0 B9R0.46 C#CC(O)CCCCCBr MCULE-4507050415 [0,0,0,0,0,0|2,0,1]=3 1 B9R0.46 C#CC(O)CCCCCC MCULE-7473928469 [0,0,0,0,0,0|1,0,1]=2 2 B9R0.46 C=CC(=O)CCCCCC MCULE-4486396694 [0,0,0,0,0,0|1,0,3]=4 3 B9R0.46 C=CC(O)CCCCCC MCULE-8553741195 [0,0,0,0,0,0|1,0,1]=2 4 B9R0.46 C=CCCCCC(O)CN MCULE-2170358695 [0,0,0,0,0,0|1,0,2]=3 5 B9R0.46 C=CCCCCC(O)CO MCULE-9731075660 [0,0,0,0,0,0|0,0,2]=2 6 B9R0.46 CCC(C)CCCCCO MCULE-2502680966 [0,0,0,0,0,0|3,0,0]=3 7 B9R0.46 CCC(C)NCCCNC MCULE-3630027564 [0,0,0,0,0,0|4,0,0]=4 8 B9R0.46 CCCCCCC(=O)CBr MCULE-5041636942 [0,0,0,0,0,0|1,0,2]=3 9 B9R0.46 CCCCCCC(=O)CC MCULE-6606139631 [0,0,0,0,0,0|1,0,2]=3 10 B9R0.46 CCCCCCC(=O)NN MCULE-6491418749 [0,0,0,0,0,0|2,0,2]=4 11 B9R0.46 CCCCCCC(=O)NO MCULE-7308576516 [0,0,0,0,0,0|1,0,2]=3 12 B9R0.46 CCCCCCC(=O)OC MCULE-7883111323 [0,0,0,0,0,0|2,0,2]=4 13 B9R0.46 CCCCCCC(Br)CBr MCULE-3379995276 [0,0,0,0,0,0|2,0,0]=2 14 B9R0.46 CCCCCCC(C)C#N MCULE-9341747817 [0,0,0,0,0,0|2,0,1]=3 15 B9R0.46 CCCCCCC(C)C=O MCULE-4073561137 [0,0,0,0,0,0|1,0,2]=3 16 B9R0.46 CCCCCCC(C)CBr MCULE-4123455914 [0,0,0,0,0,0|2,0,0]=2 17 B9R0.46 CCCCCCC(C)CC MCULE-3624776298 [0,0,0,0,0,0|2,0,0]=2 18 B9R0.46 CCCCCCC(C)CO MCULE-7202468291 [0,0,0,0,0,0|1,0,0]=1 19 B9R0.46 CCCCCCC(C)NN MCULE-7546667258 [0,0,0,0,0,0|3,0,0]=3 20 B9R0.46 CCCCCCC(C)NN MCULE-9220046974 [0,0,0,0,0,0|3,0,0]=3 21 B9R0.46 CCCCCCC(Cl)C=O MCULE-9755396866 [0,0,0,0,0,0|1,0,2]=3 22 B9R0.46 CCCCCCC(Cl)CCl MCULE-7909703582 [0,0,0,0,0,0|2,0,0]=2 23 B9R0.46 CCCCCCC(O)CBr MCULE-4248488641 [0,0,0,0,0,0|1,0,0]=1 24 B9R0.46 CCCCCCC(O)CC MCULE-7543978401 [0,0,0,0,0,0|1,0,0]=1 25 B9R0.46 CCCCCCC(O)CO MCULE-7396593748 [0,0,0,0,0,0|0,0,0]=0 26 B9R0.46 CCCCCC[C@@H](O)CO MCULE-9540453574 [0,0,0,0,0,0|0,0,0]=0 27 B9R0.46 CCCCCC[C@H](O)CO MCULE-8481484883 [0,0,0,0,0,0|0,0,0]=0 28 B9R0.46 CCCCCNC(=O)CCl MCULE-8028345115 [0,0,0,0,0,0|2,0,2]=4 29 B9R0.46 CCCCCOC(=O)CBr MCULE-3749700207 [0,0,0,0,0,0|2,0,2]=4 30 B9R0.46 CCCCCOC(=O)CC MCULE-6912037911 [0,0,0,0,0,0|2,0,2]=4 31 B9R0.46 CCCCCOC(=O)CCl MCULE-6254869186 [0,0,0,0,0,0|2,0,2]=4 32 B9R0.46 CCCCCOC(=O)CN MCULE-1223174561 [0,0,0,0,0,0|2,0,2]=4 33 B9R0.46 CCCCCOC(=O)CS MCULE-8048926704 [0,0,0,0,0,0|1,1,2]=4 34 B9R0.46 CCCCCOC(=O)C[NH3+] MCULE-4653269874 [0,0,0,0,0,0|2,0,2]=4 35 B9R0.46 CCCCOCC(O)CC MCULE-2411357752 [0,0,0,0,0,0|2,0,0]=2 36 B9R0.46 CCCCOCC(O)CCl MCULE-6855689044 [0,0,0,0,0,0|2,0,0]=2 37 B9R0.46 CCCCOCC(O)CN MCULE-1971283908 [0,0,0,0,0,0|2,0,0]=2 38 B9R0.46 CCCCOCC(O)CO MCULE-8662748140 [0,0,0,0,0,0|1,0,0]=1 39 B9R0.46 CCCCSCC(O)CO MCULE-8665487683 [0,0,0,0,0,0|1,0,0]=1 40 B9R0.46 CC[C@H](C)CCCCCO MCULE-2345749211 [0,0,0,0,0,0|3,0,0]=3 41 B9R0.46 CC[C@H](C)CCCCCO MCULE-9450083737 [0,0,0,0,0,0|3,0,0]=3 42 B9R0.46 COCCOCC(O)CCl MCULE-7963737892 [0,0,0,0,0,0|3,0,0]=3 43 B9R0.46 OCCCCCC(O)CO MCULE-1241763539 [0,0,0,0,0,0|1,0,0]=1 44 B8R0.4 BrCCCCCCCBr MCULE-4094304263 [1,0,0,0,0,0|2,0,0]=3 45 B8R0.4 BrCCCOCCCBr MCULE-7546792867 [1,0,0,0,0,0|3,0,0]=4 46 B8R0.4 C#CCCCCCCBr MCULE-9361347635 [1,0,0,0,0,0|1,0,2]=4 47 B8R0.4 C#CCCCCCCC MCULE-5881425113 [1,0,0,0,0,0|1,0,1]=3 48 B8R0.4 C#CCCCCCCCl MCULE-1758332024 [1,0,0,0,0,0|1,0,2]=4 49 B8R0.4 C#CCCCCCCN MCULE-1593470538 [1,0,0,0,0,0|1,0,2]=4 50 B8R0.4 C#CCCCCCCN MCULE-4412235962 [1,0,0,0,0,0|1,0,2]=4 51 B8R0.4 C#CCCCCCCO MCULE-9399870702 [1,0,0,0,0,0|0,0,2]=3 52 B8R0.4 C#CCOCCCCO MCULE-1265233618 [1,0,0,0,0,0|1,0,2]=4 53 B8R0.4 C=CCCCCCCBr MCULE-6451772855 [1,0,0,0,0,0|1,0,2]=4 54 B8R0.4 C=CCCCCCCC MCULE-8103203416 [1,0,0,0,0,0|1,0,1]=3 55 B8R0.4 C=CCCCCCCCl MCULE-2359680024 [1,0,0,0,0,0|1,0,2]=4 56 B8R0.4 C=CCCCCCCI MCULE-2548377676 [1,0,0,0,0,0|1,0,2]=4 57 B8R0.4 C=CCCCCCCN MCULE-3465800348 [1,0,0,0,0,0|1,0,2]=4 58 B8R0.4 C=CCCCCCCN MCULE-9820466293 [1,0,0,0,0,0|1,0,2]=4 59 B8R0.4 C=CCCCCCCO MCULE-8561904793 [1,0,0,0,0,0|0,0,2]=3 60 B8R0.4 C=CCCCCCNC MCULE-9487840122 [1,0,0,0,0,0|2,0,1]=4 61 B8R0.4 C=CCCNCCCO MCULE-1492709649 [1,0,0,0,0,0|1,0,2]=4 62 B8R0.4 C=CCOCCCCO MCULE-6517087003 [1,0,0,0,0,0|1,0,2]=4 63 B8R0.4 CC=CCCCCCC MCULE-2766900913 [1,0,0,0,0,0|1,0,2]=4 64 B8R0.4 CCC#CCCCCC MCULE-3250800871 [1,0,0,0,0,0|1,0,2]=4 65 B8R0.4 CCC/C=C\CCCC MCULE-1534641855 [1,0,0,0,0,0|1,0,2]=4 66 B8R0.4 CCC=CCCCCO MCULE-2496486842 [1,0,0,0,0,0|0,0,2]=3 67 B8R0.4 CCCC/C=C\CCO MCULE-5021089657 [1,0,0,0,0,0|0,0,2]=3 68 B8R0.4 CCCC=CCCCC MCULE-6609949802 [1,0,0,0,0,0|1,0,2]=4 69 B8R0.4 CCCCBCCCC MCULE-3163100787 [1,0,0,0,0,0|2,0,0]=3 70 B8R0.4 CCCCBCCCC MCULE-6578781762 [1,0,0,0,0,0|2,0,0]=3 71 B8R0.4 CCCCC#CCCO MCULE-6156677538 [1,0,0,0,0,0|0,0,2]=3 72 B8R0.4 CCCCC/C=C/CO MCULE-2538979274 [1,0,0,0,0,0|0,0,2]=3 73 B8R0.4 CCCCC=CCCO MCULE-5187523035 [1,0,0,0,0,0|0,0,2]=3 74 B8R0.4 CCCCCC#CCBr MCULE-7228145409 [1,0,0,0,0,0|1,0,2]=4 75 B8R0.4 CCCCCC#CCCl MCULE-8147360928 [1,0,0,0,0,0|1,0,2]=4 76 B8R0.4 CCCCCC#CCO MCULE-5966258062 [1,0,0,0,0,0|0,0,2]=3 77 B8R0.4 CCCCCC=CCO MCULE-7026544339 [1,0,0,0,0,0|0,0,2]=3 78 B8R0.4 CCCCCCC=CI MCULE-3614174427 [1,0,0,0,0,0|1,0,2]=4 79 B8R0.4 CCCCCCCC#N MCULE-3399476727 [1,0,0,0,0,0|1,0,1]=3 80 B8R0.4 CCCCCCCC=O MCULE-7111365457 [1,0,0,0,0,0|0,0,2]=3 81 B8R0.4 CCCCCCCCBr MCULE-7484248707 [1,0,0,0,0,0|1,0,0]=2 82 B8R0.4 CCCCCCCCC MCULE-1865327912 [1,0,0,0,0,0|1,0,0]=2 83 B8R0.4 CCCCCCCCCl MCULE-5953637232 [1,0,0,0,0,0|1,0,0]=2 84 B8R0.4 CCCCCCCCF MCULE-5641912511 [1,0,0,0,0,0|1,0,0]=2 85 B8R0.4 CCCCCCCCI MCULE-7304806902 [1,0,0,0,0,0|1,0,0]=2 86 B8R0.4 CCCCCCCCN MCULE-6095227778 [1,0,0,0,0,0|1,0,0]=2 87 B8R0.4 CCCCCCCCN MCULE-7012389700 [1,0,0,0,0,0|1,0,0]=2 88 B8R0.4 CCCCCCCCN MCULE-7076053015 [1,0,0,0,0,0|1,0,0]=2 89 B8R0.4 CCCCCCCCO MCULE-2656577895 [1,0,0,0,0,0|0,0,0]=1 90 B8R0.4 CCCCCCCCS MCULE-5212273874 [1,0,0,0,0,0|0,1,0]=2 91 B8R0.4 CCCCCCCNC MCULE-1143610772 [1,0,0,0,0,0|2,0,0]=3 92 B8R0.4 CCCCCCCNN MCULE-7800659587 [1,0,0,0,0,0|2,0,0]=3 93 B8R0.4 CCCCCCCON MCULE-6380236924 [1,0,0,0,0,0|2,0,0]=3 94 B8R0.4 CCCCCCCON MCULE-6581043184 [1,0,0,0,0,0|2,0,0]=3 95 B8R0.4 CCCCCCCSC MCULE-5211260102 [1,0,0,0,0,0|2,0,0]=3 96 B8R0.4 CCCCCCN=C=O MCULE-6808788959 [1,0,0,0,0,0|1,0,2]=4 97 B8R0.4 CCCCCCN=C=S MCULE-6056221769 [1,0,0,0,0,0|1,1,1]=4 98 B8R0.4 CCCCCCN=N#N MCULE-6665514222 [1,0,0,0,0,0|3,0,0]=4 99 B8R0.4 CCCCCCNC=O MCULE-3719637754 [1,0,0,0,0,0|1,0,2]=4 100 B8R0.4 CCCCCCOC=O MCULE-1329787181 [1,0,0,0,0,0|1,0,2]=4 101 B8R0.4 CCCCCCON=O MCULE-9048754026 [1,0,0,0,0,0|2,0,1]=4 102 B8R0.4 CCCCCCSC#N MCULE-2302732160 [1,0,0,0,0,0|2,0,1]=4 103 B8R0.4 CCCCCCSCC MCULE-1449428108 [1,0,0,0,0,0|2,0,0]=3 104 B8R0.4 CCCCCNCCC MCULE-7697830316 [1,0,0,0,0,0|2,0,0]=3 105 B8R0.4 CCCCCNCCN MCULE-5873419228 [1,0,0,0,0,0|2,0,0]=3 106 B8R0.4 CCCCCNCCO MCULE-7662965930 [1,0,0,0,0,0|1,0,0]=2 107 B8R0.4 CCCCCNOCC MCULE-5426574695 [1,0,0,0,0,0|3,0,0]=4 108 B8R0.4 CCCCCNOCC MCULE-6155853359 [1,0,0,0,0,0|3,0,0]=4 109 B8R0.4 CCCCCOCCO MCULE-3393695257 [1,0,0,0,0,0|1,0,0]=2 110 B8R0.4 CCCCCSCCCl MCULE-7680431310 [1,0,0,0,0,0|2,0,0]=3 111 B8R0.4 CCCCCSCCO MCULE-1239137782 [1,0,0,0,0,0|1,0,0]=2 112 B8R0.4 CCCCNCCC#N MCULE-1395411662 [1,0,0,0,0,0|2,0,1]=4 113 B8R0.4 CCCCNCCCC MCULE-1338595384 [1,0,0,0,0,0|2,0,0]=3 114 B8R0.4 CCCCNCCCC MCULE-4720016177 [1,0,0,0,0,0|2,0,0]=3 115 B8R0.4 CCCCNCCCC MCULE-6002936904 [1,0,0,0,0,0|2,0,0]=3 116 B8R0.4 CCCCNCCCC MCULE-8673755112 [1,0,0,0,0,0|2,0,0]=3 117 B8R0.4 CCCCNCCCCl MCULE-6595599220 [1,0,0,0,0,0|2,0,0]=3 118 B8R0.4 CCCCNCCCCl MCULE-8225115019 [1,0,0,0,0,0|2,0,0]=3 119 B8R0.4 CCCCNCCCN MCULE-6098022466 [1,0,0,0,0,0|2,0,0]=3 120 B8R0.4 CCCCNCCCO MCULE-7171357018 [1,0,0,0,0,0|1,0,0]=2 121 B8R0.4 CCCCNCCOC MCULE-5142206385 [1,0,0,0,0,0|3,0,0]=4 122 B8R0.4 CCCCOCCC#N MCULE-6848830768 [1,0,0,0,0,0|2,0,1]=4 123 B8R0.4 CCCCOCCCC MCULE-8568026186 [1,0,0,0,0,0|2,0,0]=3 124 B8R0.4 CCCCOCCCN MCULE-2107763231 [1,0,0,0,0,0|2,0,0]=3 125 B8R0.4 CCCCOCCCO MCULE-2797403638 [1,0,0,0,0,0|1,0,0]=2 126 B8R0.4 CCCCOCCOC MCULE-4497601798 [1,0,0,0,0,0|3,0,0]=4 127 B8R0.4 CCCCSCCCC MCULE-3121918458 [1,0,0,0,0,0|2,0,0]=3 128 B8R0.4 CCCCSCCCN MCULE-6519812920 [1,0,0,0,0,0|2,0,0]=3 129 B8R0.4 CCCC[NH2+]CCCC MCULE-4333811997 [1,0,0,0,0,0|2,0,0]=3 130 B8R0.4 CCCC[NH2+]CCCC MCULE-8030655880 [1,0,0,0,0,0|2,0,0]=3 131 B8R0.4 CCCNCCCCN MCULE-1576152293 [1,0,0,0,0,0|2,0,0]=3 132 B8R0.4 CCCNCCCCN MCULE-2764845788 [1,0,0,0,0,0|2,0,0]=3 133 B8R0.4 CCCNCCCNC MCULE-5061364734 [1,0,0,0,0,0|3,0,0]=4 134 B8R0.4 CCCSCCCCN MCULE-7923615539 [1,0,0,0,0,0|2,0,0]=3 135 B8R0.4 CCNCCCCCN MCULE-1094310455 [1,0,0,0,0,0|2,0,0]=3 136 B8R0.4 CCNCCCNCC MCULE-6294880102 [1,0,0,0,0,0|3,0,0]=4 137 B8R0.4 CCNCCOCCN MCULE-7419143110 [1,0,0,0,0,0|3,0,0]=4 138 B8R0.4 CCNCCOCCO MCULE-3581305931 [1,0,0,0,0,0|2,0,0]=3 139 B8R0.4 CCOCCOCCBr MCULE-9030593043 [1,0,0,0,0,0|3,0,0]=4 140 B8R0.4 CCOCCOCCCl MCULE-5739255923 [1,0,0,0,0,0|3,0,0]=4 141 B8R0.4 CCOCCOCCN MCULE-5375263489 [1,0,0,0,0,0|3,0,0]=4 142 B8R0.4 CCOCCOCCN MCULE-5713936875 [1,0,0,0,0,0|3,0,0]=4 143 B8R0.4 CCOCCOCCO MCULE-8940886567 [1,0,0,0,0,0|2,0,0]=3 144 B8R0.4 CCSCCOCCO MCULE-6785870605 [1,0,0,0,0,0|2,0,0]=3 145 B8R0.4 CNCCCCCCN MCULE-3241182046 [1,0,0,0,0,0|2,0,0]=3 146 B8R0.4 CNCCCCCCO MCULE-2582847385 [1,0,0,0,0,0|1,0,0]=2 147 B8R0.4 COCCCCCCBr MCULE-8590853100 [1,0,0,0,0,0|2,0,0]=3 148 B8R0.4 COCCCCCCO MCULE-5454628686 [1,0,0,0,0,0|1,0,0]=2 149 B8R0.4 COCCCCCOC MCULE-5066626930 [1,0,0,0,0,0|3,0,0]=4 150 B8R0.4 COCCCNCCN MCULE-6697775895 [1,0,0,0,0,0|3,0,0]=4 151 B8R0.4 COCCCNCCO MCULE-3069731145 [1,0,0,0,0,0|2,0,0]=3 152 B8R0.4 COCCCOCCO MCULE-7280677606 [1,0,0,0,0,0|2,0,0]=3 153 B8R0.4 COCCNCCCN MCULE-7319591268 [1,0,0,0,0,0|3,0,0]=4 154 B8R0.4 COCCNCCCO MCULE-9359795449 [1,0,0,0,0,0|2,0,0]=3 155 B8R0.4 COCCOCCCBr MCULE-1854114779 [1,0,0,0,0,0|3,0,0]=4 156 B8R0.4 COCCOCCCN MCULE-8835423066 [1,0,0,0,0,0|3,0,0]=4 157 B8R0.4 COCCOCCCO MCULE-7732325457 [1,0,0,0,0,0|2,0,0]=3 158 B8R0.4 COCCSCCCBr MCULE-9034574998 [1,0,0,0,0,0|3,0,0]=4 159 B8R0.4 CSCCCCCC#N MCULE-8965259284 [1,0,0,0,0,0|2,0,1]=4 160 B8R0.4 CSCCCCCCN MCULE-3785645703 [1,0,0,0,0,0|2,0,0]=3 161 B8R0.4 CSCCCCCCO MCULE-1590282643 [1,0,0,0,0,0|1,0,0]=2 162 B8R0.4 CSCCCCCSC MCULE-3097194542 [1,0,0,0,0,0|3,0,0]=4 163 B8R0.4 ClCCCCCCCBr MCULE-6518226792 [1,0,0,0,0,0|2,0,0]=3 164 B8R0.4 ClCCCCCCCCl MCULE-9270407250 [1,0,0,0,0,0|2,0,0]=3 165 B8R0.4 ClCCCOCCCCl MCULE-9363066168 [1,0,0,0,0,0|3,0,0]=4 166 B8R0.4 N#CCCCCCCBr MCULE-9322605267 [1,0,0,0,0,0|2,0,1]=4 167 B8R0.4 N#CCCNCCCO MCULE-8185548226 [1,0,0,0,0,0|2,0,1]=4 168 B8R0.4 N#CCCOCCCO MCULE-5612403579 [1,0,0,0,0,0|2,0,1]=4 169 B8R0.4 N#N=NCCCCCO MCULE-6037400215 [1,0,0,0,0,0|3,0,0]=4 170 B8R0.4 NCCCCCCCBr MCULE-2103124315 [1,0,0,0,0,0|2,0,0]=3 171 B8R0.4 NCCCCCCCBr MCULE-9591138313 [1,0,0,0,0,0|2,0,0]=3 172 B8R0.4 NCCCCCCCN MCULE-3408586405 [1,0,0,0,0,0|2,0,0]=3 173 B8R0.4 NCCCCCCCO MCULE-6098435698 [1,0,0,0,0,0|1,0,0]=2 174 B8R0.4 NCCCCCCCO MCULE-8352830275 [1,0,0,0,0,0|1,0,0]=2 175 B8R0.4 NCCCCNCCO MCULE-5679490980 [1,0,0,0,0,0|2,0,0]=3 176 B8R0.4 NCCCNCCCN MCULE-3936851596 [1,0,0,0,0,0|3,0,0]=4 177 B8R0.4 NCCCNCCCO MCULE-1085206494 [1,0,0,0,0,0|2,0,0]=3 178 B8R0.4 NCCCOCCCN MCULE-5378554478 [1,0,0,0,0,0|3,0,0]=4 179 B8R0.4 NCCCOCCCO MCULE-9489688996 [1,0,0,0,0,0|2,0,0]=3 180 B8R0.4 NCCNCCCCO MCULE-1668134399 [1,0,0,0,0,0|2,0,0]=3 181 B8R0.4 NCCNCCCCO MCULE-8060063829 [1,0,0,0,0,0|2,0,0]=3 182 B8R0.4 O=CCCCCCCBr MCULE-3046622133 [1,0,0,0,0,0|1,0,2]=4 183 B8R0.4 OCCCCCCCBr MCULE-2559114853 [1,0,0,0,0,0|1,0,0]=2 184 B8R0.4 OCCCCCCCCl MCULE-4143586059 [1,0,0,0,0,0|1,0,0]=2 185 B8R0.4 OCCCCCCCI MCULE-3420024644 [1,0,0,0,0,0|1,0,0]=2 186 B8R0.4 OCCCCCCCO MCULE-1201837142 [1,0,0,0,0,0|1,0,0]=2 187 B8R0.4 OCCCNCCCO MCULE-1813882908 [1,0,0,0,0,0|2,0,0]=3 188 B8R0.4 OCCCNCCCO MCULE-4567401301 [1,0,0,0,0,0|2,0,0]=3 189 B8R0.4 OCCCOCCCCl MCULE-9999003892 [1,0,0,0,0,0|2,0,0]=3 190 B8R0.4 OCCCOCCCO MCULE-2894245516 [1,0,0,0,0,0|2,0,0]=3 191 B8R0.4 OCCCSCCCO MCULE-2025331376 [1,0,0,0,0,0|2,0,0]=3 192 B8R0.4 OCCSCSCCO MCULE-5909808862 [1,0,0,0,0,0|3,0,0]=4 193 B8R0.6 C#CC(O)CCCCC MCULE-3860216745 [1,0,0,0,0,0|1,0,1]=3 194 B8R0.6 C#CC(O)CCCCC MCULE-6741270715 [1,0,0,0,0,0|1,0,1]=3 195 B8R0.6 C#CCCC[C@@H](N)CO MCULE-2559437973 [1,0,0,0,0,0|1,0,2]=4 196 B8R0.6 C#CCCC[C@@H](N)CO MCULE-9800548833 [1,0,0,0,0,0|1,0,2]=4 197 B8R0.6 C#CCCC[C@H](N)CO MCULE-1789980212 [1,0,0,0,0,0|1,0,2]=4 198 B8R0.6 C#CCCC[C@H](N)CO MCULE-7070205347 [1,0,0,0,0,0|1,0,2]=4 199 B8R0.6 C#C[C@@H](O)CCCCC MCULE-2098834943 [1,0,0,0,0,0|1,0,1]=3 200 B8R0.6 C#C[C@@H](O)CCCCC MCULE-4627033805 [1,0,0,0,0,0|1,0,1]=3 201 B8R0.6 C#C[C@H](O)CCCCC MCULE-6006340759 [1,0,0,0,0,0|1,0,1]=3 202 B8R0.6 C#C[C@H](O)CCCCC MCULE-8399407443 [1,0,0,0,0,0|1,0,1]=3 203 B8R0.6 C=CC(O)CCCCC MCULE-3974016765 [1,0,0,0,0,0|1,0,1]=3 