[C@@H]1CCCN1 MCULE-8041890978 [1,0,0,1,0,0|2,0,0]=4 817 B10R1.11 CCNC(=O)[C@@H]1CCCN1 MCULE-9049907771 [1,0,0,1,0,0|2,0,0]=4 818 B10R1.11 CCOC(=O)C1=CCCC1 MCULE-9883764892 [1,0,0,1,0,0|0,0,2]=4 819 B10R1.11 CCOC(=O)C1CC=CC1 MCULE-2916224315 [1,0,0,1,0,0|0,0,2]=4 820 B10R1.11 CCOC(=O)C1CCC=N1 MCULE-6045177128 [1,0,0,1,0,0|1,0,1]=4 821 B10R1.11 CCOC(=O)C1CCCC1 MCULE-2663692680 [1,0,0,1,0,0|0,0,0]=2 822 B10R1.11 CCOC(=O)C1CCCN1 MCULE-1775024232 [1,0,0,1,0,0|1,0,0]=3 823 B10R1.11 CCOC(=O)C1CCCN1 MCULE-1903883256 [1,0,0,1,0,0|1,0,0]=3 824 B10R1.11 CCOC(=O)C1CCCN1 MCULE-3451901294 [1,0,0,1,0,0|1,0,0]=3 825 B10R1.11 CCOC(=O)C1CCCN1 MCULE-7141672180 [1,0,0,1,0,0|1,0,0]=3 826 B10R1.11 CCOC(=O)C1CCCO1 MCULE-5716361491 [1,0,0,1,0,0|1,0,0]=3 827 B10R1.11 CCOC(=O)C1CCNC1 MCULE-7115213916 [1,0,0,1,0,0|1,0,0]=3 828 B10R1.11 CCOC(=O)C1CCNC1 MCULE-9152531741 [1,0,0,1,0,0|1,0,0]=3 829 B10R1.11 CCOC(=O)C1CCNC1 MCULE-9679994536 [1,0,0,1,0,0|1,0,0]=3 830 B10R1.11 CCOC(=O)C1CCNO1 MCULE-1209750622 [1,0,0,1,0,0|2,0,0]=4 831 B10R1.11 CCOC(=O)C1CCNO1 MCULE-9991760871 [1,0,0,1,0,0|2,0,0]=4 832 B10R1.11 CCOC(=O)C1CCOC1 MCULE-3052876388 [1,0,0,1,0,0|1,0,0]=3 833 B10R1.11 CCOC(=O)C1CSCN1 MCULE-6252748544 [1,0,0,1,0,0|2,0,0]=4 834 B10R1.11 CCOC(=O)C1CSCN1 MCULE-6823622066 [1,0,0,1,0,0|2,0,0]=4 835 B10R1.11 CCOC(=O)C1CSCN1 MCULE-8253189538 [1,0,0,1,0,0|2,0,0]=4 836 B10R1.11 CCOC(=O)C1CSCN1 MCULE-9110164814 [1,0,0,1,0,0|2,0,0]=4 837 B10R1.11 CCOC(=O)C1SCCS1 MCULE-2057673965 [1,0,0,1,0,0|2,0,0]=4 838 B10R1.11 CCOC(=O)N1CCCC1 MCULE-8096151948 [1,0,0,1,0,0|1,0,0]=3 839 B10R1.11 CCOC(=O)[C@@H]1CCCN1 MCULE-1006300490 [1,0,0,1,0,0|1,0,0]=3 840 B10R1.11 CCOC(=O)[C@@H]1CCCN1 MCULE-1035245823 [1,0,0,1,0,0|1,0,0]=3 841 B10R1.11 CCOC(=O)[C@@H]1CCCN1 MCULE-9416117855 [1,0,0,1,0,0|1,0,0]=3 842 B10R1.11 CCOC(=O)[C@@H]1CCCN1 MCULE-9593799755 [1,0,0,1,0,0|1,0,0]=3 843 B10R1.11 CCOC(=O)[C@@H]1CCNC1 MCULE-1030296291 [1,0,0,1,0,0|1,0,0]=3 844 B10R1.11 CCOC(=O)[C@@H]1CCNC1 MCULE-3397421108 [1,0,0,1,0,0|1,0,0]=3 845 B10R1.11 CCOC(=O)[C@@H]1CCNC1 MCULE-6990100207 [1,0,0,1,0,0|1,0,0]=3 846 B10R1.11 CCOC(=O)[C@@H]1CCNC1 MCULE-9366097368 [1,0,0,1,0,0|1,0,0]=3 847 B10R1.11 CCOC(=O)[C@@H]1CCON1 MCULE-3729113893 [1,0,0,1,0,0|2,0,0]=4 848 B10R1.11 CCOC(=O)[C@@H]1CCON1 MCULE-6736733188 [1,0,0,1,0,0|2,0,0]=4 849 B10R1.11 CCOC(=O)[C@@H]1CSCN1 MCULE-4756168618 [1,0,0,1,0,0|2,0,0]=4 850 B10R1.11 CCOC(=O)[C@@H]1CSCN1 MCULE-8756699166 [1,0,0,1,0,0|2,0,0]=4 851 B10R1.11 CCOC(=O)[C@@H]1CSCN1 MCULE-8987874947 [1,0,0,1,0,0|2,0,0]=4 852 B10R1.11 CCOC(=O)[C@@H]1CSCN1 MCULE-9514058691 [1,0,0,1,0,0|2,0,0]=4 853 B10R1.11 CCOC(=O)[C@H]1CCCN1 MCULE-2328365610 [1,0,0,1,0,0|1,0,0]=3 854 B10R1.11 CCOC(=O)[C@H]1CCCN1 MCULE-5190774028 [1,0,0,1,0,0|1,0,0]=3 855 B10R1.11 CCOC(=O)[C@H]1CCCN1 MCULE-5314111018 [1,0,0,1,0,0|1,0,0]=3 856 B10R1.11 CCOC(=O)[C@H]1CCCN1 MCULE-5778937284 [1,0,0,1,0,0|1,0,0]=3 857 B10R1.11 CCOC(=O)[C@H]1CCNC1 MCULE-6332593882 [1,0,0,1,0,0|1,0,0]=3 858 B10R1.11 CCOC(=O)[C@H]1CCNC1 MCULE-7146498882 [1,0,0,1,0,0|1,0,0]=3 859 B10R1.11 CCOC(=O)[C@H]1CCNC1 MCULE-7300719682 [1,0,0,1,0,0|1,0,0]=3 860 B10R1.11 CCOC(=O)[C@H]1CCNC1 MCULE-9965557527 [1,0,0,1,0,0|1,0,0]=3 861 B10R1.11 CCOC(=O)[C@H]1CCON1 MCULE-2197016826 [1,0,0,1,0,0|2,0,0]=4 862 B10R1.11 CCOC(=O)[C@H]1CCON1 MCULE-8879475586 [1,0,0,1,0,0|2,0,0]=4 863 B10R1.11 CNCC(=O)N1CCCC1 MCULE-5091589985 [1,0,0,1,0,0|2,0,0]=4 864 B10R1.11 CNCC(=O)N1CCCC1 MCULE-8771660595 [1,0,0,1,0,0|2,0,0]=4 865 B10R1.11 COCC(=O)C1CCCC1 MCULE-3230477016 [1,0,0,1,0,0|1,0,0]=3 866 B10R1.11 N#CCC(=O)C1CCCC1 