0 B11R0.4 C(=CC(=O)OCC)CCCCC MCULE-4171275205 [0,0,0,0,0,0|0,0,0]=0 1 B11R0.4 C=CCCCCCC(=O)OCC MCULE-7006723315 [0,0,0,0,0,0|0,0,4]=4 2 B11R0.4 C=COC(=O)CCCCCCC MCULE-8119830012 [0,0,0,0,0,0|0,0,4]=4 3 B11R0.4 CC=CC(=O)OCCCCCC MCULE-4880491449 [0,0,0,0,0,0|2,0,2]=4 4 B11R0.4 CCCC=CCCC(=O)OCC MCULE-9126448594 [0,0,0,0,0,0|0,0,4]=4 5 B11R0.4 CCCCC/C=C/C(=O)OCC MCULE-5442918020 [0,0,0,0,0,0|0,0,0]=0 6 B11R0.4 CCCCCC#CC(=O)OCC MCULE-5790220243 [0,0,0,0,0,0|0,0,2]=2 7 B11R0.4 CCCCCCCC(=O)CCC MCULE-1180729281 [0,0,0,0,0,0|1,0,2]=3 8 B11R0.4 CCCCCCCC(=O)OCC MCULE-2970505348 [0,0,0,0,0,0|0,0,2]=2 9 B11R0.4 CCCCCCCC(=O)OCCl MCULE-2638292153 [0,0,0,0,0,0|1,0,2]=3 10 B11R0.4 CCCCCCNC(=O)CCC MCULE-8057065415 [0,0,0,0,0,0|2,0,1]=3 11 B11R0.4 CCCCCCOC(=O)CCC MCULE-8350935490 [0,0,0,0,0,0|2,0,1]=3 12 B11R0.4 CCCCCCOC(=O)COC MCULE-6245511541 [0,0,0,0,0,0|3,0,1]=4 13 B11R0.4 CCCCCCOC(=O)OCCl MCULE-3018615324 [0,0,0,0,0,0|2,0,1]=3 14 B11R0.4 CCCCNCCC(=O)OCC MCULE-5853777478 [0,0,0,0,0,0|1,0,2]=3 15 B11R0.4 CCCCSCCC(=O)OCC MCULE-6074500572 [0,0,0,0,0,0|1,0,2]=3 16 B11R0.4 CCNC(=O)NCCCCCO MCULE-3277208115 [0,0,0,0,0,0|3,0,1]=4 17 B11R0.4 CCOC(=O)/C=C/CCCCCl MCULE-6128979271 [0,0,0,0,0,0|1,0,0]=1 18 B11R0.4 CCOC(=O)C=CCCCCCl MCULE-4585677614 [0,0,0,0,0,0|1,0,0]=1 19 B11R0.4 CCOC(=O)CCCCCC=O MCULE-8029913259 [0,0,0,0,0,0|1,0,3]=4 20 B11R0.4 CCOC(=O)CCCCCCBr MCULE-6438098940 [0,0,0,0,0,0|1,0,2]=3 21 B11R0.4 CCOC(=O)CCCCCCCl MCULE-2985397172 [0,0,0,0,0,0|1,0,2]=3 22 B11R0.4 CCOC(=O)CCCCCCI MCULE-6134074150 [0,0,0,0,0,0|1,0,2]=3 23 B11R0.4 CCOC(=O)CCCCCCN MCULE-5019264359 [0,0,0,0,0,0|1,0,2]=3 24 B11R0.4 CCOC(=O)CCCCCCN MCULE-8921407508 [0,0,0,0,0,0|1,0,2]=3 25 B11R0.4 CCOC(=O)CCCCCNC MCULE-3880282111 [0,0,0,0,0,0|1,0,2]=3 26 B11R0.4 CCOC(=O)CCCCCNC MCULE-5211183009 [0,0,0,0,0,0|1,0,2]=3 27 B11R0.4 CCOC(=O)CCNCCCO MCULE-6911342581 [0,0,0,0,0,0|2,0,2]=4 28 B11R0.4 CCOC(=O)CCNCCOC MCULE-2066847830 [0,0,0,0,0,0|2,0,2]=4 29 B11R0.4 CCOC(=O)NCCCCCO MCULE-3754810142 [0,0,0,0,0,0|2,0,1]=3 30 B10R0.1 C#CCCCCC(=O)OCC MCULE-4159925776 [1,0,0,0,0,0|0,0,3]=4 31 B10R0.1 C=C(C=NCCCC)OCC MCULE-5629491103 [1,0,0,0,0,0|2,0,0]=3 32 B10R0.1 C=CCCCCC(=O)OCC MCULE-4796834258 [1,0,0,0,0,0|0,0,3]=4 33 B10R0.1 CC=CCCCC(=O)OCC MCULE-9997629917 [1,0,0,0,0,0|0,0,3]=4 34 B10R0.1 CCCC(=O)OCCCCCl MCULE-1685252152 [1,0,0,0,0,0|3,0,0]=4 35 B10R0.1 CCCC(=O)OCCCCO MCULE-5551819643 [1,0,0,0,0,0|3,0,0]=4 36 B10R0.1 CCCC(=O)OCCCSC MCULE-9257783110 [1,0,0,0,0,0|3,0,0]=4 37 B10R0.1 CCCCC#CC(=O)OCC MCULE-4077079917 [1,0,0,0,0,0|0,0,2]=3 38 B10R0.1 CCCCCCC(=O)CCC MCULE-1716736963 [1,0,0,0,0,0|1,0,1]=3 39 B10R0.1 CCCCCCC(=O)OCC MCULE-9137582636 [1,0,0,0,0,0|0,0,1]=2 40 B10R0.1 CCCCCNC(=O)CCC MCULE-7374835979 [1,0,0,0,0,0|2,0,0]=3 41 B10R0.1 CCCCCOC(=O)CCC MCULE-8850994391 [1,0,0,0,0,0|2,0,0]=3 42 B10R0.1 CCCCNCC(=O)OCC MCULE-9216905823 [1,0,0,0,0,0|1,0,1]=3 43 B10R0.1 CCCNCCC(=O)NCC MCULE-2244073736 [1,0,0,0,0,0|2,0,1]=4 44 B10R0.1 CCCNCCC(=O)OCC MCULE-7490328359 [1,0,0,0,0,0|1,0,1]=3 45 B10R0.1 CCOC(=O)C=CCCCCl MCULE-5025299599 [1,0,0,0,0,0|1,0,0]=2 46 B10R0.1 CCOC(=O)CCCCC#N MCULE-4576520215 [1,0,0,0,0,0|1,0,2]=4 47 B10R0.1 CCOC(=O)CCCCC=O MCULE-7732334617 [1,0,0,0,0,0|1,0,2]=4 48 B10R0.1 CCOC(=O)CCCCCBr MCULE-8003265411 [1,0,0,0,0,0|1,0,1]=3 49 B10R0.1 CCOC(=O)CCCCCCl MCULE-4088253059 [1,0,0,0,0,0|1,0,1]=3 50 B10R0.1 CCOC(=O)CCCCCI MCULE-9635955061 [1,0,0,0,0,0|1,0,1]=3 51 B10R0.1 CCOC(=O)CCCCCN MCULE-3923374138 [1,0,0,0,0,0|1,0,1]=3 52 B10R0.1 CCOC(=O)CCCCCN MCULE-5512054492 [1,0,0,0,0,0|1,0,1]=3 53 B10R0.1 CCOC(=O)CCCCCO MCULE-3245932025 [1,0,0,0,0,0|1,0,1]=3 54 B10R0.1 CCOC(=O)CCSCCO MCULE-8638992281 [1,0,0,0,0,0|2,0,1]=4 55 B10R0.1 CCOC(=O)CNCCOC MCULE-2646976797 [1,0,0,0,0,0|2,0,1]=4 56 B10R0.1 CCOC(=O)COCCCCl MCULE-4550907435 [1,0,0,0,0,0|2,0,1]=4 57 B10R0.1 CCOC(=O)COCCCO MCULE-9785348075 [1,0,0,0,0,0|2,0,1]=4 58 B10R0.1 CCOCCCC(=O)OCC MCULE-9855302324 [1,0,0,0,0,0|1,0,1]=3 59 B10R0.71 C(=CCCCCO)CCCC MCULE-5192933185 [1,0,0,0,0,0|2,0,1]=4 60 B10R0.71 C=CC=CC=CCCCCC MCULE-9947050551 [1,0,0,0,0,0|1,0,2]=4 61 B10R0.71 CCCC/C=C/CCCCO MCULE-8537897542 [1,0,0,0,0,0|2,0,1]=4 62 B10R0.71 CCCC/C=C\CCCCO MCULE-8382129018 [1,0,0,0,0,0|2,0,1]=4 63 B10R0.71 CCCCC/C=C/C=C/C=O MCULE-8478423084 [1,0,0,0,0,0|2,0,1]=4 64 B10R0.71 CCCCC/C=C\CCCO MCULE-5673742797 [1,0,0,0,0,0|2,0,1]=4 65 B10R0.71 CCCCCC=CC=CC=O MCULE-9055179345 [1,0,0,0,0,0|2,0,1]=4 66 B10R0.71 CCCCCC=CCCCO MCULE-4774794120 [1,0,0,0,0,0|2,0,1]=4 67 B10R0.71 CCCCCCC=CCCO MCULE-7637000822 [1,0,0,0,0,0|2,0,1]=4 68 B10R0.71 CCCCCCCCOCC MCULE-7803614357 [1,0,0,0,0,0|0,0,3]=4 69 B10R0.71 CCCCCCCNOCC MCULE-6718978813 [1,0,0,0,0,0|1,0,2]=4 70 B10R0.71 CCCCCCCNOCC MCULE-7446092946 [1,0,0,0,0,0|1,0,2]=4 71 B10R0.74 CCCCC/C=C/C(=O)OC MCULE-1812424019 [1,0,0,0,0,0|0,0,0]=1 72 B10R0.74 CCCCCC#CC(=O)OC MCULE-8436103758 [1,0,0,0,0,0|0,0,2]=3 73 B10R0.74 CCCCCC=CC(=O)OC MCULE-3787684558 [1,0,0,0,0,0|0,0,0]=1 74 B10R0.74 CCCCCCCC(=O)CC MCULE-3418685291 [1,0,0,0,0,0|0,0,2]=3 75 B10R0.74 CCCCCCCC(=O)OC MCULE-9368782203 [1,0,0,0,0,0|0,0,2]=3 76 B10R0.74 CCCCCCNC(=O)CCl MCULE-9418401258 [1,0,0,0,0,0|2,0,1]=4 77 B10R0.74 CCCCCCOC(=O)CC MCULE-7750085667 [1,0,0,0,0,0|1,0,1]=3 78 B10R0.74 CCCCCCOC(=O)CCl MCULE-7320709801 [1,0,0,0,0,0|2,0,1]=4 79 B10R0.74 CCCCCCOC(=O)CN MCULE-5357348178 [1,0,0,0,0,0|2,0,1]=4 80 B10R0.74 CCCCCCOC(=O)CS MCULE-4845823799 [1,0,0,0,0,0|2,0,1]=4 81 B10R0.74 CCCCCCOC(=O)C[NH3+] MCULE-4114261473 [1,0,0,0,0,0|2,0,1]=4 82 B10R0.74 CCOCCSCC(=O)OC MCULE-6906722616 [1,0,0,0,0,0|2,0,1]=4 83 B10R0.74 COC(=O)CCCCCCBr MCULE-5801566678 [1,0,0,0,0,0|1,0,2]=4 84 B10R0.74 COC(=O)CCCCCCI MCULE-5629338002 [1,0,0,0,0,0|1,0,2]=4 85 B10R0.74 COC(=O)CCCCCCN MCULE-3174162228 [1,0,0,0,0,0|1,0,2]=4 86 B10R0.74 COC(=O)CCCCCCN MCULE-7552954472 [1,0,0,0,0,0|1,0,2]=4 87 B10R0.74 COC(=O)CCCCCCO MCULE-1234987175 [1,0,0,0,0,0|1,0,2]=4 88 B12R0.1 C=CCCCCCCC(=O)OCC MCULE-2529046007 [0,1,0,0,0,0|0,0,3]=4 89 B12R0.1 CCCCCC=CCC(=O)OCC MCULE-2452505052 [0,1,0,0,0,0|0,0,0]=1 90 B12R0.1 CCCCCCC#CC(=O)OCC MCULE-9938881189 [0,1,0,0,0,0|0,0,2]=3 91 B12R0.1 CCCCCCC=CC(=O)OCC MCULE-4260025223 [0,1,0,0,0,0|0,0,0]=1 92 B12R0.1 CCCCCCCCC(=O)OCC MCULE-5309868306 [0,1,0,0,0,0|0,0,2]=3 93 B12R0.1 CCCCCCCCC(=O)OCCl MCULE-7482672748 [0,1,0,0,0,0|1,0,2]=4 94 B12R0.1 CCCCCCCOC(=O)CCC MCULE-5390225657 [0,1,0,0,0,0|1,0,2]=4 95 B12R0.1 CCCCCNCCC(=O)OCC MCULE-6006388312 [0,1,0,0,0,0|0,0,2]=3 96 B12R0.1 CCCCOCCOC(=O)CCC MCULE-5623408620 [0,1,0,0,0,0|2,0,1]=4 97 B12R0.1 CCOC(=O)CCCCCCCBr MCULE-8678920768 [0,1,0,0,0,0|0,0,2]=3 98 B12R0.1 CCOC(=O)CCCCCCCCl MCULE-8377860069 [0,1,0,0,0,0|0,0,2]=3 99 B12R0.1 CCOC(=O)CCCCCCCI MCULE-5677306490 [0,1,0,0,0,0|0,0,2]=3 100 B12R0.1 CCOC(=O)CCCCCCCN MCULE-2162819446 [0,1,0,0,0,0|0,0,2]=3 101 B12R0.1 CCOC(=O)CCCCCCCN MCULE-4046698936 [0,1,0,0,0,0|0,0,2]=3 102 B12R0.1 CCOC(=O)CCCCCCCO MCULE-3311157136 [0,1,0,0,0,0|0,0,2]=3 103 B12R0.1 CCOC(=O)CCNCCCOC MCULE-1490737085 [0,1,0,0,0,0|1,0,2]=4 104 B12R0.1 CCOCCNCCC(=O)OCC