204 B8R0.6 C=CCOCC(O)CO MCULE-2581090167 [1,0,0,0,0,0|1,0,2]=4 205 B8R0.6 C=CCOC[C@H](O)CO MCULE-2586134581 [1,0,0,0,0,0|1,0,2]=4 206 B8R0.6 C=CCOC[C@H](O)CO MCULE-2761205966 [1,0,0,0,0,0|1,0,2]=4 207 B8R0.6 CCC#CCC(O)CC MCULE-9738694630 [1,0,0,0,0,0|1,0,2]=4 208 B8R0.6 CCC(C)CCCCO MCULE-9107164434 [1,0,0,0,0,0|3,0,0]=4 209 B8R0.6 CCCCCC(=N)NO MCULE-4721600537 [1,0,0,0,0,0|2,0,1]=4 210 B8R0.6 CCCCCC(=O)CBr MCULE-6642335283 [1,0,0,0,0,0|1,0,2]=4 211 B8R0.6 CCCCCC(=O)CC MCULE-2012071553 [1,0,0,0,0,0|1,0,2]=4 212 B8R0.6 CCCCCC(=O)NO MCULE-8432990947 [1,0,0,0,0,0|1,0,2]=4 213 B8R0.6 CCCCCC(Br)CBr MCULE-6200544642 [1,0,0,0,0,0|2,0,0]=3 214 B8R0.6 CCCCCC(C)CC MCULE-8343490845 [1,0,0,0,0,0|2,0,0]=3 215 B8R0.6 CCCCCC(C)CO MCULE-4884757032 [1,0,0,0,0,0|1,0,0]=2 216 B8R0.6 CCCCCC(O)CC MCULE-6682377557 [1,0,0,0,0,0|1,0,0]=2 217 B8R0.6 CCCCCC(O)CCl MCULE-5610334497 [1,0,0,0,0,0|1,0,0]=2 218 B8R0.6 CCCCCC(O)CN MCULE-6091710122 [1,0,0,0,0,0|1,0,0]=2 219 B8R0.6 CCCCCC(O)CO MCULE-4124719814 [1,0,0,0,0,0|0,0,0]=1 220 B8R0.6 CCCCNC(C)CC MCULE-9849866712 [1,0,0,0,0,0|3,0,0]=4 221 B8R0.6 CCCCOC(=O)CO MCULE-4016266350 [1,0,0,0,0,0|1,0,2]=4 222 B8R0.6 CCCNCC(O)CO MCULE-1611893086 [1,0,0,0,0,0|1,0,0]=2 223 B8R0.6 CCCOCC(C)CO MCULE-8326797774 [1,0,0,0,0,0|2,0,0]=3 224 B8R0.6 CCCOCC(O)CO MCULE-8815613620 [1,0,0,0,0,0|1,0,0]=2 225 B8R0.6 CCCOC[C@H](O)CO MCULE-7750792134 [1,0,0,0,0,0|1,0,0]=2 226 B8R0.6 CC[C@H](C)CCCCO MCULE-2674922341 [1,0,0,0,0,0|3,0,0]=4 227 B8R0.6 CC[C@H](C)CCCCO MCULE-7482991055 [1,0,0,0,0,0|3,0,0]=4 228 B8R0.6 N#CC(O)CCCCO MCULE-3554580179 [1,0,0,0,0,0|2,0,1]=4 229 B8R0.6 NCCCCC(N)CO MCULE-5938273372 [1,0,0,0,0,0|2,0,0]=3 230 B8R0.6 NCCCCC(N)CO MCULE-9464237285 [1,0,0,0,0,0|2,0,0]=3 231 B8R0.6 NCCCCC(N)CS MCULE-1078097453 [1,0,0,0,0,0|2,1,0]=4 232 B8R0.6 NCCCC[C@H](N)CO MCULE-4735749396 [1,0,0,0,0,0|2,0,0]=3 233 B8R0.6 NCCCC[C@H](N)CO MCULE-6997150748 [1,0,0,0,0,0|2,0,0]=3 234 B8R0.6 NCCCC[C@H](N)CO MCULE-7936699760 [1,0,0,0,0,0|2,0,0]=3 235 B8R0.6 NCCCC[C@H](N)CO MCULE-9135547877 [1,0,0,0,0,0|2,0,0]=3 236 B8R0.6 NCCNCC(O)CO MCULE-4818647623 [1,0,0,0,0,0|2,0,0]=3 237 B8R0.6 OC(CCl)COCCCl MCULE-4547951832 [1,0,0,0,0,0|3,0,0]=4 238 B8R0.6 OCCCCC(O)CO MCULE-5891501842 [1,0,0,0,0,0|1,0,0]=2 239 B8R0.6 OCCNCC(O)CO MCULE-1632492020 [1,0,0,0,0,0|2,0,0]=3 240 B8R0.6 OCCOCC(O)CCl MCULE-1530998868 [1,0,0,0,0,0|3,0,0]=4 241 B8R0.6 OCCOCC(O)CO MCULE-4768071463 [1,0,0,0,0,0|2,0,0]=3 242 B8R0.6 [C@H](O)(CC)CCCCC MCULE-7121730436 [1,0,0,0,0,0|1,0,0]=2 243 B8R0.6 [NH3+]CCCCC([NH3+])CBr MCULE-2049014685 [1,0,0,0,0,0|3,0,0]=4 244 B8R0.6 [NH3+]CCCCC([NH3+])CBr MCULE-6467063594 [1,0,0,0,0,0|3,0,0]=4 245 B8R0.7 C=C(Br)CCCCCC MCULE-3502674829 [1,0,0,0,0,0|1,0,2]=4 246 B8R0.7 C=C(C)CCCCCC MCULE-2243788093 [1,0,0,0,0,0|1,0,1]=3 247 B8R0.7 C=C(C)CCCCCCl MCULE-5646492015 [1,0,0,0,0,0|2,0,1]=4 248 B8R0.7 C=C(C)CSCCCC MCULE-7053589995 [1,0,0,0,0,0|2,0,1]=4 249 B8R0.7 C=C(Cl)CCCCCC MCULE-4545659103 [1,0,0,0,0,0|1,0,2]=4 250 B8R0.7 C=CCCCCB(O)O MCULE-5017277637 [1,0,0,0,0,0|1,0,2]=4 251 B8R0.7 C=CCCCCC(C)N MCULE-2841967762 [1,0,0,0,0,0|1,0,2]=4 252 B8R0.7 CC(=O)CCCCCBr MCULE-8946921118 [1,0,0,0,0,0|1,0,2]=4 253 B8R0.7 CC(=O)CCCCCN MCULE-3568024595 [1,0,0,0,0,0|1,0,2]=4 254 B8R0.7 CC(=O)CCCCCN MCULE-9938894581 [1,0,0,0,0,0|1,0,2]=4 255 B8R0.7 CC(Br)C[NH2+]CCC[NH3+] MCULE-6319897150 [1,0,0,0,0,0|3,0,0]=4 256 B8R0.7 CC(Br)C[NH2+]CCC[NH3+] MCULE-9507534494 [1,0,0,0,0,0|3,0,0]=4 257 B8R0.7 CC(C)CCCCC=O MCULE-9268976664 [1,0,0,0,0,0|2,0,1]=4 258 B8R0.7 CC(C)CCCCCBr MCULE-6339659463 [1,0,0,0,0,0|2,0,0]=3 259 B8R0.7 CC(C)CCCCCN MCULE-4764798524 [1,0,0,0,0,0|2,0,0]=3 260 B8R0.7 CC(C)CCCCCO MCULE-2133434329 [1,0,0,0,0,0|2,0,0]=3 261 B8R0.7 CC(C)CCNCCBr MCULE-2670026363 [1,0,0,0,0,0|3,0,0]=4 262 B8R0.7 CC(C)CCNCCBr MCULE-8753554915 [1,0,0,0,0,0|3,0,0]=4 263 B8R0.7 CC(C)CCNCCN MCULE-3917899793 [1,0,0,0,0,0|3,0,0]=4 264 B8R0.7 CC(C)CCNCCO MCULE-7584613000 [1,0,0,0,0,0|3,0,0]=4 265 B8R0.7 CC(C)CCOCCCl MCULE-6456640636 [1,0,0,0,0,0|3,0,0]=4 266 B8R0.7 CC(C)CCOCCN MCULE-2357363560 [1,0,0,0,0,0|3,0,0]=4 267 B8R0.7 CC(C)CCOCCO MCULE-2905905370 [1,0,0,0,0,0|3,0,0]=4 268 B8R0.7 CC(C)CNCCCO MCULE-2271519808 [1,0,0,0,0,0|3,0,0]=4 269 B8R0.7 CC(C)COCCCN MCULE-1113222381 [1,0,0,0,0,0|3,0,0]=4 270 B8R0.7 CC(C)COCCCO MCULE-8827861403 [1,0,0,0,0,0|3,0,0]=4 271 B8R0.7 CC(C)CSCCCCl MCULE-4611281209 [1,0,0,0,0,0|3,0,0]=4 272 B8R0.7 CC(C)CSCCCN MCULE-7842745549 [1,0,0,0,0,0|3,0,0]=4 273 B8R0.7 CC(C)CSCCCO MCULE-8186559992 [1,0,0,0,0,0|3,0,0]=4 274 B8R0.7 CC(C)NCCCCO MCULE-2420054943 [1,0,0,0,0,0|3,0,0]=4 275 B8R0.7 CC(C)OCCCCN MCULE-1961317000 [1,0,0,0,0,0|3,0,0]=4 276 B8R0.7 CC(C)OCCCCO MCULE-7834967841 [1,0,0,0,0,0|3,0,0]=4 277 B8R0.7 CC(C)SCCCCN MCULE-5756873286 [1,0,0,0,0,0|3,0,0]=4 278 B8R0.7 CCCC/C=C/B(O)O MCULE-9877577042 [1,0,0,0,0,0|1,0,2]=4 279 B8R0.7 CCCCC=CB(O)O MCULE-3896372455 [1,0,0,0,0,0|1,0,2]=4 280 B8R0.7 CCCCCCB(O)O MCULE-6503959495 [1,0,0,0,0,0|1,0,0]=2 281 B8R0.7 CCCCCCC(=O)C MCULE-1152821440 [1,0,0,0,0,0|0,0,2]=3 282 B8R0.7 CCCCCCC(=O)Cl MCULE-8559884798 [1,0,0,0,0,0|1,0,2]=4 283 B8R0.7 CCCCCCC(=O)N MCULE-1210996881 [1,0,0,0,0,0|1,0,2]=4 284 B8R0.7 CCCCCCC(=O)O MCULE-1489137568 [1,0,0,0,0,0|0,0,2]=3 285 B8R0.7 CCCCCCC(=O)[O-] MCULE-1711655800 [1,0,0,0,0,0|0,0,3]=4 286 B8R0.7 CCCCCCC(Br)Br MCULE-5790254532 [1,0,0,0,0,0|2,0,0]=3 287 B8R0.7 CCCCCCC(C)Br MCULE-1528804584 [1,0,0,0,0,0|1,0,0]=2 288 B8R0.7 CCCCCCC(C)C MCULE-5799144994 [1,0,0,0,0,0|1,0,0]=2 289 B8R0.7 CCCCCCC(C)I MCULE-1825555561 [1,0,0,0,0,0|1,0,0]=2 290 B8R0.7 CCCCCCC(C)N MCULE-9884342317 [1,0,0,0,0,0|1,0,0]=2 291 B8R0.7 CCCCCCC(C)O MCULE-4635370769 [1,0,0,0,0,0|0,0,0]=1 292 B8R0.7 CCCCCCC(C)O MCULE-5095200181 [1,0,0,0,0,0|0,0,0]=1 293 B8R0.7 CCCCCCN(=O)=O MCULE-8283658415 [1,0,0,0,0,0|1,0,2]=4 294 B8R0.7 CCCCCCN(C)C MCULE-4445968611 [1,0,0,0,0,0|2,0,0]=3 295 B8R0.7 CCCCCCP(Cl)Cl MCULE-4074248554 [1,0,0,0,0,0|3,0,0]=4 296 B8R0.7 CCCCCC[C@@H](C)N MCULE-1174114183 [1,0,0,0,0,0|1,0,0]=2 297 B8R0.7 CCCCCC[C@@H](C)N MCULE-2566479481 [1,0,0,0,0,0|1,0,0]=2 298 B8R0.7 CCCCCC[C@@H](C)N MCULE-9213725375 [1,0,0,0,0,0|1,0,0]=2 299 B8R0.7 CCCCCC[C@@H](C)O MCULE-5245235461 [1,0,0,0,0,0|0,0,0]=1 300 B8R0.7 CCCCCC[C@@H](C)O MCULE-8537503782 [1,0,0,0,0,0|0,0,0]=1 301 B8R0.7 CCCCCC[C@H](C)N MCULE-1870649953 [1,0,0,0,0,0|1,0,0]=2 302 B8R0.7 CCCCCC[C@H](C)N MCULE-1893221172 [1,0,0,0,0,0|1,0,0]=2 303 B8R0.7 CCCCCC[C@H](C)N MCULE-7722036180 [1,0,0,0,0,0|1,0,0]=2 304 B8R0.7 CCCCCC[C@H](C)O MCULE-2655815413 [1,0,0,0,0,0|0,0,0]=1 305 B8R0.7 CCCCCC[C@H](C)O MCULE-7784149103 [1,0,0,0,0,0|0,0,0]=1 306 B8R0.7 CCCCCNC(C)C MCULE-7953510120 [1,0,0,0,0,0|2,0,0]=3 307 B8R0.7 CCCCCOC(=O)C MCULE-4911325533 [1,0,0,0,0,0|1,0,2]=4 308 B8R0.7 CCCCNCC(=O)O MCULE-4725221957 [1,0,0,0,0,0|1,0,2]=4 309 B8R0.7 CCCCNCC(C)C MCULE-9792329369 [1,0,0,0,0,0|2,0,0]=3 310 B8R0.7 CCCCNCC(C)O MCULE-3151408580 [1,0,0,0,0,0|1,0,0]=2 311 B8R0.7 CCCCOCC(=O)O MCULE-9634255761 [1,0,0,0,0,0|1,0,2]=4 312 B8R0.7 CCCCOCC(C)O MCULE-6350800869 [1,0,0,0,0,0|1,0,0]=2 313 B8R0.7 CCCCSCC(=O)O MCULE-3580384865 [1,0,0,0,0,0|1,0,2]=4 314 B8R0.7 CCCCSCC(C)C MCULE-3062170002 [1,0,0,0,0,0|2,0,0]=3 315 B8R0.7 CCCNCCC(=O)O MCULE-3144740259 [1,0,0,0,0,0|1,0,2]=4 316 B8R0.7 CCCNCCC(=O)O MCULE-3866165037 [1,0,0,0,0,0|1,0,2]=4 317 B8R0.7 CCCNCCN(C)C MCULE-1838736190 [1,0,0,0,0,0|3,0,0]=4 318 B8R0.7 CCCNCCN(C)C MCULE-5165444564 [1,0,0,0,0,0|3,0,0]=4 319 B8R0.7 CCCOCCC(=O)O MCULE-1927238608 [1,0,0,0,0,0|1,0,2]=4 320 B8R0.7 CCCSCCC(=O)O MCULE-6454518290 [1,0,0,0,0,0|1,0,2]=4 321 B8R0.7 CCNCCCC(=O)O MCULE-7019386199 [1,0,0,0,0,0|1,0,2]=4 322 B8R0.7 CCNCCCC(=O)O MCULE-8568253592 [1,0,0,0,0,0|1,0,2]=4 323 B8R0.7 CCNCCCN(C)C MCULE-8659431830 [1,0,0,0,0,0|3,0,0]=4 324 B8R0.7 CCOCCCC(=O)O MCULE-9064011886 [1,0,0,0,0,0|1,0,2]=4 325 B8R0.7 CN(C)CCCCCN MCULE-4877386224 [1,0,0,0,0,0|3,0,0]=4 326 B8R0.7 CN(C)CCCCCN MCULE-8183173530 [1,0,0,0,0,0|3,0,0]=4 327 B8R0.7 CN(C)CCCCCN MCULE-8560175640 [1,0,0,0,0,0|3,0,0]=4 328 B8R0.7 CN(C)CCCCCO MCULE-4442986563 [1,0,0,0,0,0|3,0,0]=4 329 B8R0.7 CNCCCCC(=O)O MCULE-4298567521 [1,0,0,0,0,0|1,0,2]=4 330 B8R0.7 CNCCCCC(=O)O MCULE-5688320983 [1,0,0,0,0,0|1,0,2]=4 331 B8R0.7 CNCCCCN(C)C MCULE-2625950434 [1,0,0,0,0,0|3,0,0]=4 332 B8R0.7 CNCCCCN(C)C MCULE-2643427865 [1,0,0,0,0,0|3,0,0]=4 333 B8R0.7 CNCCCNC(C)C MCULE-7039921081 [1,0,0,0,0,0|3,0,0]=4 334 B8R0.7 CNCCCOC(C)C MCULE-5549073656 [1,0,0,0,0,0|3,0,0]=4 335 B8R0.7 CNCCCOC(C)C MCULE-5985260047 [1,0,0,0,0,0|3,0,0]=4 336 B8R0.7 COCCCCB(O)O MCULE-5339704839 [1,0,0,0,0,0|2,0,0]=3 337 B8R0.7 COCCCCC(=O)O MCULE-1268596288 [1,0,0,0,0,0|1,0,2]=4 338 B8R0.7 COCCNCC(C)C MCULE-3557260758 [1,0,0,0,0,0|3,0,0]=4 339 B8R0.7 COCCOCC(C)N MCULE-5569346034 [1,0,0,0,0,0|3,0,0]=4 340 B8R0.7 COCCOCC(C)N MCULE-8825273341 [1,0,0,0,0,0|3,0,0]=4 341 B8R0.7 CSCCCCC(=O)O MCULE-4498129620 [1,0,0,0,0,0|1,0,2]=4 342 B8R0.7 FC(F)CCCCCBr MCULE-1154573775 [1,0,0,0,0,0|3,0,0]=4 343 B8R0.7 NCCCCCC(=O)O MCULE-3640363033 [1,0,0,0,0,0|1,0,2]=4 344 B8R0.7 NCCCCCC(=O)O MCULE-6389520144 [1,0,0,0,0,0|1,0,2]=4 345 B8R0.7 O=C(O)CCCCCBr MCULE-2086088700 [1,0,0,0,0,0|1,0,2]=4 346 B8R0.7 O=C(O)CCCCCCl MCULE-3419329115 [1,0,0,0,0,0|1,0,2]=4 347 B8R0.7 O=C(O)CCCCCF MCULE-6736431365 [1,0,0,0,0,0|1,0,2]=4 348 B8R0.7 O=C(O)CCCCCO MCULE-9202536119 [1,0,0,0,0,0|1,0,2]=4 349 B8R0.7 O=C(O)CCCCCS MCULE-1414350107 [1,0,0,0,0,0|1,0,2]=4 350 B8R0.7 OB(O)CCCCCBr MCULE-1080449080 [1,0,0,0,0,0|2,0,0]=3 351 B8R0.7 [NH2+](CCCC)CC(C)C MCULE-7018223822 [1,0,0,0,0,0|2,0,0]=3 352 B10R0.1 C=CCC(C)CCCCCC MCULE-9669056285 [0,1,0,0,0,0|2,0,0]=3 353 B10R0.1 CCCCCCC(=O)CCC MCULE-1716736963 [0,1,0,0,0,0|1,0,2]=4 354 B10R0.1 CCCCCCC(=O)OCC MCULE-9137582636 [0,1,0,0,0,0|1,0,2]=4 355 B10R0.1 CCCCCCC(C)CCBr MCULE-3565681476 [0,1,0,0,0,0|2,0,0]=3 356 B10R0.1 CCCCCCC(C)CCC MCULE-7297649998 [0,1,0,0,0,0|2,0,0]=3 357 B10R0.1 CCCCCCC(C)CCO MCULE-7361079557 [0,1,0,0,0,0|1,0,0]=2 358 B10R0.1 CCCCCCC(C)N=C=O MCULE-5942468953 [0,1,0,0,0,0|1,0,2]=4 359 B10R0.1 CCCCCCC(C)N=C=S MCULE-6060891779 [0,1,0,0,0,0|1,1,1]=4 360 B10R0.1 CCCCCCC(Cl)CCC MCULE-2067978007 [0,1,0,0,0,0|2,0,0]=3 361 B10R0.1 CCCCCCC(O)CCC MCULE-2307566607 [0,1,0,0,0,0|1,0,0]=2 362 B10R0.1 CCCCCCC(O)CCO MCULE-4512993407 [0,1,0,0,0,0|0,0,0]=1 363 B10R0.1 CCCCCC[C@H](C)CCC MCULE-5233422494 [0,1,0,0,0,0|2,0,0]=3 364 B10R0.1 CCCCCC[C@H](O)CCC MCULE-3592520258 [0,1,0,0,0,0|1,0,0]=2 365 B10R0.1 CCCCCC[C@H](O)CCC MCULE-8969624714 [0,1,0,0,0,0|1,0,0]=2 366 B10R0.1 CCCCCNC(C)CCC MCULE-9526667622 [0,1,0,0,0,0|3,0,0]=4 367 B10R0.18 CCCCS(=O)CC(O)CCl MCULE-9236858784 [0,1,0,0,0,0|2,0,0]=3 368 B10R0.41 CCCCCCC(CC)CO MCULE-4162010879 [0,1,0,0,0,0|1,0,0]=2 369 B10R0.41 CCCCCCC(CO)CO MCULE-5492904032 [0,1,0,0,0,0|0,0,0]=1 370 B10R0.41 CCCCCCC(OC)OC MCULE-3152834505 [0,1,0,0,0,0|2,0,0]=3 371 B10R0.41 CCCCOCC(CC)CC MCULE-7170558503 [0,1,0,0,0,0|3,0,0]=4 372 B10R0.55 CN(C)CCOCC(O)CCl MCULE-5778987957 [0,1,0,0,0,0|3,0,0]=4 373 B10R0.55 CN(C)CCOCC(O)CCl MCULE-6545887910 [0,1,0,0,0,0|3,0,0]=4 374 B10R0.59 CCC(C)CCCC(C)CBr MCULE-9716994418 [0,1,0,0,0,0|2,0,0]=3 375 B10R0.59 OCC(O)COCC(O)CO MCULE-4296834115 [0,1,0,0,0,0|2,0,0]=3 376 B10R0.62 C#CC(C)(O)CCCCCC MCULE-4550111004 [0,1,0,0,0,0|1,0,1]=3 377 B10R0.62 CCCCCCC(C)(O)CC MCULE-8222249515 [0,1,0,0,0,0|1,0,0]=2 378 B10R0.62 CCCCCCC(Cl)(Cl)C=O MCULE-1983463862 [0,1,0,0,0,0|1,0,2]=4 379 B10R0.74 C=CC(O)CCCCCCC MCULE-2034118054 [0,1,0,0,0,0|1,0,1]=3 380 B10R0.74 C=CCCCCCC(C)CC MCULE-1533986474 [0,1,0,0,0,0|2,0,1]=4 381 B10R0.74 CCCCCCCC(=O)CC MCULE-3418685291 [0,1,0,0,0,0|1,0,2]=4 382 B10R0.74 CCCCCCCC(=O)NO MCULE-2604662374 [0,1,0,0,0,0|1,0,2]=4 383 B10R0.74 CCCCCCCC(C)C=O MCULE-6740449093 [0,1,0,0,0,0|1,0,2]=4 384 B10R0.74 CCCCCCCC(C)CN MCULE-7311446663 [0,1,0,0,0,0|2,0,0]=3 385 B10R0.74 CCCCCCCC(N)CC MCULE-5023964032 [0,1,0,0,0,0|2,0,0]=3 386 B10R0.74 CCCCCCCC(O)CC MCULE-5420300699 [0,1,0,0,0,0|1,0,0]=2 387 B10R0.74 CCCCCCCC(O)CO MCULE-4511310759 [0,1,0,0,0,0|0,0,0]=1 388 B10R0.74 CCCCCCC[C@@H](C)CC MCULE-8718967535 [0,1,0,0,0,0|2,0,0]=3 389 B10R0.74 CCCCCCNC(=O)CCl MCULE-9418401258 [0,1,0,0,0,0|1,0,2]=4 390 B10R0.74 CCCCCCOC(=O)CC MCULE-7750085667 [0,1,0,0,0,0|1,0,2]=4 391 B10R0.74 CCCCCCOC(=O)CCl MCULE-7320709801 [0,1,0,0,0,0|1,0,2]=4 392 B10R0.74 CCCCCCOC(=O)CN MCULE-5357348178 [0,1,0,0,0,0|1,0,2]=4 393 B10R0.74 CCCCCCOC(=O)CS MCULE-4845823799 [0,1,0,0,0,0|0,1,2]=4 394 B10R0.74 CCCCCCOC(=O)C[NH3+] MCULE-4114261473 [0,1,0,0,0,0|1,0,2]=4 395 B10R0.74 CCNCCCNC(C)CC MCULE-5610553943 [0,1,0,0,0,0|3,0,0]=4 396 B10R0.74 CCOCCOCC(O)CCl MCULE-8707944006 [0,1,0,0,0,0|2,0,0]=3 397 B10R0.74 CCOCCOCC(O)CN MCULE-2298197856 [0,1,0,0,0,0|2,0,0]=3 398 B10R0.74 OCCCCCCC(O)CO