MCULE-9734422429 [1,0,0,1,0,0|1,0,1]=4 867 B10R1.11 NCCC(=O)N1CCCC1 MCULE-7334189982 [1,0,0,1,0,0|2,0,0]=4 868 B10R1.11 NCCC(=O)N1CCCC1 MCULE-8876145191 [1,0,0,1,0,0|2,0,0]=4 869 B10R1.11 O=C(CCCl)N1CCCC1 MCULE-7633830345 [1,0,0,1,0,0|2,0,0]=4 870 B10R1.11 O=C(OCCl)C1CCCC1 MCULE-8357474598 [1,0,0,1,0,0|1,0,0]=3 871 B10R1.11 O=C(OCCl)N1CCCC1 MCULE-8634733063 [1,0,0,1,0,0|2,0,0]=4 872 B10R1.19 CCC1CCCCCC1=O MCULE-8032779658 [1,0,0,1,0,0|0,0,0]=2 873 B10R1.19 CCC1NCCCNC1=O MCULE-3991998861 [1,0,0,1,0,0|2,0,0]=4 874 B10R1.19 CCN1CCCNCC1=O MCULE-3571024405 [1,0,0,1,0,0|2,0,0]=4 875 B10R1.19 CCN1CCCNCC1=O MCULE-4254439389 [1,0,0,1,0,0|2,0,0]=4 876 B10R1.19 CCN1CCNCCC1=O MCULE-7164789319 [1,0,0,1,0,0|2,0,0]=4 877 B10R1.19 CCN1CCNCCC1=O MCULE-9020529314 [1,0,0,1,0,0|2,0,0]=4 878 B10R1.19 CC[C@@H]1NCCCNC1=O MCULE-5830249410 [1,0,0,1,0,0|2,0,0]=4 879 B10R1.19 CC[C@H]1NCCCNC1=O MCULE-4266677415 [1,0,0,1,0,0|2,0,0]=4 880 B10R1.19 N#CC1CCCCCC1=O MCULE-1907886746 [1,0,0,1,0,0|1,0,1]=4 881 B10R1.19 NCC1CCCCNC1=O MCULE-1946763373 [1,0,0,1,0,0|2,0,0]=4 882 B10R1.19 NCC1CCCCNC1=O MCULE-4514221590 [1,0,0,1,0,0|2,0,0]=4 883 B10R1.19 O=C1CCCCCN1CO MCULE-8622356666 [1,0,0,1,0,0|2,0,0]=4 884 B10R1.19 O=C1NCCCCC1CBr MCULE-4441145418 [1,0,0,1,0,0|2,0,0]=4 885 B10R1.19 O=C1NCCCCC1CO MCULE-8501668247 [1,0,0,1,0,0|2,0,0]=4 886 B10R1.21 CCCCCC1CCCC1 MCULE-2927062716 [1,0,0,1,0,0|1,0,1]=4 887 B10R1.21 CCCCCC1OCCO1 MCULE-1814222548 [1,0,0,1,0,0|0,0,2]=4 888 B10R1.25 CC1NC(=O)CCC1CN MCULE-1206731946 [1,0,0,1,0,0|2,0,0]=4 889 B10R1.25 CC1NC(=O)CCC1CN MCULE-1921458347 [1,0,0,1,0,0|2,0,0]=4 890 B10R1.25 CCN1CCC(=O)CC1C MCULE-6933399002 [1,0,0,1,0,0|1,0,0]=3 891 B10R1.29 CCCCC1=CCCC1=O MCULE-3298793962 [1,0,0,1,0,0|0,0,2]=4 892 B10R1.29 CCCCC1CCCC1=O MCULE-7853231747 [1,0,0,1,0,0|0,0,0]=2 893 B10R1.29 CCCCC1CCCC1N MCULE-4431843178 [1,0,0,1,0,0|1,0,1]=4 894 B10R1.29 CCCCN1CCCC1=O MCULE-4214883053 [1,0,0,1,0,0|1,0,0]=3 895 B10R1.29 CCOCC1CCCC1=O MCULE-9114631954 [1,0,0,1,0,0|1,0,0]=3 896 B10R1.29 CNCCN1CCCC1=O MCULE-4360482877 [1,0,0,1,0,0|2,0,0]=4 897 B10R1.29 CNCCN1CCCC1=O MCULE-6909271074 [1,0,0,1,0,0|2,0,0]=4 898 B10R1.29 COCCC1CCCC1=O MCULE-3820027368 [1,0,0,1,0,0|1,0,0]=3 899 B10R1.29 COCCC1CCNC1=O MCULE-3116351154 [1,0,0,1,0,0|2,0,0]=4 900 B10R1.29 COCOC1CCCC1=O MCULE-4014159200 [1,0,0,1,0,0|2,0,0]=4 901 B10R1.29 N#CCCC1CCCC1=O MCULE-5481171300 [1,0,0,1,0,0|1,0,1]=4 902 B10R1.29 NCCCC1CCOC1=O MCULE-4266690176 [1,0,0,1,0,0|1,0,0]=3 903 B10R1.29 NCCCC1CCOC1=O MCULE-9834041839 [1,0,0,1,0,0|1,0,0]=3 904 B10R1.29 NCCCN1CCCC1=O MCULE-7525290934 [1,0,0,1,0,0|2,0,0]=4 905 B10R1.29 NCCCN1CCOC1=O MCULE-4075677949 [1,0,0,1,0,0|2,0,0]=4 906 B10R1.29 NCCCN1CCOC1=O MCULE-6730610957 [1,0,0,1,0,0|2,0,0]=4 907 B10R1.29 O=C1CCCC1CCCF MCULE-9345325426 [1,0,0,1,0,0|1,0,0]=3 908 B10R1.29 O=C1CCCN1CCCCl MCULE-6294076675 [1,0,0,1,0,0|2,0,0]=4 909 B10R1.29 O=C1CCCN1CCCO MCULE-5493768478 [1,0,0,1,0,0|2,0,0]=4 910 B10R1.29 O=C1OCCN1CCCBr MCULE-9124926426 [1,0,0,1,0,0|2,0,0]=4 911 B10R1.77 O=C1CCCCCC(=O)C1 MCULE-5507646577 [1,0,0,1,0,0|1,0,1]=4 912 B10R1.77 O=C1CCCCCC(=O)O1 MCULE-4901663442 [1,0,0,1,0,0|1,0,1]=4 913 B10R1.78 O=C1CCCCCCCC1 MCULE-1205201333 [1,0,0,1,0,0|0,0,0]=2 914 B10R1.78 O=C1CCCCCCCN1 MCULE-2754830482 [1,0,0,1,0,0|1,0,0]=3 915 B10R1.78 O=C1CCCCCCCO1 MCULE-8839309567 [1,0,0,1,0,0|0,0,0]=2 916 B10R1.79 O=C1CCCC(=O)CCC1 MCULE-2006786254 [1,0,0,1,0,0|1,0,1]=4 917 B10R1.79 O=C1CCCC(CCC1)O MCULE-4016461466 [1,0,0,1,0,0|1,0,0]=3 918 B10R1.85 NCCC1=CCCCCC1 MCULE-4125734570 [1,0,0,1,0,0|2,0,0]=4 919 B10R1.85 