MCULE-8716932397 [0,1,0,0,0,0|1,0,2]=4 105 B12R0.4 CCCCCCCC(=O)CC(C)C MCULE-8560500059 [0,1,0,0,0,0|1,0,2]=4 106 B12R0.4 CCCCCCCC(=O)OC(C)C MCULE-9786578174 [0,1,0,0,0,0|0,0,2]=3 107 B12R0.4 CCCCCCNC(=O)CC(C)C MCULE-7166408587 [0,1,0,0,0,0|2,0,1]=4 108 B12R0.49 CCCCCCOC(=O)C(C)CC MCULE-8057194585 [0,1,0,0,0,0|2,0,1]=4 109 B12R0.49 CCCCCCOC(=O)C(Cl)CC MCULE-7520169766 [0,1,0,0,0,0|2,0,1]=4 110 B12R0.101 CCCCC(=O)CCC(=O)OCC MCULE-1267611941 [0,1,0,0,0,0|0,0,3]=4 111 B12R0.101 CCCCC(C)CCC(=O)OCC MCULE-6733464056 [0,1,0,0,0,0|0,0,2]=3 112 B12R0.101 CCCCN(C)CCC(=O)OCC MCULE-9816715483 [0,1,0,0,0,0|1,0,2]=4 113 B12R0.114 CCCCC/C=C(\C)/C(=O)OCC MCULE-8195902601 [0,1,0,0,0,0|0,0,0]=1 114 B12R0.114 CCCCCC=C(C)C(=O)OCC MCULE-5847999326 [0,1,0,0,0,0|0,0,0]=1 115 B12R0.114 CCCCCCC(Br)C(=O)OCC MCULE-8234853299 [0,1,0,0,0,0|0,0,2]=3 116 B12R0.114 CCCCCCC(C)C(=O)OCC MCULE-6433825405 [0,1,0,0,0,0|0,0,2]=3 117 B12R0.114 CCNC(=O)C(=O)NCCCOC MCULE-1525727922 [0,1,0,0,0,0|3,0,0]=4 118 B12R0.114 CCOC(=O)C(=O)CCCCC#N MCULE-7366627955 [0,1,0,0,0,0|1,0,2]=4 119 B12R0.114 CCOC(=O)C(=O)CCCCCCl MCULE-5451364428 [0,1,0,0,0,0|1,0,1]=3 120 B12R0.206 CCCCCCCC(=O)CCCC MCULE-8871455068 [0,1,0,0,0,0|1,0,2]=4 121 B12R0.206 CCCCCCCC(=O)NCCO MCULE-8854560543 [0,1,0,0,0,0|1,0,2]=4 122 B12R0.206 CCCCCCCC(=O)OCCC MCULE-5108681764 [0,1,0,0,0,0|0,0,2]=3 123 B12R0.206 CCCCCCCC(=O)SCCO MCULE-1605041145 [0,1,0,0,0,0|0,1,2]=4 124 B12R0.239 CCCCCC(=O)CC(=O)OCC MCULE-5338610169 [0,1,0,0,0,0|0,0,1]=2 125 B12R0.239 CCCCCC(C)CC(=O)OCC MCULE-6554122155 [0,1,0,0,0,0|0,0,2]=3 126 B12R0.239 CCCCCC(C)OC(=O)CCC MCULE-5985723386 [0,1,0,0,0,0|2,0,1]=4 127 B12R0.239 CCCCCC(O)CC(=O)OCC MCULE-5021805198 [0,1,0,0,0,0|0,0,2]=3 128 B12R0.239 CCCCOC(=O)CC(=O)OCC MCULE-2106345446 [0,1,0,0,0,0|1,0,1]=3 129 B12R0.239 CCOC(=O)CC(=O)CCCCCl MCULE-1163774058 [0,1,0,0,0,0|1,0,1]=3 130 B12R0.239 CCOC(=O)CC(=O)CCCOC MCULE-3782749536 [0,1,0,0,0,0|1,0,1]=3 131 B12R0.239 CCOCCC(=O)CC(=O)OCC MCULE-8773996282 [0,1,0,0,0,0|1,0,1]=3 132 B12R0.276 CCOC(=O)CCCCC(=O)CC MCULE-9237019902 [0,1,0,0,0,0|0,0,3]=4 133 B12R0.277 C=C(C)CCCCCC(=O)OCC MCULE-8886396978 [0,1,0,0,0,0|0,0,3]=4 134 B12R0.277 CCOC(=O)CCCCCC(=O)C MCULE-9869285908 [0,1,0,0,0,0|0,0,3]=4 135 B12R0.277 CCOC(=O)CCCCCC(C)C MCULE-4669970484 [0,1,0,0,0,0|0,0,2]=3 136 B12R0.277 CCOC(=O)CCNCCC(C)C MCULE-6849942061 [0,1,0,0,0,0|1,0,2]=4 137 B12R0.285 CCCC(=O)CCCC(=O)OCC MCULE-8740401703 [0,1,0,0,0,0|0,0,3]=4 138 B12R0.285 CCOC(=O)/C=C/CC(=O)OCC MCULE-8698288110 [0,1,0,0,0,0|1,0,1]=3 139 B12R0.285 CCOC(=O)C=CCC(=O)OCC MCULE-6557612404 [0,1,0,0,0,0|1,0,1]=3 140 B12R1.28 CCCCCC1CCCC(=O)O1 MCULE-2527242599 [0,0,0,1,0,0|2,0,1]=4 141 B12R1.28 CCCCOC1=CC(=O)CCC1 MCULE-4416106131 [0,0,0,1,0,0|2,0,0]=3 142 B12R1.32 CCCC(=O)NC1CCCCC1 MCULE-9277292558 [0,0,0,1,0,0|2,0,1]=4 143 B12R1.32 CCCC(=O)OC1CCCCC1 MCULE-9637902009 [0,0,0,1,0,0|2,0,1]=4 144 B12R1.32 CCOC(=O)/C=C/1\CCCNC1 MCULE-4484090278 [0,0,0,1,0,0|1,0,0]=2 145 B12R1.32 CCOC(=O)/C=C/1\CCCNC1 MCULE-9600397707 [0,0,0,1,0,0|1,0,0]=2 146 B12R1.32 CCOC(=O)/C=C\1/CCCNC1 MCULE-1615052545 [0,0,0,1,0,0|1,0,0]=2 147 B12R1.32 CCOC(=O)/C=C\1/CCCNC1 MCULE-9582474330 [0,0,0,1,0,0|1,0,0]=2 148 B12R1.32 CCOC(=O)C=C1CCCCC1 MCULE-3079324701 [0,0,0,1,0,0|0,0,0]=1 149 B12R1.32 CCOC(=O)C=C1CCCNC1 MCULE-4042820546 [0,0,0,1,0,0|1,0,0]=2 150 B12R1.32 CCOC(=O)C=C1CCCNC1 MCULE-6105852255 [0,0,0,1,0,0|1,0,0]=2 151 B12R1.32 CCOC(=O)C=C1CCNCC1 MCULE-8282288532 [0,0,0,1,0,0|1,0,0]=2 152 B12R1.32 CCOC(=O)C=C1CCOCC1 MCULE-6097486664 [0,0,0,1,0,0|1,0,0]=2 153 B12R1.32 CCOC(=O)C=C1CCSCC1 MCULE-5436272461 [0,0,0,1,0,0|1,0,0]=2 154 B12R1.32 CCOC(=O)C=C1COCCN1 MCULE-8785686628 [0,0,0,1,0,0|2,0,0]=3 155 B12R1.32 CCOC(=O)CC1=CCCCC1 MCULE-3018994027 [0,0,0,1,0,0|0,0,2]=3 156 B12R1.32 CCOC(=O)CC1CCCCC1 MCULE-1152805009 [0,0,0,1,0,0|0,0,2]=3 157 B12R1.32 CCOC(=O)CC1CCCCN1 MCULE-3468218069 [0,0,0,1,0,0|1,0,2]=4 158 B12R1.32 CCOC(=O)CC1CCCCN1 MCULE-9630026467 [0,0,0,1,0,0|1,0,2]=4 159 B12R1.32 CCOC(=O)CC1CCCCO1 MCULE-3394134389 [0,0,0,1,0,0|1,0,2]=4 160 B12R1.32 CCOC(=O)CC1CCCNC1 MCULE-6171511240 [0,0,0,1,0,0|1,0,2]=4 161 B12R1.32 CCOC(=O)CC1CCCNC1 MCULE-9078267622 [0,0,0,1,0,0|1,0,2]=4 162 B12R1.32 CCOC(=O)CC1CCNCC1 MCULE-3199758876 [0,0,0,1,0,0|1,0,2]=4 163 B12R1.32 CCOC(=O)CC1CCNCC1 MCULE-9384776786 [0,0,0,1,0,0|1,0,2]=4 164 B12R1.32 CCOC(=O)CC1CCOCC1 MCULE-4235227337 [0,0,0,1,0,0|1,0,2]=4 165 B12R1.32 CCOC(=O)CC1CCSCC1 MCULE-6026333577 [0,0,0,1,0,0|1,0,2]=4 166 B12R1.32 CCOC(=O)CN1CCCCC1 MCULE-7400575339 [0,0,0,1,0,0|1,0,1]=3 167 B12R1.32 CCOC(=O)CN1CCNCC1 MCULE-6474808307 [0,0,0,1,0,0|2,0,1]=4 168 B12R1.32 CCOC(=O)CN1CCNCC1 MCULE-9540871772 [0,0,0,1,0,0|2,0,1]=4 169 B12R1.32 CCOC(=O)CN1CCOCC1 MCULE-7817726015 [0,0,0,1,0,0|2,0,1]=4 170 B12R1.32 CCOC(=O)CN1CCSCC1 MCULE-9105245970 [0,0,0,1,0,0|2,0,1]=4 171 B12R1.32 CCOC(=O)C[C@@H]1CCCCN1 MCULE-4718348165 [0,0,0,1,0,0|1,0,2]=4 172 B12R1.32 CCOC(=O)C[C@@H]1CCCCN1 MCULE-6308291120 [0,0,0,1,0,0|1,0,2]=4 173 B12R1.32 CCOC(=O)C[C@@H]1CCCNC1 MCULE-1912596801 [0,0,0,1,0,0|1,0,2]=4 174 B12R1.32 CCOC(=O)C[C@@H]1CCCNC1 MCULE-3081515342 [0,0,0,1,0,0|1,0,2]=4 175 B12R1.32 CCOC(=O)C[C@@H]1CCCNC1 MCULE-6596738815 [0,0,0,1,0,0|1,0,2]=4 176 B12R1.32 CCOC(=O)C[C@@H]1CCCNC1 MCULE-9089981425 [0,0,0,1,0,0|1,0,2]=4 177 B12R1.32 CCOC(=O)C[C@H]1CCCCN1 MCULE-1021454962 [0,0,0,1,0,0|1,0,2]=4 178 B12R1.32 CCOC(=O)C[C@H]1CCCCN1 MCULE-7531255519 [0,0,0,1,0,0|1,0,2]=4 179 B12R1.32 CCOC(=O)C[C@H]1CCCNC1 MCULE-1413384276 [0,0,0,1,0,0|1,0,2]=4 180 B12R1.32 CCOC(=O)C[C@H]1CCCNC1 MCULE-1486420888 [0,0,0,1,0,0|1,0,2]=4 181 B12R1.32 CCOC(=O)C[C@H]1CCCNC1 MCULE-5522529773 [0,0,0,1,0,0|1,0,2]=4 182 B12R1.32 CCOC(=O)C[C@H]1CCCNC1 MCULE-9968031199 [0,0,0,1,0,0|1,0,2]=4 183 B12R1.32 CCOC(=O)NC1CCCCC1 MCULE-3205850197 [0,0,0,1,0,0|1,0,1]=3 184 B12R1.32 CCOC(=O)NC1CCCNC1 MCULE-8523276676 [0,0,0,1,0,0|2,0,1]=4 185 B12R1.32 CCOC(=O)NC1CCNCC1 MCULE-3688132775 [0,0,0,1,0,0|2,0,1]=4 186 B12R1.32 CCOC(=O)NC1CCNCC1 MCULE-5836302717 [0,0,0,1,0,0|2,0,1]=4 187 B12R1.32 CCOC(=O)NN1CCCCC1 MCULE-9620315682 [0,0,0,1,0,0|2,0,0]=3 188 B12R1.32 CCSC(=O)NC1CCCCC1 MCULE-1717153065 [0,0,0,1,0,0|1,1,1]=4 189 B12R1.32 O=C(CC1CCCCC1)OCCl MCULE-6172375896 [0,0,0,1,0,0|1,0,2]=4 190 B12R1.32 O=C(OCCl)OC1CCCCC1 MCULE-6321992113 [0,0,0,1,0,0|2,0,1]=4 191 B12R1.51 CCNC(=O)CCC1CCCC1 MCULE-5070875347 [0,0,0,1,0,0|1,0,2]=4 192 B12R1.51 CCOC(=O)/C=C/C1CCCC1 MCULE-2221943770 [0,0,0,1,0,0|0,0,0]=1 193 B12R1.51 CCOC(=O)/C=C/N1CCCC1 MCULE-9027334847 [0,0,0,1,0,0|1,0,0]=2 194 B12R1.51 CCOC(=O)C=CC1CCCC1 MCULE-2022772727 [0,0,0,1,0,0|0,0,0]=1 195 B12R1.51 CCOC(=O)C=CN1CCCC1 MCULE-8774983031 [0,0,0,1,0,0|1,0,0]=2 196 B12R1.51 CCOC(=O)CCC1CCCC1 MCULE-2375028456 [0,0,0,1,0,0|0,0,2]=3 197 B12R1.51 CCOC(=O)CCC1CCNC1 MCULE-7408479999 [0,0,0,1,0,0|1,0,2]=4 198 B12R1.51 CCOC(=O)CCC1CCNC1 MCULE-8613452910 [0,0,0,1,0,0|1,0,2]=4 199 B12R1.51 CCOC(=O)CCN1CCCC1 MCULE-3249117287 [0,0,0,1,0,0|1,0,2]=4 200 B12R1.51 CCOC(=O)CNC1CCCC1 MCULE-3738945622 [0,0,0,1,0,0|1,0,1]=3 