MCULE-1673794211 [0,1,0,0,0,0|0,0,0]=1 399 B10R0.75 CCCCCCC(Br)C(=O)Br MCULE-8391154868 [0,1,0,0,0,0|1,0,2]=4 400 B10R0.75 CCCCCCC(Br)C(=O)O MCULE-3532642872 [0,1,0,0,0,0|1,0,1]=3 401 B10R0.75 CCCCCCC(C)C(=O)C MCULE-2296587993 [0,1,0,0,0,0|1,0,2]=4 402 B10R0.75 CCCCCCC(C)C(=O)Cl MCULE-4801747974 [0,1,0,0,0,0|1,0,2]=4 403 B10R0.75 CCCCCCC(C)C(=O)O MCULE-6664640382 [0,1,0,0,0,0|1,0,1]=3 404 B10R0.75 CCCCCCC(F)C(=O)O MCULE-3865739259 [0,1,0,0,0,0|1,0,1]=3 405 B10R0.75 CCCCCCC(N)C(=O)O MCULE-2527731470 [0,1,0,0,0,0|1,0,1]=3 406 B10R0.75 CCCCCCC(N)C(=O)O MCULE-5498377990 [0,1,0,0,0,0|1,0,1]=3 407 B10R0.75 CCCCCCC(O)C(=O)O MCULE-1679305682 [0,1,0,0,0,0|0,0,1]=2 408 B10R0.75 CCCCCC[C@@H](N)C(=O)O MCULE-9163680563 [0,1,0,0,0,0|1,0,1]=3 409 B10R0.75 CCCCCC[C@@H](N)C(=O)O MCULE-9959237270 [0,1,0,0,0,0|1,0,1]=3 410 B10R0.75 CCCCCC[C@H](N)C(=O)O MCULE-6660531044 [0,1,0,0,0,0|1,0,1]=3 411 B10R0.75 CCCCCC[C@H](N)C(=O)O MCULE-7151037911 [0,1,0,0,0,0|1,0,1]=3 412 B10R0.75 CCCCSC[C@@H](N)C(=O)O MCULE-8737283640 [0,1,0,0,0,0|2,0,1]=4 413 B10R0.75 CCCCSC[C@H](N)C(=O)O MCULE-5383064231 [0,1,0,0,0,0|2,0,1]=4 414 B10R0.75 CNCCCCC(N)C(=O)O MCULE-5703952072 [0,1,0,0,0,0|2,0,1]=4 415 B10R0.75 CNCCCCC(N)C(=O)O MCULE-8267439974 [0,1,0,0,0,0|2,0,1]=4 416 B10R0.75 CNCCCC[C@H](N)C(=O)O MCULE-4130643324 [0,1,0,0,0,0|2,0,1]=4 417 B10R0.75 CNCCCC[C@H](N)C(=O)O MCULE-5394599260 [0,1,0,0,0,0|2,0,1]=4 418 B10R0.75 CNCCCC[C@H](N)C(=O)O MCULE-6328038825 [0,1,0,0,0,0|2,0,1]=4 419 B10R0.75 CNCCCC[C@H](N)C(=O)O MCULE-6736060504 [0,1,0,0,0,0|2,0,1]=4 420 B10R0.75 NCCCCC[C@@H](N)C(=O)O MCULE-7846811170 [0,1,0,0,0,0|2,0,1]=4 421 B10R0.75 NCCCCC[C@@H](N)C(=O)O MCULE-8562914837 [0,1,0,0,0,0|2,0,1]=4 422 B10R0.75 NCCCCC[C@H](N)C(=O)O MCULE-4522889843 [0,1,0,0,0,0|2,0,1]=4 423 B10R0.75 NCCCCC[C@H](N)C(=O)O MCULE-9026496023 [0,1,0,0,0,0|2,0,1]=4 424 B10R0.83 CCCCCC(=O)C(C)CC MCULE-8709917766 [0,1,0,0,0,0|2,0,1]=4 425 B10R0.83 CCCCCC(=O)C(N)CO MCULE-3102740681 [0,1,0,0,0,0|1,0,1]=3 426 B10R0.83 CCCCCC(=O)C(N)CO MCULE-5960330140 [0,1,0,0,0,0|1,0,1]=3 427 B10R0.83 CCCCCC(O)C(O)CO MCULE-9228799760 [0,1,0,0,0,0|0,0,0]=1 428 B10R0.83 CCCCOC(=O)C(O)CC MCULE-9177969209 [0,1,0,0,0,0|2,0,1]=4 429 B10R0.83 CCCCOC(=O)[C@@H](O)CC MCULE-3356665164 [0,1,0,0,0,0|2,0,1]=4 430 B10R0.83 CCCCOC(=O)[C@@H](O)CC MCULE-5141009962 [0,1,0,0,0,0|2,0,1]=4 431 B10R0.108 CCCC(=O)OCC(O)CO MCULE-4269121827 [0,1,0,0,0,0|1,0,1]=3 432 B10R0.108 CCCC(=O)OC[C@@H](O)CO MCULE-8353916476 [0,1,0,0,0,0|1,0,1]=3 433 B10R1.1 CC1CCC(CC1)CCBr MCULE-7247171213 [0,0,0,1,0,0|3,0,0]=4 434 B10R1.1 CC1CCC(CC1)CCO MCULE-9796800456 [0,0,0,1,0,0|3,0,0]=4 435 B10R1.1 CCCC1CCC(=O)CC1 MCULE-4621155554 [0,0,0,1,0,0|1,0,2]=4 436 B10R1.1 CCCC1CCC(CC1)N MCULE-5845385067 [0,0,0,1,0,0|2,0,0]=3 437 B10R1.1 CCCC1CCC(CC1)O MCULE-1063543963 [0,0,0,1,0,0|1,0,0]=2 438 B10R1.1 CCCN1CCC(CC1)C MCULE-2952331694 [0,0,0,1,0,0|3,0,0]=4 439 B10R1.1 CCCN1CCC(CC1)N MCULE-1133245071 [0,0,0,1,0,0|3,0,0]=4 440 B10R1.1 CCCN1CCC(CC1)N MCULE-6000501442 [0,0,0,1,0,0|3,0,0]=4 441 B10R1.1 CCCN1CCC(CC1)N MCULE-8990692486 [0,0,0,1,0,0|3,0,0]=4 442 B10R1.1 CCC[C@H]1CC[C@@H](CC1)O MCULE-2982122695 [0,0,0,1,0,0|1,0,0]=2 443 B10R1.1 CCNC1CCC(CC1)N MCULE-2866377476 [0,0,0,1,0,0|3,0,0]=4 444 B10R1.1 CCNC1CCC(CC1)N MCULE-9969223850 [0,0,0,1,0,0|3,0,0]=4 445 B10R1.1 CCN[C@H]1CC[C@@H](CC1)N MCULE-5906511242 [0,0,0,1,0,0|3,0,0]=4 446 B10R1.1 CCN[C@H]1CC[C@@H](CC1)N MCULE-7000605746 [0,0,0,1,0,0|3,0,0]=4 447 B10R1.1 CCOC1CCC(CC1)N MCULE-1753835083 [0,0,0,1,0,0|3,0,0]=4 448 B10R1.1 CCOC1CCC(CC1)N MCULE-9154995591 [0,0,0,1,0,0|3,0,0]=4 449 B10R1.1 CCO[C@H]1CC[C@@H](CC1)N MCULE-4712723894 [0,0,0,1,0,0|3,0,0]=4 450 B10R1.1 CCO[C@H]1CC[C@@H](CC1)N MCULE-6647228786 [0,0,0,1,0,0|3,0,0]=4 451 B10R1.1 CNCC1CCC(CC1)N MCULE-2895781925 [0,0,0,1,0,0|3,0,0]=4 452 B10R1.1 COCC1CCC(CC1)N MCULE-5974743119 [0,0,0,1,0,0|3,0,0]=4 453 B10R1.1 COC[C@H]1CC[C@@H](CC1)N MCULE-5274155888 [0,0,0,1,0,0|3,0,0]=4 454 B10R1.1 COC[C@H]1CC[C@@H](CC1)N MCULE-8711609175 [0,0,0,1,0,0|3,0,0]=4 455 B10R1.1 CSCC1CCC(CC1)N MCULE-1549048650 [0,0,0,1,0,0|3,0,0]=4 456 B10R1.1 CSCC1CCC(CC1)N MCULE-9132415202 [0,0,0,1,0,0|3,0,0]=4 457 B10R1.1 CSC[C@H]1CC[C@@H](CC1)N MCULE-1017379588 [0,0,0,1,0,0|3,0,0]=4 458 B10R1.1 CSC[C@H]1CC[C@@H](CC1)N MCULE-5025473679 [0,0,0,1,0,0|3,0,0]=4 459 B10R1.1 C[C@H]1CC[C@@H](CC1)CCN MCULE-2028549449 [0,0,0,1,0,0|3,0,0]=4 460 B10R1.1 C[C@H]1CC[C@@H](CC1)CCO MCULE-1279004613 [0,0,0,1,0,0|3,0,0]=4 461 B10R1.1 N#CC[C@H]1CC[C@@H](CO1)N MCULE-3106907030 [0,0,0,1,0,0|2,0,1]=4 462 B10R1.1 NC1CCC(CC1)CCF MCULE-2593274553 [0,0,0,1,0,0|3,0,0]=4 463 B10R1.1 NC1CCC(CC1)CCO MCULE-2693310690 [0,0,0,1,0,0|3,0,0]=4 464 B10R1.1 NC1CCC(CC1)CCO MCULE-8091196791 [0,0,0,1,0,0|3,0,0]=4 465 B10R1.1 NCCC1CCC(CC1)N MCULE-3547999388 [0,0,0,1,0,0|3,0,0]=4 466 B10R1.1 NCCC1CCC(CC1)O MCULE-6058469002 [0,0,0,1,0,0|2,0,0]=3 467 B10R1.1 NCCN1CCC(CC1)O MCULE-1528838763 [0,0,0,1,0,0|3,0,0]=4 468 B10R1.1 NCCN1CCC(CC1)O MCULE-6533014795 [0,0,0,1,0,0|3,0,0]=4 469 B10R1.1 N[C@H]1CC[C@@H](CC1)CCO MCULE-3276458475 [0,0,0,1,0,0|3,0,0]=4 470 B10R1.1 N[C@H]1CC[C@@H](CC1)CCO MCULE-9655238186 [0,0,0,1,0,0|3,0,0]=4 471 B10R1.1 N[C@H]1CC[C@H](CC1)CCO MCULE-6918430746 [0,0,0,1,0,0|3,0,0]=4 472 B10R1.1 N[C@H]1CC[C@H](CC1)CCO MCULE-8657047988 [0,0,0,1,0,0|3,0,0]=4 473 B10R1.1 OC1CCN(CC1)CCCl MCULE-4794909826 [0,0,0,1,0,0|3,0,0]=4 474 B10R1.1 OC1CCN(CC1)CCF MCULE-8271432567 [0,0,0,1,0,0|3,0,0]=4 475 B10R1.1 OCCC1CCC(CC1)O MCULE-3760583629 [0,0,0,1,0,0|2,0,0]=3 476 B10R1.1 OCCN1CCC(CC1)O MCULE-9447332159 [0,0,0,1,0,0|3,0,0]=4 477 B10R1.2 CC1CCCC(C1C)CN MCULE-5286924755 [0,0,0,1,0,0|3,0,0]=4 478 B10R1.2 CCC1CCCC(N1C)C MCULE-4437914292 [0,0,0,1,0,0|3,0,0]=4 479 B10R1.2 CNC1CCCC(C1C)C MCULE-4330874563 [0,0,0,1,0,0|3,0,0]=4 480 B10R1.2 CN[C@@H]1CCC[C@H]([C@@H]1O)O MCULE-2638179747 [0,0,0,1,0,0|1,0,0]=2 481 B10R1.2 CO[C@@H]1CCC[C@H]([C@H]1O)N MCULE-6769712877 [0,0,0,1,0,0|2,0,0]=3 482 B10R1.2 N[C@H]1CCO[C@@H]([C@H]1O)CO MCULE-3135160668 [0,0,0,1,0,0|3,0,0]=4 483 B10R1.2 N[C@H]1CCO[C@@H]([C@H]1O)CO MCULE-4840233170 [0,0,0,1,0,0|3,0,0]=4 484 B10R1.2 OC[C@H]1CNC[C@H]([C@@H]1O)O MCULE-5106848192 [0,0,0,1,0,0|2,0,0]=3 485 B10R1.2 OC[C@H]1CNC[C@H]([C@@H]1O)O MCULE-6551511352 [0,0,0,1,0,0|2,0,0]=3 486 B10R1.2 OC[C@H]1CNC[C@H]([C@@H]1O)O MCULE-8271266524 [0,0,0,1,0,0|2,0,0]=3 487 B10R1.2 OC[C@H]1NCC[C@H](C1O)O MCULE-3419174170 [0,0,0,1,0,0|2,0,0]=3 488 B10R1.2 OC[C@H]1NCC[C@H]([C@@H]1O)O MCULE-2511097258 [0,0,0,1,0,0|2,0,0]=3 489 B10R1.2 OC[C@H]1NCC[C@H]([C@@H]1O)O MCULE-5560787253 [0,0,0,1,0,0|2,0,0]=3 490 B10R1.7 CC1CCCCCCC1=O MCULE-5002473983 [0,0,0,1,0,0|1,0,2]=4 491 B10R1.7 NC1CCCCCCC1O MCULE-9142911119 [0,0,0,1,0,0|1,0,0]=2 492 B10R1.7 N[C@@H]1CCCCCC[C@@H]1O MCULE-1728493798 [0,0,0,1,0,0|1,0,0]=2 493 B10R1.7 N[C@@H]1CCCCCC[C@H]1O MCULE-8702565765 [0,0,0,1,0,0|1,0,0]=2 494 B10R1.7 N[C@H]1CCCCCC[C@@H]1O MCULE-4894585058 [0,0,0,1,0,0|1,0,0]=2 495 B10R1.7 N[C@H]1CCCCCC[C@H]1O MCULE-3214389652 [0,0,0,1,0,0|1,0,0]=2 496 B10R1.7 OC1CCCCCCC1O MCULE-4573160076 [0,0,0,1,0,0|0,0,0]=1 497 B10R1.7 O[C@H]1CCCCCC[C@H]1O MCULE-3578348851 [0,0,0,1,0,0|0,0,0]=1 498 B10R1.15 C#CC(N)C1CCCCC1 MCULE-9165363419 [0,0,0,1,0,0|2,0,1]=4 499 B10R1.15 C#CC(O)C1CCCCC1 MCULE-1450923869 [0,0,0,1,0,0|1,0,1]=3 500 B10R1.15 C=C(CO)C1CCNCC1 MCULE-2096772328 [0,0,0,1,0,0|2,0,1]=4 501 B10R1.15 C=CC(O)C1CCCCC1 MCULE-4108928861 [0,0,0,1,0,0|1,0,1]=3 502 B10R1.15 CC(=NO)C1CCCCC1 MCULE-1684283685 [0,0,0,1,0,0|2,0,1]=4 503 B10R1.15 CC(C=O)C1CCCCC1 MCULE-8646762788 [0,0,0,1,0,0|1,0,2]=4 504 B10R1.15 CC(CBr)C1CCCCC1 MCULE-2948345832 [0,0,0,1,0,0|2,0,0]=3 505 B10R1.15 CC(CCl)N1CCCCC1 MCULE-1148684281 [0,0,0,1,0,0|3,0,0]=4 506 B10R1.15 CC(CCl)N1CCCCC1 MCULE-3502299548 [0,0,0,1,0,0|3,0,0]=4 507 B10R1.15 CC(CN)C1CCCCC1 MCULE-8818157357 [0,0,0,1,0,0|2,0,0]=3 508 B10R1.15 CC(CN)N1CCCCC1 MCULE-3818563803 [0,0,0,1,0,0|3,0,0]=4 509 B10R1.15 CC(CO)C1CCCCC1 MCULE-8690797205 [0,0,0,1,0,0|1,0,0]=2 510 B10R1.15 CC(CO)C1CCCCN1 MCULE-4944883554 [0,0,0,1,0,0|2,0,0]=3 511 B10R1.15 CC(CO)C1CCCCO1 MCULE-4150266717 [0,0,0,1,0,0|2,0,0]=3 512 B10R1.15 CC(CO)C1CCNCC1 MCULE-1112294262 [0,0,0,1,0,0|2,0,0]=3 513 B10R1.15 CC(CO)C1CCOCC1 MCULE-2291779221 [0,0,0,1,0,0|2,0,0]=3 514 B10R1.15 CC(CO)N1CCCCC1 MCULE-4402990422 [0,0,0,1,0,0|2,0,0]=3 515 B10R1.15 CC(CO)N1CCCCC1 MCULE-5772863437 [0,0,0,1,0,0|2,0,0]=3 516 B10R1.15 CC(CO)N1CCNCC1 MCULE-7240409844 [0,0,0,1,0,0|3,0,0]=4 517 B10R1.15 CC(CO)N1CCNCC1 MCULE-8768522295 [0,0,0,1,0,0|3,0,0]=4 518 B10R1.15 CC(CO)N1CCOCC1 MCULE-6653758786 [0,0,0,1,0,0|3,0,0]=4 519 B10R1.15 CC(NN)C1CCCCC1 MCULE-2293336667 [0,0,0,1,0,0|3,0,0]=4 520 B10R1.15 CC(NN)C1CCCCC1 MCULE-4858570926 [0,0,0,1,0,0|3,0,0]=4 521 B10R1.15 CC(NN)C1CCCCC1 MCULE-6946948316 [0,0,0,1,0,0|3,0,0]=4 522 B10R1.15 CCC(=O)C1CCCCC1 MCULE-8203276385 [0,0,0,1,0,0|1,0,2]=4 523 B10R1.15 CCC(Br)C1CCCCC1 MCULE-5145667891 [0,0,0,1,0,0|2,0,0]=3 524 B10R1.15 CCC(C)C1CCCCC1 MCULE-4749493132 [0,0,0,1,0,0|2,0,0]=3 525 B10R1.15 CCC(C)C1CCCCN1 MCULE-4339303771 [0,0,0,1,0,0|3,0,0]=4 526 B10R1.15 CCC(C)C1CCCCN1 MCULE-9200077293 [0,0,0,1,0,0|3,0,0]=4 527 B10R1.15 CCC(N)C1CCCCC1 MCULE-2735585562 [0,0,0,1,0,0|2,0,0]=3 528 B10R1.15 CCC(N)C1CCCCC1 MCULE-7856139706 [0,0,0,1,0,0|2,0,0]=3 529 B10R1.15 CCC(N)C1CCCCC1 MCULE-8145497391 [0,0,0,1,0,0|2,0,0]=3 530 B10R1.15 CCC(N)C1CCCCC1 MCULE-8723758208 [0,0,0,1,0,0|2,0,0]=3 531 B10R1.15 CCC(N)C1CCCCO1 MCULE-7954176934 [0,0,0,1,0,0|3,0,0]=4 532 B10R1.15 CCC(N)C1CCCOC1 MCULE-3442263317 [0,0,0,1,0,0|3,0,0]=4 533 B10R1.15 CCC(N)C1CCOCC1 MCULE-9139011424 [0,0,0,1,0,0|3,0,0]=4 534 B10R1.15 CCC(O)C1CCCCC1 MCULE-2881249865 [0,0,0,1,0,0|1,0,0]=2 535 B10R1.15 CCC(O)C1CCCCN1 MCULE-7730134295 [0,0,0,1,0,0|2,0,0]=3 536 B10R1.15 CCC(O)C1CCNCC1 MCULE-6028347565 [0,0,0,1,0,0|2,0,0]=3 537 B10R1.15 CCC(O)C1CCOCC1 MCULE-5455110043 [0,0,0,1,0,0|2,0,0]=3 538 B10R1.15 CC[C@@H](O)[C@@H]1CCCCN1 MCULE-5363275416 [0,0,0,1,0,0|2,0,0]=3 539 B10R1.15 CC[C@H](N)C1CCCCC1 MCULE-2266134248 [0,0,0,1,0,0|2,0,0]=3 540 B10R1.15 CC[C@H](N)C1CCCCC1 MCULE-2837970190 [0,0,0,1,0,0|2,0,0]=3 541 B10R1.15 CC[C@H](N)C1CCCCC1 MCULE-4058884975 [0,0,0,1,0,0|2,0,0]=3 542 B10R1.15 CC[C@H](N)C1CCCCC1 MCULE-4904125954 [0,0,0,1,0,0|2,0,0]=3 543 B10R1.15 CNC(C)C1CCCCC1 MCULE-4829165226 [0,0,0,1,0,0|3,0,0]=4 544 B10R1.15 CNC(C)C1CCCCC1 MCULE-6419542933 [0,0,0,1,0,0|3,0,0]=4 545 B10R1.15 CN[C@@H](C)C1CCCCC1 MCULE-1057557326 [0,0,0,1,0,0|3,0,0]=4 546 B10R1.15 CN[C@@H](C)C1CCCCC1 MCULE-1749688322 [0,0,0,1,0,0|3,0,0]=4 547 B10R1.15 CN[C@H](C)C1CCCCC1 MCULE-2041676554 [0,0,0,1,0,0|3,0,0]=4 548 B10R1.15 CN[C@H](C)C1CCCCC1 MCULE-5113516525 [0,0,0,1,0,0|3,0,0]=4 549 B10R1.15 C[C@@H](CO)N1CCNCC1 MCULE-7621619260 [0,0,0,1,0,0|3,0,0]=4 550 B10R1.15 C[C@@H](CO)N1CCOCC1 MCULE-6953620623 [0,0,0,1,0,0|3,0,0]=4 551 B10R1.15 N#CC(Cl)C1CCCCC1 MCULE-8190079895 [0,0,0,1,0,0|2,0,1]=4 552 B10R1.15 N#CC(N)C1CCCCC1 MCULE-3274285377 [0,0,0,1,0,0|2,0,1]=4 553 B10R1.15 N#CC(N)C1CCCCC1 MCULE-4121683192 [0,0,0,1,0,0|2,0,1]=4 554 B10R1.15 N#CC(O)C1CCCCC1 MCULE-2814689309 [0,0,0,1,0,0|1,0,1]=3 555 B10R1.15 N/C(=N/O)/C1CCCCC1 MCULE-7400174450 [0,0,0,1,0,0|2,0,1]=4 556 B10R1.15 NC(CO)C1CCCCC1 MCULE-7205591328 [0,0,0,1,0,0|1,0,0]=2 557 B10R1.15 NC(CO)C1CCCCC1 MCULE-7370703075 [0,0,0,1,0,0|1,0,0]=2 558 B10R1.15 NC(CO)C1CCCCC1 MCULE-8745977604 [0,0,0,1,0,0|1,0,0]=2 559 B10R1.15 NC(CO)C1CCCOC1 MCULE-4152145176 [0,0,0,1,0,0|2,0,0]=3 560 B10R1.15 NC(CO)C1CCCOC1 MCULE-7286913939 [0,0,0,1,0,0|2,0,0]=3 561 B10R1.15 NC(CO)C1CCOCC1 MCULE-4207996874 [0,0,0,1,0,0|2,0,0]=3 562 B10R1.15 NC(CO)C1CCOCC1 MCULE-6646407511 [0,0,0,1,0,0|2,0,0]=3 563 B10R1.15 NCC(=O)C1CCCCC1 MCULE-5312619543 [0,0,0,1,0,0|1,0,2]=4 564 B10R1.15 NCC(=O)C1CCCCC1 MCULE-8215004471 [0,0,0,1,0,0|1,0,2]=4 565 B10R1.15 NCC(N)C1CCCCC1 MCULE-3140142671 [0,0,0,1,0,0|2,0,0]=3 566 B10R1.15 NCC(O)C1CCCCC1 MCULE-7199366772 [0,0,0,1,0,0|1,0,0]=2 567 B10R1.15 NCC(O)C1CCCCC1 MCULE-8529609856 [0,0,0,1,0,0|1,0,0]=2 568 B10R1.15 NCC(O)C1CCOCC1 MCULE-6676500413 [0,0,0,1,0,0|2,0,0]=3 569 B10R1.15 NCC(O)C1CCOCC1 MCULE-7393315444 [0,0,0,1,0,0|2,0,0]=3 570 B10R1.15 N[C@@H](CF)C1CCCCC1 MCULE-3762114197 [0,0,0,1,0,0|2,0,0]=3 571 B10R1.15 N[C@@H](CF)C1CCCCC1 MCULE-6703398254 [0,0,0,1,0,0|2,0,0]=3 572 B10R1.15 N[C@@H](CO)C1CCCCC1 MCULE-2384926884 [0,0,0,1,0,0|1,0,0]=2 573 B10R1.15 N[C@@H](CO)C1CCCCC1 MCULE-7290753104 [0,0,0,1,0,0|1,0,0]=2 574 B10R1.15 N[C@@H](CO)C1CCCCC1 MCULE-8304806141 [0,0,0,1,0,0|1,0,0]=2 575 B10R1.15 N[C@H](CF)C1CCCCC1 MCULE-1021109156 [0,0,0,1,0,0|2,0,0]=3 576 B10R1.15 N[C@H](CF)C1CCCCC1 MCULE-2626727063 [0,0,0,1,0,0|2,0,0]=3 577 B10R1.15 N[C@H](CO)C1CCCCC1 MCULE-2300999389 [0,0,0,1,0,0|1,0,0]=2 