NCCC1=CCCCCC1 MCULE-6059430273 [1,0,0,1,0,0|2,0,0]=4 920 B10R1.135 CCOC(=O)C1CC1C#N MCULE-2037389327 [1,0,0,1,0,0|1,0,1]=4 921 B10R1.135 CCOC(=O)C1CC1C=O MCULE-4411928205 [1,0,0,1,0,0|1,0,1]=4 922 B10R1.135 CCOC(=O)C1CC1CBr MCULE-6084968129 [1,0,0,1,0,0|1,0,0]=3 923 B10R1.135 CCOC(=O)C1CC1CO MCULE-5409175813 [1,0,0,1,0,0|1,0,0]=3 924 B10R1.135 CCOC(=O)[C@@H]1C[C@@H]1C#N MCULE-4576349370 [1,0,0,1,0,0|1,0,1]=4 925 B10R1.135 CCOC(=O)[C@@H]1C[C@@H]1C#N MCULE-6654045746 [1,0,0,1,0,0|1,0,1]=4 926 B10R1.135 CCOC(=O)[C@@H]1C[C@@H]1CO MCULE-5599332272 [1,0,0,1,0,0|1,0,0]=3 927 B10R1.135 CCOC(=O)[C@@H]1C[C@H]1C#N MCULE-2286763484 [1,0,0,1,0,0|1,0,1]=4 928 B10R1.135 CCOC(=O)[C@@H]1C[C@H]1C#N MCULE-7550268937 [1,0,0,1,0,0|1,0,1]=4 929 B10R1.135 CCOC(=O)[C@@H]1C[C@H]1CC MCULE-8044030961 [1,0,0,1,0,0|0,0,0]=2 930 B10R1.135 CCOC(=O)[C@@H]1C[C@H]1CO MCULE-4890993826 [1,0,0,1,0,0|1,0,0]=3 931 B10R1.135 CCOC(=O)[C@H]1C[C@@H]1C=O MCULE-4273587216 [1,0,0,1,0,0|1,0,1]=4 932 B10R1.135 CCOC(=O)[C@H]1C[C@@H]1CN MCULE-1373238494 [1,0,0,1,0,0|1,0,0]=3 933 B10R1.135 CCOC(=O)[C@H]1C[C@@H]1CN MCULE-2443716725 [1,0,0,1,0,0|1,0,0]=3 934 B10R1.135 CCOC(=O)[C@H]1C[C@@H]1CN MCULE-4844887669 [1,0,0,1,0,0|1,0,0]=3 935 B10R1.135 CCOC(=O)[C@H]1C[C@@H]1CN MCULE-9541430173 [1,0,0,1,0,0|1,0,0]=3 936 B10R1.135 CCOC(=O)[C@H]1C[C@@H]1CO MCULE-3086555442 [1,0,0,1,0,0|1,0,0]=3 937 B10R1.135 CCOC(=O)[C@H]1C[C@@H]1CO MCULE-7050125487 [1,0,0,1,0,0|1,0,0]=3 938 B10R1.135 CCOC(=O)[C@H]1C[C@H]1CO MCULE-2707024886 [1,0,0,1,0,0|1,0,0]=3 939 B10R1.135 CCOC(=O)[C@H]1C[C@H]1CO MCULE-2769503441 [1,0,0,1,0,0|1,0,0]=3 940 B10R1.135 [C@@H]1(C[C@H]1C(=O)OCC)C#N MCULE-9885197395 [1,0,0,1,0,0|1,0,1]=4 941 B10R1.135 [C@H]1(C[C@H]1C(=O)OCC)C#N MCULE-2667886498 [1,0,0,1,0,0|1,0,1]=4 942 B10R1.137 CCNC(=O)NC1CCC1 MCULE-6967655165 [1,0,0,1,0,0|2,0,0]=4 943 B10R1.137 CCOC(=O)C=C1CCC1 MCULE-8612971671 [1,0,0,1,0,0|0,0,2]=4 944 B10R1.137 CCOC(=O)CC1CCC1 MCULE-3214468910 [1,0,0,1,0,0|0,0,0]=2 945 B10R1.137 CCOC(=O)CC1CCO1 MCULE-7631610817 [1,0,0,1,0,0|1,0,0]=3 946 B10R1.137 CCOC(=O)CC1CNC1 MCULE-2494284664 [1,0,0,1,0,0|1,0,0]=3 947 B10R1.137 CCOC(=O)CC1CNC1 MCULE-5393504475 [1,0,0,1,0,0|1,0,0]=3 948 B10R1.137 CCOC(=O)CC1CNC1 MCULE-9594842551 [1,0,0,1,0,0|1,0,0]=3 949 B10R1.137 CCOC(=O)CC1COC1 MCULE-4428687625 [1,0,0,1,0,0|1,0,0]=3 950 B10R1.138 CCCC(=O)OCC1CO1 MCULE-7498637039 [1,0,0,1,0,0|2,0,0]=4 951 B10R1.138 CCCC(=O)OCC1CO1 MCULE-7738461686 [1,0,0,1,0,0|2,0,0]=4 952 B10R1.138 CCCC(=O)OC[C@@H]1CO1 MCULE-4174717115 [1,0,0,1,0,0|2,0,0]=4 953 B10R1.138 CCCC(=O)OC[C@@H]1CO1 MCULE-9788663505 [1,0,0,1,0,0|2,0,0]=4 954 B10R1.138 CCCC(=O)OC[C@H]1CO1 MCULE-2289186317 [1,0,0,1,0,0|2,0,0]=4 955 B10R1.138 CCCC(=O)OC[C@H]1CO1 MCULE-2909990291 [1,0,0,1,0,0|2,0,0]=4 956 B10R1.138 CCOC(=O)/C=C/C1CC1 MCULE-5149227855 [1,0,0,1,0,0|0,0,2]=4 957 B10R1.138 CCOC(=O)C=CC1CC1 MCULE-5035333331 [1,0,0,1,0,0|0,0,2]=4 958 B10R1.138 CCOC(=O)CCC1CO1 MCULE-5849542527 [1,0,0,1,0,0|1,0,0]=3 959 B10R1.138 CCOC(=O)CNC1CC1 MCULE-5200789560 [1,0,0,1,0,0|1,0,0]=3 960 B10R1.138 CNCC(=O)NCC1CC1 MCULE-9650091122 [1,0,0,1,0,0|2,0,0]=4 961 B10R1.186 COCCNC(=O)C1CC1 MCULE-8136795409 [1,0,0,1,0,0|2,0,0]=4 962 B10R1.186 O=C(NCCCO)C1CC1 MCULE-9557111398 [1,0,0,1,0,0|2,0,0]=4 963 B10R1.197 CCC1CCCC(=O)CC1 MCULE-9268041087 [1,0,0,1,0,0|0,0,0]=2 964 B10R1.197 CCC1CCCC(CC1)N MCULE-5672798446 [1,0,0,1,0,0|1,0,1]=4 965 B10R1.197 CCC1CCNC(=O)CC1 MCULE-8320678614 [1,0,0,1,0,0|1,0,0]=3 966 B10R1.197 CCN1CCNC(=O)CC1 MCULE-4047795961 [1,0,0,1,0,0|2,0,0]=4 967 B10R1.197 COC1CCCC(=O)CC1 