201 B12R1.51 CCOC(=O)CNC1CCCC1 MCULE-5699447837 [0,0,0,1,0,0|1,0,1]=3 202 B12R1.51 CCOC(=O)CO[C@@H]1CCNC1 MCULE-3876719155 [0,0,0,1,0,0|2,0,1]=4 203 B12R1.51 CCOC(=O)CO[C@@H]1CCNC1 MCULE-6519366162 [0,0,0,1,0,0|2,0,1]=4 204 B12R1.51 CCOC(=O)CO[C@H]1CCNC1 MCULE-6110452246 [0,0,0,1,0,0|2,0,1]=4 205 B12R1.51 CCOC(=O)CO[C@H]1CCNC1 MCULE-6491057747 [0,0,0,1,0,0|2,0,1]=4 206 B12R1.51 CCOC(=O)NN=C1CCCC1 MCULE-6085861042 [0,0,0,1,0,0|2,0,1]=4 207 B12R1.308 CCOC(=O)C1=C(CCCC1)N MCULE-3127663767 [0,0,0,1,0,0|1,0,2]=4 208 B12R1.308 CCOC(=O)C1=C(CCCC1)S MCULE-1937519015 [0,0,0,1,0,0|1,0,2]=4 209 B12R1.308 CCOC(=O)C1=C(OCCC1)C MCULE-8976382509 [0,0,0,1,0,0|1,0,2]=4 210 B12R1.308 CCOC(=O)C1=CCCCC1O MCULE-3540625882 [0,0,0,1,0,0|1,0,0]=2 211 B12R1.308 CCOC(=O)C1CCCCC1N MCULE-4675578239 [0,0,0,1,0,0|1,0,2]=4 212 B12R1.308 CCOC(=O)C1CCCCC1N MCULE-5818513894 [0,0,0,1,0,0|1,0,2]=4 213 B12R1.308 CCOC(=O)C1CCCCC1O MCULE-8707557136 [0,0,0,1,0,0|1,0,2]=4 214 B12R1.308 CCOC(=O)C1CCCCN1C MCULE-2232844061 [0,0,0,1,0,0|1,0,2]=4 215 B12R1.308 CCOC(=O)C1CCCCN1C MCULE-7838475779 [0,0,0,1,0,0|1,0,2]=4 216 B12R1.308 CCOC(=O)C1CCCNC1C MCULE-3546129728 [0,0,0,1,0,0|1,0,2]=4 217 B12R1.308 CCOC(=O)C1CCCNC1C MCULE-3938102200 [0,0,0,1,0,0|1,0,2]=4 218 B12R1.308 CCOC(=O)C1CCNCC1C MCULE-4814798739 [0,0,0,1,0,0|1,0,2]=4 219 B12R1.308 CCOC(=O)C1CCNCC1C MCULE-9223326965 [0,0,0,1,0,0|1,0,2]=4 220 B12R1.308 CCOC(=O)C1NCCCC1O MCULE-1344548321 [0,0,0,1,0,0|2,0,1]=4 221 B12R1.308 CCOC(=O)C1NCCCC1O MCULE-7074202375 [0,0,0,1,0,0|2,0,1]=4 222 B12R1.308 CCOC(=O)[C@@H]1CCCC[C@@H]1N MCULE-3259808089 [0,0,0,1,0,0|1,0,2]=4 223 B12R1.308 CCOC(=O)[C@@H]1CCCC[C@@H]1N MCULE-5527486908 [0,0,0,1,0,0|1,0,2]=4 224 B12R1.308 CCOC(=O)[C@@H]1CCCC[C@@H]1N MCULE-7267942276 [0,0,0,1,0,0|1,0,2]=4 225 B12R1.308 CCOC(=O)[C@@H]1CCCC[C@@H]1N MCULE-7676672902 [0,0,0,1,0,0|1,0,2]=4 226 B12R1.308 CCOC(=O)[C@@H]1CCCC[C@@H]1O MCULE-5754647175 [0,0,0,1,0,0|1,0,2]=4 227 B12R1.308 CCOC(=O)[C@@H]1CCCC[C@@H]1O MCULE-9025537110 [0,0,0,1,0,0|1,0,2]=4 228 B12R1.308 CCOC(=O)[C@@H]1CCCC[C@H]1N MCULE-3264292987 [0,0,0,1,0,0|1,0,2]=4 229 B12R1.308 CCOC(=O)[C@@H]1CCCC[C@H]1N MCULE-4044207632 [0,0,0,1,0,0|1,0,2]=4 230 B12R1.308 CCOC(=O)[C@@H]1CCCC[C@H]1N MCULE-7023353223 [0,0,0,1,0,0|1,0,2]=4 231 B12R1.308 CCOC(=O)[C@@H]1CCCC[C@H]1N MCULE-8939434109 [0,0,0,1,0,0|1,0,2]=4 232 B12R1.308 CCOC(=O)[C@@H]1CCCC[C@H]1O MCULE-8722046583 [0,0,0,1,0,0|1,0,2]=4 233 B12R1.308 CCOC(=O)[C@@H]1CCCC[C@H]1O MCULE-9682850380 [0,0,0,1,0,0|1,0,2]=4 234 B12R1.308 CCOC(=O)[C@@H]1CCCN[C@@H]1C MCULE-4264613154 [0,0,0,1,0,0|1,0,2]=4 235 B12R1.308 CCOC(=O)[C@@H]1CCCN[C@@H]1C MCULE-7021300400 [0,0,0,1,0,0|1,0,2]=4 236 B12R1.308 CCOC(=O)[C@@H]1CCCN[C@@H]1C MCULE-8942533528 [0,0,0,1,0,0|1,0,2]=4 237 B12R1.308 CCOC(=O)[C@@H]1CCCN[C@@H]1C MCULE-8944043869 [0,0,0,1,0,0|1,0,2]=4 238 B12R1.308 CCOC(=O)[C@@H]1CCNC[C@@H]1C MCULE-4011806478 [0,0,0,1,0,0|1,0,2]=4 239 B12R1.308 CCOC(=O)[C@@H]1CCNC[C@@H]1C MCULE-4759206194 [0,0,0,1,0,0|1,0,2]=4 240 B12R1.308 CCOC(=O)[C@@H]1CCNC[C@@H]1C MCULE-5288906012 [0,0,0,1,0,0|1,0,2]=4 241 B12R1.308 CCOC(=O)[C@@H]1CCNC[C@@H]1C MCULE-9269114722 [0,0,0,1,0,0|1,0,2]=4 242 B12R1.308 CCOC(=O)[C@H]1CCCC[C@@H]1N MCULE-1876449119 [0,0,0,1,0,0|1,0,2]=4 243 B12R1.308 CCOC(=O)[C@H]1CCCC[C@@H]1N MCULE-6228332153 [0,0,0,1,0,0|1,0,2]=4 244 B12R1.308 CCOC(=O)[C@H]1CCCC[C@@H]1N MCULE-6949247414 [0,0,0,1,0,0|1,0,2]=4 245 B12R1.308 CCOC(=O)[C@H]1CCCC[C@@H]1N MCULE-6973028628 [0,0,0,1,0,0|1,0,2]=4 246 B12R1.308 CCOC(=O)[C@H]1CCCC[C@@H]1O MCULE-2425911704 [0,0,0,1,0,0|1,0,2]=4 247 B12R1.308 CCOC(=O)[C@H]1CCCC[C@@H]1O MCULE-2877928900 [0,0,0,1,0,0|1,0,2]=4 248 B12R1.308 CCOC(=O)[C@H]1CCCC[C@H]1N MCULE-2964455864 [0,0,0,1,0,0|1,0,2]=4 249 B12R1.308 CCOC(=O)[C@H]1CCCC[C@H]1N MCULE-3558468507 [0,0,0,1,0,0|1,0,2]=4 250 B12R1.308 CCOC(=O)[C@H]1CCCC[C@H]1N MCULE-5790828870 [0,0,0,1,0,0|1,0,2]=4 251 B12R1.308 CCOC(=O)[C@H]1CCCC[C@H]1N MCULE-8489682625 [0,0,0,1,0,0|1,0,2]=4 252 B12R1.308 CCOC(=O)[C@H]1CCCN[C@@H]1C MCULE-4258887585 [0,0,0,1,0,0|1,0,2]=4 253 B12R1.308 CCOC(=O)[C@H]1CCCN[C@@H]1C MCULE-5031648716 [0,0,0,1,0,0|1,0,2]=4 254 B12R1.308 CCOC(=O)[C@H]1CCCN[C@@H]1C MCULE-5572651048 [0,0,0,1,0,0|1,0,2]=4 255 B12R1.308 CCOC(=O)[C@H]1CCCN[C@@H]1C MCULE-8121949629 [0,0,0,1,0,0|1,0,2]=4 256 B12R1.310 CCOC(=O)CCCNC1CC1 MCULE-2730722608 [0,0,0,1,0,0|1,0,2]=4 257 B12R1.310 CCOC(=O)CCCNC1CC1 MCULE-6885520387 [0,0,0,1,0,0|1,0,2]=4 258 B12R1.310 CCOC(=O)CCNCC1CC1 MCULE-8609364829 [0,0,0,1,0,0|1,0,2]=4 259 B12R1.316 CCOC(=O)C1=C(NN=C1)CC MCULE-5956301053 [0,0,0,1,0,0|2,0,1]=4 260 B12R1.316 CCOC(=O)C1=CC=NN1CC MCULE-3549061452 [0,0,0,1,0,0|2,0,1]=4 261 B12R1.316 CCOC(=O)C1=CON=C1CC MCULE-8774231930 [0,0,0,1,0,0|2,0,1]=4 262 B12R1.316 CCOC(=O)C1CCCN1CC MCULE-9739478822 [0,0,0,1,0,0|1,0,2]=4 263 B12R1.316 CCOC(=O)[C@@H]1CCCN1CC MCULE-1920137250 [0,0,0,1,0,0|1,0,2]=4 264 B12R1.316 CCOC(=O)[C@@H]1CCCN1CC MCULE-9103719979 [0,0,0,1,0,0|1,0,2]=4 265 B12R1.316 CCOC(=O)[C@@H]1CNC[C@H]1CC MCULE-2532024209 [0,0,0,1,0,0|1,0,2]=4 266 B12R1.316 CCOC(=O)[C@@H]1CNC[C@H]1CC MCULE-3739918098 [0,0,0,1,0,0|1,0,2]=4 267 B12R1.316 CCOC(=O)[C@H]1CNC[C@@H]1CC MCULE-7508239467 [0,0,0,1,0,0|1,0,2]=4 268 B12R1.316 CCOC(=O)[C@H]1CNC[C@@H]1CC MCULE-8765023118 [0,0,0,1,0,0|1,0,2]=4 269 B12R1.316 [C@@H]1(CCCN1CC)C(=O)OCC MCULE-3644196227 [0,0,0,1,0,0|1,0,2]=4 270 B12R1.318 CCOC(=O)C=C1NCCN1C MCULE-7374790955 [0,0,0,1,0,0|2,0,0]=3 271 B12R1.372 CCCCCCC1=CCCC1=O MCULE-1287633510 [0,0,0,1,0,0|1,0,2]=4 272 B12R1.372 CCCCCCC1CCCC1=O MCULE-9980064191 [0,0,0,1,0,0|1,0,2]=4 273 B12R1.372 CCCCCCC1CCOC1=O MCULE-7489729502 [0,0,0,1,0,0|0,0,2]=3 274 B12R1.372 CCCCCCN1CCCC1=O MCULE-1097521229 [0,0,0,1,0,0|2,0,1]=4 275 B12R1.1564 CCNC(=O)C1CCCCCN1 MCULE-2640565986 [0,0,0,1,0,0|2,0,1]=4 276 B12R1.1564 CCOC(=O)C1CCCCCC1 MCULE-4116850705 [0,0,0,1,0,0|0,0,2]=3 277 B12R1.1564 CCOC(=O)C1CCCCCN1 MCULE-1724738944 [0,0,0,1,0,0|1,0,1]=3 278 B12R1.1564 CCOC(=O)C1CCCCNC1 MCULE-4744656071 [0,0,0,1,0,0|1,0,2]=4 279 B12R1.1564 CCOC(=O)C1CCCCNC1 MCULE-6291260435 [0,0,0,1,0,0|1,0,2]=4 280 B12R1.1564 CCOC(=O)C1CCCNCC1 MCULE-3223346715 [0,0,0,1,0,0|1,0,2]=4 281 B12R1.1564 CCOC(=O)C1CCCNCC1 MCULE-8499221190 [0,0,0,1,0,0|1,0,2]=4 282 B12R1.1564 CCOC(=O)N1CCCCCC1 MCULE-9546533625 [0,0,0,1,0,0|1,0,1]=3 283 B12R1.1564 CCOC(=O)N1CCCNCC1 MCULE-8114160079 [0,0,0,1,0,0|2,0,1]=4 284 B12R1.1564 CCSC(=O)N1CCCCCC1 MCULE-8927719912 [0,0,0,1,0,0|1,1,1]=4 285 B9R0.5 C#CCCCC(=O)OCC MCULE-7331649216 [2,0,0,0,0,0|0,0,2]=4 286 B9R0.5 C(=C/C=C/C(=O)OCC)\C MCULE-3576105065 [2,0,0,0,0,0|0,0,2]=4 287 B9R0.5 C=CCCCC(=O)OCC MCULE-6747714335 [2,0,0,0,0,0|0,0,2]=4 288 B9R0.5 C=COC(=O)CCCCC MCULE-9610448604 [2,0,0,0,0,0|0,0,2]=4 289 B9R0.5 CC/C=C/CC(=O)OCC MCULE-7234058677 [2,0,0,0,0,0|0,0,2]=4 290 B9R0.5 CC=CC=CC(=O)OCC MCULE-7644578303 [2,0,0,0,0,0|0,0,2]=4 291 B9R0.5 CCC/C=C/C(=O)OCC MCULE-4832092410 [2,0,0,0,0,0|0,0,0]=2 292 B9R0.5 CCC=CCC(=O)OCC MCULE-2895347288 [2,0,0,0,0,0|0,0,2]=4 293 B9R0.5 