578 B10R1.15 N[C@H](CO)C1CCCCC1 MCULE-6613082885 [0,0,0,1,0,0|1,0,0]=2 579 B10R1.15 N[C@H](CO)C1CCCCC1 MCULE-6887686110 [0,0,0,1,0,0|1,0,0]=2 580 B10R1.15 N[C@H](CO)C1CCCCC1 MCULE-9265008029 [0,0,0,1,0,0|1,0,0]=2 581 B10R1.15 O/N=C(\Cl)/C1CCCCC1 MCULE-3114876572 [0,0,0,1,0,0|2,0,1]=4 582 B10R1.15 O=C(CBr)C1CCCCC1 MCULE-1828005520 [0,0,0,1,0,0|1,0,2]=4 583 B10R1.15 O=C(CCl)C1CCCCC1 MCULE-1798641564 [0,0,0,1,0,0|1,0,2]=4 584 B10R1.15 O=C(CO)C1CCCCC1 MCULE-7711081081 [0,0,0,1,0,0|0,0,2]=3 585 B10R1.15 O=C(CO)N1CCCCC1 MCULE-2972774035 [0,0,0,1,0,0|1,0,2]=4 586 B10R1.15 O=C(NO)C1CCCCC1 MCULE-4311817351 [0,0,0,1,0,0|1,0,2]=4 587 B10R1.15 OC(CBr)C1CCCCC1 MCULE-4672715356 [0,0,0,1,0,0|1,0,0]=2 588 B10R1.15 OC(CCl)C1CCCCC1 MCULE-2813494650 [0,0,0,1,0,0|1,0,0]=2 589 B10R1.15 OC(CF)C1CCCCC1 MCULE-2558300635 [0,0,0,1,0,0|1,0,0]=2 590 B10R1.15 OC(CI)C1CCCCC1 MCULE-8401899170 [0,0,0,1,0,0|1,0,0]=2 591 B10R1.15 OCC(O)C1CCCCN1 MCULE-6655190494 [0,0,0,1,0,0|1,0,0]=2 592 B10R1.15 OCC(O)C1CCCCO1 MCULE-2204525592 [0,0,0,1,0,0|1,0,0]=2 593 B10R1.15 OCC(O)C1CCNCC1 MCULE-1554215254 [0,0,0,1,0,0|1,0,0]=2 594 B10R1.15 OCC(O)C1CCNCC1 MCULE-4689262741 [0,0,0,1,0,0|1,0,0]=2 595 B10R1.15 OC[C@@H](O)C1CCNCC1 MCULE-9617632132 [0,0,0,1,0,0|1,0,0]=2 596 B10R1.16 CCCCC1CCC(C1)N MCULE-6344946035 [0,0,0,1,0,0|2,0,0]=3 597 B10R1.16 CCCCC1OCC(O1)C MCULE-6055464693 [0,0,0,1,0,0|2,0,0]=3 598 B10R1.16 CCCCN1CCC(C1)N MCULE-3220985961 [0,0,0,1,0,0|3,0,0]=4 599 B10R1.16 CCCCN1CCC(C1)N MCULE-5009108657 [0,0,0,1,0,0|3,0,0]=4 600 B10R1.16 COCCN1CCC(C1)O MCULE-5083784954 [0,0,0,1,0,0|3,0,0]=4 601 B10R1.16 NCCCN1CC[C@H](C1)O MCULE-6127930765 [0,0,0,1,0,0|3,0,0]=4 602 B10R1.16 OC1CCN(C1)CCCF MCULE-8123735655 [0,0,0,1,0,0|3,0,0]=4 603 B10R1.16 O[C@@H]1CCN(C1)CCCF MCULE-3786405733 [0,0,0,1,0,0|3,0,0]=4 604 B10R1.16 O[C@@H]1CCN(C1)CCCF MCULE-6345512047 [0,0,0,1,0,0|3,0,0]=4 605 B10R1.16 O[C@H]1CCN(C1)CCCF MCULE-9214253281 [0,0,0,1,0,0|3,0,0]=4 606 B10R1.27 CC(CN)CN1CCCC1 MCULE-7714663495 [0,0,0,1,0,0|3,0,0]=4 607 B10R1.27 CC(CO)CC1CCCC1 MCULE-9953987757 [0,0,0,1,0,0|1,0,0]=2 608 B10R1.27 CC(CO)CN1CCCC1 MCULE-5182283403 [0,0,0,1,0,0|2,0,0]=3 609 B10R1.27 CC(CO)NC1CCCC1 MCULE-9218996229 [0,0,0,1,0,0|2,0,0]=3 610 B10R1.27 CCC(C)CC1CCNC1 MCULE-8252472265 [0,0,0,1,0,0|3,0,0]=4 611 B10R1.27 CCC(C)NC1CCCC1 MCULE-4719820903 [0,0,0,1,0,0|3,0,0]=4 612 B10R1.27 CCC(C)NC1CCCC1 MCULE-5711823686 [0,0,0,1,0,0|3,0,0]=4 613 B10R1.27 CCC(N)CN1CCCC1 MCULE-5495439109 [0,0,0,1,0,0|3,0,0]=4 614 B10R1.27 CCC(N)CN1CCCC1 MCULE-6985998037 [0,0,0,1,0,0|3,0,0]=4 615 B10R1.27 CCC(O)CN1CCCC1 MCULE-5824673052 [0,0,0,1,0,0|2,0,0]=3 616 B10R1.27 CCC(O)C[NH+]1CCCC1 MCULE-4433741385 [0,0,0,1,0,0|2,0,0]=3 617 B10R1.27 CNC(C)CC1CCCC1 MCULE-6338868910 [0,0,0,1,0,0|3,0,0]=4 618 B10R1.27 N/C(=N/O)/CC1CCCC1 MCULE-5747462847 [0,0,0,1,0,0|2,0,1]=4 619 B10R1.27 NC(CO)CC1CCCC1 MCULE-6351800661 [0,0,0,1,0,0|1,0,0]=2 620 B10R1.27 NC(CO)CC1CCCC1 MCULE-7941804108 [0,0,0,1,0,0|1,0,0]=2 621 B10R1.27 NC(CO)CC1CCCO1 MCULE-7544199811 [0,0,0,1,0,0|2,0,0]=3 622 B10R1.27 NC(CO)CC1CCOC1 MCULE-8378662893 [0,0,0,1,0,0|2,0,0]=3 623 B10R1.27 NC(CO)CC1OCCO1 MCULE-4568329066 [0,0,0,1,0,0|3,0,0]=4 624 B10R1.27 NC(CO)CN1CCCC1 MCULE-5549240286 [0,0,0,1,0,0|2,0,0]=3 625 B10R1.27 NC(CO)CN1CCCC1 MCULE-6994008599 [0,0,0,1,0,0|2,0,0]=3 626 B10R1.27 NCC(O)CN1CCCC1 MCULE-9325741480 [0,0,0,1,0,0|2,0,0]=3 627 B10R1.27 O=C(CO)NC1CCCC1 MCULE-7488310244 [0,0,0,1,0,0|1,0,2]=4 628 B10R1.27 OCC(O)CN1CCCC1 MCULE-5801014059 [0,0,0,1,0,0|1,0,0]=2 629 B10R1.40 CCC1CCC[N+]1(C)CC MCULE-6676026586 [0,0,0,1,0,0|3,0,0]=4 630 B10R1.40 CCC1CCC[N+]1(C)CC MCULE-7674238820 [0,0,0,1,0,0|3,0,0]=4 631 B10R1.40 C[C@@]1(CNC[C@H]1CO)CO MCULE-7424649218 [0,0,0,1,0,0|3,0,0]=4 632 B10R1.40 C[C@@]1(CNC[C@H]1CO)CO MCULE-7508444643 [0,0,0,1,0,0|3,0,0]=4 633 B10R1.57 CCCCCOC1CNC1 MCULE-1170990409 [0,0,0,1,0,0|3,0,0]=4 634 B10R1.78 O=C1CCCCCCCC1 MCULE-1205201333 [0,0,0,1,0,0|1,0,2]=4 635 B10R1.87 CCSC1CCC1(O)CN MCULE-5124446976 [0,0,0,1,0,0|2,0,0]=3 636 B10R1.96 CCCN1CCC(C1)CN MCULE-2493920355 [0,0,0,1,0,0|3,0,0]=4 637 B10R1.96 CCCN1CCC(C1)CO MCULE-5808111058 [0,0,0,1,0,0|2,0,0]=3 638 B10R1.96 CCCN1CCC(C1)CO MCULE-9100332204 [0,0,0,1,0,0|2,0,0]=3 639 B10R1.96 NCCN1CCC(C1)CO MCULE-1279234881 [0,0,0,1,0,0|3,0,0]=4 640 B10R1.149 CC(CN)C1CCCN1C MCULE-2095494269 [0,0,0,1,0,0|3,0,0]=4 641 B10R1.149 CC(CN)C1CCCN1C MCULE-8809783650 [0,0,0,1,0,0|3,0,0]=4 642 B10R1.149 C[C@H]1CNC[C@@H]1C(=O)CO MCULE-2509682466 [0,0,0,1,0,0|1,0,2]=4 643 B10R1.151 CC(CO)NCC1CCC1 MCULE-6696982431 [0,0,0,1,0,0|2,0,0]=3 644 B10R1.153 CCC(N)COCC1CC1 MCULE-8398450981 [0,0,0,1,0,0|3,0,0]=4 645 B10R1.153 NCC(O)COCC1CC1 MCULE-4025869800 [0,0,0,1,0,0|2,0,0]=3 646 B10R1.153 N[C@H](CO)CSCC1CC1 MCULE-7601624270 [0,0,0,1,0,0|2,0,0]=3 647 B10R1.161 BrCC1OCCCCCO1 MCULE-3056414225 [0,0,0,1,0,0|2,0,0]=3 648 B10R1.161 C=CC1CCCCCCC1 MCULE-4062427042 [0,0,0,1,0,0|2,0,1]=4 649 B10R1.161 CNC1CCCCCCC1 MCULE-2172886818 [0,0,0,1,0,0|3,0,0]=4 650 B10R1.161 CNC1CCCCCCC1 MCULE-2549730402 [0,0,0,1,0,0|3,0,0]=4 651 B10R1.161 N#CC1CCCCCCC1 MCULE-8673985853 [0,0,0,1,0,0|2,0,1]=4 652 B10R1.161 NCC1CCCCCCC1 MCULE-9635361503 [0,0,0,1,0,0|2,0,0]=3 653 B10R1.161 O=CC1CCCCCCC1 MCULE-6277104874 [0,0,0,1,0,0|1,0,2]=4 654 B10R1.161 OCC1CCCCCCC1 MCULE-1512335429 [0,0,0,1,0,0|1,0,0]=2 655 B10R1.161 ON=C1CCCCCCC1 MCULE-1582039185 [0,0,0,1,0,0|2,0,1]=4 656 B10R1.162 CN1CCCCC(C1)CN MCULE-4179582464 [0,0,0,1,0,0|3,0,0]=4 657 B10R1.162 CN1CCNCC(C1)CO MCULE-5487611315 [0,0,0,1,0,0|3,0,0]=4 658 B10R1.162 CN1CCNCC(C1)CO MCULE-8760456064 [0,0,0,1,0,0|3,0,0]=4 659 B10R1.162 O=C1CCCCC(N1)CO MCULE-9454883286 [0,0,0,1,0,0|2,0,1]=4 660 B10R1.172 CCC1CCCC(C1)C=O MCULE-4357346988 [0,0,0,1,0,0|1,0,2]=4 661 B10R1.172 CCC1CCCC(C1)CN MCULE-6538752752 [0,0,0,1,0,0|2,0,0]=3 662 B10R1.172 CCC1CNCC(O1)CC MCULE-5035089082 [0,0,0,1,0,0|2,0,0]=3 663 B10R1.172 CCN1CCCC(C1)CN MCULE-7689841548 [0,0,0,1,0,0|3,0,0]=4 664 B10R1.172 CCN1CCCC(C1)CO MCULE-8923148904 [0,0,0,1,0,0|2,0,0]=3 665 B10R1.172 COC1=CC(CCC1)CO MCULE-4704775875 [0,0,0,1,0,0|2,0,1]=4 666 B10R1.172 COC1CCCC(C1)CO MCULE-7450480573 [0,0,0,1,0,0|2,0,0]=3 667 B10R1.172 FCC1CNCC(O1)CF MCULE-1006144114 [0,0,0,1,0,0|3,0,0]=4 668 B10R1.172 FCC1CNCC(O1)CF MCULE-1152146065 [0,0,0,1,0,0|3,0,0]=4 669 B10R1.172 IC[C@@H]1COC[C@H](O1)CI MCULE-1054690985 [0,0,0,1,0,0|3,0,0]=4 670 B10R1.172 NCC1CCCC(C1)CN MCULE-9621780495 [0,0,0,1,0,0|3,0,0]=4 671 B10R1.172 NC[C@@H]1CCC[C@@H](C1)CO MCULE-4521290774 [0,0,0,1,0,0|2,0,0]=3 672 B10R1.172 NC[C@@H]1CCC[C@@H](C1)CO MCULE-7994183611 [0,0,0,1,0,0|2,0,0]=3 673 B10R1.172 NC[C@H]1CCC[C@H](C1)CN MCULE-3859033801 [0,0,0,1,0,0|3,0,0]=4 674 B10R1.172 OCC1CCCN(C1)CO MCULE-2550767356 [0,0,0,1,0,0|3,0,0]=4 675 B10R1.172 OCC1CNCC(C1)CO MCULE-2134620636 [0,0,0,1,0,0|3,0,0]=4 676 B10R1.172 OCC1CNCC(C1)CO MCULE-8435821857 [0,0,0,1,0,0|3,0,0]=4 677 B10R1.172 OC[C@@H]1CNC[C@@H](C1)CO MCULE-5573020830 [0,0,0,1,0,0|3,0,0]=4 678 B10R1.172 OC[C@@H]1CNC[C@@H](C1)CO MCULE-8236931267 [0,0,0,1,0,0|3,0,0]=4 679 B10R1.172 OC[C@@H]1CNC[C@@H](O1)CO MCULE-6537133350 [0,0,0,1,0,0|2,0,0]=3 680 B10R1.172 OC[C@@H]1CNC[C@@H](O1)CO MCULE-7436086494 [0,0,0,1,0,0|2,0,0]=3 681 B10R1.197 CCC1CCCC(=O)CC1 MCULE-9268041087 [0,0,0,1,0,0|1,0,2]=4 682 B10R1.197 CCC1CCCC(CC1)N MCULE-5672798446 [0,0,0,1,0,0|2,0,0]=3 683 B10R1.230 C#C[C@@]1(CCCC[C@@H]1N)O MCULE-2980219862 [0,0,0,1,0,0|2,0,1]=4 684 B10R1.230 CC1(CCCCC1O)CN MCULE-9079785994 [0,0,0,1,0,0|3,0,0]=4 685 B10R1.230 CC1(CCCCC1O)CO MCULE-8520743819 [0,0,0,1,0,0|2,0,0]=3 686 B10R1.230 CC1(CCNCC1O)CO MCULE-7558970237 [0,0,0,1,0,0|3,0,0]=4 687 B10R1.230 CC1(CCNCC1O)CO MCULE-7842019949 [0,0,0,1,0,0|3,0,0]=4 688 B10R1.230 CC1(CNCCC1O)CO MCULE-6324884790 [0,0,0,1,0,0|3,0,0]=4 689 B10R1.230 CC1(CNCCC1O)CO MCULE-9805860984 [0,0,0,1,0,0|3,0,0]=4 690 B10R1.230 CC1CCCCC1(N)CO MCULE-7168996754 [0,0,0,1,0,0|1,0,0]=2 691 B10R1.230 CC1CCCCC1(O)C#N MCULE-3047697353 [0,0,0,1,0,0|1,0,1]=3 692 B10R1.230 CC1CCCCC1(O)CN MCULE-2093676567 [0,0,0,1,0,0|1,0,0]=2 693 B10R1.230 CC1CCCCC1(O)CO MCULE-4407995674 [0,0,0,1,0,0|0,0,0]=1 694 B10R1.230 CC[N+]1(CCCCC1C)C MCULE-3243464600 [0,0,0,1,0,0|3,0,0]=4 695 B10R1.230 CC[N+]1(CCCCC1C)C MCULE-6597695089 [0,0,0,1,0,0|3,0,0]=4 696 B10R1.230 OC1(CCNCC1F)CF MCULE-8563180807 [0,0,0,1,0,0|3,0,0]=4 697 B10R1.230 O[C@@]1(CCNC[C@@H]1F)CF MCULE-6508961687 [0,0,0,1,0,0|3,0,0]=4 698 B10R1.230 O[C@]1(CCNC[C@@H]1F)CF MCULE-4784800940 [0,0,0,1,0,0|3,0,0]=4 699 B10R1.232 C#CC1(CCCCCC1)N MCULE-4472321046 [0,0,0,1,0,0|2,0,1]=4 700 B10R1.232 C#CC1(CCCCCC1)N MCULE-9249331102 [0,0,0,1,0,0|2,0,1]=4 701 B10R1.232 C#CC1(CCCCCC1)O MCULE-3463068322 [0,0,0,1,0,0|1,0,1]=3 702 B10R1.232 CC1(CCCCCC1)C=O MCULE-5506985890 [0,0,0,1,0,0|1,0,2]=4 703 B10R1.232 CC1(CCCCCC1)CN MCULE-2109754128 [0,0,0,1,0,0|2,0,0]=3 704 B10R1.232 CC1(CCCNCC1)CO MCULE-4197675951 [0,0,0,1,0,0|2,0,0]=3 705 B10R1.232 CC1(CCCNCC1)CO MCULE-4474965300 [0,0,0,1,0,0|2,0,0]=3 706 B10R1.232 CCC1(CCCCCC1)N MCULE-9137549799 [0,0,0,1,0,0|2,0,0]=3 707 B10R1.232 CCC1(CCCNCC1)C MCULE-6669976694 [0,0,0,1,0,0|3,0,0]=4 708 B10R1.232 N#CC1(CCCCCC1)N MCULE-4463547838 [0,0,0,1,0,0|2,0,1]=4 709 B10R1.232 N#CC1(CCCCCC1)N MCULE-5487751679 [0,0,0,1,0,0|2,0,1]=4 710 B10R1.232 NC1(CCCCCC1)CO MCULE-2170288125 [0,0,0,1,0,0|1,0,0]=2 711 B10R1.232 NCC1(CCCCCC1)N MCULE-4118353070 [0,0,0,1,0,0|2,0,0]=3 712 B10R1.232 NCC1(CCCCCC1)O MCULE-3327612117 [0,0,0,1,0,0|1,0,0]=2 713 B10R1.232 NCC1(CCCCCC1)O MCULE-6301223397 [0,0,0,1,0,0|1,0,0]=2 714 B10R1.232 NCC1(CSCCSC1)O MCULE-4617298907 [0,0,0,1,0,0|3,0,0]=4 715 B10R1.232 OC1(CCCCNC1)CF MCULE-4844300242 [0,0,0,1,0,0|2,0,0]=3 716 B10R1.232 OC1(CCCCNC1)CF MCULE-5282987199 [0,0,0,1,0,0|2,0,0]=3 717 B10R1.232 OC1(CCCNCC1)CF MCULE-2837000697 [0,0,0,1,0,0|2,0,0]=3 718 B10R1.232 OC1(CCCNCC1)CF MCULE-6932830843 [0,0,0,1,0,0|2,0,0]=3 719 B10R1.232 OCC1(CCCCCC1)O MCULE-9814612692 [0,0,0,1,0,0|0,0,0]=1 720 B10R1.232 OCC1(CCCNCC1)F MCULE-1408932953 [0,0,0,1,0,0|2,0,0]=3 721 B10R1.232 OCC1(CCCNCC1)F MCULE-5039908012 [0,0,0,1,0,0|2,0,0]=3 722 B10R1.232 OCC1(CCCNCC1)O MCULE-3461379297 [0,0,0,1,0,0|1,0,0]=2 723 B10R1.232 OCC1(CCCNCC1)O MCULE-5976611841 [0,0,0,1,0,0|1,0,0]=2 724 B10R1.275 N[C@@H]1CCCC[C@H]([C@@H]1O)O MCULE-8809733803 [0,0,0,1,0,0|1,0,0]=2 725 B7R0.1 BrCCCCCCBr MCULE-5187406804 [2,0,0,0,0,0|2,0,0]=4 726 B7R0.1 C#CCCCCCC MCULE-4406928583 [2,0,0,0,0,0|0,0,2]=4 727 B7R0.1 C#CCCCCCO MCULE-2909503471 [2,0,0,0,0,0|0,0,2]=4 728 B7R0.1 C/C=C/CCCCC MCULE-6911363331 [2,0,0,0,0,0|0,0,2]=4 729 B7R0.1 C/C=C\CCCCC MCULE-9470036254 [2,0,0,0,0,0|0,0,2]=4 730 B7R0.1 C=CCCCCCC MCULE-6867393536 [2,0,0,0,0,0|0,0,2]=4 731 B7R0.1 C=CCCCCCO MCULE-1200112990 [2,0,0,0,0,0|0,0,2]=4 732 B7R0.1 CC#CCCCCC MCULE-3651650902 [2,0,0,0,0,0|0,0,2]=4 733 B7R0.1 CC#CCCCCO MCULE-8668355627 [2,0,0,0,0,0|0,0,2]=4 734 B7R0.1 CC/C=C/CCCC MCULE-7439146649 [2,0,0,0,0,0|0,0,2]=4 735 B7R0.1 CC/C=C\CCCO MCULE-7890119012 [2,0,0,0,0,0|0,0,2]=4 736 B7R0.1 CC=CCCCCC MCULE-7111489659 [2,0,0,0,0,0|0,0,2]=4 737 B7R0.1 CC=CCCCCO MCULE-8707373340 [2,0,0,0,0,0|0,0,2]=4 738 B7R0.1 CCC#CCCCC MCULE-5815218275 [2,0,0,0,0,0|0,0,2]=4 739 B7R0.1 CCC/C=C/CCC MCULE-4580411068 [2,0,0,0,0,0|0,0,2]=4 740 B7R0.1 CCC/C=C\CCC MCULE-3832748741 [2,0,0,0,0,0|0,0,2]=4 741 B7R0.1 CCC=CCCCC MCULE-9716720293 [2,0,0,0,0,0|0,0,2]=4 742 B7R0.1 CCC=CCCCO MCULE-9620732691 [2,0,0,0,0,0|0,0,2]=4 743 B7R0.1 CCCC#CCCC MCULE-7777692011 [2,0,0,0,0,0|0,0,2]=4 744 B7R0.1 CCCC#CCCO MCULE-7581204382 [2,0,0,0,0,0|0,0,2]=4 745 B7R0.1 CCCC/C=C/CO MCULE-5404793542 [2,0,0,0,0,0|0,0,2]=4 746 B7R0.1 CCCC=CCCC MCULE-6897310592 [2,0,0,0,0,0|0,0,2]=4 747 B7R0.1 CCCCC#CCO MCULE-9057096480 [2,0,0,0,0,0|0,0,2]=4 748 B7R0.1 CCCCC=CCO MCULE-7891403223 [2,0,0,0,0,0|0,0,2]=4 749 B7R0.1 CCCCCCC#N MCULE-7652123212 [2,0,0,0,0,0|1,0,1]=4 750 B7R0.1 CCCCCCC=O MCULE-5251820425 [2,0,0,0,0,0|0,0,2]=4 751 B7R0.1 CCCCCCCBr MCULE-8042829299 [2,0,0,0,0,0|1,0,0]=3 752 B7R0.1 CCCCCCCC MCULE-3248084959 [2,0,0,0,0,0|0,0,0]=2 753 B7R0.1 CCCCCCCCl MCULE-6286146566 [2,0,0,0,0,0|1,0,0]=3 754 B7R0.1 CCCCCCCF MCULE-9794868174 [2,0,0,0,0,0|1,0,0]=3 755 B7R0.1 CCCCCCCI MCULE-2930393920 [2,0,0,0,0,0|1,0,0]=3 756 B7R0.1 CCCCCCCN MCULE-1126747714 [2,0,0,0,0,0|1,0,0]=3 757 B7R0.1 CCCCCCCO MCULE-5882959353 [2,0,0,0,0,0|0,0,0]=2 758 B7R0.1 CCCCCCCS MCULE-3901364910 [2,0,0,0,0,0|0,1,0]=3 759 B7R0.1 CCCCCCNC MCULE-1828296852 [2,0,0,0,0,0|1,0,0]=3 760 B7R0.1 CCCCCCNN MCULE-5116098983 [2,0,0,0,0,0|2,0,0]=4 761 B7R0.1 CCCCCCNO MCULE-4175875706 [2,0,0,0,0,0|1,0,0]=3 762 B7R0.1 CCCCCCNO MCULE-8719557426 [2,0,0,0,0,0|1,0,0]=3 763 B7R0.1 CCCCCCOC MCULE-7148964901 [2,0,0,0,0,0|1,0,0]=3 764 B7R0.1 CCCCCCON MCULE-1836746134 [2,0,0,0,0,0|2,0,0]=4 765 B7R0.1 CCCCCCON MCULE-9566158736 [2,0,0,0,0,0|2,0,0]=4 766 B7R0.1 CCCCCOCC MCULE-6346670527 [2,0,0,0,0,0|1,0,0]=3 767 B7R0.1 CCCCNCCC MCULE-6342731867 [2,0,0,0,0,0|1,0,0]=3 768 B7R0.1 CCCCNCCN MCULE-3865190511 [2,0,0,0,0,0|2,0,0]=4 769 B7R0.1 CCCCNCCO MCULE-3582031814 [2,0,0,0,0,0|1,0,0]=3 770 B7R0.1 CCCCNCCS MCULE-6926403617 [2,0,0,0,0,0|1,1,0]=4 771 B7R0.1 CCCCOCCBr MCULE-5314812532 [2,0,0,0,0,0|2,0,0]=4 772 B7R0.1 CCCCOCCCl MCULE-9147804479 [2,0,0,0,0,0|2,0,0]=4 773 B7R0.1 CCCCOCCI MCULE-3571589392 [2,0,0,0,0,0|2,0,0]=4 774 B7R0.1 CCCCOCCN MCULE-1817743996 [2,0,0,0,0,0|2,0,0]=4 775 B7R0.1 CCCCOCCN MCULE-3658840205 [2,0,0,0,0,0|2,0,0]=4 776 B7R0.1 CCCCOCCO MCULE-1727546427 [2,0,0,0,0,0|1,0,0]=3 777 B7R0.1 CCCCOCCO MCULE-4417721312 [2,0,0,0,0,0|1,0,0]=3 778 B7R0.1 CCCCOCCS MCULE-7419398753 [2,0,0,0,0,0|1,1,0]=4 779 B7R0.1 CCCCSCCC MCULE-3137952516 [2,0,0,0,0,0|1,0,0]=3 780 B7R0.1 CCCCSCCN MCULE-3521818954 [2,0,0,0,0,0|2,0,0]=4 781 B7R0.1 CCCCSCCN MCULE-5281011566 [2,0,0,0,0,0|2,0,0]=4 782 B7R0.1 CCCCSCCO MCULE-8791357083 [2,0,0,0,0,0|1,0,0]=3 783 B7R0.1 CCCCSCCS MCULE-4109311315 [2,0,0,0,0,0|1,1,0]=4 784 B7R0.1 CCCNCCCN MCULE-6668094176 [2,0,0,0,0,0|2,0,0]=4 785 B7R0.1 CCCNCCCO MCULE-4366982860 [2,0,0,0,0,0|1,0,0]=3 786 B7R0.1 CCCNCCNC MCULE-3857593384 [2,0,0,0,0,0|2,0,0]=4 787 B7R0.1 CCCNCCOC MCULE-4425567647 [2,0,0,0,0,0|2,0,0]=4 788 B7R0.1 CCCNNCCC MCULE-1099710970 [2,0,0,0,0,0|2,0,0]=4 789 B7R0.1 CCCNNCCC MCULE-3763521244 [2,0,0,0,0,0|2,0,0]=4 790 B7R0.1 CCCOCCCN MCULE-5875738973 [2,0,0,0,0,0|2,0,0]=4 791 B7R0.1 CCCSCCCN MCULE-2911445961 [2,0,0,0,0,0|2,0,0]=4 792 B7R0.1 CCCSSCCC MCULE-2667977107 [2,0,0,0,0,0|2,0,0]=4 793 B7R0.1 CCNCCCCO MCULE-4851249509 [2,0,0,0,0,0|1,0,0]=3 794 B7R0.1 CCNCCNCC MCULE-2663126630 [2,0,0,0,0,0|2,0,0]=4 795 B7R0.1 CCNCCNCC MCULE-8627955138 [2,0,0,0,0,0|2,0,0]=4 796 B7R0.1 CCNCCNCC MCULE-9858982602 [2,0,0,0,0,0|2,0,0]=4 797 B7R0.1 CCNCCOCC MCULE-8895991816 [2,0,0,0,0,0|2,0,0]=4 798 B7R0.1 CCOCCCCN MCULE-6583734908 [2,0,0,0,0,0|2,0,0]=4 799 B7R0.1 CCOCCCCO MCULE-9986213119 [2,0,0,0,0,0|1,0,0]=3 800 B7R0.1 CCOCCOCC MCULE-5593873009 [2,0,0,0,0,0|2,0,0]=4 801 B7R0.1 CCSCCCCN MCULE-7961306984 [2,0,0,0,0,0|2,0,0]=4 802 B7R0.1 CCSCCCCO MCULE-1712194349 [2,0,0,0,0,0|1,0,0]=3 803 B7R0.1 CCSCCSCC MCULE-2178899960 [2,0,0,0,0,0|2,0,0]=4 804 B7R0.1 CNCCCCCN MCULE-8023367999 [2,0,0,0,0,0|2,0,0]=4 805 B7R0.1 CNCCCCCO MCULE-2988249730 [2,0,0,0,0,0|1,0,0]=3 806 B7R0.1 CNCCCCCO MCULE-8033733525 [2,0,0,0,0,0|1,0,0]=3 807 B7R0.1 CNCCCCNC MCULE-4466243376 [2,0,0,0,0,0|2,0,0]=4 808 B7R0.1 CNCCCCOC MCULE-3203262011 [2,0,0,0,0,0|2,0,0]=4 809 B7R0.1 CNCCOCCO MCULE-7869540361 [2,0,0,0,0,0|2,0,0]=4 810 B7R0.1 COCCCCCBr MCULE-9843465236 [2,0,0,0,0,0|2,0,0]=4 811 B7R0.1 COCCCCCCl MCULE-6956815361 [2,0,0,0,0,0|2,0,0]=4 812 B7R0.1 COCCCCCN MCULE-2109050097 [2,0,0,0,0,0|2,0,0]=4 813 B7R0.1 COCCCCCO MCULE-6003118644 [2,0,0,0,0,0|1,0,0]=3 814 B7R0.1 COCCCCOC MCULE-3614881304 [2,0,0,0,0,0|2,0,0]=4 815 B7R0.1 COCCNCCO MCULE-3082225541 [2,0,0,0,0,0|2,0,0]=4 816 B7R0.1 COCCOCCO MCULE-4230242952 [2,0,0,0,0,0|2,0,0]=4 817 B7R0.1 COCCSCCO MCULE-5057235828 [2,0,0,0,0,0|2,0,0]=4 818 B7R0.1 CSCCCCCN MCULE-8771942873 [2,0,0,0,0,0|2,0,0]=4 819 B7R0.1 CSCCCCCO MCULE-3422729293 [2,0,0,0,0,0|1,0,0]=3 820 B7R0.1 ClCCCCCCBr MCULE-7471712605 [2,0,0,0,0,0|2,0,0]=4 821 B7R0.1 ClCCCCCCCl MCULE-2423183693 [2,0,0,0,0,0|2,0,0]=4 822 B7R0.1 ClCCCCCCI MCULE-2662361744 [2,0,0,0,0,0|2,0,0]=4 823 B7R0.1 FCCCCCCBr MCULE-9238324978 [2,0,0,0,0,0|2,0,0]=4 824 B7R0.1 ICCCCCCI MCULE-1005202656 [2,0,0,0,0,0|2,0,0]=4 825 B7R0.1 NCCCCCCBr MCULE-4017495581 [2,0,0,0,0,0|2,0,0]=4 826 B7R0.1 NCCCCCCBr MCULE-4048883510 [2,0,0,0,0,0|2,0,0]=4 827 B7R0.1 NCCCCCCN MCULE-1038764376 [2,0,0,0,0,0|2,0,0]=4 828 B7R0.1 NCCCCCCN MCULE-3766020930 [2,0,0,0,0,0|2,0,0]=4 829 B7R0.1 NCCCCCCN MCULE-9535729200 [2,0,0,0,0,0|2,0,0]=4 830 B7R0.1 NCCCCCCO MCULE-2264326846 [2,0,0,0,0,0|1,0,0]=3 831 B7R0.1 NCCCCCCS MCULE-3764839885 [2,0,0,0,0,0|1,1,0]=4 832 B7R0.1 NCCCCCCS MCULE-5822376723 [2,0,0,0,0,0|1,1,0]=4 833 B7R0.1 NCCCNCCO MCULE-1084481336 [2,0,0,0,0,0|2,0,0]=4 834 B7R0.1 NCCCOCCO MCULE-7244821044 [2,0,0,0,0,0|2,0,0]=4 835 B7R0.1 NCCNCCCO MCULE-6476789217 [2,0,0,0,0,0|2,0,0]=4 836 B7R0.1 NCCOCCCO MCULE-2435588099 [2,0,0,0,0,0|2,0,0]=4 837 B7R0.1 NCCOCCCO MCULE-9188421727 [2,0,0,0,0,0|2,0,0]=4 838 B7R0.1 NCCSCCCO MCULE-1578023056 [2,0,0,0,0,0|2,0,0]=4 839 B7R0.1 O=CCCCCCO MCULE-3978349845 [2,0,0,0,0,0|1,0,1]=4 840 B7R0.1 O=CCCCCCO MCULE-4997016680 [2,0,0,0,0,0|1,0,1]=4 841 B7R0.1 OCCCCCCBr MCULE-3500356936 [2,0,0,0,0,0|1,0,0]=3 842 B7R0.1 OCCCCCCCl MCULE-4507452440 [2,0,0,0,0,0|1,0,0]=3 843 B7R0.1 OCCCCCCF MCULE-7082491218 [2,0,0,0,0,0|1,0,0]=3 844 B7R0.1 OCCCCCCI MCULE-3710706648 [2,0,0,0,0,0|1,0,0]=3 845 B7R0.1 OCCCCCCO MCULE-8817570517 [2,0,0,0,0,0|1,0,0]=3 846 B7R0.1 OCCCCCCS MCULE-9135853131 [2,0,0,0,0,0|1,0,0]=3 847 B7R0.1 OCCCNCCO MCULE-1959450493 [2,0,0,0,0,0|2,0,0]=4 848 B7R0.1 OCCCOCCCl MCULE-9172390990 [2,0,0,0,0,0|2,0,0]=4 849 B7R0.1 OCCOCCCBr MCULE-3397483886 [2,0,0,0,0,0|2,0,0]=4 850 B7R0.1 SCCCCCCS MCULE-2873828857 [2,0,0,0,0,0|1,1,0]=4 851 B7R0.1 [NH3+]CCCCCC[NH3+] MCULE-2211304471 [2,0,0,0,0,0|2,0,0]=4 852 B7R0.3 C#CC(O)CCCC MCULE-8547184224 [2,0,0,0,0,0|1,0,1]=4 853 B7R0.3 C=CC(O)CCCC MCULE-1674668011 [2,0,0,0,0,0|1,0,1]=4 854 B7R0.3 C=CCC[C@@H](O)CO MCULE-6352864696 [2,0,0,0,0,0|0,0,2]=4 855 B7R0.3 CC(CO)CCCO MCULE-8589885622 [2,0,0,0,0,0|2,0,0]=4 856 B7R0.3 CCC(O)CCCN MCULE-1491163174 [2,0,0,0,0,0|2,0,0]=4 857 B7R0.3 CCC(O)CCCN MCULE-5150508895 [2,0,0,0,0,0|2,0,0]=4 858 B7R0.3 CCC(O)CCCO MCULE-1099760826 [2,0,0,0,0,0|2,0,0]=4 859 B7R0.3 CCC(O)CCOC MCULE-1245099360 [2,0,0,0,0,0|2,0,0]=4 860 B7R0.3 CCCCC(Br)CBr MCULE-9142273359 [2,0,0,0,0,0|2,0,0]=4 861 B7R0.3 CCCCC(Br)CC MCULE-3813549657 [2,0,0,0,0,0|2,0,0]=4 862 B7R0.3 CCCCC(C)CC MCULE-9471981954 [2,0,0,0,0,0|2,0,0]=4 863 B7R0.3 CCCCC(Cl)CCl MCULE-6681580076 [2,0,0,0,0,0|2,0,0]=4 864 B7R0.3 CCCCC(N)CC MCULE-1353863738 [2,0,0,0,0,0|2,0,0]=4 865 B7R0.3 CCCCC(N)CC MCULE-9870475040 [2,0,0,0,0,0|2,0,0]=4 866 B7R0.3 CCCCC(N)CN MCULE-2038464943 [2,0,0,0,0,0|2,0,0]=4 867 B7R0.3 CCCCC(N)CO MCULE-1874423109 [2,0,0,0,0,0|1,0,0]=3 868 B7R0.3 CCCCC(N)CO MCULE-2041767659 [2,0,0,0,0,0|1,0,0]=3 869 B7R0.3 CCCCC(N)CO MCULE-4533575851 [2,0,0,0,0,0|1,0,0]=3 870 B7R0.3 CCCCC(N)CO MCULE-7141990411 [2,0,0,0,0,0|1,0,0]=3 871 B7R0.3 CCCCC(O)CBr MCULE-8416535559 [2,0,0,0,0,0|1,0,0]=3 872 B7R0.3 CCCCC(O)CC MCULE-3912386534 [2,0,0,0,0,0|1,0,0]=3 873 B7R0.3 CCCCC(O)CN MCULE-1383380728 [2,0,0,0,0,0|1,0,0]=3 874 B7R0.3 CCCCC(O)CO MCULE-6903923961 [2,0,0,0,0,0|0,0,0]=2 875 B7R0.3 CCCC[C@@H](N)CO MCULE-1379297850 [2,0,0,0,0,0|1,0,0]=3 876 B7R0.3 CCCC[C@@H](N)CO MCULE-5016786633 [2,0,0,0,0,0|1,0,0]=3 877 B7R0.3 CCCC[C@@H](N)CO MCULE-6669873658 [2,0,0,0,0,0|1,0,0]=3 878 B7R0.3 CCCC[C@@H](N)CO MCULE-6809294141 [2,0,0,0,0,0|1,0,0]=3 879 B7R0.3 CCCC[C@H](N)CO MCULE-3277509271 [2,0,0,0,0,0|1,0,0]=3 880 B7R0.3 CCCC[C@H](N)CO MCULE-5867397890 [2,0,0,0,0,0|1,0,0]=3 881 B7R0.3 CCCNC(C)CO MCULE-6575712324 [2,0,0,0,0,0|2,0,0]=4 882 B7R0.3 CCNCC(O)CC MCULE-9820144398 [2,0,0,0,0,0|2,0,0]=4 883 B7R0.3 CCOCC(C)CO MCULE-6831759423 [2,0,0,0,0,0|2,0,0]=4 884 B7R0.3 CCOCC(N)CO MCULE-8546500751 [2,0,0,0,0,0|2,0,0]=4 885 B7R0.3 CCOCC(O)CCl MCULE-5119359541 [2,0,0,0,0,0|2,0,0]=4 886 B7R0.3 CCOCC(O)CN MCULE-2355759727 [2,0,0,0,0,0|2,0,0]=4 887 B7R0.3 CCOCC(O)CO MCULE-2728952355 [2,0,0,0,0,0|1,0,0]=3 888 B7R0.3 COCCC(N)CO MCULE-9758817920 [2,0,0,0,0,0|2,0,0]=4 889 B7R0.3 CSCCC(N)CO MCULE-1688371230 [2,0,0,0,0,0|2,0,0]=4 890 B7R0.3 CSCCC(O)CN MCULE-3835830442 [2,0,0,0,0,0|2,0,0]=4 891 B7R0.3 CSCC[C@@H](N)CO MCULE-2764794918 [2,0,0,0,0,0|2,0,0]=4 892 B7R0.3 CSCC[C@@H](N)CO MCULE-7120101109 [2,0,0,0,0,0|2,0,0]=4 893 B7R0.3 CSCC[C@H](N)CO MCULE-6014525130 [2,0,0,0,0,0|2,0,0]=4 894 B7R0.3 CSCC[C@H](N)CO MCULE-9216326176 [2,0,0,0,0,0|2,0,0]=4 895 B7R0.3 OCCCC(O)CO MCULE-3529953491 [2,0,0,0,0,0|1,0,0]=3 896 B7R0.4 C#CCCCC(C)O MCULE-7136902430 [2,0,0,0,0,0|0,0,2]=4 897 B7R0.4 C#CCCC[C@@H](C)O MCULE-3650631732 [2,0,0,0,0,0|0,0,2]=4 898 B7R0.4 C=C(C)CCCCC MCULE-6108413722 [2,0,0,0,0,0|1,0,1]=4 899 B7R0.4 C=CCCCC(C)O MCULE-6692920526 [2,0,0,0,0,0|0,0,2]=4 900 B7R0.4 CC(Br)CCCCO MCULE-2106751856 [2,0,0,0,0,0|2,0,0]=4 901 B7R0.4 CC(C)CCCCBr MCULE-9236389539 [2,0,0,0,0,0|2,0,0]=4 902 B7R0.4 CC(C)CCCCCl MCULE-5223516486 [2,0,0,0,0,0|2,0,0]=4 903 B7R0.4 CC(C)CCCCN MCULE-3591523204 [2,0,0,0,0,0|2,0,0]=4 904 B7R0.4 CC(C)CCCCO MCULE-9053698607 [2,0,0,0,0,0|2,0,0]=4 905 B7R0.4 CC(Cl)CCCCCl MCULE-4829013540 [2,0,0,0,0,0|2,0,0]=4 906 B7R0.4 CC(N)CCCCN MCULE-3497267062 [2,0,0,0,0,0|2,0,0]=4 907 B7R0.4 CC(N)CCCCN MCULE-9887360104 [2,0,0,0,0,0|2,0,0]=4 908 B7R0.4 CC(N)CCCCO MCULE-7039935081 [2,0,0,0,0,0|2,0,0]=4 909 B7R0.4 CC(N)CCCCO MCULE-8167834378 [2,0,0,0,0,0|2,0,0]=4 910 B7R0.4 CC(O)CCCCO MCULE-3790969400 [2,0,0,0,0,0|1,0,0]=3 911 B7R0.4 CC(O)CNCCN MCULE-3904214677 [2,0,0,0,0,0|2,0,0]=4 912 B7R0.4 CC(O)CNCCO MCULE-4873845500 [2,0,0,0,0,0|2,0,0]=4 913 B7R0.4 CC(O)CSCCO MCULE-8885458360 [2,0,0,0,0,0|2,0,0]=4 914 B7R0.4 CCC#CCC(C)O MCULE-4633396611 [2,0,0,0,0,0|0,0,2]=4 915 B7R0.4 CCCC#CC(C)O MCULE-4333844811 [2,0,0,0,0,0|0,0,2]=4 916 B7R0.4 CCCCCB(O)O MCULE-3441747739 [2,0,0,0,0,0|1,0,0]=3 917 B7R0.4 CCCCCC(=O)C MCULE-6017828463 [2,0,0,0,0,0|0,0,2]=4 918 B7R0.4 CCCCCC(=O)O MCULE-1671810139 [2,0,0,0,0,0|0,0,2]=4 919 B7R0.4 CCCCCC(C)Br MCULE-4688847972 [2,0,0,0,0,0|1,0,0]=3 920 B7R0.4 CCCCCC(C)C MCULE-9815158757 [2,0,0,0,0,0|1,0,0]=3 921 B7R0.4 CCCCCC(C)Cl MCULE-1461261404 [2,0,0,0,0,0|1,0,0]=3 922 B7R0.4 CCCCCC(C)N MCULE-1307982487 [2,0,0,0,0,0|1,0,0]=3 923 B7R0.4 CCCCCC(C)N MCULE-8625441795 [2,0,0,0,0,0|1,0,0]=3 924 B7R0.4 CCCCCC(C)N MCULE-9791654909 [2,0,0,0,0,0|1,0,0]=3 925 B7R0.4 CCCCCC(C)O MCULE-2463855771 [2,0,0,0,0,0|0,0,0]=2 926 B7R0.4 CCCCCC(C)S MCULE-3173115736 [2,0,0,0,0,0|0,1,0]=3 927 B7R0.4 CCCCC[C@@H](C)N MCULE-2460238945 [2,0,0,0,0,0|1,0,0]=3 928 B7R0.4 CCCCC[C@@H](C)N MCULE-6386771130 [2,0,0,0,0,0|1,0,0]=3 929 B7R0.4 CCCCC[C@@H](C)N MCULE-6470246577 [2,0,0,0,0,0|1,0,0]=3 930 B7R0.4 CCCCC[C@@H](C)O MCULE-1984852239 [2,0,0,0,0,0|0,0,0]=2 931 B7R0.4 CCCCC[C@@H](C)O MCULE-2769933740 [2,0,0,0,0,0|0,0,0]=2 932 B7R0.4 CCCCC[C@H](C)N MCULE-8119988811 [2,0,0,0,0,0|1,0,0]=3 933 B7R0.4 CCCCC[C@H](C)N MCULE-9987283826 [2,0,0,0,0,0|1,0,0]=3 934 B7R0.4 CCCCC[C@H](C)O MCULE-2305379902 [2,0,0,0,0,0|0,0,0]=2 935 B7R0.4 CCCCC[C@H](C)O MCULE-5898721044 [2,0,0,0,0,0|0,0,0]=2 936 B7R0.4 CCCCNC(C)C MCULE-2695970517 [2,0,0,0,0,0|2,0,0]=4 937 B7R0.4 CCCCNC(C)C MCULE-9973816117 [2,0,0,0,0,0|2,0,0]=4 938 B7R0.4 CCCCOC(C)C MCULE-1504269570 [2,0,0,0,0,0|2,0,0]=4 939 B7R0.4 CCCNCC(C)C MCULE-2869656642 [2,0,0,0,0,0|2,0,0]=4 940 B7R0.4 CCCNCC(C)O MCULE-8110237473 [2,0,0,0,0,0|1,0,0]=3 941 B7R0.4 CCCOCC(C)O MCULE-9214840563 [2,0,0,0,0,0|1,0,0]=3 942 B7R0.4 CCSCCC(C)N MCULE-6854502332 [2,0,0,0,0,0|2,0,0]=4 943 B7R0.4 CNCCCC(C)C MCULE-1784678333 [2,0,0,0,0,0|2,0,0]=4 944 B7R0.4 COCCCC(C)N MCULE-4298611846 [2,0,0,0,0,0|2,0,0]=4 945 B7R0.4 COCCCC(C)N MCULE-8139434838 [2,0,0,0,0,0|2,0,0]=4 946 B7R0.4 COCCCC(C)O MCULE-4190294636 [2,0,0,0,0,0|1,0,0]=3 947 B7R0.4 OB(O)CCCCBr MCULE-3231135677 [2,0,0,0,0,0|2,0,0]=4 948 B9R0.2 C=C(Br)CCCCCCC MCULE-7091252982 [1,1,0,0,0,0|1,0,1]=4 949 B9R0.2 C=C(C)CCCCCCC MCULE-6074571960 [1,1,0,0,0,0|1,0,1]=4 950 B9R0.2 C=C(C)CCCCCCCl MCULE-8555589200 [1,1,0,0,0,0|1,0,1]=4 951 B9R0.2 C=C(Cl)CCCCCCC MCULE-4513303196 [1,1,0,0,0,0|1,0,1]=4 952 B9R0.2 C=CCCCCCC(C)C MCULE-9645214202 [1,1,0,0,0,0|1,0,1]=4 953 B9R0.2 CC(=O)CCCCCCN MCULE-5842243037 [1,1,0,0,0,0|1,0,1]=4 954 B9R0.2 CC(=O)CCCCCCN MCULE-6017408205 [1,1,0,0,0,0|1,0,1]=4 955 B9R0.2 CC(C)CCCCCCBr MCULE-1608789467 [1,1,0,0,0,0|1,0,0]=3 956 B9R0.2 CC(C)CCCCCCN MCULE-5169278674 [1,1,0,0,0,0|1,0,0]=3 957 B9R0.2 CC(C)CCCCCCO MCULE-1311865208 [1,1,0,0,0,0|0,0,0]=2 958 B9R0.2 CC(C)CCOCCCN MCULE-8121420339 [1,1,0,0,0,0|2,0,0]=4 959 B9R0.2 CC(C)CSCCCCN MCULE-2450122241 [1,1,0,0,0,0|2,0,0]=4 960 B9R0.2 CC(C)NCCCCCN MCULE-1109263155 [1,1,0,0,0,0|2,0,0]=4 961 B9R0.2 CC(C)NCCCCCO MCULE-7223381486 [1,1,0,0,0,0|1,0,0]=3 962 B9R0.2 CC(C)NCCOCCO MCULE-1908249477 [1,1,0,0,0,0|2,0,0]=4 963 B9R0.2 CC(C)NCCOCCO MCULE-3095080776 [1,1,0,0,0,0|2,0,0]=4 964 B9R0.2 CCCCCCCB(O)O MCULE-2487835239 [1,1,0,0,0,0|1,0,0]=3 965 B9R0.2 CCCCCCCC(=N)N MCULE-8703701987 [1,1,0,0,0,0|1,0,1]=4 966 B9R0.2 CCCCCCCC(=O)C MCULE-9635928766 [1,1,0,0,0,0|0,0,2]=4 967 B9R0.2 CCCCCCCC(=O)Cl MCULE-9979489292 [1,1,0,0,0,0|0,0,2]=4 968 B9R0.2 CCCCCCCC(=O)N MCULE-8774193381 [1,1,0,0,0,0|0,0,2]=4 969 B9R0.2 CCCCCCCC(=O)O