MCULE-1338107491 [1,0,0,1,0,0|1,0,0]=3 968 B10R1.197 O=C1CCC(CCN1)CBr MCULE-7639931591 [1,0,0,1,0,0|2,0,0]=4 969 B10R1.197 O=C1CCC(CCN1)CO MCULE-6536142470 [1,0,0,1,0,0|2,0,0]=4 970 B10R1.245 CCC1C(=O)CCCC1=O MCULE-2763743652 [1,0,0,1,0,0|1,0,1]=4 971 B10R1.260 CCOC1CC(=O)C1SC MCULE-6609805791 [1,0,0,1,0,0|2,0,0]=4 972 B10R1.377 CCCC1(CCCCC1)N MCULE-7817834233 [1,0,0,1,0,0|1,0,1]=4 973 B10R1.377 CCCC1(CCCCC1)O MCULE-7596295635 [1,0,0,1,0,0|0,0,2]=4 974 B10R1.377 CCC[N+]1(CCCCC1)C MCULE-4618328796 [1,0,0,1,0,0|2,0,0]=4 975 B10R1.377 CCC[N+]1(CCCCC1)C MCULE-8959378168 [1,0,0,1,0,0|2,0,0]=4 976 B10R1.4 C=CCC1CCCOC1=O MCULE-4559726552 [1,0,0,1,0,0|0,0,2]=4 977 B10R1.4 CCCC1=CCCCC1=O MCULE-9765434554 [1,0,0,1,0,0|1,0,1]=4 978 B10R1.4 CCCC1CCCCC1=O MCULE-3320705054 [1,0,0,1,0,0|1,0,0]=3 979 B10R1.4 CCCC1NCCNC1=O MCULE-9907026950 [1,0,0,1,0,0|2,0,0]=4 980 B10R1.4 CCCN1CCNCC1=O MCULE-6335276136 [1,0,0,1,0,0|2,0,0]=4 981 B10R1.4 CCCN1CCNCC1=O MCULE-9352928130 [1,0,0,1,0,0|2,0,0]=4 982 B10R1.4 CCOC1CCCCC1=O MCULE-9251299042 [1,0,0,1,0,0|2,0,0]=4 983 B10R1.4 NCCN1CCCCC1=O MCULE-1427901317 [1,0,0,1,0,0|2,0,0]=4 984 B10R1.4 NCCN1CCCCC1=O MCULE-6448945987 [1,0,0,1,0,0|2,0,0]=4 985 B10R1.4 NCCN1CCCCC1=O MCULE-9599542364 [1,0,0,1,0,0|2,0,0]=4 986 B10R1.4 NCCN1CCCOC1=O MCULE-4521838716 [1,0,0,1,0,0|2,0,0]=4 987 B10R1.4 NCCN1CCCOC1=O MCULE-9880721224 [1,0,0,1,0,0|2,0,0]=4 988 B10R1.4 O=C1CCCCN1CCO MCULE-2557885455 [1,0,0,1,0,0|2,0,0]=4 989 B10R1.4 O=C1NCCCC1CCO MCULE-7839494483 [1,0,0,1,0,0|2,0,0]=4 990 B10R1.16 CCCCC1OCC(O1)C MCULE-6055464693 [1,0,0,1,0,0|0,0,2]=4 991 B10R1.17 CCCCB1OCCCO1 MCULE-7527059970 [1,0,0,1,0,0|1,0,1]=4 992 B10R1.17 CCCOC1CCCCO1 MCULE-5501679825 [1,0,0,1,0,0|0,0,2]=4 993 B10R1.162 NCC1CCCCC(=O)N1 MCULE-4887883772 [1,0,0,1,0,0|2,0,0]=4 994 B10R1.162 O=C1CC(CCCN1)CO MCULE-9468190378 [1,0,0,1,0,0|2,0,0]=4 995 B10R1.162 O=C1CCCCC(N1)CO MCULE-9454883286 [1,0,0,1,0,0|2,0,0]=4 996 B10R1.178 NCCNC(=O)C1CCC1 MCULE-6932073160 [1,0,0,1,0,0|2,0,0]=4 997 B10R1.178 NCCNC(=O)C1CCC1 MCULE-7411905163 [1,0,0,1,0,0|2,0,0]=4 998 B10R1.178 O=C(NCCO)C1CCC1 MCULE-5028687652 [1,0,0,1,0,0|2,0,0]=4 999 B10R1.180 NCCCC(=O)NC1CC1 MCULE-7365010520 [1,0,0,1,0,0|2,0,0]=4 1000 B10R1.180 NCCCC(=O)NC1CC1 MCULE-8958914297 [1,0,0,1,0,0|2,0,0]=4 1001 B10R1.180 O=C(CCCCl)NC1CC1 MCULE-3215037389 [1,0,0,1,0,0|2,0,0]=4 1002 B10R1.187 CCCN1C(=O)CCC1O MCULE-6879311728 [1,0,0,1,0,0|2,0,0]=4 1003 B10R1.293 CCCNC(=O)C1CC1C MCULE-1813376780 [1,0,0,1,0,0|1,0,0]=3 1004 B10R1.161 BrCC1CCC=CCCC1 MCULE-8178003544 [1,0,0,1,0,0|2,0,0]=4 1005 B10R1.161 NCC1CCC=CCCC1 MCULE-1079618656 [1,0,0,1,0,0|2,0,0]=4 1006 B10R1.161 NCC1CCC=CCCC1 MCULE-5008046589 [1,0,0,1,0,0|2,0,0]=4 1007 B10R1.161 NCC1CCC=CCCC1 MCULE-5765894925 [1,0,0,1,0,0|2,0,0]=4 1008 B10R1.161 NCC1CCC=CCCC1 MCULE-7351350794 [1,0,0,1,0,0|2,0,0]=4 1009 B10R1.185 C1CCCCNCCCC1 MCULE-8151021132 [1,0,0,1,0,0|1,0,1]=4 1010 B12R1.53 CCCCC(=O)CC1OCCO1 MCULE-4954095269 [0,1,0,1,0,0|2,0,0]=4 1011 B12R1.53 CCCNC(=S)NC1CCCC1 MCULE-7623176460 [0,1,0,1,0,0|1,1,0]=4 1012 B12R1.53 CCCOC(=O)CC1OCCO1 MCULE-9717488696 [0,1,0,1,0,0|1,0,0]=3 1013 B12R1.53 NCCCC(=O)OC1CCCC1 MCULE-3366176678 [0,1,0,1,0,0|2,0,0]=4 1014 B12R1.53 NCCCC(=O)OC1CCCC1 MCULE-6516840027 [0,1,0,1,0,0|2,0,0]=4 1015 B12R1.53 NCCNC(=O)CC1CCCC1 MCULE-4123990604 [0,1,0,1,0,0|2,0,0]=4 1016 B12R1.53 O=C(CCCCl)NC1CCCC1 MCULE-7446771570 [0,1,0,1,0,0|2,0,0]=4 1017 B12R1.141 O=C1CCCCCCCC(=O)O1 MCULE-2456565439 [0,1,0,1,0,0|0,0,1]=3 1018 B12R1.170 NCCC1CCCCCC(=O)N1 MCULE-7372073941 [0,1,0,1,0,0|1,0,0]=3 1019 B12R1.170 