CCCC#CC(=O)OCC MCULE-5376486364 [2,0,0,0,0,0|0,0,2]=4 294 B9R0.5 CCCC=CC(=O)OCC MCULE-6059990808 [2,0,0,0,0,0|0,0,0]=2 295 B9R0.5 CCCCCC(=O)CCC MCULE-5706146235 [2,0,0,0,0,0|1,0,0]=3 296 B9R0.5 CCCCCC(=O)OCC MCULE-5403677128 [2,0,0,0,0,0|0,0,0]=2 297 B9R0.5 CCCCNC(=O)CCC MCULE-7141834161 [2,0,0,0,0,0|2,0,0]=4 298 B9R0.5 CCCCNC(=O)NCC MCULE-3629972521 [2,0,0,0,0,0|2,0,0]=4 299 B9R0.5 CCCCNC(=O)OCC MCULE-8548277091 [2,0,0,0,0,0|1,0,0]=3 300 B9R0.5 CCCCOC(=O)CCC MCULE-3979612740 [2,0,0,0,0,0|2,0,0]=4 301 B9R0.5 CCCNCC(=O)OCC MCULE-1614665340 [2,0,0,0,0,0|1,0,0]=3 302 B9R0.5 CCNC(=O)CCCCO MCULE-9325293372 [2,0,0,0,0,0|2,0,0]=4 303 B9R0.5 CCNCCC(=O)NCC MCULE-6441681901 [2,0,0,0,0,0|2,0,0]=4 304 B9R0.5 CCNCCC(=O)OCC MCULE-5511872214 [2,0,0,0,0,0|1,0,0]=3 305 B9R0.5 CCO/C=C/C(=O)OCC MCULE-1507361975 [2,0,0,0,0,0|1,0,0]=3 306 B9R0.5 CCO/N=C/C(=O)OCC MCULE-5936482731 [2,0,0,0,0,0|2,0,0]=4 307 B9R0.5 CCO/N=C/C(=O)OCC MCULE-6380511451 [2,0,0,0,0,0|2,0,0]=4 308 B9R0.5 CCOC(=N)CCCCBr MCULE-4651734827 [2,0,0,0,0,0|2,0,0]=4 309 B9R0.5 CCOC(=O)C=CCCBr MCULE-9357314783 [2,0,0,0,0,0|1,0,0]=3 310 B9R0.5 CCOC(=O)C=CCCO MCULE-2905144053 [2,0,0,0,0,0|1,0,0]=3 311 B9R0.5 CCOC(=O)CCCC#N MCULE-3543261727 [2,0,0,0,0,0|1,0,1]=4 312 B9R0.5 CCOC(=O)CCCC=O MCULE-3082074155 [2,0,0,0,0,0|1,0,1]=4 313 B9R0.5 CCOC(=O)CCCCBr MCULE-9188586817 [2,0,0,0,0,0|1,0,0]=3 314 B9R0.5 CCOC(=O)CCCCCl MCULE-8211485770 [2,0,0,0,0,0|1,0,0]=3 315 B9R0.5 CCOC(=O)CCCCI MCULE-9427602912 [2,0,0,0,0,0|1,0,0]=3 316 B9R0.5 CCOC(=O)CCCCN MCULE-3254365356 [2,0,0,0,0,0|1,0,0]=3 317 B9R0.5 CCOC(=O)CCCCN MCULE-6113178932 [2,0,0,0,0,0|1,0,0]=3 318 B9R0.5 CCOC(=O)CCCCO MCULE-3157415426 [2,0,0,0,0,0|1,0,0]=3 319 B9R0.5 CCOC(=O)CNCCN MCULE-5162250475 [2,0,0,0,0,0|2,0,0]=4 320 B9R0.5 CCOC(=O)CNCCN MCULE-6793281928 [2,0,0,0,0,0|2,0,0]=4 321 B9R0.5 CCOC(=O)COCCBr MCULE-4604862482 [2,0,0,0,0,0|2,0,0]=4 322 B9R0.5 CCOC(=O)COCCCl MCULE-9218281344 [2,0,0,0,0,0|2,0,0]=4 323 B9R0.5 CCOC(=O)COCCI MCULE-7705777158 [2,0,0,0,0,0|2,0,0]=4 324 B9R0.5 CCOC(=O)COCCN MCULE-7738890913 [2,0,0,0,0,0|2,0,0]=4 325 B9R0.5 CCOC(=O)COCCN MCULE-8436568303 [2,0,0,0,0,0|2,0,0]=4 326 B9R0.5 CCOC(=O)COCOC MCULE-9141216887 [2,0,0,0,0,0|2,0,0]=4 327 B9R0.5 CCOC(=O)CSCCN MCULE-9316167874 [2,0,0,0,0,0|2,0,0]=4 328 B9R0.5 CCOC=CC(=O)OCC MCULE-6557988220 [2,0,0,0,0,0|1,0,0]=3 329 B9R0.5 CCOCCC(=O)OCC MCULE-8331611688 [2,0,0,0,0,0|1,0,0]=3 330 B9R0.45 C(=C\CCCCCO)\CC MCULE-7910166129 [2,0,0,0,0,0|1,0,1]=4 331 B9R0.45 CCC=CCCCCCO MCULE-1504274864 [2,0,0,0,0,0|1,0,1]=4 332 B9R0.45 CCCC/C=C/CCCC MCULE-5215613168 [2,0,0,0,0,0|1,0,1]=4 333 B9R0.45 CCCC/C=C\CCCC MCULE-7961413462 [2,0,0,0,0,0|1,0,1]=4 334 B9R0.45 CCCCC/C=C\CCO MCULE-4434068395 [2,0,0,0,0,0|1,0,1]=4 335 B9R0.45 CCCCC=CCCCC MCULE-4261429100 [2,0,0,0,0,0|1,0,1]=4 336 B9R0.45 CCCCCC/C=C/CO MCULE-1969100525 [2,0,0,0,0,0|1,0,1]=4 337 B9R0.45 CCCCCC/C=C\CO MCULE-4688229291 [2,0,0,0,0,0|1,0,1]=4 338 B9R0.45 CCCCCC=CCCO MCULE-4969061256 [2,0,0,0,0,0|1,0,1]=4 339 B9R0.45 CCCCCCC=CCO MCULE-8666977236 [2,0,0,0,0,0|1,0,1]=4 340 B9R0.45 CCCCCCNOCC MCULE-7230044709 [2,0,0,0,0,0|1,0,1]=4 341 B9R0.45 CCCCCCNOCC MCULE-8309226243 [2,0,0,0,0,0|1,0,1]=4 342 B9R0.46 C=C(C=NCCCC)OC MCULE-4916638013 [2,0,0,0,0,0|2,0,0]=4 343 B9R0.46 CCCCC#CC(=O)OC MCULE-6610188635 [2,0,0,0,0,0|0,0,2]=4 344 B9R0.46 CCCCC=CC(=O)OC MCULE-3507079471 [2,0,0,0,0,0|0,0,0]=2 345 B9R0.46 CCCCCCC(=O)CBr MCULE-5041636942 [2,0,0,0,0,0|1,0,1]=4 346 B9R0.46 CCCCCCC(=O)CC MCULE-6606139631 [2,0,0,0,0,0|0,0,1]=3 347 B9R0.46 CCCCCCC(=O)OC MCULE-7883111323 [2,0,0,0,0,0|0,0,1]=3 348 B9R0.46 CCCCCNC(=O)CCl MCULE-8028345115 [2,0,0,0,0,0|2,0,0]=4 349 B9R0.46 CCCCCOC(=O)CBr MCULE-3749700207 [2,0,0,0,0,0|2,0,0]=4 350 B9R0.46 CCCCCOC(=O)CC MCULE-6912037911 [2,0,0,0,0,0|1,0,0]=3 351 B9R0.46 CCCCCOC(=O)CCl MCULE-6254869186 [2,0,0,0,0,0|2,0,0]=4 352 B9R0.46 CCCCCOC(=O)CN MCULE-1223174561 [2,0,0,0,0,0|2,0,0]=4 353 B9R0.46 CCCCCOC(=O)CS MCULE-8048926704 [2,0,0,0,0,0|2,0,0]=4 354 B9R0.46 CCCCCOC(=O)C[NH3+] MCULE-4653269874 [2,0,0,0,0,0|2,0,0]=4 355 B9R0.46 CCCCSCC(=O)OC MCULE-1208944064 [2,0,0,0,0,0|1,0,1]=4 356 B9R0.46 CCCNCCC(=O)OC MCULE-4786941347 [2,0,0,0,0,0|1,0,1]=4 357 B9R0.46 CCNCCCC(=O)OC MCULE-1330024068 [2,0,0,0,0,0|1,0,1]=4 358 B9R0.46 CCNCCCC(=O)OC MCULE-1608160566 [2,0,0,0,0,0|1,0,1]=4 359 B9R0.46 CNCCCCC(=O)OC MCULE-3479794664 [2,0,0,0,0,0|1,0,1]=4 360 B9R0.46 CNCCCCC(=O)OC MCULE-3875784281 [2,0,0,0,0,0|1,0,1]=4 361 B9R0.46 COC(=O)CCCCCBr MCULE-5661009403 [2,0,0,0,0,0|1,0,1]=4 362 B9R0.46 COC(=O)CCCCCCl MCULE-2967199349 [2,0,0,0,0,0|1,0,1]=4 363 B9R0.46 COC(=O)CCCCCI MCULE-6638103547 [2,0,0,0,0,0|1,0,1]=4 364 B9R0.46 COC(=O)CCCCCN MCULE-9013585398 [2,0,0,0,0,0|1,0,1]=4 365 B9R0.46 COC(=O)CCCCCN MCULE-9184696999 [2,0,0,0,0,0|1,0,1]=4 366 B9R0.46 COC(=O)CCCCCO MCULE-6405405706 [2,0,0,0,0,0|1,0,1]=4 367 B9R0.46 COC(=O)CCCCCS MCULE-3886120866 [2,0,0,0,0,0|1,0,1]=4 368 B9R0.46 COCCCCC(=O)OC MCULE-9886328481 [2,0,0,0,0,0|1,0,1]=4 369 B9R0.2 CCC/C=C/C=C/C(=O)O MCULE-7747589239 [2,0,0,0,0,0|0,0,2]=4 370 B9R0.2 CCCC/C=C/CC(=O)O MCULE-3008379579 [2,0,0,0,0,0|0,0,2]=4 371 B9R0.2 CCCC=CC=CC(=O)O MCULE-5198543935 [2,0,0,0,0,0|0,0,2]=4 372 B9R0.2 CCCCC/C=C/B(O)O MCULE-4174871813 [2,0,0,0,0,0|1,0,1]=4 373 B9R0.2 CCCCC/C=C/C(=O)C MCULE-4810438787 [2,0,0,0,0,0|0,0,0]=2 374 B9R0.2 CCCCC/C=C/C(=O)O MCULE-5661205729 [2,0,0,0,0,0|0,0,0]=2 375 B9R0.2 CCCCC=CCC(=O)O MCULE-1531958630 [2,0,0,0,0,0|0,0,2]=4 376 B9R0.2 CCCCCC#CC(=O)O MCULE-1860076106 [2,0,0,0,0,0|0,0,2]=4 377 B9R0.2 CCCCCC=CB(O)O MCULE-8986052883 [2,0,0,0,0,0|1,0,1]=4 378 B9R0.2 CCCCCC=CC(=O)C MCULE-2447853309 [2,0,0,0,0,0|0,0,0]=2 379 B9R0.2 CCCCCC=CC(=O)O MCULE-6969617806 [2,0,0,0,0,0|0,0,0]=2 380 B9R0.2 CCCCCCCC(=O)C MCULE-9635928766 [2,0,0,0,0,0|0,0,2]=4 381 B9R0.2 CCCCCCCC(=O)O MCULE-5193957469 [2,0,0,0,0,0|0,0,2]=4 382 B9R0.2 CCCCCCOC(=O)C MCULE-7353613022 [2,0,0,0,0,0|1,0,1]=4 383 B9R0.2 CCCCCOCC(=O)O MCULE-8190672624 [2,0,0,0,0,0|1,0,1]=4 384 B11R0.2 CC(C)OC(=O)CCCCCBr MCULE-5192424932 [1,1,0,0,0,0|1,0,1]=4 385 B11R0.2 CCCCCOC(=O)CC(C)C MCULE-1565898581 [1,1,0,0,0,0|2,0,0]=4 386 B11R0.5 CCCCC(=O)CC(=O)OCC MCULE-4230578552 [1,1,0,0,0,0|0,0,1]=3 387 B11R0.5 CCCCC(N)CC(=O)OCC MCULE-2649536123 [1,1,0,0,0,0|0,0,1]=3 388 B11R0.5 CCCCC(N)CC(=O)OCC MCULE-6648259380 [1,1,0,0,0,0|0,0,1]=3 389 B11R0.5 CCCCC(O)CC(=O)OCC MCULE-1375788706 [1,1,0,0,0,0|0,0,1]=3 390 B11R0.5 CCOC(=O)CC(=O)CCOC MCULE-1660267189 [1,1,0,0,0,0|1,0,1]=4 391 B11R0.5 CCOC(=O)C[C@H](C)CCCO MCULE-7777596847 [1,1,0,0,0,0|1,0,1]=4 392 B11R0.5 CCOCC(=O)CC(=O)OCC MCULE-6712148047 [1,1,0,0,0,0|1,0,1]=4 393 B11R0.62 CCCC(=O)CCC(=O)OCC MCULE-3394958382 [1,1,0,0,0,0|0,0,2]=4 394 B11R0.62 CCCC(C)CCC(=O)OCC MCULE-9209148912 [1,1,0,0,0,0|0,0,1]=3 395 B11R0.62 CCOC(=O)/C=C/C(=O)OCC MCULE-3355274756 [1,1,0,0,0,0|1,0,1]=4 396 B11R0.62 CCOC(=O)/C=C\C(=O)OCC MCULE-1444251835 [1,1,0,0,0,0|1,0,1]=4 397 B11R0.62 CCOC(=O)C=CC(=O)OCC MCULE-3418342624 [1,1,0,0,0,0|1,0,1]=4 398 B11R0.81 C=CCOC(=O)CCCCCC MCULE-3528769589 [1,1,0,0,0,0|0,0,2]=4 399 B11R0.81 CCCCCCC(=O)CCCC MCULE-3791343950 [1,1,0,0,0,0|1,0,1]=4 400 B11R0.81 CCCCCCC(=O)NCCO MCULE-7382167098 [1,1,0,0,0,0|1,0,1]=4 401 B11R0.81 CCCCCCC(=O)OCCC MCULE-6309887109 [1,1,0,0,0,0|0,0,1]=3 402 B11R0.81 CCCCCOC(=O)CCCC MCULE-4804815950 [1,1,0,0,0,0|2,0,0]=4 403 B11R0.142 CCCCCOC(=O)C(C)CC MCULE-3065870950 [1,1,0,0,0,0|2,0,0]=4 404 B11R0.155 CCCCCC(=O)C(=O)OCC MCULE-6264599402 [1,1,0,0,0,0|0,0,0]=2 405 B11R0.155 CCCCCC(Br)C(=O)OCC MCULE-5071739287 [1,1,0,0,0,0|0,0,1]=3 406 B11R0.155 CCCCNC(=O)C(=O)NCC MCULE-7458551905 [1,1,0,0,0,0|2,0,0]=4 407 B11R0.155 CCO/C=C/C(=O)C(=O)OCC MCULE-8669095551 [1,1,0,0,0,0|1,0,1]=4 408 B11R0.155 CCOC(=O)C(=O)CCCC#N MCULE-4317374856 [1,1,0,0,0,0|1,0,1]=4 409 B11R0.155 CCOC(=O)C(=O)CCCCCl MCULE-2730081165 [1,1,0,0,0,0|1,0,0]=3 410 B11R0.155 CCOC(=O)C(=O)NCCOC MCULE-2506561736 [1,1,0,0,0,0|2,0,0]=4 411 B11R0.155 CCOC(=O)C(N)CCCCN MCULE-6161225514 [1,1,0,0,0,0|1,0,1]=4 412 B11R0.155 CCOC(=O)C(N)CCCCN MCULE-6784052563 [1,1,0,0,0,0|1,0,1]=4 413 B11R0.155 CCOC(=O)C(N)CCCCN MCULE-7207725681 [1,1,0,0,0,0|1,0,1]=4 414 B11R0.155 CCOC(=O)C(N)CCCCN MCULE-8403724896 [1,1,0,0,0,0|1,0,1]=4 415 B11R0.155 CCOC(=O)C(N)CCCOC MCULE-5689363804 [1,1,0,0,0,0|1,0,1]=4 416 B11R0.155 CCOC(=O)[C@@H](N)CCCCN MCULE-1818096073 [1,1,0,0,0,0|1,0,1]=4 417 B11R0.155 CCOC(=O)[C@@H](N)CCCCN MCULE-3988865124 [1,1,0,0,0,0|1,0,1]=4 418 B11R0.155 CCOC(=O)[C@@H](N)CCCCN MCULE-5713269112 [1,1,0,0,0,0|1,0,1]=4 419 B11R0.155 CCOC=CC(=O)C(=O)OCC MCULE-1205526936 [1,1,0,0,0,0|1,0,1]=4 420 B11R0.155 [C@H](N)(CCCCN)C(=O)OCC MCULE-3847914782 [1,1,0,0,0,0|1,0,1]=4 421 B11R0.155 [C@H](N)(CCCCN)C(=O)OCC MCULE-6370873846 [1,1,0,0,0,0|1,0,1]=4 422 B11R0.174 CCOC(=O)CCCC(=O)CC MCULE-7206281460 [1,1,0,0,0,0|0,0,2]=4 423 B11R0.174 CCOC(=O)CCNC(C)CC MCULE-1121544810 [1,1,0,0,0,0|1,0,1]=4 424 B11R0.176 C=C(C)CCCCC(=O)OCC MCULE-7155352281 [1,1,0,0,0,0|0,0,2]=4 425 B11R0.176 CCOC(=O)CCCCC(C)C MCULE-1122758538 [1,1,0,0,0,0|0,0,1]=3 426 B11R0.176 CCOC(=O)CCCCN(C)C MCULE-3964441840 [1,1,0,0,0,0|1,0,1]=4 427 B11R0.176 CCOC(=O)CCCCN(C)C MCULE-9060441726 [1,1,0,0,0,0|1,0,1]=4 428 B11R0.176 CCOC(=O)CCNCC(C)C MCULE-7863091825 [1,1,0,0,0,0|1,0,1]=4 429 B11R0.176 CCOC(=O)NCCCN(C)C MCULE-3997315924 [1,1,0,0,0,0|2,0,0]=4 430 B11R0.3 CCCC/C=C\CCCCCC MCULE-3573509087 [1,1,0,0,0,0|1,0,1]=4 431 B11R0.3 CCCCC=CCCCCCC MCULE-5218594928 [1,1,0,0,0,0|1,0,1]=4 432 B11R0.3 CCCCCC/C=C/C=C/CO MCULE-8951938021 [1,1,0,0,0,0|2,0,0]=4 433 B11R0.3 CCCCCCC=CC=CCO MCULE-5798292331 [1,1,0,0,0,0|2,0,0]=4 434 B11R0.42 CCCCCCOC(=O)C(C)C MCULE-2183299447 [1,1,0,0,0,0|1,0,1]=4 435 B11R0.106 COC(=O)/C=C/CCC(=O)OC MCULE-7603966348 [1,1,0,0,0,0|1,0,1]=4 436 B11R0.106 COC(=O)C=CCCC(=O)OC MCULE-4437090003 [1,1,0,0,0,0|1,0,1]=4 437 B11R0.154 CCCCCC(=O)CC(=O)OC MCULE-9153189731 [1,1,0,0,0,0|0,0,1]=3 438 B11R0.154 CCCCCC(C)NC(=O)CC MCULE-5203796337 [1,1,0,0,0,0|1,0,1]=4 439 B11R0.154 CCCCCC(C)NC(=O)OC MCULE-7863422076 [1,1,0,0,0,0|1,0,1]=4 440 B11R0.154 CCCCCC(O)CC(=O)OC MCULE-9477041708 [1,1,0,0,0,0|0,0,2]=4 441 B11R0.154 CCCCC[C@H](O)CC(=O)OC MCULE-4127190955 [1,1,0,0,0,0|0,0,2]=4 442 B13R0.2 C(=CCCC(=O)OCC)CCCCC MCULE-7720982156 [0,2,0,0,0,0|0,0,0]=2 443 B13R0.2 C=CCCCCCCCC(=O)OCC MCULE-7330309912 [0,2,0,0,0,0|0,0,2]=4 444 B13R0.2 CCCCC/C=C/CCC(=O)OCC MCULE-2528964118 [0,2,0,0,0,0|0,0,0]=2 445 B13R0.2 CCCCC/C=C\C=C\C(=O)OCC MCULE-3578089676 [0,2,0,0,0,0|0,0,0]=2 446 B13R0.2 CCCCCC=CC=CC(=O)OCC MCULE-6246344331 [0,2,0,0,0,0|0,0,0]=2 447 B13R0.2 CCCCCCC/C=C/C(=O)OCC MCULE-9821388261 [0,2,0,0,0,0|0,0,0]=2 448 B13R0.2 CCCCCCCC=CC(=O)OCC MCULE-8496462023 [0,2,0,0,0,0|0,0,0]=2 449 B13R0.2 CCCCCCCCCC(=O)OCC MCULE-9201389917 [0,2,0,0,0,0|0,0,2]=4 450 B13R0.2 CCCCCCNCCC(=O)OCC MCULE-8059203538 [0,2,0,0,0,0|0,0,2]=4 451 B13R0.2 CCOC(=O)CCCCCCCCBr MCULE-7199679649 [0,2,0,0,0,0|0,0,2]=4 452 B13R0.2 CCOCCCNCCC(=O)OCC MCULE-5907720522 [0,2,0,0,0,0|0,0,2]=4 453 B13R0.87 CCOC(=O)CCCCCC(=O)CC MCULE-9296151326 [0,2,0,0,0,0|0,0,2]=4 454 B13R0.88 C=C(C)CCCCCCC(=O)OCC MCULE-4909005807 [0,2,0,0,0,0|0,0,2]=4 455 B13R0.175 CCCCC(=O)CCCC(=O)OCC MCULE-9779499391 [0,2,0,0,0,0|0,0,2]=4 456 B13R0.193 CCCCCC(=O)C=CC(=O)OCC MCULE-4374046967 [0,2,0,0,0,0|0,0,0]=2 457 B13R0.193 CCCCCC(=O)CCC(=O)OCC MCULE-4346357886 [0,2,0,0,0,0|0,0,1]=3 458 B13R0.193 CCCCCC(O)C=CC(=O)OCC MCULE-6682483213 [0,2,0,0,0,0|0,0,0]=2 459 B13R0.193 CCCCNC(=O)NNC(=O)OCC MCULE-4936258392 [0,2,0,0,0,0|2,0,0]=4 460 B13R0.275 CCCCCCCC(C)C(=O)OCC MCULE-3939081286 [0,2,0,0,0,0|0,0,2]=4 461 B13R0.275 CCCCO/C=C/C(=O)C(=O)OCC MCULE-6926531238 [0,2,0,0,0,0|0,0,1]=3 462 B13R0.275 CCOC(=O)C(=O)CCCCCC#N MCULE-7325488782 [0,2,0,0,0,0|0,0,2]=4 463 B13R0.275 CCOC(=O)C(=O)CCCCCCCl MCULE-6238076438 [0,2,0,0,0,0|0,0,1]=3 464 B13R0.330 CC#CCCCC(=O)CC(=O)OCC MCULE-9785553227 [0,2,0,0,0,0|0,0,2]=4 465 B13R0.330 CCCCCCC(=O)CC(=O)OCC MCULE-7009669263 [0,2,0,0,0,0|0,0,1]=3 466 B13R0.330 CCCCCCC(O)CC(=O)OCC MCULE-1322338775 [0,2,0,0,0,0|0,0,2]=4 467 B13R0.330 CCOC(=O)CC(=O)COCCOC MCULE-1971389963 [0,2,0,0,0,0|1,0,1]=4 468 B13R0.335 CCCCCCCCC(=O)OC(C)C MCULE-6579125494 [0,2,0,0,0,0|0,0,2]=4 469 B13R0.367 CCCC(=O)CCCCC(=O)OCC MCULE-3320708203 [0,2,0,0,0,0|0,0,2]=4 470 B13R0.367 CCOC(=O)C/C=C/CC(=O)OCC MCULE-5525043268 [0,2,0,0,0,0|1,0,1]=4 471 B13R0.367 CCOC(=O)CC=CCC(=O)OCC MCULE-5350773474 [0,2,0,0,0,0|1,0,1]=4 472 B13R0.367 CCOC(=O)CCCCC(Cl)CCCl MCULE-9571782817 [0,2,0,0,0,0|0,0,2]=4 473 B13R0.367 CCOC(=O)CCCCC(O)CCCl MCULE-5110914158 [0,2,0,0,0,0|0,0,2]=4 474 B13R0.39 CCCCC(C)C(=O)CC(=O)OCC MCULE-7205529611 [0,2,0,0,0,0|0,0,1]=3 475 B13R0.120 CCCCC(=O)CC(=O)C(=O)OCC MCULE-9149325428 [0,2,0,0,0,0|0,0,2]=4 476 B13R0.176 CCCOC(=O)C=CC(=O)OCCC MCULE-4725161876 [0,2,0,0,0,0|1,0,1]=4 477 B13R0.305 CCCCC(CC)CCC(=O)OCC MCULE-9778951174 [0,2,0,0,0,0|0,0,2]=4 478 B13R0.305 CCCCC(CC)CNC(=O)OCC MCULE-3015846389 [0,2,0,0,0,0|1,0,1]=4 479 B13R0.806 CCCCCCC(C)(N)C(=O)OCC MCULE-2166645203 [0,2,0,0,0,0|0,0,2]=4 480 B13R0.806 CCCCCCC(F)(F)C(=O)OCC MCULE-2998894767 [0,2,0,0,0,0|0,0,2]=4 481 B13R0.154 CCCCCCCC(=O)OCC(C)C MCULE-4691724059 [0,2,0,0,0,0|0,0,2]=4 482 B13R0.195 CCCCCC(=O)NC(=O)CCCC MCULE-2381656471 [0,2,0,0,0,0|2,0,0]=4 483 B13R0.338 CCCCCCCC(=O)OCCCC MCULE-6089605512 [0,2,0,0,0,0|0,0,2]=4 484 B13R0.89 CCOC(=O)C=C(C)CC(=O)OCC MCULE-5585201163 [0,2,0,0,0,0|1,0,1]=4 485 B13R0.331 CCOC(=O)CC(=O)CCCC(C)C MCULE-3183647227 [0,2,0,0,0,0|0,0,1]=3 486 B11R1.16 C1(CCCNC1)C(=O)OCC MCULE-7218455020 [1,0,0,1,0,0|1,0,1]=4 487 B11R1.16 CCCC(=O)C1CCCCC1 MCULE-1634042258 [1,0,0,1,0,0|1,0,1]=4 488 B11R1.16 CCCC(=O)N1CCCCC1 MCULE-9769447457 [1,0,0,1,0,0|2,0,0]=4 489 B11R1.16 CCNC(=O)C1CCCCC1 MCULE-9090071277 [1,0,0,1,0,0|1,0,1]=4 490 B11R1.16 CCOC(=O)C1=CCCNC1 MCULE-2494881503 [1,0,0,1,0,0|1,0,0]=3 491 B11R1.16 CCOC(=O)C1=CCCNC1 MCULE-9977440197 [1,0,0,1,0,0|1,0,0]=3 492 B11R1.16 CCOC(=O)C1=CCCOC1 MCULE-5684493828 [1,0,0,1,0,0|1,0,0]=3 493 B11R1.16 CCOC(=O)C1=CCNCC1 MCULE-3550900853 [1,0,0,1,0,0|1,0,0]=3 494 B11R1.16 CCOC(=O)C1=CCNCC1 