MCULE-5193957469 [1,1,0,0,0,0|0,0,1]=3 970 B9R0.2 CCCCCCCC(=O)[O-] MCULE-3608650495 [1,1,0,0,0,0|0,0,2]=4 971 B9R0.2 CCCCCCCC(=O)[O-] MCULE-8227046407 [1,1,0,0,0,0|0,0,2]=4 972 B9R0.2 CCCCCCCC(C)Br MCULE-1086603851 [1,1,0,0,0,0|1,0,0]=3 973 B9R0.2 CCCCCCCC(C)C MCULE-6606361985 [1,1,0,0,0,0|1,0,0]=3 974 B9R0.2 CCCCCCCC(C)N MCULE-7510062756 [1,1,0,0,0,0|1,0,0]=3 975 B9R0.2 CCCCCCCC(C)O MCULE-5218382339 [1,1,0,0,0,0|0,0,0]=2 976 B9R0.2 CCCCCCCN(=O)=O MCULE-3345030651 [1,1,0,0,0,0|1,0,1]=4 977 B9R0.2 CCCCCCCN(C)C MCULE-8135887454 [1,1,0,0,0,0|2,0,0]=4 978 B9R0.2 CCCCCCC[C@@H](C)N MCULE-4735169409 [1,1,0,0,0,0|1,0,0]=3 979 B9R0.2 CCCCCCC[C@H](C)O MCULE-6211597611 [1,1,0,0,0,0|0,0,0]=2 980 B9R0.2 CCCCCOCC(=O)O MCULE-8190672624 [1,1,0,0,0,0|1,0,1]=4 981 B9R0.2 CCCCOCCC(=O)O MCULE-3735085695 [1,1,0,0,0,0|1,0,1]=4 982 B9R0.2 CCCCSCCC(=O)O MCULE-7414288717 [1,1,0,0,0,0|1,0,1]=4 983 B9R0.2 CCCOCCCC(=O)O MCULE-8829980105 [1,1,0,0,0,0|1,0,1]=4 984 B9R0.2 CCCSCCCC(=O)O MCULE-9850452520 [1,1,0,0,0,0|1,0,1]=4 985 B9R0.2 CCNCCCCC(=O)O MCULE-1386195341 [1,1,0,0,0,0|1,0,1]=4 986 B9R0.2 CCNCCCCC(=O)O MCULE-1922836400 [1,1,0,0,0,0|1,0,1]=4 987 B9R0.2 CCOCCCCC(=O)O MCULE-8522289104 [1,1,0,0,0,0|1,0,1]=4 988 B9R0.2 CCOCCOCC(C)O MCULE-4621055001 [1,1,0,0,0,0|2,0,0]=4 989 B9R0.2 CN(C)CCCCCCN MCULE-6623815643 [1,1,0,0,0,0|2,0,0]=4 990 B9R0.2 CN(C)CCCCCCO MCULE-8600373924 [1,1,0,0,0,0|1,0,0]=3 991 B9R0.2 CNCCCCCC(=O)O MCULE-8016435275 [1,1,0,0,0,0|1,0,1]=4 992 B9R0.2 COCCCCCC(=O)O MCULE-1769987918 [1,1,0,0,0,0|1,0,1]=4 993 B9R0.2 CSCCCCCC(=O)O MCULE-9069370044 [1,1,0,0,0,0|1,0,1]=4 994 B9R0.2 C[NH2+]CCCCCC(=O)O MCULE-8971339830 [1,1,0,0,0,0|1,0,1]=4 995 B9R0.2 NC(=O)CCCCCCO MCULE-7432797193 [1,1,0,0,0,0|1,0,1]=4 996 B9R0.2 NCCCCCCC(=O)O MCULE-6089872609 [1,1,0,0,0,0|1,0,1]=4 997 B9R0.2 NCCCCCCC(=O)O MCULE-7769232328 [1,1,0,0,0,0|1,0,1]=4 998 B9R0.2 O=C(O)CCCCCCBr MCULE-3980379488 [1,1,0,0,0,0|1,0,1]=4 999 B9R0.2 O=C(O)CCCCCCF MCULE-7539264820 [1,1,0,0,0,0|1,0,1]=4 1000 B9R0.2 O=C(O)CCCCCCO MCULE-7270362706 [1,1,0,0,0,0|1,0,1]=4 1001 B9R0.2 O=C(O)CCCCCCS MCULE-5659986053 [1,1,0,0,0,0|1,0,1]=4 1002 B9R0.2 O=N(=O)CCCCCCO MCULE-4612254871 [1,1,0,0,0,0|2,0,0]=4 1003 B9R0.2 OB(O)CCCCCCBr MCULE-2961009060 [1,1,0,0,0,0|2,0,0]=4 1004 B9R0.5 C=CCC(C)CCCCC MCULE-2730037142 [1,1,0,0,0,0|1,0,1]=4 1005 B9R0.5 C=CCC(O)CCCCC MCULE-6811117459 [1,1,0,0,0,0|1,0,1]=4 1006 B9R0.5 CCCCCC(=O)CCC MCULE-5706146235 [1,1,0,0,0,0|1,0,1]=4 1007 B9R0.5 CCCCCC(C)CC=O MCULE-4528527314 [1,1,0,0,0,0|0,0,2]=4 1008 B9R0.5 CCCCCC(C)CCBr MCULE-7502279942 [1,1,0,0,0,0|1,0,0]=3 1009 B9R0.5 CCCCCC(C)CCC MCULE-5749911992 [1,1,0,0,0,0|1,0,0]=3 1010 B9R0.5 CCCCCC(C)CCO MCULE-6787638248 [1,1,0,0,0,0|0,0,0]=2 1011 B9R0.5 CCCCCC(O)CCC MCULE-8117002289 [1,1,0,0,0,0|1,0,0]=3 1012 B9R0.5 CCCCCC(O)CCO MCULE-7307683143 [1,1,0,0,0,0|0,0,0]=2 1013 B9R0.5 CCCCSC(C)CCN MCULE-2976322552 [1,1,0,0,0,0|2,0,0]=4 1014 B9R0.5 CCNC(=O)CCCCO MCULE-9325293372 [1,1,0,0,0,0|1,0,1]=4 1015 B9R0.5 CCOC(=O)CCCCO MCULE-3157415426 [1,1,0,0,0,0|1,0,1]=4 1016 B9R0.18 CCCCC(=O)CCCC MCULE-6886826396 [1,1,0,0,0,0|1,0,1]=4 1017 B9R0.18 CCCCC(C)CCCC MCULE-8127947187 [1,1,0,0,0,0|1,0,0]=3 1018 B9R0.18 CCCCC(N)CCCC MCULE-6345811578 [1,1,0,0,0,0|1,0,0]=3 1019 B9R0.18 CCCCC(O)CCCC MCULE-4443702940 [1,1,0,0,0,0|1,0,0]=3 1020 B9R0.18 CCCCC(O)CCCO MCULE-8337847504 [1,1,0,0,0,0|0,0,0]=2 1021 B9R0.18 CCCCN(C)CCCC MCULE-3403478694 [1,1,0,0,0,0|2,0,0]=4 1022 B9R0.18 CCCCN(C)CCCN MCULE-5569531246 [1,1,0,0,0,0|2,0,0]=4 1023 B9R0.18 CCCCP(=O)CCCC MCULE-5667541179 [1,1,0,0,0,0|2,0,0]=4 1024 B9R0.18 CCCCS(=O)CCCC MCULE-7738371145 [1,1,0,0,0,0|2,0,0]=4 1025 B9R0.18 CN(CCCO)CCCO MCULE-7584673151 [1,1,0,0,0,0|2,0,0]=4 1026 B9R0.45 BrCCCCCCCCBr MCULE-7960475988 [1,1,0,0,0,0|1,0,0]=3 1027 B9R0.45 C#CCCCCCCCC MCULE-3452683648 [1,1,0,0,0,0|1,0,0]=3 1028 B9R0.45 C#CCCCCCCCI MCULE-7418177661 [1,1,0,0,0,0|1,0,1]=4 1029 B9R0.45 C#CCCCCCCCO MCULE-8834112591 [1,1,0,0,0,0|0,0,1]=3 1030 B9R0.45 C(=C\CCCCCO)\CC MCULE-7910166129 [1,1,0,0,0,0|0,0,1]=3 1031 B9R0.45 C=CCCCCCCCBr MCULE-6324921683 [1,1,0,0,0,0|1,0,1]=4 1032 B9R0.45 C=CCCCCCCCC MCULE-1391753135 [1,1,0,0,0,0|1,0,0]=3 1033 B9R0.45 C=CCCCCCCCCl MCULE-3438052360 [1,1,0,0,0,0|1,0,1]=4 1034 B9R0.45 C=CCCCCCCCN MCULE-5068886534 [1,1,0,0,0,0|1,0,1]=4 1035 B9R0.45 C=CCCCCCCCN MCULE-7639889154 [1,1,0,0,0,0|1,0,1]=4 1036 B9R0.45 C=CCCCCCCCO MCULE-9611510472 [1,1,0,0,0,0|0,0,1]=3 1037 B9R0.45 C=CCCNCCCCO MCULE-4909275740 [1,1,0,0,0,0|0,0,2]=4 1038 B9R0.45 CC#CCCCCCCC MCULE-9888604196 [1,1,0,0,0,0|1,0,1]=4 1039 B9R0.45 CC=CCCCCCCC MCULE-6461098537 [1,1,0,0,0,0|1,0,1]=4 1040 B9R0.45 CCC#CCCCCCC MCULE-2394718279 [1,1,0,0,0,0|1,0,1]=4 1041 B9R0.45 CCC=CCCCCCO MCULE-1504274864 [1,1,0,0,0,0|0,0,1]=3 1042 B9R0.45 CCCC#CCCCCC MCULE-7200051907 [1,1,0,0,0,0|1,0,1]=4 1043 B9R0.45 CCCC/C=C/CCCC MCULE-5215613168 [1,1,0,0,0,0|1,0,1]=4 1044 B9R0.45 CCCC/C=C\CCCC MCULE-7961413462 [1,1,0,0,0,0|1,0,1]=4 1045 B9R0.45 CCCCC#CCCCC MCULE-8619108623 [1,1,0,0,0,0|1,0,1]=4 1046 B9R0.45 CCCCC#CCCCCl MCULE-2340213018 [1,1,0,0,0,0|1,0,1]=4 1047 B9R0.45 CCCCC#CCCCO MCULE-1298739911 [1,1,0,0,0,0|0,0,1]=3 1048 B9R0.45 CCCCC/C=C\CCO MCULE-4434068395 [1,1,0,0,0,0|0,0,1]=3 1049 B9R0.45 CCCCC=CCCCC MCULE-4261429100 [1,1,0,0,0,0|1,0,1]=4 1050 B9R0.45 CCCCCC#CCCO MCULE-7189083538 [1,1,0,0,0,0|0,0,1]=3 1051 B9R0.45 CCCCCC/C=C/CO MCULE-1969100525 [1,1,0,0,0,0|0,0,1]=3 1052 B9R0.45 CCCCCC/C=C\CO MCULE-4688229291 [1,1,0,0,0,0|0,0,1]=3 1053 B9R0.45 CCCCCC=CCCO MCULE-4969061256 [1,1,0,0,0,0|0,0,1]=3 1054 B9R0.45 CCCCCCC#CCO MCULE-7144291083 [1,1,0,0,0,0|0,0,1]=3 1055 B9R0.45 CCCCCCC=CCO MCULE-8666977236 [1,1,0,0,0,0|0,0,1]=3 1056 B9R0.45 CCCCCCCCC#N MCULE-9980153452 [1,1,0,0,0,0|1,0,0]=3 1057 B9R0.45 CCCCCCCCC=O MCULE-9888879952 [1,1,0,0,0,0|0,0,1]=3 1058 B9R0.45 CCCCCCCCCBr MCULE-1405697483 [1,1,0,0,0,0|1,0,0]=3 1059 B9R0.45 CCCCCCCCCC MCULE-6071426098 [1,1,0,0,0,0|1,0,0]=3 1060 B9R0.45 CCCCCCCCCCl MCULE-6711902685 [1,1,0,0,0,0|1,0,0]=3 1061 B9R0.45 CCCCCCCCCF MCULE-9584148452 [1,1,0,0,0,0|1,0,0]=3 1062 B9R0.45 CCCCCCCCCI MCULE-8717337450 [1,1,0,0,0,0|1,0,0]=3 1063 B9R0.45 CCCCCCCCCN MCULE-5395407299 [1,1,0,0,0,0|1,0,0]=3 1064 B9R0.45 CCCCCCCCCO MCULE-4020281400 [1,1,0,0,0,0|0,0,0]=2 1065 B9R0.45 CCCCCCCCCS MCULE-1070515106 [1,1,0,0,0,0|0,1,0]=3 1066 B9R0.45 CCCCCCCCNC MCULE-6996288442 [1,1,0,0,0,0|1,0,0]=3 1067 B9R0.45 CCCCCCCCOC MCULE-4646070035 [1,1,0,0,0,0|0,0,0]=2 1068 B9R0.45 CCCCCCCCSC MCULE-5517176664 [1,1,0,0,0,0|0,1,0]=3 1069 B9R0.45 CCCCCCCN=C=O MCULE-8681396809 [1,1,0,0,0,0|0,0,2]=4 1070 B9R0.45 CCCCCCCN=C=S MCULE-2877179378 [1,1,0,0,0,0|0,1,1]=4 1071 B9R0.45 CCCCCCCN=N#N MCULE-7837723655 [1,1,0,0,0,0|2,0,0]=4 1072 B9R0.45 CCCCCCCNC=O MCULE-7638122818 [1,1,0,0,0,0|0,0,2]=4 1073 B9R0.45 CCCCCCCNCC MCULE-3055645322 [1,1,0,0,0,0|1,0,0]=3 1074 B9R0.45 CCCCCCCOC=O MCULE-6396391540 [1,1,0,0,0,0|0,0,2]=4 1075 B9R0.45 CCCCCCNCCN MCULE-2521807905 [1,1,0,0,0,0|1,0,0]=3 1076 B9R0.45 CCCCCCNCCN MCULE-5886608711 [1,1,0,0,0,0|1,0,0]=3 1077 B9R0.45 CCCCCCNCCO MCULE-6828996225 [1,1,0,0,0,0|0,0,0]=2 1078 B9R0.45 CCCCCCNOCC MCULE-7230044709 [1,1,0,0,0,0|2,0,0]=4 1079 B9R0.45 CCCCCCNOCC MCULE-8309226243 [1,1,0,0,0,0|2,0,0]=4 1080 B9R0.45 CCCCCCOCCCl MCULE-5675234570 [1,1,0,0,0,0|1,0,0]=3 1081 B9R0.45 CCCCCCOCCO MCULE-1339769602 [1,1,0,0,0,0|0,0,0]=2 1082 B9R0.45 CCCCCCSCCO MCULE-3331753796 [1,1,0,0,0,0|0,0,0]=2 1083 B9R0.45 CCCCCNCCC#N MCULE-6878613771 [1,1,0,0,0,0|1,0,1]=4 1084 B9R0.45 CCCCCNCCCC MCULE-4324738465 [1,1,0,0,0,0|1,0,0]=3 1085 B9R0.45 CCCCCNCCNC MCULE-3521145032 [1,1,0,0,0,0|2,0,0]=4 1086 B9R0.45 CCCCCOCCC#N MCULE-7711243368 [1,1,0,0,0,0|1,0,1]=4 1087 B9R0.45 CCCCCOCCCO MCULE-3048029561 [1,1,0,0,0,0|0,0,0]=2 1088 B9R0.45 CCCCNCCCCO MCULE-1748671401 [1,1,0,0,0,0|0,0,0]=2 1089 B9R0.45 CCCCNCCOCC MCULE-5585133594 [1,1,0,0,0,0|2,0,0]=4 1090 B9R0.45 CCCCOCCCCO MCULE-1926189258 [1,1,0,0,0,0|0,0,0]=2 1091 B9R0.45 CCCCSCCOCC MCULE-4700764338 [1,1,0,0,0,0|2,0,0]=4 1092 B9R0.45 CCCCSSCCCC MCULE-5887157893 [1,1,0,0,0,0|2,0,0]=4 1093 B9R0.45 CCCC[NH2+]CCCCCl MCULE-2045714641 [1,1,0,0,0,0|1,0,0]=3 1094 B9R0.45 CCCC[NH2+]CCCCCl MCULE-2222567485 [1,1,0,0,0,0|1,0,0]=3 1095 B9R0.45 CCCNCCCNCC MCULE-1018165528 [1,1,0,0,0,0|2,0,0]=4 1096 B9R0.45 CCCNCCNCCC MCULE-7703644113 [1,1,0,0,0,0|2,0,0]=4 1097 B9R0.45 CCCNCCOCCO MCULE-9598749389 [1,1,0,0,0,0|1,0,0]=3 1098 B9R0.45 CCCOCCOCCCl MCULE-1639946093 [1,1,0,0,0,0|2,0,0]=4 1099 B9R0.45 CCCOCCOCCO MCULE-8416880348 [1,1,0,0,0,0|1,0,0]=3 1100 B9R0.45 CCNCCOCCOC MCULE-7366180249 [1,1,0,0,0,0|2,0,0]=4 1101 B9R0.45 CCOCCCCOCC MCULE-5008558328 [1,1,0,0,0,0|2,0,0]=4 1102 B9R0.45 CCOCCOCCOC MCULE-8877803293 [1,1,0,0,0,0|2,0,0]=4 1103 B9R0.45 CCSCCCCSCC MCULE-9432415547 [1,1,0,0,0,0|2,0,0]=4 1104 B9R0.45 CNCCCCCCNC MCULE-8440815147 [1,1,0,0,0,0|2,0,0]=4 1105 B9R0.45 CNCCCNCCCO MCULE-9778642064 [1,1,0,0,0,0|1,0,0]=3 1106 B9R0.45 CNCCCNCCOC MCULE-3649953785 [1,1,0,0,0,0|2,0,0]=4 1107 B9R0.45 CNCCOCCCOC MCULE-5420619528 [1,1,0,0,0,0|2,0,0]=4 1108 B9R0.45 COCCCCCCOC MCULE-8796987038 [1,1,0,0,0,0|1,0,0]=3 1109 B9R0.45 COCCCNCCCN MCULE-2970161939 [1,1,0,0,0,0|2,0,0]=4 1110 B9R0.45 COCCCNCCOC MCULE-6284699375 [1,1,0,0,0,0|2,0,0]=4 1111 B9R0.45 COCCCOCCCO MCULE-6516268580 [1,1,0,0,0,0|1,0,0]=3 1112 B9R0.45 COCCNCCCCO MCULE-8413188192 [1,1,0,0,0,0|1,0,0]=3 1113 B9R0.45 COCCOCCCCN MCULE-3477207788 [1,1,0,0,0,0|2,0,0]=4 1114 B9R0.45 ClCCCCCCCCCl MCULE-7522868799 [1,1,0,0,0,0|1,0,0]=3 1115 B9R0.45 ICCCCCCCCI MCULE-6544838106 [1,1,0,0,0,0|1,0,0]=3 1116 B9R0.45 N#CCCCCCCCBr MCULE-5175952413 [1,1,0,0,0,0|1,0,1]=4 1117 B9R0.45 N#N=NCCCCCCO MCULE-9510215214 [1,1,0,0,0,0|2,0,0]=4 1118 B9R0.45 NCCCCCCCCBr MCULE-6623783968 [1,1,0,0,0,0|1,0,0]=3 1119 B9R0.45 NCCCCCCCCBr MCULE-9911947498 [1,1,0,0,0,0|1,0,0]=3 1120 B9R0.45 NCCCCCCCCN MCULE-1106731228 [1,1,0,0,0,0|1,0,0]=3 1121 B9R0.45 NCCCCCCCCN MCULE-9889097856 [1,1,0,0,0,0|1,0,0]=3 1122 B9R0.45 NCCCCCCCCO MCULE-1230018398 [1,1,0,0,0,0|0,0,0]=2 1123 B9R0.45 NCCCCNCCCN MCULE-1390030323 [1,1,0,0,0,0|2,0,0]=4 1124 B9R0.45 NCCCCNCCCN MCULE-4146689208 [1,1,0,0,0,0|2,0,0]=4 1125 B9R0.45 NCCCCNCCCN MCULE-4688641416 [1,1,0,0,0,0|2,0,0]=4 1126 B9R0.45 NCCCCNCCCN MCULE-6635730810 [1,1,0,0,0,0|2,0,0]=4 1127 B9R0.45 NCCCCNCCCN MCULE-8096530192 [1,1,0,0,0,0|2,0,0]=4 1128 B9R0.45 NCCNCCCCCO MCULE-7178121419 [1,1,0,0,0,0|1,0,0]=3 1129 B9R0.45 NCCNCCCCCO MCULE-8348628451 [1,1,0,0,0,0|1,0,0]=3 1130 B9R0.45 NCCNCCNCCO MCULE-6914029155 [1,1,0,0,0,0|2,0,0]=4 1131 B9R0.45 NCCNCCOCCO MCULE-4097685062 [1,1,0,0,0,0|2,0,0]=4 1132 B9R0.45 NCCOCCOCCO MCULE-4276739250 [1,1,0,0,0,0|2,0,0]=4 1133 B9R0.45 OCCCCCCC#CI MCULE-2278070473 [1,1,0,0,0,0|0,0,2]=4 1134 B9R0.45 OCCCCCCCCBr MCULE-2005797184 [1,1,0,0,0,0|0,0,0]=2 1135 B9R0.45 OCCCCCCCCCl MCULE-8776830410 [1,1,0,0,0,0|0,0,0]=2 1136 B9R0.45 OCCCCCCCCI MCULE-7793639517 [1,1,0,0,0,0|0,0,0]=2 1137 B9R0.45 OCCCCCCCCO MCULE-7897417838 [1,1,0,0,0,0|0,0,0]=2 1138 B9R0.45 OCCCCCCCCS MCULE-8372814979 [1,1,0,0,0,0|0,0,0]=2 1139 B9R0.45 OCCCSSCCCO MCULE-9381854953 [1,1,0,0,0,0|2,0,0]=4 1140 B9R0.45 OCCNCCNCCO MCULE-1416647308 [1,1,0,0,0,0|2,0,0]=4 1141 B9R0.45 OCCNCCOCCO MCULE-6121228725 [1,1,0,0,0,0|2,0,0]=4 1142 B9R0.45 OCCOCCOCCBr MCULE-1007432891 [1,1,0,0,0,0|2,0,0]=4 1143 B9R0.45 OCCOCCOCCCl MCULE-5775604504 [1,1,0,0,0,0|2,0,0]=4 1144 B9R0.45 OCCOCCOCCF MCULE-9381073862 [1,1,0,0,0,0|2,0,0]=4 1145 B9R0.45 OCCOCCOCCO MCULE-2608815184 [1,1,0,0,0,0|2,0,0]=4 1146 B9R0.45 OCCOCCOCCO MCULE-7605038595 [1,1,0,0,0,0|2,0,0]=4 1147 B9R0.45 OCCOCCOCCS MCULE-9899646316 [1,1,0,0,0,0|2,0,0]=4 1148 B9R0.45 OCCSCCSCCO MCULE-4836365698 [1,1,0,0,0,0|2,0,0]=4 1149 B9R0.45 SCCCCCCCCS MCULE-5325130158 [1,1,0,0,0,0|0,1,0]=3 1150 B9R0.45 [NH2+](CCCC)CCCCC MCULE-5314318531 [1,1,0,0,0,0|1,0,0]=3 1151 B9R0.1 CC(C)CCCC(C)CO MCULE-8737374566 [1,1,0,0,0,0|1,0,0]=3 1152 B9R0.1 CC(C)COCC(O)CN MCULE-5255759665 [1,1,0,0,0,0|2,0,0]=4 1153 B9R0.1 CC(C)COCC(O)CO MCULE-6665926443 [1,1,0,0,0,0|1,0,0]=3 1154 B9R0.1 CCC(C)CCCC(C)C MCULE-1067814067 [1,1,0,0,0,0|2,0,0]=4 1155 B9R0.1 C[C@@H](N)COC[C@H](O)CCl MCULE-1215329842 [1,1,0,0,0,0|2,0,0]=4 1156 B9R0.1 C[C@@H](N)COC[C@H](O)CCl MCULE-1680848350 [1,1,0,0,0,0|2,0,0]=4 1157 B9R0.1 O=C(O)CCCC(O)CO MCULE-8338266320 [1,1,0,0,0,0|1,0,1]=4 1158 B9R0.8 CCCCC(C)C(C)CC MCULE-4441142939 [1,1,0,0,0,0|2,0,0]=4 1159 B9R0.8 CCCOC(=O)C(O)CO MCULE-8417972941 [1,1,0,0,0,0|1,0,1]=4 1160 B9R0.8 COCCC(O)C(O)CO MCULE-8755237951 [1,1,0,0,0,0|1,0,0]=3 1161 B9R0.8 COCC[C@H](O)[C@H](O)CO MCULE-6552589711 [1,1,0,0,0,0|1,0,0]=3 1162 B9R0.20 CCCCCC(C)(C)CC MCULE-1624392380 [1,1,0,0,0,0|2,0,0]=4 1163 B9R0.20 CCCCCC(C)(C)CN MCULE-5282463066 [1,1,0,0,0,0|2,0,0]=4 1164 