NCCC1CCCCCC(=O)N1 MCULE-9427535286 [0,1,0,1,0,0|1,0,0]=3 1020 B12R1.308 CCOC(=O)C1CCCOC1=O MCULE-6960980375 [0,1,0,1,0,0|1,0,1]=4 1021 B12R1.18 CCCCN1CCCCCC1=O MCULE-2860927768 [0,1,0,1,0,0|1,0,0]=3 1022 B12R1.18 CCCCN1CCNCCC1=O MCULE-5173759883 [0,1,0,1,0,0|2,0,0]=4 1023 B12R1.18 COCCN1CCCNCC1=O MCULE-8191923960 [0,1,0,1,0,0|2,0,0]=4 1024 B12R1.18 COCCN1CCNCCC1=O MCULE-4504817503 [0,1,0,1,0,0|2,0,0]=4 1025 B12R1.18 COCCN1CCNCCC1=O MCULE-8800911728 [0,1,0,1,0,0|2,0,0]=4 1026 B12R1.18 N#CCCN1CCCCCC1=O MCULE-1773998051 [0,1,0,1,0,0|1,0,1]=4 1027 B12R1.18 NCCCN1CCCCCC1=O MCULE-7534720301 [0,1,0,1,0,0|1,0,0]=3 1028 B12R1.18 NCCCN1CCCCCC1=O MCULE-7641696435 [0,1,0,1,0,0|1,0,0]=3 1029 B12R1.30 CCCCC(=O)N1CCNCC1 MCULE-1192263869 [0,1,0,1,0,0|2,0,0]=4 1030 B12R1.30 CCCCC(=O)N1CCOCC1 MCULE-5393106532 [0,1,0,1,0,0|2,0,0]=4 1031 B12R1.30 CCCNC(=O)C1CCCCC1 MCULE-9880143399 [0,1,0,1,0,0|1,0,0]=3 1032 B12R1.30 CCCNC(=O)C1CCCCN1 MCULE-4935097773 [0,1,0,1,0,0|1,0,0]=3 1033 B12R1.30 CCCNC(=O)C1CCCCN1 MCULE-7018821140 [0,1,0,1,0,0|1,0,0]=3 1034 B12R1.30 CCCNC(=O)C1CCCNC1 MCULE-1747538317 [0,1,0,1,0,0|1,0,0]=3 1035 B12R1.30 CCCNC(=O)C1CCCNC1 MCULE-7812408394 [0,1,0,1,0,0|1,0,0]=3 1036 B12R1.30 CCCNC(=O)C1CCNCC1 MCULE-2247095150 [0,1,0,1,0,0|1,0,0]=3 1037 B12R1.30 CCCNC(=O)C1CCNCC1 MCULE-8422399687 [0,1,0,1,0,0|1,0,0]=3 1038 B12R1.30 CCCNC(=O)N1CCSCC1 MCULE-7355025531 [0,1,0,1,0,0|2,0,0]=4 1039 B12R1.30 CCCNC(=O)[C@@H]1CCCNC1 MCULE-3965728637 [0,1,0,1,0,0|1,0,0]=3 1040 B12R1.30 CCCNC(=O)[C@@H]1CCCNC1 MCULE-5620969736 [0,1,0,1,0,0|1,0,0]=3 1041 B12R1.30 CCCNC(=O)[C@H]1CCCCN1 MCULE-2477123619 [0,1,0,1,0,0|1,0,0]=3 1042 B12R1.30 CCCNC(=O)[C@H]1CCCNC1 MCULE-5203122069 [0,1,0,1,0,0|1,0,0]=3 1043 B12R1.30 CCCOC(=O)C1CCCCN1 MCULE-4165315159 [0,1,0,1,0,0|0,0,0]=2 1044 B12R1.30 CCCOC(=O)C1CCCCN1 MCULE-7026352123 [0,1,0,1,0,0|0,0,0]=2 1045 B12R1.30 CCCOC(=O)N1CCNCC1 MCULE-2756132108 [0,1,0,1,0,0|1,0,0]=3 1046 B12R1.30 CCCOC(=O)N1CCNCC1 MCULE-9204022328 [0,1,0,1,0,0|1,0,0]=3 1047 B12R1.30 COCCC(=O)C1CCOCC1 MCULE-9225958903 [0,1,0,1,0,0|2,0,0]=4 1048 B12R1.30 NCCNC(=O)C1CCCCC1 MCULE-9592409617 [0,1,0,1,0,0|2,0,0]=4 1049 B12R1.30 NCCNC(=O)C1CCCCC1 MCULE-9696700550 [0,1,0,1,0,0|2,0,0]=4 1050 B12R1.30 O=C(CCCCl)N1CCCCC1 MCULE-5827466130 [0,1,0,1,0,0|2,0,0]=4 1051 B12R1.30 O=C(NCCBr)C1CCCCC1 MCULE-3152668815 [0,1,0,1,0,0|2,0,0]=4 1052 B12R1.30 O=C(NCCCl)C1CCOCC1 MCULE-7938481144 [0,1,0,1,0,0|2,0,0]=4 1053 B12R1.30 O=C(NCCO)C1CCCCN1 MCULE-2590309633 [0,1,0,1,0,0|2,0,0]=4 1054 B12R1.30 O=C(NCCO)C1CCCCN1 MCULE-4913405302 [0,1,0,1,0,0|2,0,0]=4 1055 B12R1.30 O=C(NCCO)C1CCCNC1 MCULE-8684914137 [0,1,0,1,0,0|2,0,0]=4 1056 B12R1.30 O=C(NCCO)C1CCCNC1 MCULE-8856649378 [0,1,0,1,0,0|2,0,0]=4 1057 B12R1.30 O=C(NCCO)C1CCNCC1 MCULE-6243467865 [0,1,0,1,0,0|2,0,0]=4 1058 B12R1.30 O=C(NCCO)C1CCNCC1 MCULE-7396609772 [0,1,0,1,0,0|2,0,0]=4 1059 B12R1.54 CC(C)CNC(=O)C1CCCC1 MCULE-7195365193 [0,1,0,1,0,0|1,0,0]=3 1060 B12R1.54 CC(C)CNC(=O)C1CCCN1 MCULE-2129476067 [0,1,0,1,0,0|2,0,0]=4 1061 B12R1.54 CC(C)CNC(=O)C1CCCN1 MCULE-3791600414 [0,1,0,1,0,0|2,0,0]=4 1062 B12R1.54 CC(C)CNC(=O)[C@@H]1CCNC1 MCULE-3884144738 [0,1,0,1,0,0|2,0,0]=4 1063 B12R1.54 CC(C)CNC(=O)[C@@H]1CCNC1 MCULE-5023041609 [0,1,0,1,0,0|2,0,0]=4 1064 B12R1.54 CC(C)CNC(=O)[C@H]1CCNC1 MCULE-1889535777 [0,1,0,1,0,0|2,0,0]=4 1065 B12R1.54 CC(C)CNC(=O)[C@H]1CCNC1 MCULE-3732820256 [0,1,0,1,0,0|2,0,0]=4 1066 B12R1.210 C=C(C)CN1CCCCCC1=O MCULE-8593964326 [0,1,0,1,0,0|1,0,1]=4 1067 B12R1.210 CC(C)CN1CCNCCC1=O MCULE-8054198953 [0,1,0,1,0,0|2,0,0]=4 1068 B12R1.486 