MCULE-6019226182 [1,0,0,1,0,0|1,0,0]=3 495 B11R1.16 CCOC(=O)C1=CNCCC1 MCULE-9071812580 [1,0,0,1,0,0|1,0,0]=3 496 B11R1.16 CCOC(=O)C1=CNCCS1 MCULE-6640913067 [1,0,0,1,0,0|2,0,0]=4 497 B11R1.16 CCOC(=O)C1=COCCC1 MCULE-8401522266 [1,0,0,1,0,0|1,0,0]=3 498 B11R1.16 CCOC(=O)C1CCCCC1 MCULE-9489706932 [1,0,0,1,0,0|0,0,1]=3 499 B11R1.16 CCOC(=O)C1CCCCN1 MCULE-3387848530 [1,0,0,1,0,0|1,0,1]=4 500 B11R1.16 CCOC(=O)C1CCCCN1 MCULE-6852631244 [1,0,0,1,0,0|1,0,1]=4 501 B11R1.16 CCOC(=O)C1CCCCN1 MCULE-7008895744 [1,0,0,1,0,0|1,0,1]=4 502 B11R1.16 CCOC(=O)C1CCCCN1 MCULE-8548542082 [1,0,0,1,0,0|1,0,1]=4 503 B11R1.16 CCOC(=O)C1CCCCO1 MCULE-6947775878 [1,0,0,1,0,0|1,0,1]=4 504 B11R1.16 CCOC(=O)C1CCCNC1 MCULE-3675023359 [1,0,0,1,0,0|1,0,1]=4 505 B11R1.16 CCOC(=O)C1CCCNC1 MCULE-4746135984 [1,0,0,1,0,0|1,0,1]=4 506 B11R1.16 CCOC(=O)C1CCCNC1 MCULE-8856518925 [1,0,0,1,0,0|1,0,1]=4 507 B11R1.16 CCOC(=O)C1CCCOC1 MCULE-7996513426 [1,0,0,1,0,0|1,0,1]=4 508 B11R1.16 CCOC(=O)C1CCNCC1 MCULE-1027841713 [1,0,0,1,0,0|1,0,1]=4 509 B11R1.16 CCOC(=O)C1CCNCC1 MCULE-4502754234 [1,0,0,1,0,0|1,0,1]=4 510 B11R1.16 CCOC(=O)C1CCOCC1 MCULE-6838508341 [1,0,0,1,0,0|1,0,1]=4 511 B11R1.16 CCOC(=O)N1C=CCCC1 MCULE-2782539090 [1,0,0,1,0,0|1,0,1]=4 512 B11R1.16 CCOC(=O)N1CCCCC1 MCULE-9100997547 [1,0,0,1,0,0|1,0,0]=3 513 B11R1.16 CCOC(=O)N1CCNCC1 MCULE-3621512585 [1,0,0,1,0,0|2,0,0]=4 514 B11R1.16 CCOC(=O)N1CCOCC1 MCULE-2835623669 [1,0,0,1,0,0|2,0,0]=4 515 B11R1.16 CCOC(=O)[C@@H]1CCCCN1 MCULE-1748361632 [1,0,0,1,0,0|1,0,1]=4 516 B11R1.16 CCOC(=O)[C@@H]1CCCCN1 MCULE-2693297322 [1,0,0,1,0,0|1,0,1]=4 517 B11R1.16 CCOC(=O)[C@@H]1CCCCN1 MCULE-5302379375 [1,0,0,1,0,0|1,0,1]=4 518 B11R1.16 CCOC(=O)[C@@H]1CCCCN1 MCULE-6361807016 [1,0,0,1,0,0|1,0,1]=4 519 B11R1.16 CCOC(=O)[C@@H]1CCCNC1 MCULE-1359008002 [1,0,0,1,0,0|1,0,1]=4 520 B11R1.16 CCOC(=O)[C@@H]1CCCNC1 MCULE-3017848023 [1,0,0,1,0,0|1,0,1]=4 521 B11R1.16 CCOC(=O)[C@@H]1CCCNC1 MCULE-3626074988 [1,0,0,1,0,0|1,0,1]=4 522 B11R1.16 CCOC(=O)[C@@H]1CCCNC1 MCULE-4968733918 [1,0,0,1,0,0|1,0,1]=4 523 B11R1.16 CCOC(=O)[C@@H]1CCCNC1 MCULE-8465407593 [1,0,0,1,0,0|1,0,1]=4 524 B11R1.16 CCOC(=O)[C@@H]1CCCNC1 MCULE-9622641716 [1,0,0,1,0,0|1,0,1]=4 525 B11R1.16 CCOC(=O)[C@H]1CCCCN1 MCULE-1831173115 [1,0,0,1,0,0|1,0,1]=4 526 B11R1.16 CCOC(=O)[C@H]1CCCCN1 MCULE-3506778792 [1,0,0,1,0,0|1,0,1]=4 527 B11R1.16 CCOC(=O)[C@H]1CCCCN1 MCULE-4098494223 [1,0,0,1,0,0|1,0,1]=4 528 B11R1.16 CCOC(=O)[C@H]1CCCCN1 MCULE-7328799091 [1,0,0,1,0,0|1,0,1]=4 529 B11R1.16 CCOC(=O)[C@H]1CCCNC1 MCULE-2736748797 [1,0,0,1,0,0|1,0,1]=4 530 B11R1.16 CCOC(=O)[C@H]1CCCNC1 MCULE-3698900770 [1,0,0,1,0,0|1,0,1]=4 531 B11R1.16 CCOC(=O)[C@H]1CCCNC1 MCULE-6641118890 [1,0,0,1,0,0|1,0,1]=4 532 B11R1.16 CCOC(=O)[C@H]1CCCNC1 MCULE-7157160072 [1,0,0,1,0,0|1,0,1]=4 533 B11R1.16 CCOC(=O)[C@H]1CCCNC1 MCULE-7599426784 [1,0,0,1,0,0|1,0,1]=4 534 B11R1.16 CCOC(=O)[C@H]1CCCNC1 MCULE-9165782492 [1,0,0,1,0,0|1,0,1]=4 535 B11R1.16 CCOC(=S)N1CCCCC1 MCULE-7210433552 [1,0,0,1,0,0|1,1,0]=4 536 B11R1.16 N1CCCC(C1)C(=O)OCC MCULE-7955165183 [1,0,0,1,0,0|1,0,1]=4 537 B11R1.16 O=C(OCCl)C1CCCCC1 MCULE-2780074453 [1,0,0,1,0,0|1,0,1]=4 538 B11R1.24 CCCCC1=CC(=O)CCC1 MCULE-9500356684 [1,0,0,1,0,0|1,0,0]=3 539 B11R1.24 CCCCC1CCCC(=O)O1 MCULE-5855223168 [1,0,0,1,0,0|2,0,0]=4 540 B11R1.30 CCCC(=O)NC1CCCC1 MCULE-1301109285 [1,0,0,1,0,0|2,0,0]=4 541 B11R1.30 CCOC(=O)/C=C\1/CCNC1 MCULE-1201234748 [1,0,0,1,0,0|1,0,0]=3 542 B11R1.30 CCOC(=O)/C=C\1/CCNC1 MCULE-6253274076 [1,0,0,1,0,0|1,0,0]=3 543 B11R1.30 CCOC(=O)C=C1CCCC1 MCULE-7811515870 [1,0,0,1,0,0|0,0,0]=2 544 B11R1.30 CCOC(=O)C=C1CCNC1 MCULE-3577381412 [1,0,0,1,0,0|1,0,0]=3 545 B11R1.30 CCOC(=O)CC1CCCC1 MCULE-2844673391 [1,0,0,1,0,0|0,0,1]=3 546 B11R1.30 CCOC(=O)CC1CCCN1 MCULE-5947811140 [1,0,0,1,0,0|1,0,1]=4 547 B11R1.30 CCOC(=O)CC1CCCN1 MCULE-7326766201 [1,0,0,1,0,0|1,0,1]=4 548 B11R1.30 CCOC(=O)CC1CCCO1 MCULE-6422962356 [1,0,0,1,0,0|1,0,1]=4 549 B11R1.30 CCOC(=O)CC1CCNC1 MCULE-1123765721 [1,0,0,1,0,0|1,0,1]=4 550 B11R1.30 CCOC(=O)CC1CCNC1 MCULE-5502932086 [1,0,0,1,0,0|1,0,1]=4 551 B11R1.30 CCOC(=O)CC1CCOC1 MCULE-3816959960 [1,0,0,1,0,0|1,0,1]=4 552 B11R1.30 CCOC(=O)CN1CCCC1 MCULE-6950382542 [1,0,0,1,0,0|1,0,1]=4 553 B11R1.30 CCOC(=O)C[C@H]1CCNC1 MCULE-1209534740 [1,0,0,1,0,0|1,0,1]=4 554 B11R1.30 CCOC(=O)C[C@H]1CCNC1 MCULE-2515107565 [1,0,0,1,0,0|1,0,1]=4 555 B11R1.30 CCOC(=O)C[C@H]1CCNC1 MCULE-4863211163 [1,0,0,1,0,0|1,0,1]=4 556 B11R1.30 CCOC(=O)C[C@H]1CCNC1 MCULE-5115028770 [1,0,0,1,0,0|1,0,1]=4 557 B11R1.30 O=C(CC1CCCC1)OCCl MCULE-4873010573 [1,0,0,1,0,0|1,0,1]=4 558 B11R1.101 O=C1CCCCCCCCC1 MCULE-7431354983 [1,0,0,1,0,0|1,0,1]=4 559 B11R1.101 O=C1CCCCCCCCN1 MCULE-4805310836 [1,0,0,1,0,0|1,0,1]=4 560 B11R1.135 CCCC1CCNC(=O)CC1 MCULE-3101429191 [1,0,0,1,0,0|1,0,1]=4 561 B11R1.180 CCCCC=C1CCCC1=O MCULE-3061361246 [1,0,0,1,0,0|1,0,0]=3 562 B11R1.180 CCCCCC1=CCCC1=O MCULE-2643922279 [1,0,0,1,0,0|1,0,1]=4 563 B11R1.180 CCCCCC1CCCC1=O MCULE-7048040111 [1,0,0,1,0,0|1,0,1]=4 564 B11R1.180 CCCCCN1CCCC1=O MCULE-7791437264 [1,0,0,1,0,0|2,0,0]=4 565 B11R1.199 CCOC(=O)C1=C(CCC1)N MCULE-4791177664 [1,0,0,1,0,0|1,0,1]=4 566 B11R1.199 CCOC(=O)C1CCCC1N MCULE-4744440276 [1,0,0,1,0,0|1,0,1]=4 567 B11R1.199 CCOC(=O)C1CCCC1N MCULE-9857282632 [1,0,0,1,0,0|1,0,1]=4 568 B11R1.199 CCOC(=O)C1CCCC1O MCULE-9155260134 [1,0,0,1,0,0|1,0,1]=4 569 B11R1.199 CCOC(=O)C1CCNC1C MCULE-1824974216 [1,0,0,1,0,0|1,0,1]=4 570 B11R1.199 CCOC(=O)C1CNCC1C MCULE-8063603247 [1,0,0,1,0,0|1,0,1]=4 571 B11R1.199 CCOC(=O)C1NCCC1C MCULE-2070726860 [1,0,0,1,0,0|1,0,1]=4 572 B11R1.199 CCOC(=O)[C@@H]1CCC[C@@H]1N MCULE-4132662846 [1,0,0,1,0,0|1,0,1]=4 573 B11R1.199 CCOC(=O)[C@@H]1CCC[C@@H]1N MCULE-5969287271 [1,0,0,1,0,0|1,0,1]=4 574 B11R1.199 CCOC(=O)[C@@H]1CCC[C@@H]1N MCULE-6169423843 [1,0,0,1,0,0|1,0,1]=4 575 B11R1.199 CCOC(=O)[C@@H]1CCC[C@@H]1N MCULE-9324644701 [1,0,0,1,0,0|1,0,1]=4 576 B11R1.199 CCOC(=O)[C@@H]1CCC[C@@H]1O MCULE-1732093217 [1,0,0,1,0,0|1,0,1]=4 577 B11R1.199 CCOC(=O)[C@@H]1CCC[C@@H]1O MCULE-2867532959 [1,0,0,1,0,0|1,0,1]=4 578 B11R1.199 CCOC(=O)[C@@H]1CCC[C@H]1N MCULE-2186277279 [1,0,0,1,0,0|1,0,1]=4 579 B11R1.199 CCOC(=O)[C@@H]1CCC[C@H]1N MCULE-3939519217 [1,0,0,1,0,0|1,0,1]=4 580 B11R1.199 CCOC(=O)[C@@H]1CCC[C@H]1N MCULE-5751284317 [1,0,0,1,0,0|1,0,1]=4 581 B11R1.199 CCOC(=O)[C@@H]1CCC[C@H]1N MCULE-7151904075 [1,0,0,1,0,0|1,0,1]=4 582 B11R1.199 CCOC(=O)[C@@H]1CCC[C@H]1N MCULE-8585923007 [1,0,0,1,0,0|1,0,1]=4 583 B11R1.199 CCOC(=O)[C@@H]1CCC[C@H]1O MCULE-1459601802 [1,0,0,1,0,0|1,0,1]=4 584 B11R1.199 CCOC(=O)[C@@H]1CCC[C@H]1O MCULE-6974814890 [1,0,0,1,0,0|1,0,1]=4 585 B11R1.199 CCOC(=O)[C@@H]1CCN[C@@H]1C MCULE-2354452497 [1,0,0,1,0,0|1,0,1]=4 586 B11R1.199 CCOC(=O)[C@@H]1CCN[C@H]1C MCULE-5969475192 [1,0,0,1,0,0|1,0,1]=4 587 B11R1.199 CCOC(=O)[C@@H]1CNC[C@H]1C MCULE-7965699372 [1,0,0,1,0,0|1,0,1]=4 588 B11R1.199 CCOC(=O)[C@@H]1NCC[C@@H]1C MCULE-1666171700 [1,0,0,1,0,0|1,0,1]=4 589 B11R1.199 CCOC(=O)[C@@H]1NCC[C@@H]1C MCULE-7247848958 [1,0,0,1,0,0|1,0,1]=4 