B9R0.20 CCCCCC(C)(O)CC MCULE-1815029739 [1,1,0,0,0,0|1,0,0]=3 1165 B9R0.24 CCC(C)CCC(C)CO MCULE-2874782306 [1,1,0,0,0,0|1,0,0]=3 1166 B9R0.24 CCC(O)CCC(O)CC MCULE-1642680986 [1,1,0,0,0,0|1,0,0]=3 1167 B9R0.24 CC[C@@H](O)CC[C@H](O)CC MCULE-1865073881 [1,1,0,0,0,0|1,0,0]=3 1168 B9R0.24 CC[C@@H](O)CC[C@H](O)CC MCULE-3722023249 [1,1,0,0,0,0|1,0,0]=3 1169 B9R0.24 CC[C@H](O)CC[C@@H](O)CC MCULE-2960364022 [1,1,0,0,0,0|1,0,0]=3 1170 B9R0.24 CC[C@H](O)CC[C@@H](O)CC MCULE-6575186172 [1,1,0,0,0,0|1,0,0]=3 1171 B9R0.34 CCCC(C)CC(C)CC MCULE-6332739976 [1,1,0,0,0,0|2,0,0]=4 1172 B9R0.34 CCOC(=O)CC(O)CO MCULE-8896194093 [1,1,0,0,0,0|1,0,1]=4 1173 B9R0.47 CCCCCC(C)C(=O)O MCULE-3831811055 [1,1,0,0,0,0|1,0,1]=4 1174 B9R0.47 CCCCCC(C)C(C)C MCULE-2636833283 [1,1,0,0,0,0|2,0,0]=4 1175 B9R0.47 CCCCCC(Cl)C(C)Cl MCULE-3130271642 [1,1,0,0,0,0|2,0,0]=4 1176 B9R0.47 CCCCCC(N)C(=O)O MCULE-5558679374 [1,1,0,0,0,0|1,0,1]=4 1177 B9R0.47 CCCCCC(N)C(=O)O MCULE-8607576790 [1,1,0,0,0,0|1,0,1]=4 1178 B9R0.47 CCCCCC(O)C(=O)O MCULE-4151749430 [1,1,0,0,0,0|0,0,1]=3 1179 B9R0.47 CCCCCC(O)C(C)C MCULE-1365333754 [1,1,0,0,0,0|1,0,0]=3 1180 B9R0.47 CCCCC[C@@H](N)C(=O)O MCULE-3981603450 [1,1,0,0,0,0|1,0,1]=4 1181 B9R0.47 CCCCC[C@@H](N)C(=O)O MCULE-6090735433 [1,1,0,0,0,0|1,0,1]=4 1182 B9R0.47 CCCCC[C@H](N)C(=O)O MCULE-8108024359 [1,1,0,0,0,0|1,0,1]=4 1183 B9R0.47 CCCCC[C@H](N)C(=O)O MCULE-9961773652 [1,1,0,0,0,0|1,0,1]=4 1184 B9R0.50 CCCCCC(C=O)CC MCULE-2036961521 [1,1,0,0,0,0|1,0,1]=4 1185 B9R0.50 CCCCCC(CC)CC MCULE-6306174845 [1,1,0,0,0,0|2,0,0]=4 1186 B9R0.50 CCCCCC(CO)CO MCULE-5254181477 [1,1,0,0,0,0|0,0,0]=2 1187 B9R0.50 CCCCCC(OC)OC MCULE-8808414526 [1,1,0,0,0,0|2,0,0]=4 1188 B9R0.50 NCCCCC(CO)CO MCULE-9856529758 [1,1,0,0,0,0|1,0,0]=3 1189 B9R0.4 CC(C)CC(C)CCCO MCULE-8138707756 [1,1,0,0,0,0|2,0,0]=4 1190 B9R0.4 CCCCC(=O)CC(C)C MCULE-5810585247 [1,1,0,0,0,0|1,0,1]=4 1191 B9R0.4 CCCCC(C)CC(=O)O MCULE-1674327007 [1,1,0,0,0,0|0,0,2]=4 1192 B9R0.4 CCCCC(C)CC(C)C MCULE-5058808542 [1,1,0,0,0,0|1,0,0]=3 1193 B9R0.4 CCCCC(N)CC(=O)O MCULE-4002800812 [1,1,0,0,0,0|0,0,2]=4 1194 B9R0.4 CCCCC(N)CC(=O)O MCULE-8705314129 [1,1,0,0,0,0|0,0,2]=4 1195 B9R0.4 CCCCC(O)CC(=O)O MCULE-6348296633 [1,1,0,0,0,0|0,0,2]=4 1196 B9R0.4 CCCCN(C)CC(C)N MCULE-1104627387 [1,1,0,0,0,0|2,0,0]=4 1197 B9R0.4 CCCCN(C)C[C@@H](C)N MCULE-4305813032 [1,1,0,0,0,0|2,0,0]=4 1198 B9R0.4 CCCCN(C)C[C@H](C)N MCULE-9350523814 [1,1,0,0,0,0|2,0,0]=4 1199 B9R0.4 CCCC[C@@H](N)CC(=O)O MCULE-8271790861 [1,1,0,0,0,0|0,0,2]=4 1200 B9R0.4 CCCC[C@H](C)CC(=O)O MCULE-2048808547 [1,1,0,0,0,0|0,0,2]=4 1201 B9R0.4 CCCC[C@H](N)CC(=O)O MCULE-1387096023 [1,1,0,0,0,0|0,0,2]=4 1202 B9R0.4 CCNCC(N)CC(C)C MCULE-3601821382 [1,1,0,0,0,0|2,0,0]=4 1203 B9R0.4 CCOC[C@@H](N)CC(C)C MCULE-4064676814 [1,1,0,0,0,0|2,0,0]=4 1204 B9R0.4 CCOC[C@@H](N)CC(C)C MCULE-5876457429 [1,1,0,0,0,0|2,0,0]=4 1205 B9R0.4 CCOC[C@H](N)CC(C)C MCULE-9114519227 [1,1,0,0,0,0|2,0,0]=4 1206 B9R0.4 CCOC[C@H](N)CC(C)C MCULE-9320340955 [1,1,0,0,0,0|2,0,0]=4 1207 B9R0.38 CC(C)(C)CCCCCBr MCULE-4246334487 [1,1,0,0,0,0|2,0,0]=4 1208 B9R0.38 CCCCC#CC(C)(C)O MCULE-8861277836 [1,1,0,0,0,0|0,0,2]=4 1209 B9R0.38 CCCCCCC(C)(C)C MCULE-9273320974 [1,1,0,0,0,0|1,0,0]=3 1210 B9R0.38 CCCCCCC(C)(C)O MCULE-4930467845 [1,1,0,0,0,0|0,0,0]=2 1211 B9R0.38 CCCCCCC(C)(C)S MCULE-9664015973 [1,1,0,0,0,0|0,1,0]=3 1212 B9R0.38 CCCCCCP(=O)(O)O MCULE-9622755834 [1,1,0,0,0,0|1,0,0]=3 1213 B9R0.38 CCCCCCS(=O)(=O)O MCULE-4883139983 [1,1,0,0,0,0|1,0,1]=4 1214 B9R0.38 CCCCCC[N+](C)(C)C MCULE-1452936831 [1,1,0,0,0,0|2,0,0]=4 1215 B9R0.38 CCCCCC[N+](C)(C)C MCULE-9999169380 [1,1,0,0,0,0|2,0,0]=4 1216 B9R0.38 CCCCCC[N+](C)(C)[O-] MCULE-5890458220 [1,1,0,0,0,0|1,0,1]=4 1217 B9R0.38 CCCCCC[Si](C)(C)Cl MCULE-7452397650 [1,1,0,0,0,0|1,1,0]=4 1218 B9R0.38 CCCCCC[Si](C)(Cl)Cl MCULE-6065604351 [1,1,0,0,0,0|1,1,0]=4 1219 B9R0.38 CCCCNCP(=O)(C)O MCULE-4370254909 [1,1,0,0,0,0|2,0,0]=4 1220 B9R0.38 COCCNCC(C)(C)O MCULE-4080025556 [1,1,0,0,0,0|2,0,0]=4 1221 B9R0.38 COCCOCC(C)(C)O MCULE-1786665579 [1,1,0,0,0,0|2,0,0]=4 1222 B9R0.48 C=C(C)CCC(C)CCC MCULE-7509184096 [1,1,0,0,0,0|1,0,1]=4 1223 B9R0.48 CCCC(C)CCC(=O)C MCULE-1446034135 [1,1,0,0,0,0|0,0,2]=4 1224 B9R0.48 CCCC(C)CCC(=O)O MCULE-2307170636 [1,1,0,0,0,0|0,0,2]=4 1225 B9R0.48 CCCC(N)CCC(=O)O MCULE-2596842997 [1,1,0,0,0,0|0,0,2]=4 1226 B9R0.48 CCCC(N)CCC(=O)O MCULE-4723059719 [1,1,0,0,0,0|0,0,2]=4 1227 B9R0.48 COCC(C)OCC(C)O MCULE-1172706932 [1,1,0,0,0,0|2,0,0]=4 1228 B9R0.55 CC(=O)CCCCC(C)C MCULE-8847308651 [1,1,0,0,0,0|0,0,2]=4 1229 B9R0.55 CC(C)CCCCC(=O)O MCULE-9552597130 [1,1,0,0,0,0|0,0,2]=4 1230 B9R0.55 CC(C)CCCCC(C)C MCULE-2916402516 [1,1,0,0,0,0|1,0,0]=3 1231 B9R0.55 CC(N)CCCCC(=O)O MCULE-3306602652 [1,1,0,0,0,0|0,0,2]=4 1232 B9R0.55 CC(N)CCCCC(=O)O MCULE-3909320120 [1,1,0,0,0,0|0,0,2]=4 1233 B9R0.55 CC(N)CCCCC(C)N MCULE-6403395102 [1,1,0,0,0,0|1,0,0]=3 1234 B11R0.2 C=C(C)CC(C)CCCCCC MCULE-9270463569 [0,2,0,0,0,0|2,0,0]=4 1235 B11R0.2 CCCCCCC(=O)CC(=O)O MCULE-9513160139 [0,2,0,0,0,0|0,0,2]=4 1236 B11R0.2 CCCCCCC(C)CC(=O)O MCULE-4777686649 [0,2,0,0,0,0|1,0,0]=3 1237 B11R0.2 CCCCCCC(C)CC(C)C MCULE-7789928086 [0,2,0,0,0,0|2,0,0]=4 1238 B11R0.2 CCCCCCC(N)CC(=O)O MCULE-6987665804 [0,2,0,0,0,0|1,0,0]=3 1239 B11R0.2 CCCCCCC(N)CC(=O)O MCULE-8299240038 [0,2,0,0,0,0|1,0,0]=3 1240 B11R0.2 CCCCCCC(O)CC(=O)O MCULE-8278468713 [0,2,0,0,0,0|0,0,0]=2 1241 B11R0.2 CCCCCCN(C)CC(=O)O MCULE-5638671142 [0,2,0,0,0,0|2,0,0]=4 1242 B11R0.2 CCCCCCN(C)CC(=O)O MCULE-6664823722 [0,2,0,0,0,0|2,0,0]=4 1243 B11R0.4 C=CCC(C)CCCCCCC MCULE-9517976108 [0,2,0,0,0,0|2,0,0]=4 1244 B11R0.4 CCCCCCCC(O)CCC MCULE-3007528112 [0,2,0,0,0,0|1,0,0]=3 1245 B11R0.4 CCCCCCOC(=O)COC MCULE-6245511541 [0,2,0,0,0,0|0,0,2]=4 1246 B11R0.5 CCCCC(C)CC(C)CCC MCULE-3160157562 [0,2,0,0,0,0|2,0,0]=4 1247 B11R0.5 CCCCS(=O)CC(O)COC MCULE-8269765154 [0,2,0,0,0,0|1,0,0]=3 1248 B11R0.81 CCCCCCC(=O)NCCO MCULE-7382167098 [0,2,0,0,0,0|0,0,2]=4 1249 B11R0.81 CCCCCCC(C)OCCCl MCULE-5692239728 [0,2,0,0,0,0|2,0,0]=4 1250 B11R0.81 CCCCCCC(C)OCCO MCULE-2974953071 [0,2,0,0,0,0|1,0,0]=3 1251 B11R0.81 CCCCCCC(O)CCCC MCULE-1549907527 [0,2,0,0,0,0|1,0,0]=3 1252 B11R0.81 CCCCSCC(O)COCC MCULE-4785529266 [0,2,0,0,0,0|1,0,0]=3 1253 B11R0.142 CCCCCCC(Br)C(=O)OC MCULE-3994207813 [0,2,0,0,0,0|1,0,1]=4 1254 B11R0.142 CCCCCC[C@H](N)C(=O)OC MCULE-1398170037 [0,2,0,0,0,0|1,0,1]=4 1255 B11R0.142 CCCCCC[C@H](N)C(=O)OC MCULE-3295480977 [0,2,0,0,0,0|1,0,1]=4 1256 B11R0.142 CCCCCC[C@H](N)C(=O)OC MCULE-5212970889 [0,2,0,0,0,0|1,0,1]=4 1257 B11R0.142 CCCCCC[C@H](N)C(=O)OC MCULE-7851215638 [0,2,0,0,0,0|1,0,1]=4 1258 B11R0.161 CCCCCCC(CC)CCO MCULE-9832388189 [0,2,0,0,0,0|1,0,0]=3 1259 B11R0.161 CCCCCCC(CC)CNC MCULE-6886936656 [0,2,0,0,0,0|2,0,0]=4 1260 B11R0.161 CCCCCCC(CC)CNC MCULE-7093604644 [0,2,0,0,0,0|2,0,0]=4 1261 B11R0.176 O=C(O)CCCCC(O)CCO MCULE-6457534836 [0,2,0,0,0,0|1,0,1]=4 1262 B11R0.304 CCCCCCS(=O)(=O)CCO MCULE-7619929087 [0,2,0,0,0,0|1,0,1]=4 1263 B11R0.166 CCCCC(CC)CC(O)CC MCULE-3264294429 [0,2,0,0,0,0|1,0,0]=3 1264 B11R0.246 CCCCS(=O)(=O)CC(O)CCl MCULE-6867248436 [0,2,0,0,0,0|2,0,0]=4 1265 B11R0.76 CCCCCCC(CC)C(=O)O MCULE-6377253083 [0,2,0,0,0,0|1,0,0]=3 1266 B11R0.76 CCCCCCC(NC)C(=O)O MCULE-7287509088 [0,2,0,0,0,0|1,0,1]=4 1267 B11R0.124 CCCCCCCC(OC)OC MCULE-1543024371 [0,2,0,0,0,0|2,0,0]=4 1268 B11R0.106 CCC(N)CCCCC(N)CC MCULE-4962945540 [0,2,0,0,0,0|2,0,0]=4 1269 B11R0.114 OC[C@@H](O)CNCCC(F)(F)F MCULE-3247231535 [0,2,0,0,0,0|2,0,0]=4 1270 B11R0.49 C#CC(C)(O)CCCCCCC MCULE-9070681606 [0,2,0,0,0,0|1,0,1]=4 1271 B11R0.125 CCCCCCC(C)(N)C(=O)O MCULE-1741748079 [0,2,0,0,0,0|1,0,1]=4 1272 B11R0.40 C=CCCCCCCC(O)CN MCULE-2780524307 [0,2,0,0,0,0|1,0,0]=3 1273 B11R0.40 CCCCCCCCC(Br)CBr MCULE-7825522302 [0,2,0,0,0,0|2,0,0]=4 1274 B11R0.40 CCCCCCCCC(C)CO MCULE-6530142953 [0,2,0,0,0,0|1,0,0]=3 1275 B11R0.40 CCCCCCCCC(Cl)CCl MCULE-6741925726 [0,2,0,0,0,0|2,0,0]=4 1276 B11R0.40 CCCCCCCCC(N)CO MCULE-3838512887 [0,2,0,0,0,0|1,0,0]=3 1277 B11R0.40 CCCCCCCCC(O)CC MCULE-7447063642 [0,2,0,0,0,0|1,0,0]=3 1278 B11R0.40 CCCCCCCCC(O)CN MCULE-1386452336 [0,2,0,0,0,0|1,0,0]=3 1279 B11R0.40 CCCCCCCCC(O)CO MCULE-4401791520 [0,2,0,0,0,0|0,0,0]=2 1280 B11R0.40 CCCCCCCCC([NH3+])CO MCULE-9745638839 [0,2,0,0,0,0|1,0,0]=3 1281 B11R0.40 CCCCCCCC[C@@H](O)CO MCULE-3097644735 [0,2,0,0,0,0|0,0,0]=2 1282 B11R0.40 CCCCCCCC[C@@H](O)CO MCULE-9306542938 [0,2,0,0,0,0|0,0,0]=2 1283 B11R0.40 CCCCCCOCC(O)CCl MCULE-9400857337 [0,2,0,0,0,0|1,0,0]=3 1284 B11R0.40 CCCCCCOCC(O)CO MCULE-6836288154 [0,2,0,0,0,0|0,0,0]=2 1285 B11R0.40 OC(CCl)COCCOCCCl MCULE-8697226098 [0,2,0,0,0,0|2,0,0]=4 1286 B11R0.40 OCCCCCCCC(O)CO MCULE-9195681013 [0,2,0,0,0,0|0,0,0]=2 1287 B11R0.42 CCCCCCCC(C)C(=O)O MCULE-1400601550 [0,2,0,0,0,0|1,0,1]=4 1288 B11R0.42 CCCCCCCC(C)C(C)C MCULE-1381751569 [0,2,0,0,0,0|2,0,0]=4 1289 B11R0.42 CCCCCCCC(N)C(=O)O MCULE-4518631723 [0,2,0,0,0,0|1,0,1]=4 1290 B11R0.42 CCCCCCC[C@@H](N)C(=O)O MCULE-7367412741 [0,2,0,0,0,0|1,0,1]=4 1291 B11R0.42 CCCCCCC[C@H](N)C(=O)O MCULE-4025079053 [0,2,0,0,0,0|1,0,1]=4 1292 B11R0.42 CCCCCCC[C@H](N)C(=O)O MCULE-4061410149 [0,2,0,0,0,0|1,0,1]=4 1293 B11R0.42 CCCCCCNC(C)C(C)C MCULE-1364336844 [0,2,0,0,0,0|2,0,0]=4 1294 B11R0.42 CCCCCCNC(C)C(C)C MCULE-7249426571 [0,2,0,0,0,0|2,0,0]=4 1295 B11R0.42 CCCCCCOC(C)C(=O)O MCULE-5771954047 [0,2,0,0,0,0|1,0,1]=4 1296 B11R0.42 CCCCSCCC(N)C(=O)O MCULE-9943276345 [0,2,0,0,0,0|1,0,1]=4 1297 B11R0.42 CCCCSCC[C@@H](N)C(=O)O MCULE-5947369888 [0,2,0,0,0,0|1,0,1]=4 1298 B11R0.42 CCCCSCC[C@H](N)C(=O)O MCULE-6636715475 [0,2,0,0,0,0|1,0,1]=4 1299 B11R0.111 O=C(O)CCCSCC(O)CO MCULE-6771933903 [0,2,0,0,0,0|1,0,1]=4 1300 B11R0.139 CCCCCC(O)C(O)C(=O)O MCULE-3131050684 [0,2,0,0,0,0|0,0,1]=3 1301 B11R0.151 CCCCCCC(O)C(F)(F)F MCULE-3938709315 [0,2,0,0,0,0|1,0,0]=3 1302 B11R0.151 CCCCCC[C@H](O)C(F)(F)F MCULE-4552828365 [0,2,0,0,0,0|1,0,0]=3 1303 B11R0.151 CCCCCC[C@H](O)C(F)(F)F MCULE-7484067673 [0,2,0,0,0,0|1,0,0]=3 1304 B9R1.5 BrC1CCCCCC1Br MCULE-2183687656 [1,0,0,1,0,0|2,0,0]=4 1305 B9R1.5 CC1CCCCCC1=O MCULE-3737709008 [1,0,0,1,0,0|0,0,2]=4 1306 B9R1.5 CC1CCCCCC1N MCULE-5854491023 [1,0,0,1,0,0|1,0,0]=3 1307 B9R1.5 CC1CCCNCC1C MCULE-3413141564 [1,0,0,1,0,0|2,0,0]=4 1308 B9R1.5 CC1CCCNCC1C MCULE-6316766408 [1,0,0,1,0,0|2,0,0]=4 1309 B9R1.5 CC1CCNCCC1O MCULE-2014482309 [1,0,0,1,0,0|1,0,0]=3 1310 B9R1.5 CC1CCNCCC1O MCULE-7020970444 [1,0,0,1,0,0|1,0,0]=3 1311 B9R1.5 CC1CNCCCC1O MCULE-7042298511 [1,0,0,1,0,0|1,0,0]=3 1312 B9R1.5 CC1CNCCCC1O MCULE-8658161534 [1,0,0,1,0,0|1,0,0]=3 1313 B9R1.5 NC1CCCCCC1O MCULE-8315023618 [1,0,0,1,0,0|1,0,0]=3 1314 B9R1.5 N[C@@H]1CCCCC[C@@H]1O MCULE-2063759577 [1,0,0,1,0,0|1,0,0]=3 1315 B9R1.5 N[C@@H]1CCCCC[C@@H]1O MCULE-8213087274 [1,0,0,1,0,0|1,0,0]=3 1316 B9R1.5 N[C@@H]1CCCCC[C@H]1O MCULE-5613622981 [1,0,0,1,0,0|1,0,0]=3 1317 B9R1.5 N[C@H]1CCCCC[C@@H]1O MCULE-6991711117 [1,0,0,1,0,0|1,0,0]=3 1318 B9R1.5 N[C@H]1CCCCC[C@H]1N MCULE-4838437415 [1,0,0,1,0,0|2,0,0]=4 1319 B9R1.5 N[C@H]1CCCCC[C@H]1N MCULE-9986210496 [1,0,0,1,0,0|2,0,0]=4 1320 B9R1.5 N[C@H]1CCCCC[C@H]1O MCULE-2920839467 [1,0,0,1,0,0|1,0,0]=3 1321 B9R1.5 N[C@H]1CCCCC[C@H]1O MCULE-2969566133 [1,0,0,1,0,0|1,0,0]=3 1322 B9R1.5 O=C1CCCCCC1O MCULE-1763055677 [1,0,0,1,0,0|1,0,1]=4 1323 B9R1.5 OC1CCCCCC1O MCULE-7682077273 [1,0,0,1,0,0|1,0,0]=3 1324 B9R1.5 OC1CCNCCC1F MCULE-6523954631 [1,0,0,1,0,0|2,0,0]=4 1325 B9R1.5 OC1CCNCCC1F MCULE-9888134998 [1,0,0,1,0,0|2,0,0]=4 1326 B9R1.5 OC1CNCCCC1F MCULE-3253307740 [1,0,0,1,0,0|2,0,0]=4 1327 B9R1.5 OC1CNCCCC1F MCULE-9432299615 [1,0,0,1,0,0|2,0,0]=4 1328 B9R1.5 O[C@H]1CCCCC[C@@H]1O MCULE-9651607332 [1,0,0,1,0,0|1,0,0]=3 1329 B9R1.8 BrCCC1CCCCC1 MCULE-9299250705 [1,0,0,1,0,0|1,0,0]=3 1330 B9R1.8 BrCCC1CCCCN1 MCULE-1500097659 [1,0,0,1,0,0|2,0,0]=4 1331 B9R1.8 BrCCC1CCCCN1 MCULE-3711942593 [1,0,0,1,0,0|2,0,0]=4 1332 B9R1.8 BrCCC1CCCCN1 MCULE-7767580351 [1,0,0,1,0,0|2,0,0]=4 1333 B9R1.8 BrCCC1CCCCO1 MCULE-4230649212 [1,0,0,1,0,0|1,0,0]=3 1334 B9R1.8 BrCCC1CCCNC1 MCULE-2519817553 [1,0,0,1,0,0|2,0,0]=4 1335 B9R1.8 BrCCC1CCCNC1 MCULE-7320613897 [1,0,0,1,0,0|2,0,0]=4 1336 B9R1.8 BrCCC1CCCOC1 MCULE-5741308473 [1,0,0,1,0,0|2,0,0]=4 1337 B9R1.8 BrCCC1CCNCC1 MCULE-1655352389 [1,0,0,1,0,0|2,0,0]=4 1338 B9R1.8 BrCCC1CCNCC1 MCULE-9621591471 [1,0,0,1,0,0|2,0,0]=4 1339 B9R1.8 BrCCC1CCOCC1 MCULE-4291105264 [1,0,0,1,0,0|2,0,0]=4 1340 B9R1.8 BrCCC1COCCO1 MCULE-6995566395 [1,0,0,1,0,0|2,0,0]=4 1341 B9R1.8 BrCCC1OCCCO1 MCULE-1909621175 [1,0,0,1,0,0|2,0,0]=4 1342 B9R1.8 BrCCN1CCCCC1 MCULE-1576488740 [1,0,0,1,0,0|2,0,0]=4 1343 B9R1.8 BrCCN1CCCCC1 MCULE-5686542858 [1,0,0,1,0,0|2,0,0]=4 1344 B9R1.8 BrCCN1CCCCO1 MCULE-1223411183 [1,0,0,1,0,0|2,0,0]=4 1345 B9R1.8 C#CCC1CCCCC1 MCULE-5692828942 [1,0,0,1,0,0|1,0,1]=4 