CCCCNC(=O)[C@H]1C[C@@H](C1)N MCULE-1259796697 [0,1,0,1,0,0|2,0,0]=4 1069 B12R1.486 CCCCNC(=O)[C@H]1C[C@@H](C1)N MCULE-3263819364 [0,1,0,1,0,0|2,0,0]=4 1070 B12R1.7 CCCCCCC1OCC(O1)C MCULE-3434939793 [0,1,0,1,0,0|0,0,2]=4 1071 B12R1.8 CCCNCCC1=CCCCC1 MCULE-5403673634 [0,1,0,1,0,0|2,0,0]=4 1072 B12R1.8 CCCNCCC1=CCCCC1 MCULE-7022123980 [0,1,0,1,0,0|2,0,0]=4 1073 B12R1.215 O=C1CCNCCCCCCN1 MCULE-1263100451 [0,1,0,1,0,0|1,0,0]=3 1074 B12R1.215 O=C1CCNCCCOCCN1 MCULE-2789680382 [0,1,0,1,0,0|2,0,0]=4 1075 B12R1.267 CCCCC=C1CCCCC1=O MCULE-6881426714 [0,1,0,1,0,0|1,0,1]=4 1076 B12R1.267 CCCCCC1CCCCC1=O MCULE-3162873716 [0,1,0,1,0,0|1,0,0]=3 1077 B12R1.267 NCCCCN1CCCCC1=O MCULE-5609841049 [0,1,0,1,0,0|2,0,0]=4 1078 B12R1.267 O=C1CCCCC1CNCCBr MCULE-7462371251 [0,1,0,1,0,0|2,0,0]=4 1079 B12R1.267 O=C1CCCCC1CNCCBr MCULE-8159055342 [0,1,0,1,0,0|2,0,0]=4 1080 B12R1.561 CNCCCNC(=O)C1CCC1 MCULE-1217924473 [0,1,0,1,0,0|2,0,0]=4 1081 B12R1.563 NCCCCNC(=O)CC1CC1 MCULE-1167429297 [0,1,0,1,0,0|2,0,0]=4 1082 B12R1.567 CCCCCC1=C(CCC1=O)C MCULE-6930955162 [0,1,0,1,0,0|1,0,1]=4 1083 B12R1.1007 O=C1CCCCC(=O)OCCO1 MCULE-2873980195 [0,1,0,1,0,0|1,0,1]=4 1084 B12R1.35 CCCCNC(=O)C1CCCN1 MCULE-7417615513 [0,1,0,1,0,0|2,0,0]=4 1085 B12R1.35 CCCCNC(=O)C1CCCN1 MCULE-8344866512 [0,1,0,1,0,0|2,0,0]=4 1086 B12R1.35 CCCCOC(=O)C1CCNC1 MCULE-9066445944 [0,1,0,1,0,0|1,0,0]=3 1087 B12R1.35 COCCNC(=O)C1CCCN1 MCULE-5104316466 [0,1,0,1,0,0|2,0,0]=4 1088 B12R1.35 COCCNC(=O)C1CCCN1 MCULE-8835483489 [0,1,0,1,0,0|2,0,0]=4 1089 B12R1.35 COCCNC(=O)[C@@H]1CCNC1 MCULE-6950268300 [0,1,0,1,0,0|2,0,0]=4 1090 B12R1.35 COCCNC(=O)[C@@H]1CCNC1 MCULE-8917257979 [0,1,0,1,0,0|2,0,0]=4 1091 B12R1.35 COCCNC(=O)[C@H]1CCNC1 MCULE-5139542993 [0,1,0,1,0,0|2,0,0]=4 1092 B12R1.35 COCCNC(=O)[C@H]1CCNC1 MCULE-7889064138 [0,1,0,1,0,0|2,0,0]=4 1093 B12R1.35 O=C(NCCCCl)C1CCCC1 MCULE-2760781843 [0,1,0,1,0,0|1,0,0]=3 1094 B12R1.35 O=C(NCCCO)C1CCCN1 MCULE-5944063960 [0,1,0,1,0,0|2,0,0]=4 1095 B12R1.35 O=C(NCCCO)C1CCCN1 MCULE-9955067552 [0,1,0,1,0,0|2,0,0]=4 1096 B12R1.1414 OCCCOC1CCCCCC1 MCULE-9402583694 [0,1,0,1,0,0|1,0,1]=4 1097 B12R1.25 CCCCC1NCCN(C1=O)C MCULE-5309908803 [0,1,0,1,0,0|2,0,0]=4 1098 B12R1.15 CCC(C)NC(=O)C1CCCC1 MCULE-5491323702 [0,1,0,1,0,0|1,0,0]=3 1099 B12R1.15 CCC(C)NC(=O)C1CCCN1 MCULE-6185793578 [0,1,0,1,0,0|2,0,0]=4 1100 B12R1.15 CCC(C)NC(=O)C1CCCN1 MCULE-8984953179 [0,1,0,1,0,0|2,0,0]=4 1101 B12R1.15 CCC(C)NC(=O)N1CCCC1 MCULE-7261613001 [0,1,0,1,0,0|2,0,0]=4 1102 B12R1.365 CCC(N)C1CCCCNC1=O MCULE-2973623704 [0,1,0,1,0,0|2,0,0]=4 1103 B12R1.365 CCC(N)C1CCCCNC1=O MCULE-3135675523 [0,1,0,1,0,0|2,0,0]=4 1104 B12R1.55 CCCC(N)C(=O)N1CCCC1 MCULE-6182351238 [0,1,0,1,0,0|2,0,0]=4 1105 B12R1.55 CCCC(N)C(=O)N1CCCC1 MCULE-9396997421 [0,1,0,1,0,0|2,0,0]=4 1106 B12R1.55 CCOC(=O)C(=O)C1CCCC1 MCULE-3529813520 [0,1,0,1,0,0|2,0,0]=4 1107 B12R2.41 C1CCC2=NCCCN2CC1 MCULE-9669804011 [0,0,0,2,0,0|2,0,0]=4 1108 B12R2.229 O=C1CCNCC2N1CCC2 MCULE-5354866844 [0,0,0,2,0,0|2,0,0]=4 1109 B12R2.229 O=C1CCNC[C@H]2N1CCC2 MCULE-3430808630 [0,0,0,2,0,0|2,0,0]=4 1110 B12R2.229 O=C1NCCCC2C1CNC2 MCULE-6681743352 [0,0,0,2,0,0|2,0,0]=4 1111 B12R2.229 O=C1NCCCC2C1CNC2 MCULE-8669557280 [0,0,0,2,0,0|2,0,0]=4 1112 B12R2.455 O=C1CNCC2CCCN1C2 MCULE-6746069011 [0,0,0,2,0,0|2,0,0]=4 1113 B12R2.455 [C@@H]12CCCN(C1)C(=O)CNC2 MCULE-8701369821 [0,0,0,2,0,0|2,0,0]=4 1114 B12R2.1041 O=C1CC2CCCCCC2C1 MCULE-3866880179 [0,0,0,2,0,0|1,0,0]=3 1115 B12R2.7 O=C1CCCCC12CCCC2 MCULE-2674738319 [0,0,0,2,0,0|1,0,0]=3 1116 B12R2.7 O=C1CCNCC12CCCC2 MCULE-7001240727 [0,0,0,2,0,0|2,0,0]=4 1117 