590 B11R1.199 CCOC(=O)[C@@H]1NCC[C@H]1C MCULE-6177092493 [1,0,0,1,0,0|1,0,1]=4 591 B11R1.199 CCOC(=O)[C@H]1CCC[C@@H]1N MCULE-3601767113 [1,0,0,1,0,0|1,0,1]=4 592 B11R1.199 CCOC(=O)[C@H]1CCC[C@@H]1N MCULE-6957813411 [1,0,0,1,0,0|1,0,1]=4 593 B11R1.199 CCOC(=O)[C@H]1CCC[C@H]1N MCULE-1305947087 [1,0,0,1,0,0|1,0,1]=4 594 B11R1.199 CCOC(=O)[C@H]1CCC[C@H]1N MCULE-1727343030 [1,0,0,1,0,0|1,0,1]=4 595 B11R1.199 CCOC(=O)[C@H]1CCC[C@H]1N MCULE-3606897920 [1,0,0,1,0,0|1,0,1]=4 596 B11R1.199 CCOC(=O)[C@H]1CCC[C@H]1N MCULE-4139911354 [1,0,0,1,0,0|1,0,1]=4 597 B11R1.199 CCOC(=O)[C@H]1CCC[C@H]1N MCULE-4274273299 [1,0,0,1,0,0|1,0,1]=4 598 B11R1.199 CCOC(=O)[C@H]1CCC[C@H]1N MCULE-4654939022 [1,0,0,1,0,0|1,0,1]=4 599 B11R1.199 CCOC(=O)[C@H]1CCN[C@@H]1C MCULE-5767802234 [1,0,0,1,0,0|1,0,1]=4 600 B11R1.199 CCOC(=O)[C@H]1CCN[C@H]1C MCULE-2196272727 [1,0,0,1,0,0|1,0,1]=4 601 B11R1.199 CCOC(=O)[C@H]1CNC[C@@H]1C MCULE-1336913244 [1,0,0,1,0,0|1,0,1]=4 602 B11R1.199 CCOC(=O)[C@H]1CNC[C@@H]1C MCULE-2896751298 [1,0,0,1,0,0|1,0,1]=4 603 B11R1.199 CCOC(=O)[C@H]1NCC[C@@H]1C MCULE-9098112527 [1,0,0,1,0,0|1,0,1]=4 604 B11R1.199 CCOC(=O)[C@H]1NCC[C@H]1C MCULE-4833931996 [1,0,0,1,0,0|1,0,1]=4 605 B11R1.199 CCOC(=O)[C@H]1NCC[C@H]1C MCULE-8712554117 [1,0,0,1,0,0|1,0,1]=4 606 B11R1.230 CCCCC1OC(=O)CC1C MCULE-2892818509 [1,0,0,1,0,0|2,0,0]=4 607 B11R1.288 CCOC(=O)C=CC1OC1C MCULE-1126587814 [1,0,0,1,0,0|1,0,0]=3 608 B11R1.289 CCOC(=O)/C=C/C1CCC1 MCULE-3685223647 [1,0,0,1,0,0|0,0,0]=2 609 B11R1.289 CCOC(=O)C=CC1CCC1 MCULE-7861856483 [1,0,0,1,0,0|0,0,0]=2 610 B11R1.289 CCOC(=O)CCC1CCC1 MCULE-8865347499 [1,0,0,1,0,0|0,0,1]=3 611 B11R1.289 CCOC(=O)CCN1CCC1 MCULE-7384324736 [1,0,0,1,0,0|1,0,1]=4 612 B11R1.289 CCOC(=O)CNC1CCC1 MCULE-7494502106 [1,0,0,1,0,0|1,0,1]=4 613 B11R1.290 CCOC(=O)CCNC1CC1 MCULE-3399465340 [1,0,0,1,0,0|1,0,1]=4 614 B11R1.290 CCOC(=O)CNCC1CC1 MCULE-8908855539 [1,0,0,1,0,0|1,0,1]=4 615 B11R1.290 CCOC(=O)COCC1CC1 MCULE-9684603130 [1,0,0,1,0,0|1,0,1]=4 616 B11R1.28 CCCCCC1=CCNCC1 MCULE-3759142054 [1,0,0,1,0,0|1,0,1]=4 617 B11R1.1 CCCCC1CCC(=O)CC1 MCULE-3632759144 [1,0,0,1,0,0|0,0,2]=4 618 B11R1.25 COC(=O)/C=C/C1CCCC1 MCULE-1352596380 [1,0,0,1,0,0|0,0,0]=2 619 B11R1.25 COC(=O)/C=C/N1CCCC1 MCULE-5240446180 [1,0,0,1,0,0|1,0,0]=3 620 B11R1.25 COC(=O)C=CC1CCCC1 MCULE-8918279747 [1,0,0,1,0,0|0,0,0]=2 621 B11R1.25 COC(=O)CCC1CCCC1 MCULE-5184172905 [1,0,0,1,0,0|0,0,2]=4 622 B11R1.25 COC(=O)CNC1CCCC1 MCULE-1776376918 [1,0,0,1,0,0|1,0,1]=4 623 B11R1.25 COC(=O)CNC1CCCC1 MCULE-2460300969 [1,0,0,1,0,0|1,0,1]=4 624 B11R1.27 CCCCCC1CCC(=O)O1 MCULE-8658118167 [1,0,0,1,0,0|1,0,1]=4 625 B11R1.27 CCCCC[C@H]1CCC(=O)O1 MCULE-5773106371 [1,0,0,1,0,0|1,0,1]=4 626 B11R1.40 CCC(=O)CC1CCCCC1 MCULE-4548371264 [1,0,0,1,0,0|0,0,2]=4 627 B11R1.40 CCC(=O)NC1CCCCC1 MCULE-3419977107 [1,0,0,1,0,0|1,0,1]=4 628 B11R1.40 CCC(=O)OC1CCCCC1 MCULE-4878482925 [1,0,0,1,0,0|1,0,1]=4 629 B11R1.40 COC(=O)C=C1CCCCC1 MCULE-4895716264 [1,0,0,1,0,0|0,0,0]=2 630 B11R1.40 COC(=O)C=C1CCCCN1 MCULE-1404515648 [1,0,0,1,0,0|1,0,0]=3 631 B11R1.40 COC(=O)C=C1CCCOC1 MCULE-4989506759 [1,0,0,1,0,0|1,0,0]=3 632 B11R1.40 COC(=O)C=C1CCOCC1 MCULE-8966074278 [1,0,0,1,0,0|1,0,0]=3 633 B11R1.40 COC(=O)C=C1CCSCC1 MCULE-4860035890 [1,0,0,1,0,0|1,0,0]=3 634 B11R1.40 COC(=O)CC1CCCCC1 MCULE-4749534991 [1,0,0,1,0,0|0,0,2]=4 635 B11R1.40 COC(=O)NC1CCCCC1 MCULE-4935299070 [1,0,0,1,0,0|1,0,1]=4 636 B11R1.214 CCCCC1=CC=C(S1)CC MCULE-8423230583 [1,0,0,1,0,0|0,1,1]=4 637 B11R1.222 COC(=O)C1NCCCC1C MCULE-4240891821 [1,0,0,1,0,0|1,0,1]=4 638 B11R1.222 COC(=O)C1NCCCC1C MCULE-4887956825 [1,0,0,1,0,0|1,0,1]=4 639 B11R1.222 COC(=O)[C@H]1NCCC[C@H]1C MCULE-3063776541 [1,0,0,1,0,0|1,0,1]=4 640 B11R1.222 COC(=O)[C@H]1NCCC[C@H]1C MCULE-5946883789 [1,0,0,1,0,0|1,0,1]=4 641 B11R1.222 COC(=O)[C@H]1NCCC[C@H]1C MCULE-6952115958 [1,0,0,1,0,0|1,0,1]=4 642 B11R1.222 COC(=O)[C@H]1NCCC[C@H]1C MCULE-7399475599 [1,0,0,1,0,0|1,0,1]=4 643 B11R1.228 COC(=O)C=C1CCCN1C MCULE-5736162283 [1,0,0,1,0,0|1,0,0]=3 644 B11R1.852 CCC(=O)C1CCCCCC1 MCULE-7443621337 [1,0,0,1,0,0|0,0,2]=4 645 B11R1.852 COC(=O)C1CCCCCC1 MCULE-8003000735 [1,0,0,1,0,0|0,0,2]=4 646 B11R1.852 COC(=O)C1CCCCCN1 MCULE-8548406183 [1,0,0,1,0,0|1,0,1]=4 647 B11R1.852 COC(=O)C1CCCCCN1 MCULE-9755218906 [1,0,0,1,0,0|1,0,1]=4 648 B11R1.852 COC(=O)[C@@H]1CCCCCN1 MCULE-2832726026 [1,0,0,1,0,0|1,0,1]=4 649 B11R1.852 COC(=O)[C@@H]1CCCCCN1 MCULE-6917033588 [1,0,0,1,0,0|1,0,1]=4 650 B11R1.852 COC(=O)[C@H]1CCCCCN1 MCULE-1594353042 [1,0,0,1,0,0|1,0,1]=4 651 B11R1.852 COC(=O)[C@H]1CCCCCN1 MCULE-7957773860 [1,0,0,1,0,0|1,0,1]=4 652 B13R1.42 CCOC(=O)/C=C/C1CCCCC1 MCULE-1457900968 [0,1,0,1,0,0|0,0,0]=2 653 B13R1.42 CCOC(=O)/C=C/C1CCNCC1 MCULE-1868236818 [0,1,0,1,0,0|0,0,0]=2 654 B13R1.42 CCOC(=O)/C=C/C1CCOCC1 MCULE-8254004680 [0,1,0,1,0,0|0,0,0]=2 655 B13R1.42 CCOC(=O)/C=C/N1CCOCC1 MCULE-8643748250 [0,1,0,1,0,0|1,0,0]=3 656 B13R1.42 CCOC(=O)C=CC1CCCCC1 MCULE-5687333040 [0,1,0,1,0,0|0,0,0]=2 657 B13R1.42 CCOC(=O)C=CC1CCOCC1 MCULE-8386161785 [0,1,0,1,0,0|0,0,0]=2 658 B13R1.42 CCOC(=O)C=CN1CCOCC1 MCULE-1626265065 [0,1,0,1,0,0|1,0,0]=3 659 B13R1.42 CCOC(=O)CCC1CCCCC1 MCULE-3795646947 [0,1,0,1,0,0|0,0,2]=4 660 B13R1.42 CCOC(=O)CCC1CCCCN1 MCULE-8312422994 [0,1,0,1,0,0|0,0,2]=4 661 B13R1.42 CCOC(=O)CCC1CCCCN1 MCULE-9450759265 [0,1,0,1,0,0|0,0,2]=4 662 B13R1.42 CCOC(=O)CCC1CCCNC1 MCULE-1637411753 [0,1,0,1,0,0|0,0,2]=4 663 B13R1.42 CCOC(=O)CCC1CCCNC1 MCULE-8761619525 [0,1,0,1,0,0|0,0,2]=4 664 B13R1.42 CCOC(=O)CCC1CCNCC1 MCULE-6427583290 [0,1,0,1,0,0|0,0,2]=4 665 B13R1.42 CCOC(=O)CCC1CCNCC1 MCULE-9125092654 [0,1,0,1,0,0|0,0,2]=4 666 B13R1.42 CCOC(=O)CCC1CCOCC1 MCULE-5773636038 [0,1,0,1,0,0|0,0,2]=4 667 B13R1.42 CCOC(=O)CCN1CCCCC1 MCULE-1605821182 [0,1,0,1,0,0|0,0,2]=4 668 B13R1.42 CCOC(=O)CNC1CCCCC1 MCULE-1722006916 [0,1,0,1,0,0|0,0,2]=4 669 B13R1.42 CCOC(=O)CNC1CCCCC1 MCULE-4764520099 [0,1,0,1,0,0|0,0,2]=4 670 B13R1.42 CCOC(=O)COC1CCCCO1 MCULE-4958737382 [0,1,0,1,0,0|1,0,1]=4 671 B13R1.42 CCOC(=O)COC1CCNCC1 MCULE-2621367837 [0,1,0,1,0,0|1,0,1]=4 672 B13R1.42 CCOC(=O)COC1CCNCC1 MCULE-6082423574 [0,1,0,1,0,0|1,0,1]=4 673 B13R1.42 CCOC(=O)NN=C1CCSCC1 MCULE-3263186281 [0,1,0,1,0,0|2,0,0]=4 674 B13R1.208 CCCC1=C(C=NN1)C(=O)OCC MCULE-4355103385 [0,1,0,1,0,0|1,0,1]=4 675 B13R1.208 CCCN1C=CN=C1C(=O)OCC MCULE-9081508932 [0,1,0,1,0,0|1,0,1]=4 676 B13R1.279 O=C1CCCCCCCCCCO1 MCULE-5646678690 [0,1,0,1,0,0|0,0,2]=4 677 B13R1.404 CCOC(=O)CCNC1CCCC1 MCULE-1525288622 [0,1,0,1,0,0|0,0,2]=4 678 B13R1.404 CCOC(=O)CCNC1CCCC1 MCULE-8488402424 [0,1,0,1,0,0|0,0,2]=4 679 B13R1.404 CCOC(=O)CNCC1CCCO1 MCULE-5596592609 [0,1,0,1,0,0|1,0,1]=4 680 B13R1.404 CCOC(=O)COCC1CCCO1 MCULE-2076514702 [0,1,0,1,0,0|1,0,1]=4 681 B13R1.448 CCOC(=O)CCCNC1CCC1 MCULE-1013663406 [0,1,0,1,0,0|0,0,2]=4 682 B13R1.463 CCOC(=O)C1CCCCCC1=O MCULE-8781094992 [0,1,0,1,0,0|0,0,1]=3 683 B13R1.463 CCOC(=O)C1CCNCCC1=O MCULE-4199529667 [0,1,0,1,0,0|1,0,1]=4 684 B13R1.463 CCOC(=O)C1CCNCCC1=O MCULE-7118705456 [0,1,0,1,0,0|1,0,1]=4 685 B13R1.463 CCOC(=O)C1CCOCCC1=O MCULE-8850172326 [0,1,0,1,0,0|1,0,1]=4 686 B13R1.463 CCOC(=O)C1CCSCCC1=O MCULE-6137242607 [0,1,0,1,0,0|1,0,1]=4 687 B13R1.463 CCOC(=O)C1CNCCCC1=O MCULE-6824477261 [0,1,0,1,0,0|1,0,1]=4 688 B13R1.463 CCOC(=O)C1CNCCCC1=O MCULE-9970129859 [0,1,0,1,0,0|1,0,1]=4 689 B13R1.463 CCSC(=O)N1CCCCCC1=O MCULE-4766875850 [0,1,0,1,0,0|1,1,0]=4 690 B13R1.464 CCOC(=O)N1CCCCC1CO MCULE-3880015020 [0,1,0,1,0,0|1,0,1]=4 691 B13R1.470 CCOC(=O)CC1CCCCC1C MCULE-2556210216 [0,1,0,1,0,0|0,0,2]=4 692 B13R1.470 CCOC(=O)CC1CCNCC1C MCULE-6866763376 [0,1,0,1,0,0|0,0,2]=4 693 B13R1.470 CCOC(=O)CC1CCNCC1C MCULE-8458420799 [0,1,0,1,0,0|0,0,2]=4 694 B13R1.470 CCOC(=O)CN1CCCCC1C MCULE-7049686856 [0,1,0,1,0,0|0,0,2]=4 695 B13R1.1464 CCOC(=O)C1CCCCCCC1 MCULE-7547074128 [0,1,0,1,0,0|0,0,2]=4 696 B13R1.1575 CCOC(=O)C=C1CCCCCC1 MCULE-9731133687 [0,1,0,1,0,0|0,0,0]=2 697 B13R1.1575 CCOC(=O)C=C1CCCCCN1 MCULE-9843864045 [0,1,0,1,0,0|0,0,0]=2 698 B13R1.1575 CCOC(=O)CC1CCCCCC1 MCULE-3082077758 [0,1,0,1,0,0|0,0,2]=4 699 B13R1.1575 CCOC(=O)CN1CCCCCC1 MCULE-5110746682 [0,1,0,1,0,0|0,0,2]=4 700 B13R1.1575 CCOC(=O)CN1CCCNCC1 MCULE-2285037240 [0,1,0,1,0,0|1,0,1]=4 701 B13R1.1575 CCOC(=O)CN1CCCNCC1 MCULE-4526170590 [0,1,0,1,0,0|1,0,1]=4 702 B13R1.1575 CCOC(=O)NC1CCCCCC1 MCULE-5320832869 [0,1,0,1,0,0|0,0,2]=4 703 B13R1.2851 CCCCOC1CC1C(=O)OCC MCULE-7375295486 [0,1,0,1,0,0|0,0,2]=4 704 B13R1.348 CC(C)OC(=O)NC1CCCCC1 MCULE-9541087531 [0,1,0,1,0,0|1,0,1]=4 705 B13R1.348 CC(Cl)OC(=O)OC1CCCCC1 MCULE-3736745183 [0,1,0,1,0,0|1,0,1]=4 706 B13R1.3574 CCCCC/C=C/C(=O)NC1CC1 MCULE-7911480108 [0,1,0,1,0,0|1,0,0]=3 707 B13R1.3574 CCCCCC=CC(=O)NC1CC1 MCULE-4649522920 [0,1,0,1,0,0|1,0,0]=3 708 B13R1.47 CCOC(=O)C(=O)C1CCCCC1 MCULE-4193969886 [0,1,0,1,0,0|0,0,1]=3 709 B13R1.47 CCOC(=O)C(=O)C1CCCCN1 MCULE-7143642530 [0,1,0,1,0,0|1,0,1]=4 710 B13R1.47 CCOC(=O)C(=O)C1CCCCN1 MCULE-8587800131 [0,1,0,1,0,0|1,0,1]=4 711 B13R1.47 CCOC(=O)C(=O)N1CCCCC1 MCULE-9475430431 [0,1,0,1,0,0|1,0,0]=3 712 B13R1.47 CCOC(=O)C(=O)N1CCNCC1 MCULE-4413723883 [0,1,0,1,0,0|2,0,0]=4 713 B13R1.47 CCOC(=O)C(=O)N1CCNCC1 MCULE-7165942951 [0,1,0,1,0,0|2,0,0]=4 714 B13R1.47 CCOC(=O)C(=O)N1CCOCC1 MCULE-4492481246 [0,1,0,1,0,0|2,0,0]=4 715 B13R1.47 CCOC(=O)C(Br)C1CCCCC1 MCULE-4107624146 [0,1,0,1,0,0|0,0,2]=4 716 B13R1.47 CCOC(=O)C(C)N1CCCCC1 MCULE-5752417904 [0,1,0,1,0,0|1,0,1]=4 717 B13R1.47 CCOC(=O)C(N)C1CCCCC1 MCULE-9164476075 [0,1,0,1,0,0|0,0,2]=4 718 B13R1.47 CCOC(=O)N(C)C1CCCCC1 MCULE-1811616474 [0,1,0,1,0,0|1,0,1]=4 719 B13R1.66 CCOC(=O)C(=O)NC1CCCC1 MCULE-8089860243 [0,1,0,1,0,0|1,0,0]=3 720 B13R1.361 CCCC1=CC=C(S1)C(=O)OCC MCULE-2776606103 [0,1,0,1,0,0|0,0,2]=4 721 B13R1.361 CCCC1=NC(=CN1)C(=O)OCC MCULE-6574112174 [0,1,0,1,0,0|1,0,1]=4 722 B13R1.361 CCCC1=NC(=CO1)C(=O)OCC MCULE-4438820308 [0,1,0,1,0,0|1,0,1]=4 723 B13R1.361 CCCC1=NC(=CS1)C(=O)OCC MCULE-3257962086 [0,1,0,1,0,0|1,0,1]=4 724 B13R1.361 CCCC1=NC=C(S1)C(=O)OCC MCULE-8440620363 [0,1,0,1,0,0|1,0,1]=4 725 B13R1.1552 CCOC(=O)C1(CCCCCC1)N MCULE-3699716388 [0,1,0,1,0,0|0,0,2]=4 726 B13R1.1552 CCOC(=O)C1(CCCCCC1)N MCULE-6391214994 [0,1,0,1,0,0|0,0,2]=4 727 B13R1.2909 CCOC(=O)/C(=C\1/CCCC1=O)/O MCULE-2063375253 [0,1,0,1,0,0|1,0,1]=4 728 B13R1.2909 CCOC(=O)C(=C1CCCC1=O)O MCULE-5388267657 [0,1,0,1,0,0|1,0,1]=4 729 B13R1.44 CCCOC(=O)NC1CCCCC1 MCULE-8501561862 [0,1,0,1,0,0|1,0,1]=4 730 B13R1.500 CCCCN1C=CC(=N1)COCC MCULE-4486178963 [0,1,0,1,0,0|2,0,0]=4 731 B13R1.1133 CCCCCOC1=C(CCC1=O)C MCULE-9316511187 [0,1,0,1,0,0|2,0,0]=4 732 B13R1.20 CCOC(=O)CN1CCCC(C1)C MCULE-1934333754 [0,1,0,1,0,0|1,0,1]=4 733 B13R1.20 CCOC(=O)CN1CCCC(C1)O MCULE-2173090586 [0,1,0,1,0,0|1,0,1]=4 734 B13R1.33 CCOC(=O)/C=C(/C)\N1CCCC1 MCULE-5008646698 [0,1,0,1,0,0|1,0,0]=3 735 B13R1.33 CCOC(=O)/C=C(\C)/N1CCCC1 MCULE-3315996412 [0,1,0,1,0,0|1,0,0]=3 736 B13R1.33 CCOC(=O)C=C(C)N1CCCC1 MCULE-4559305456 [0,1,0,1,0,0|1,0,0]=3 737 B13R1.33 CCOC(=O)CC(=O)C1CCCC1 MCULE-7687507727 [0,1,0,1,0,0|0,0,1]=3 738 B13R1.33 CCOC(=O)CC(=O)C1CCCO1 MCULE-1837740704 [0,1,0,1,0,0|1,0,1]=4 739 B13R1.33 CCOC(=O)CC(=O)C1CCOC1 MCULE-2253798831 [0,1,0,1,0,0|1,0,1]=4 740 B13R1.33 CCOC(=O)NC(=S)N1CCCC1 MCULE-4687332731 [0,1,0,1,0,0|2,0,0]=4 741 B13R1.2570 CCOC(=O)CC1(CCCCC1)N MCULE-4084225680 [0,1,0,1,0,0|0,0,2]=4 742 B13R1.2570 CCOC(=O)CC1(CCCCC1)N MCULE-7401166688 [0,1,0,1,0,0|0,0,2]=4 743 B13R1.2570 CCOC(=O)CC1(CCCCC1)O MCULE-4757386246 [0,1,0,1,0,0|0,0,2]=4 744 B13R1.2846 CCOC(=O)CC(=O)CC1CCC1 MCULE-4545611586 [0,1,0,1,0,0|0,0,1]=3 745 B13R1.4453 CCOC(=O)C1=C(CCCC1=O)C MCULE-7787317898 [0,1,0,1,0,0|0,0,1]=3 746 B13R1.4453 CCOC(=O)C1=C(NCCC1=O)C MCULE-2200842362 [0,1,0,1,0,0|1,0,1]=4 747 B13R1.19 CCOC(=O)C=C1CCN(CC1)C MCULE-3528968075 [0,1,0,1,0,0|1,0,0]=3 748 B13R1.19 CCOC(=O)CC1CCC(CC1)I MCULE-6081193339 [0,1,0,1,0,0|0,0,2]=4 749 B13R1.19 CCOC(=O)CC1CCC(CC1)N MCULE-1221636934 [0,1,0,1,0,0|0,0,2]=4 750 B13R1.19 CCOC(=O)CC1CCC(CC1)O MCULE-3925018264 [0,1,0,1,0,0|0,0,2]=4 751 B13R1.19 CCOC(=O)CC1CCC(CC1)[NH3+] MCULE-3511978838 [0,1,0,1,0,0|0,0,2]=4 752 B13R1.19 CCOC(=O)CN1CCC(CC1)C MCULE-2303954267 [0,1,0,1,0,0|1,0,1]=4 753 B13R1.19 CCOC(=O)CN1CCC(CC1)N MCULE-5794385182 [0,1,0,1,0,0|1,0,1]=4 754 B13R1.19 CCOC(=O)CN1CCC(CC1)N MCULE-8902359333 [0,1,0,1,0,0|1,0,1]=4 755 B13R1.19 CCOC(=O)CN1CCC(CC1)O MCULE-4754022390 [0,1,0,1,0,0|1,0,1]=4 756 B13R1.19 CCOC(=O)C[C@H]1CC[C@@H](CC1)N MCULE-4475702265 [0,1,0,1,0,0|0,0,2]=4 757 B13R1.19 CCOC(=O)C[C@H]1CC[C@@H](CC1)N MCULE-9398025473 [0,1,0,1,0,0|0,0,2]=4 758 B13R1.19 CCOC(=O)C[C@H]1CC[C@@H](CC1)O MCULE-6317896896 [0,1,0,1,0,0|0,0,2]=4 759 B13R1.19 CCOC(=O)NC1CCC(CC1)N MCULE-7047679011 [0,1,0,1,0,0|1,0,1]=4 760 B13R1.19 CCOC(=O)NC1CCC(CC1)O MCULE-2188735240 [0,1,0,1,0,0|1,0,1]=4 761 B13R1.19 CCOC(=O)N[C@H]1CC[C@@H](CC1)O MCULE-9872160286 [0,1,0,1,0,0|1,0,1]=4 762 B13R1.2679 CCC(O)CC1=C(OC(=O)C=C1)C MCULE-8584132287 [0,1,0,1,0,0|0,0,2]=4 763 B13R1.1511 CCCC(O)C1=C(OC(=O)C=C1)C MCULE-9915685244 [0,1,0,1,0,0|0,0,2]=4 764 B13R1.1511 CCOC(=O)[C@@H]1CC[C@@H](C[C@@H]1C)N MCULE-2986375338 [0,1,0,1,0,0|0,0,2]=4 765 B13R1.1511 CCOC(=O)[C@@H]1CC[C@@H](C[C@@H]1C)N MCULE-3638368958 [0,1,0,1,0,0|0,0,2]=4 766 B13R2.856 CCOC(=O)C1=CC2CCC1O2 MCULE-7829335047 [0,0,0,2,0,0|1,0,0]=3 767 B13R2.856 CCOC(=O)C1CC2CCC1C2 MCULE-7725816513 [0,0,0,2,0,0|0,0,2]=4 768 B13R2.856 CCOC(=O)C1NC2CCC1C2 MCULE-5269957407 [0,0,0,2,0,0|1,0,1]=4 769 B13R2.856 CCOC(=O)C1NC2CCC1C2 MCULE-8948967875 [0,0,0,2,0,0|1,0,1]=4 770 B13R2.856 CCOC(=O)[C@H]1N[C@@H]2CC[C@H]1C2 MCULE-2657240745 [0,0,0,2,0,0|1,0,1]=4 771 B13R2.856 CCOC(=O)[C@H]1N[C@@H]2CC[C@H]1C2 MCULE-3536339613 [0,0,0,2,0,0|1,0,1]=4 772 B13R2.856 [C@H]12CC[C@H](C1)N[C@@H]2C(=O)OCC MCULE-6000371866 [0,0,0,2,0,0|1,0,1]=4 773 B13R2.856 [C@H]12CC[C@H](C1)N[C@@H]2C(=O)OCC MCULE-6086423318 [0,0,0,2,0,0|1,0,1]=4 774 B13R2.4023 O=C1OC(=O)C2=C1CCCCC2 MCULE-9616259526 [0,0,0,2,0,0|1,0,1]=4 775 B13R2.4023 O=C1OC(C2=C1CCCCC2)O MCULE-7677780224 [0,0,0,2,0,0|1,0,0]=3 776 B13R2.12120 CC12CCCC=C1C(=O)OC2=O MCULE-3940027232 [0,0,0,2,0,0|1,0,1]=4