B12R2.7 O=C1NCCCC12CCCC2 MCULE-4003925548 [0,0,0,2,0,0|1,0,0]=3 1118 B12R2.7 O=C1NCCCC12CCCN2 MCULE-3628239818 [0,0,0,2,0,0|2,0,0]=4 1119 B12R2.7 O=C1NCCCC12CCCN2 MCULE-6136711115 [0,0,0,2,0,0|2,0,0]=4 1120 B12R2.7 O=C1NCCCC12CCNC2 MCULE-7835953096 [0,0,0,2,0,0|2,0,0]=4 1121 B12R2.7 O=C1NCCCC12CCNC2 MCULE-9705262931 [0,0,0,2,0,0|2,0,0]=4 1122 B12R2.7 O=C1NCCNC12CCCC2 MCULE-3068523257 [0,0,0,2,0,0|2,0,0]=4 1123 B12R2.7 O=C1NCCNC12CCCC2 MCULE-8516961031 [0,0,0,2,0,0|2,0,0]=4 1124 B12R2.24 O=C1C=C2CCCCC2CC1 MCULE-1925425954 [0,0,0,2,0,0|1,0,1]=4 1125 B12R2.24 O=C1CCC2=C(O1)CCCC2 MCULE-3616070284 [0,0,0,2,0,0|0,0,2]=4 1126 B12R2.24 O=C1CCC2CCCCC2C1 MCULE-5132415908 [0,0,0,2,0,0|1,0,0]=3 1127 B12R2.24 O=C1CCC2CCCCC2O1 MCULE-8264574980 [0,0,0,2,0,0|0,0,0]=2 1128 B12R2.24 O=C1CCC2CCCNC2C1 MCULE-6331379359 [0,0,0,2,0,0|2,0,0]=4 1129 B12R2.24 O=C1CCC2CNCCC2N1 MCULE-1605613797 [0,0,0,2,0,0|2,0,0]=4 1130 B12R2.24 O=C1CCC2CNCCC2N1 MCULE-4751402400 [0,0,0,2,0,0|2,0,0]=4 1131 B12R2.24 O=C1CCC2COCCC2C1 MCULE-2996737699 [0,0,0,2,0,0|2,0,0]=4 1132 B12R2.24 O=C1CCN2CCCCC2C1 MCULE-8834975179 [0,0,0,2,0,0|2,0,0]=4 1133 B12R2.24 O=C1CN2CCCCC2CN1 MCULE-4553224664 [0,0,0,2,0,0|2,0,0]=4 1134 B12R2.24 O=C1CNC2CCCCC2N1 MCULE-4636303193 [0,0,0,2,0,0|2,0,0]=4 1135 B12R2.24 O=C1CNC2CCCCC2O1 MCULE-1674440433 [0,0,0,2,0,0|1,0,0]=3 1136 B12R2.24 O=C1COC2CCCCC2N1 MCULE-3544591104 [0,0,0,2,0,0|2,0,0]=4 1137 B12R2.24 O=C1CSC2CCCCC2O1 MCULE-2850415472 [0,0,0,2,0,0|1,0,0]=3 1138 B12R2.24 [C@@H]12CCCC[C@H]1NC(=O)CN2 MCULE-2920414481 [0,0,0,2,0,0|2,0,0]=4 1139 B12R2.24 [C@@H]12CNCC[C@H]1COC(=O)N2 MCULE-4787024813 [0,0,0,2,0,0|2,0,0]=4 1140 B12R2.24 [C@H]12CCCC[C@H]1NC(=O)CN2 MCULE-7195121221 [0,0,0,2,0,0|2,0,0]=4 1141 B12R2.225 O=C1CCCCC1OC2CC2 MCULE-1497562604 [0,0,0,2,0,0|2,0,0]=4 1142 B12R2.517 O=C1CCCCC1C2COC2 MCULE-7214040965 [0,0,0,2,0,0|2,0,0]=4 1143 B12R2.1081 C12CCCC(=O)C1CCCN2 MCULE-7871473963 [0,0,0,2,0,0|2,0,0]=4 1144 B12R2.1081 C12CCCCC1C(=O)CCN2 MCULE-5542279033 [0,0,0,2,0,0|2,0,0]=4 1145 B12R2.1081 O=C1CCCC2C1CCCC2 MCULE-8480896518 [0,0,0,2,0,0|1,0,0]=3 1146 B12R2.1081 O=C1CCCC2N1CCNC2 MCULE-5025496575 [0,0,0,2,0,0|2,0,0]=4 1147 B12R2.1081 O=C1CCCC2N1CCNC2 MCULE-5496789049 [0,0,0,2,0,0|2,0,0]=4 1148 B12R2.1081 O=C1CCCN2C1CCCC2 MCULE-3277635107 [0,0,0,2,0,0|2,0,0]=4 1149 B12R2.1081 O=C1CCC[C@@H]2[C@@H]1CCCC2 MCULE-5964799305 [0,0,0,2,0,0|1,0,0]=3 1150 B12R2.1081 O=C1CCNC2C1CCCC2 MCULE-6781228133 [0,0,0,2,0,0|2,0,0]=4 1151 B12R2.1081 O=C1CCNC2N1CCCC2 MCULE-7383053948 [0,0,0,2,0,0|2,0,0]=4 1152 B12R2.1081 O=C1CNCC2N1CCCC2 MCULE-5438706854 [0,0,0,2,0,0|2,0,0]=4 1153 B12R2.1081 O=C1CNCC2N1CCCC2 MCULE-9023773742 [0,0,0,2,0,0|2,0,0]=4 1154 B12R2.1081 O=C1NCCC2C1CCNC2 MCULE-4722262759 [0,0,0,2,0,0|2,0,0]=4 1155 B12R2.1081 O=C1NCCC2C1CCNC2 MCULE-5602366246 [0,0,0,2,0,0|2,0,0]=4 1156 B12R2.1081 O=C1NCCC2C1CCNC2 MCULE-8721795873 [0,0,0,2,0,0|2,0,0]=4 1157 B12R2.1081 O=C1NCCC2C1NCCC2 MCULE-2965834050 [0,0,0,2,0,0|2,0,0]=4 1158 B12R2.1081 O=C1NCCN2C1CCCC2 MCULE-4674978248 [0,0,0,2,0,0|2,0,0]=4 1159 B12R2.1081 [C@@H]12CCCC(=O)N1CCNC2 MCULE-4764122446 [0,0,0,2,0,0|2,0,0]=4 1160 B12R2.1081 [C@@H]12CCCC(=O)N1CCNC2 MCULE-8407336784 [0,0,0,2,0,0|2,0,0]=4 1161 B12R2.1081 [C@@H]12CCCCN1C(=O)CNC2 MCULE-3371879382 [0,0,0,2,0,0|2,0,0]=4 1162 B12R2.1081 [C@@H]12CCCCN1C(=O)CNC2 MCULE-6889335982 [0,0,0,2,0,0|2,0,0]=4 1163 B12R2.1081 [C@@H]12CCCC[C@H]1C(=O)CCN2 MCULE-3781193879 [0,0,0,2,0,0|2,0,0]=4 1164 B12R2.1081 [C@@H]12CCCC[C@H]1C(=O)CCN2 MCULE-5151768324 [0,0,0,2,0,0|2,0,0]=4 1165 B12R2.1081 [C@H]12CCCC(=O)N1CCNC2 MCULE-4814093132 [0,0,0,2,0,0|2,0,0]=4 1166 B12R2.1081 [C@H]12CCCC(=O)N1CCNC2 MCULE-9247976237 [0,0,0,2,0,0|2,0,0]=4 1167 B12R2.1081 [C@H]12CCCCN1C(=O)CNC2 MCULE-6245598698 [0,0,0,2,0,0|2,0,0]=4 1168 B12R2.594 O=C1CC2CCCC(N2)CN1 MCULE-6880570407 [0,0,0,2,0,0|2,0,0]=4 1169 B12R2.5121 CC1CCCC2(O1)CCCO2 MCULE-5007265318 [0,0,0,2,0,0|0,0,2]=4 1170 B12R2.375 COC1OCC2C1CC(=O)O2 MCULE-5720946300 [0,0,0,2,0,0|2,0,0]=4 1171 B12R2.375 CO[C@H]1OC[C@H]2[C@@H]1CC(=O)O2 MCULE-4081479521 [0,0,0,2,0,0|2,0,0]=4 1172 B12R2.375 CO[C@H]1OC[C@H]2[C@@H]1CC(=O)O2 MCULE-9782089683 [0,0,0,2,0,0|2,0,0]=4 1173 B12R2.375 [C@H]12CC(=O)O[C@H]1COC2OC MCULE-2750034634 [0,0,0,2,0,0|2,0,0]=4 1174 B12R2.375 [C@H]12CC(=O)O[C@H]1CO[C@@H]2OC MCULE-1306471249 [0,0,0,2,0,0|2,0,0]=4 1175 B12R2.2918 CC1COC2(O1)CCCCC2 MCULE-7484660010 [0,0,0,2,0,0|0,0,2]=4 1176 B12R2.2 C1COB(OC1)C2CCCC2 MCULE-8359606234 [0,0,0,2,0,0|1,0,1]=4 1177 B12R2.4370 C1CCC2(CC1)OCCCO2 MCULE-1463083630 [0,0,0,2,0,0|0,0,2]=4 1178 B12R2.221 CN1CCC(=O)C2C1CCC2 MCULE-2094972831 [0,0,0,2,0,0|2,0,0]=4 1179 B12R2.2034 CN1CCC(=O)C12CCCC2 MCULE-3325932871 [0,0,0,2,0,0|2,0,0]=4 1180 B12R2.2074 O=C(CC1CC1)N2CCCC2 MCULE-8947317147 [0,0,0,2,0,0|2,0,0]=4 1181 B12R2.2074 O=C(NC1CC1)C2CCCC2 MCULE-3765543325 [0,0,0,2,0,0|1,0,0]=3 1182 B12R2.2074 O=C(NC1CC1)C2CCCN2 MCULE-3317350606 [0,0,0,2,0,0|2,0,0]=4 1183 B12R2.2074 O=C(NC1CC1)C2CCCN2 MCULE-9459040129 [0,0,0,2,0,0|2,0,0]=4 1184 B12R2.2074 O=C(NC1CC1)C2CCNC2 MCULE-3227378328 [0,0,0,2,0,0|2,0,0]=4 1185 B12R2.2074 O=C(NC1CC1)C2CCNC2 MCULE-6534998848 [0,0,0,2,0,0|2,0,0]=4 1186 B12R2.2074 O=C(NC1CC1)C2CCOC2 MCULE-9139303049 [0,0,0,2,0,0|2,0,0]=4 1187 B12R2.2074 O=C(NC1CC1)[C@@H]2CCCN2 MCULE-5588240108 [0,0,0,2,0,0|2,0,0]=4 1188 B12R2.2074 O=C(NC1CC1)[C@@H]2CCCN2 MCULE-8344881492 [0,0,0,2,0,0|2,0,0]=4 1189 B12R2.3797 O=C(C1CCC1)C2CCCO2 MCULE-1609519332 [0,0,0,2,0,0|2,0,0]=4 1190 B12R2.3797 O=C(C1CCC1)C2CCOC2 MCULE-3763094151 [0,0,0,2,0,0|2,0,0]=4 1191 B12R2.3797 O=C(C1CCCC1)C2CCC2 MCULE-3273756705 [0,0,0,2,0,0|1,0,0]=3 1192 B12R2.2257 CCN1C2CCC1CC(=O)C2 MCULE-4621433430 [0,0,0,2,0,0|2,0,0]=4 1193 B12R2.114 O=C1CCCC2CNCC2N1 MCULE-8908023981 [0,0,0,2,0,0|2,0,0]=4 1194 B12R2.114 O=C1CCC[C@@H]2CNC[C@@H]2N1 MCULE-9416220594 [0,0,0,2,0,0|2,0,0]=4 1195 B12R2.114 [C@H]12CCCC(=O)N[C@H]1CCN2 MCULE-1453873523 [0,0,0,2,0,0|2,0,0]=4 1196 B12R2.114 [C@H]12CCCC(=O)N[C@H]1CCN2 MCULE-8235994215 [0,0,0,2,0,0|2,0,0]=4 1197 B12R2.1067 O=C1NC2C1CCCCCC2 MCULE-1390214368 [0,0,0,2,0,0|1,0,0]=3 1198 B12R2.5478 O=C1CC2(CCC2)NCCN1 MCULE-7191052475 [0,0,0,2,0,0|2,0,0]=4 1199 B12R2.219 CC12CNCCN1C(=O)OC2 MCULE-9079374219 [0,0,0,2,0,0|2,0,0]=4 1200 B12R2.606 CN1CC2CCC(=O)CC2C1 MCULE-7194256496 [0,0,0,2,0,0|2,0,0]=4 1201 B12R2.1154 CN1C2CCCC1CC(=O)C2 MCULE-4596962992 [0,0,0,2,0,0|2,0,0]=4 1202 B12R2.1154 CN1C2CCCC1CC(=O)C2 MCULE-5416654087 [0,0,0,2,0,0|2,0,0]=4 1203 B12R2.1154 [C@@H]12CCC[C@@H](N1C)CC(=O)C2 MCULE-7313573839 [0,0,0,2,0,0|2,0,0]=4 1204 B12R2.3934 CN1CCC(=O)CC12CCC2 MCULE-7764474194 [0,0,0,2,0,0|2,0,0]=4 1205 B12R2.1670 NCC1OC(=O)CC12CCC2 MCULE-4797014758 [0,0,0,2,0,0|1,0,0]=3 1206 B12R2.1670 NCC1OC(=O)CC12CCC2 MCULE-9225722842 [0,0,0,2,0,0|1,0,0]=3 1207 B12R2.1670 O=C1CC2(CCC2)C(O1)CI MCULE-5437870941 [0,0,0,2,0,0|1,0,0]=3 1208 B12R2.3937 O=C1CCC2(N1CCC2)CO MCULE-1316919504 [0,0,0,2,0,0|2,0,0]=4 1209 B12R2.3280 O=C(NCC1CC1)C2CCC2 MCULE-1843521235 [0,0,0,2,0,0|2,0,0]=4 1210 B12R2.3288 O=C(CNC1CC1)NC2CC2 MCULE-5489225474 [0,0,0,2,0,0|2,0,0]=4 1211 B12R2.2289 CCOC1CC(=O)C12CCC2 MCULE-6581758245 [0,0,0,2,0,0|2,0,0]=4