1346 B9R1.8 C=CCC1CCCCC1 MCULE-6299666608 [1,0,0,1,0,0|1,0,1]=4 1347 B9R1.8 CCCC1CCCCC1 MCULE-7477053795 [1,0,0,1,0,0|1,0,0]=3 1348 B9R1.8 CCCC1CCCCN1 MCULE-1476155918 [1,0,0,1,0,0|1,0,0]=3 1349 B9R1.8 CCCC1CCCCN1 MCULE-1672724119 [1,0,0,1,0,0|1,0,0]=3 1350 B9R1.8 CCCC1CCCCN1 MCULE-5635587568 [1,0,0,1,0,0|1,0,0]=3 1351 B9R1.8 CCCC1CCCCN1 MCULE-7901233025 [1,0,0,1,0,0|1,0,0]=3 1352 B9R1.8 CCCC1CCCCN1 MCULE-8248346628 [1,0,0,1,0,0|1,0,0]=3 1353 B9R1.8 CCCC1CCCNC1 MCULE-4630550411 [1,0,0,1,0,0|2,0,0]=4 1354 B9R1.8 CCCC1CCCNC1 MCULE-6458267050 [1,0,0,1,0,0|2,0,0]=4 1355 B9R1.8 CCCC1CCNCC1 MCULE-2518589445 [1,0,0,1,0,0|2,0,0]=4 1356 B9R1.8 CCCC1CCNCC1 MCULE-4448725528 [1,0,0,1,0,0|2,0,0]=4 1357 B9R1.8 CCCC1CNCCN1 MCULE-7073466124 [1,0,0,1,0,0|2,0,0]=4 1358 B9R1.8 CCCC1CNCCO1 MCULE-9447741986 [1,0,0,1,0,0|1,0,0]=3 1359 B9R1.8 CCCC1COCCN1 MCULE-4391950653 [1,0,0,1,0,0|2,0,0]=4 1360 B9R1.8 CCCC1OCCCO1 MCULE-8359246042 [1,0,0,1,0,0|1,0,0]=3 1361 B9R1.8 CCCN1CCCCC1 MCULE-1219970936 [1,0,0,1,0,0|2,0,0]=4 1362 B9R1.8 CCCN1CCCCC1 MCULE-1933753818 [1,0,0,1,0,0|2,0,0]=4 1363 B9R1.8 CCC[C@@H]1CCCCN1 MCULE-6770891257 [1,0,0,1,0,0|1,0,0]=3 1364 B9R1.8 CCC[C@@H]1CCCCN1 MCULE-7954142000 [1,0,0,1,0,0|1,0,0]=3 1365 B9R1.8 CCC[C@H]1CCCCN1 MCULE-2517558052 [1,0,0,1,0,0|1,0,0]=3 1366 B9R1.8 CCC[C@H]1CCCCN1 MCULE-8255238091 [1,0,0,1,0,0|1,0,0]=3 1367 B9R1.8 CCC[C@H]1CCCCN1 MCULE-8429691236 [1,0,0,1,0,0|1,0,0]=3 1368 B9R1.8 CCC[C@H]1CCCCN1 MCULE-9434683135 [1,0,0,1,0,0|1,0,0]=3 1369 B9R1.8 CCNC1CCCCC1 MCULE-1079828121 [1,0,0,1,0,0|2,0,0]=4 1370 B9R1.8 CCNC1CCCCC1 MCULE-5943281030 [1,0,0,1,0,0|2,0,0]=4 1371 B9R1.8 CCOC1CNCCO1 MCULE-5598394113 [1,0,0,1,0,0|2,0,0]=4 1372 B9R1.8 CNCC1CCCCC1 MCULE-3140944607 [1,0,0,1,0,0|2,0,0]=4 1373 B9R1.8 CNCC1CCCCC1 MCULE-3915957758 [1,0,0,1,0,0|2,0,0]=4 1374 B9R1.8 CNCC1CCCCO1 MCULE-2559251364 [1,0,0,1,0,0|1,0,0]=3 1375 B9R1.8 CNCC1CCCCO1 MCULE-2931965460 [1,0,0,1,0,0|1,0,0]=3 1376 B9R1.8 CNCC1CNCCO1 MCULE-2314810849 [1,0,0,1,0,0|2,0,0]=4 1377 B9R1.8 CNCC1CNCCO1 MCULE-6083185869 [1,0,0,1,0,0|2,0,0]=4 1378 B9R1.8 CNCC1COCCO1 MCULE-3663472494 [1,0,0,1,0,0|2,0,0]=4 1379 B9R1.8 CNCC1COCCO1 MCULE-4042719770 [1,0,0,1,0,0|2,0,0]=4 1380 B9R1.8 CNCC1COCCO1 MCULE-4373994709 [1,0,0,1,0,0|2,0,0]=4 1381 B9R1.8 CNC[C@@H]1CCCCN1 MCULE-4321064733 [1,0,0,1,0,0|2,0,0]=4 1382 B9R1.8 CNC[C@@H]1CCCCN1 MCULE-9313891572 [1,0,0,1,0,0|2,0,0]=4 1383 B9R1.8 CNC[C@@H]1COCCO1 MCULE-1631348179 [1,0,0,1,0,0|2,0,0]=4 1384 B9R1.8 CNC[C@@H]1COCCO1 MCULE-2978269905 [1,0,0,1,0,0|2,0,0]=4 1385 B9R1.8 CNC[C@@H]1COCCO1 MCULE-3723240434 [1,0,0,1,0,0|2,0,0]=4 1386 B9R1.8 CNC[C@@H]1COCCO1 MCULE-5028881677 [1,0,0,1,0,0|2,0,0]=4 1387 B9R1.8 CNC[C@H]1CCCCN1 MCULE-1546664766 [1,0,0,1,0,0|2,0,0]=4 1388 B9R1.8 CNC[C@H]1CCCCN1 MCULE-7467254233 [1,0,0,1,0,0|2,0,0]=4 1389 B9R1.8 CNC[C@H]1COCCO1 MCULE-2451760661 [1,0,0,1,0,0|2,0,0]=4 1390 B9R1.8 CNC[C@H]1COCCO1 MCULE-5593195285 [1,0,0,1,0,0|2,0,0]=4 1391 B9R1.8 CNC[C@H]1COCCO1 MCULE-6619773603 [1,0,0,1,0,0|2,0,0]=4 1392 B9R1.8 CNC[C@H]1COCCO1 MCULE-7870966324 [1,0,0,1,0,0|2,0,0]=4 1393 B9R1.8 COCC1CCCCN1 MCULE-1947273818 [1,0,0,1,0,0|2,0,0]=4 1394 B9R1.8 COCC1CCCCN1 MCULE-5179816472 [1,0,0,1,0,0|2,0,0]=4 1395 B9R1.8 COCC1CNCCO1 MCULE-4284650075 [1,0,0,1,0,0|2,0,0]=4 1396 B9R1.8 COCC1CNCCO1 MCULE-4306480276 [1,0,0,1,0,0|2,0,0]=4 1397 B9R1.8 COCC1CNCCO1 MCULE-9238704936 [1,0,0,1,0,0|2,0,0]=4 1398 B9R1.8 COCC1CNCCO1 MCULE-9910887537 [1,0,0,1,0,0|2,0,0]=4 1399 B9R1.8 COC[C@@H]1CCCCN1 MCULE-2798950485 [1,0,0,1,0,0|2,0,0]=4 1400 B9R1.8 COC[C@@H]1CCCCN1 MCULE-8642793821 [1,0,0,1,0,0|2,0,0]=4 1401 B9R1.8 COC[C@@H]1CNCCO1 MCULE-1759320762 [1,0,0,1,0,0|2,0,0]=4 1402 B9R1.8 COC[C@@H]1CNCCO1 MCULE-3365011086 [1,0,0,1,0,0|2,0,0]=4 1403 B9R1.8 COC[C@@H]1CNCCO1 MCULE-6900505382 [1,0,0,1,0,0|2,0,0]=4 1404 B9R1.8 COC[C@@H]1CNCCO1 MCULE-8734322374 [1,0,0,1,0,0|2,0,0]=4 1405 B9R1.8 COC[C@H]1CCCCN1 MCULE-3580108507 [1,0,0,1,0,0|2,0,0]=4 1406 B9R1.8 COC[C@H]1CCCCN1 MCULE-4232708572 [1,0,0,1,0,0|2,0,0]=4 1407 B9R1.8 COC[C@H]1CNCCO1 MCULE-1644022700 [1,0,0,1,0,0|2,0,0]=4 1408 B9R1.8 COC[C@H]1CNCCO1 MCULE-4433196291 [1,0,0,1,0,0|2,0,0]=4 1409 B9R1.8 COC[C@H]1CNCCO1 MCULE-5949615002 [1,0,0,1,0,0|2,0,0]=4 1410 B9R1.8 COC[C@H]1CNCCO1 MCULE-6997620929 [1,0,0,1,0,0|2,0,0]=4 1411 B9R1.8 CSCC1CCCCN1 MCULE-2012373064 [1,0,0,1,0,0|2,0,0]=4 1412 B9R1.8 CSCC1CCCCN1 MCULE-9083698079 [1,0,0,1,0,0|2,0,0]=4 1413 B9R1.8 ClCCC1CCCCC1 MCULE-9726073749 [1,0,0,1,0,0|1,0,0]=3 1414 B9R1.8 ClCCC1CCCCN1 MCULE-3550163742 [1,0,0,1,0,0|2,0,0]=4 1415 B9R1.8 ClCCC1CCCCN1 MCULE-4587156712 [1,0,0,1,0,0|2,0,0]=4 1416 B9R1.8 ClCCC1CCNCC1 MCULE-2950265514 [1,0,0,1,0,0|2,0,0]=4 1417 B9R1.8 ClCCC1CCNCC1 MCULE-6272821075 [1,0,0,1,0,0|2,0,0]=4 1418 B9R1.8 ClCCC1CCOCC1 MCULE-3173642012 [1,0,0,1,0,0|2,0,0]=4 1419 B9R1.8 ClCCN1CCCCC1 MCULE-1776788397 [1,0,0,1,0,0|2,0,0]=4 1420 B9R1.8 ClCCN1CCCCC1 MCULE-6642251535 [1,0,0,1,0,0|2,0,0]=4 1421 B9R1.8 ClCOC1CCCCC1 MCULE-2178125784 [1,0,0,1,0,0|2,0,0]=4 1422 B9R1.8 FCCC1CCCNC1 MCULE-2308514802 [1,0,0,1,0,0|2,0,0]=4 1423 B9R1.8 FCCC1CCCNC1 MCULE-7436132702 [1,0,0,1,0,0|2,0,0]=4 1424 B9R1.8 FCCC1CCNCC1 MCULE-4179412048 [1,0,0,1,0,0|2,0,0]=4 1425 B9R1.8 FCCC1CCNCC1 MCULE-6736060314 [1,0,0,1,0,0|2,0,0]=4 1426 B9R1.8 FCCC1CNCCO1 MCULE-5391892512 [1,0,0,1,0,0|2,0,0]=4 1427 B9R1.8 ICCC1CCCCC1 MCULE-8795138408 [1,0,0,1,0,0|1,0,0]=3 1428 B9R1.8 ICCC1CCOCC1 MCULE-5007120840 [1,0,0,1,0,0|2,0,0]=4 1429 B9R1.8 N#CCC1CCCCC1 MCULE-1749955817 [1,0,0,1,0,0|1,0,1]=4 1430 B9R1.8 N#CCC1CCCCO1 MCULE-6904630467 [1,0,0,1,0,0|1,0,1]=4 1431 B9R1.8 NCCC1CCCCC1 MCULE-3912289573 [1,0,0,1,0,0|1,0,0]=3 1432 B9R1.8 NCCC1CCCCC1 MCULE-8270155473 [1,0,0,1,0,0|1,0,0]=3 1433 B9R1.8 NCCC1CCCCN1 MCULE-3796829641 [1,0,0,1,0,0|2,0,0]=4 1434 B9R1.8 NCCC1CCCCN1 MCULE-8953940837 [1,0,0,1,0,0|2,0,0]=4 1435 B9R1.8 NCCC1CCCCO1 MCULE-3942491369 [1,0,0,1,0,0|1,0,0]=3 1436 B9R1.8 NCCC1CCCCO1 MCULE-8718659242 [1,0,0,1,0,0|1,0,0]=3 1437 B9R1.8 NCCC1CCCNC1 MCULE-2317830825 [1,0,0,1,0,0|2,0,0]=4 1438 B9R1.8 NCCC1CCCNC1 MCULE-7843131930 [1,0,0,1,0,0|2,0,0]=4 1439 B9R1.8 NCCC1CCCOC1 MCULE-6749080914 [1,0,0,1,0,0|2,0,0]=4 1440 B9R1.8 NCCC1CCNCC1 MCULE-3063629016 [1,0,0,1,0,0|2,0,0]=4 1441 B9R1.8 NCCC1CCNCC1 MCULE-9932609620 [1,0,0,1,0,0|2,0,0]=4 1442 B9R1.8 NCCC1CCOCC1 MCULE-3307341350 [1,0,0,1,0,0|2,0,0]=4 1443 B9R1.8 NCCC1CCOCC1 MCULE-4280882062 [1,0,0,1,0,0|2,0,0]=4 1444 B9R1.8 NCCC1CCSCC1 MCULE-8541499738 [1,0,0,1,0,0|2,0,0]=4 1445 B9R1.8 NCCC1CNCCO1 MCULE-5314215349 [1,0,0,1,0,0|2,0,0]=4 1446 B9R1.8 NCCC1COCCO1 MCULE-7148437042 [1,0,0,1,0,0|2,0,0]=4 1447 B9R1.8 NCCC1OCCCO1 MCULE-2186855737 [1,0,0,1,0,0|2,0,0]=4 1448 B9R1.8 NCCN1CCCCC1 MCULE-2805214779 [1,0,0,1,0,0|2,0,0]=4 1449 B9R1.8 NCCN1CCCCC1 MCULE-8551893283 [1,0,0,1,0,0|2,0,0]=4 1450 B9R1.8 NCCN1CCCCO1 MCULE-3193772471 [1,0,0,1,0,0|2,0,0]=4 1451 B9R1.8 NCCN1CCCCO1 MCULE-6744979905 [1,0,0,1,0,0|2,0,0]=4 1452 B9R1.8 NNCC1CCCCC1 MCULE-5000115152 [1,0,0,1,0,0|2,0,0]=4 1453 B9R1.8 NNCC1CCCCC1 MCULE-5929866009 [1,0,0,1,0,0|2,0,0]=4 1454 B9R1.8 NNCC1CCCCC1 MCULE-6807430135 [1,0,0,1,0,0|2,0,0]=4 1455 B9R1.8 NNCC1CCCCO1 MCULE-1287371850 [1,0,0,1,0,0|2,0,0]=4 1456 B9R1.8 NNCC1CCCCO1 MCULE-2768429905 [1,0,0,1,0,0|2,0,0]=4 1457 B9R1.8 NNCC1CCCCO1 MCULE-6733005378 [1,0,0,1,0,0|2,0,0]=4 1458 B9R1.8 NOCC1CCCCC1 MCULE-4119292714 [1,0,0,1,0,0|2,0,0]=4 1459 B9R1.8 NOCC1CCCCC1 MCULE-4685909729 [1,0,0,1,0,0|2,0,0]=4 1460 B9R1.8 O=CCC1CCCCC1 MCULE-1210709345 [1,0,0,1,0,0|0,0,2]=4 1461 B9R1.8 O=CCC1CCCCO1 MCULE-5585343100 [1,0,0,1,0,0|1,0,1]=4 1462 B9R1.8 OCC=C1CCCCC1 MCULE-1575946847 [1,0,0,1,0,0|0,0,2]=4 1463 B9R1.8 OCCC1=CCCCC1 MCULE-5341389843 [1,0,0,1,0,0|0,0,2]=4 1464 B9R1.8 OCCC1C=CCCC1 MCULE-4423636846 [1,0,0,1,0,0|0,0,2]=4 1465 B9R1.8 OCCC1CCCCC1 MCULE-1419875265 [1,0,0,1,0,0|0,0,0]=2 1466 B9R1.8 OCCC1CCCCN1 MCULE-5358571234 [1,0,0,1,0,0|1,0,0]=3 1467 B9R1.8 OCCC1CCCCN1 MCULE-6316167724 [1,0,0,1,0,0|1,0,0]=3 1468 B9R1.8 OCCC1CCCCN1 MCULE-6383343166 [1,0,0,1,0,0|1,0,0]=3 1469 B9R1.8 OCCC1CCCCN1 MCULE-8192447369 [1,0,0,1,0,0|1,0,0]=3 1470 B9R1.8 OCCC1CCCCO1 MCULE-8834615080 [1,0,0,1,0,0|1,0,0]=3 1471 B9R1.8 OCCC1CCCNC1 MCULE-1585744813 [1,0,0,1,0,0|1,0,0]=3 1472 B9R1.8 OCCC1CCCNC1 MCULE-2334553785 [1,0,0,1,0,0|1,0,0]=3 1473 B9R1.8 OCCC1CCCOC1 MCULE-3721207963 [1,0,0,1,0,0|1,0,0]=3 1474 B9R1.8 OCCC1CCNCC1 MCULE-4733455288 [1,0,0,1,0,0|1,0,0]=3 1475 B9R1.8 OCCC1CCNCC1 MCULE-8781109111 [1,0,0,1,0,0|1,0,0]=3 1476 B9R1.8 OCCC1CCOCC1 MCULE-2699930826 [1,0,0,1,0,0|1,0,0]=3 1477 B9R1.8 OCCC1CNCCN1 MCULE-1485603248 [1,0,0,1,0,0|2,0,0]=4 1478 B9R1.8 OCCC1CNCCN1 MCULE-4527044795 [1,0,0,1,0,0|2,0,0]=4 1479 B9R1.8 OCCC1CNCCN1 MCULE-5830758261 [1,0,0,1,0,0|2,0,0]=4 1480 B9R1.8 OCCC1CNCCN1 MCULE-6879027812 [1,0,0,1,0,0|2,0,0]=4 1481 B9R1.8 OCCC1CNCCO1 MCULE-5426840446 [1,0,0,1,0,0|2,0,0]=4 1482 B9R1.8 OCCC1CNCCO1 MCULE-7364226481 [1,0,0,1,0,0|2,0,0]=4 1483 B9R1.8 OCCC1COCCN1 MCULE-7671693934 [1,0,0,1,0,0|2,0,0]=4 1484 B9R1.8 OCCC1COCCN1 MCULE-7975926802 [1,0,0,1,0,0|2,0,0]=4 1485 B9R1.8 OCCC1COCCO1 MCULE-8026004111 [1,0,0,1,0,0|2,0,0]=4 1486 B9R1.8 OCCC1CSCCN1 MCULE-2529715107 [1,0,0,1,0,0|2,0,0]=4 1487 B9R1.8 OCCC1SCCCS1 MCULE-5450372948 [1,0,0,1,0,0|2,0,0]=4 1488 B9R1.8 OCCN1CCCCC1 MCULE-5210318838 [1,0,0,1,0,0|1,0,0]=3 1489 B9R1.8 OCCN1CCCCC1 MCULE-6060210408 [1,0,0,1,0,0|1,0,0]=3 1490 B9R1.8 OCCN1CCCCO1 MCULE-3704734263 [1,0,0,1,0,0|2,0,0]=4 1491 B9R1.8 OCCN1CCNCC1 MCULE-7497741827 [1,0,0,1,0,0|2,0,0]=4 1492 B9R1.8 OCCN1CCOCC1 MCULE-4008383485 [1,0,0,1,0,0|2,0,0]=4 1493 B9R1.8 OCCN1CCSCC1 MCULE-5257909195 [1,0,0,1,0,0|2,0,0]=4 1494 B9R1.8 OCC[C@@H]1CCCCN1 MCULE-1411975903 [1,0,0,1,0,0|1,0,0]=3 1495 B9R1.8 OCC[C@@H]1CCCCN1 MCULE-1687945599 [1,0,0,1,0,0|1,0,0]=3 1496 B9R1.8 OCC[C@@H]1CCCCN1 MCULE-4768860231 [1,0,0,1,0,0|1,0,0]=3 1497 B9R1.8 OCC[C@@H]1CNCCN1 MCULE-1010322548 [1,0,0,1,0,0|2,0,0]=4 1498 B9R1.8 OCC[C@@H]1CNCCN1 MCULE-1682721450 [1,0,0,1,0,0|2,0,0]=4 1499 B9R1.8 OCC[C@@H]1CNCCN1 MCULE-2510457733 [1,0,0,1,0,0|2,0,0]=4 1500 B9R1.8 OCC[C@@H]1CNCCN1 MCULE-7412945816 [1,0,0,1,0,0|2,0,0]=4 1501 B9R1.8 OCC[C@@H]1CNCCN1 MCULE-7736283995 [1,0,0,1,0,0|2,0,0]=4 1502 B9R1.8 OCC[C@@H]1COCCN1 MCULE-2492409848 [1,0,0,1,0,0|2,0,0]=4 1503 B9R1.8 OCC[C@@H]1COCCN1 MCULE-7538532704 [1,0,0,1,0,0|2,0,0]=4 1504 B9R1.8 OCC[C@@H]1COCCN1 MCULE-8411336469 [1,0,0,1,0,0|2,0,0]=4 1505 B9R1.8 OCC[C@H]1CCCCN1 MCULE-1159412973 [1,0,0,1,0,0|1,0,0]=3 1506 B9R1.8 OCC[C@H]1CCCCN1 MCULE-7155911761 [1,0,0,1,0,0|1,0,0]=3 1507 B9R1.8 OCC[C@H]1CCCCN1 MCULE-8194139814 [1,0,0,1,0,0|1,0,0]=3 1508 B9R1.8 OCC[C@H]1CCCCN1 MCULE-9431208414 [1,0,0,1,0,0|1,0,0]=3 1509 B9R1.8 OCC[C@H]1CCCNC1 MCULE-7415878358 [1,0,0,1,0,0|1,0,0]=3 1510 B9R1.8 OCC[C@H]1CNCCN1 MCULE-1153840758 [1,0,0,1,0,0|2,0,0]=4 1511 B9R1.8 OCC[C@H]1CNCCN1 MCULE-2356486057 [1,0,0,1,0,0|2,0,0]=4 1512 B9R1.8 OCC[C@H]1CNCCN1 MCULE-5425698593 [1,0,0,1,0,0|2,0,0]=4 1513 B9R1.8 OCC[C@H]1CNCCN1 MCULE-7344138049 [1,0,0,1,0,0|2,0,0]=4 1514 B9R1.8 OCC[C@H]1COCCN1 MCULE-4269275620 [1,0,0,1,0,0|2,0,0]=4 1515 B9R1.8 SCCC1CCCCC1 MCULE-4338002677 [1,0,0,1,0,0|0,1,0]=3 1516 B9R1.8 SCCN1CCCCC1 MCULE-5583235881 [1,0,0,1,0,0|1,1,0]=4 1517 B9R1.8 [C@H]1(CCCCN1)CCO MCULE-4666239626 [1,0,0,1,0,0|1,0,0]=3 1518 B9R1.12 BrCCCC1CCCC1 MCULE-8917652864 [1,0,0,1,0,0|1,0,0]=3 1519 B9R1.12 BrCCCC1CCOC1 MCULE-8066690419 [1,0,0,1,0,0|2,0,0]=4 1520 B9R1.12 BrCCCC1OCCO1 MCULE-1201884899 [1,0,0,1,0,0|2,0,0]=4 1521 B9R1.12 BrCCCN1CCCC1 MCULE-3876092057 [1,0,0,1,0,0|2,0,0]=4 1522 B9R1.12 BrCCCN1CCCC1 MCULE-9403473496 [1,0,0,1,0,0|2,0,0]=4 1523 B9R1.12 BrCCOC1CCCC1 MCULE-8207200369 [1,0,0,1,0,0|2,0,0]=4 1524 B9R1.12 C#CCCC1CCCO1 MCULE-2740573893 [1,0,0,1,0,0|0,0,2]=4 1525 B9R1.12 CCCCC1=NCCO1 MCULE-6606126914 [1,0,0,1,0,0|1,0,1]=4 1526 B9R1.12 CCCCC1CCCN1 MCULE-1125287156 [1,0,0,1,0,0|1,0,0]=3 1527 B9R1.12 CCCCC1CCCN1 MCULE-9488507483 [1,0,0,1,0,0|1,0,0]=3 1528 B9R1.12 CCCCC1CCCO1 MCULE-6226220964 [1,0,0,1,0,0|0,0,0]=2 1529 B9R1.12 CCCCC1CCNC1 MCULE-3000104007 [1,0,0,1,0,0|2,0,0]=4 1530 B9R1.12 CCCCC1CCNC1 MCULE-5937287599 [1,0,0,1,0,0|2,0,0]=4 1531 B9R1.12 CCCCC1OCCO1 MCULE-6084525207 [1,0,0,1,0,0|1,0,0]=3 1532 B9R1.12 CCCCN1CCCC1 MCULE-2222043743 [1,0,0,1,0,0|2,0,0]=4 1533 B9R1.12 CCCNC1CCCC1 MCULE-1907915360 [1,0,0,1,0,0|2,0,0]=4 1534 B9R1.12 CCCNC1CCCC1 MCULE-7444605982 [1,0,0,1,0,0|2,0,0]=4 1535 B9R1.12 CCNCC1CCCC1 MCULE-7055093528 [1,0,0,1,0,0|2,0,0]=4 1536 B9R1.12 CCNCC1CCCO1 MCULE-6762362230 [1,0,0,1,0,0|1,0,0]=3 1537 B9R1.12 CCNCC1CCCO1 MCULE-6799465904 [1,0,0,1,0,0|1,0,0]=3 1538 B9R1.12 CCOCC1CCCN1 MCULE-9596857478 [1,0,0,1,0,0|2,0,0]=4 1539 B9R1.12 CCOCC1CCCO1 MCULE-8991933635 [1,0,0,1,0,0|1,0,0]=3 1540 B9R1.12 CNCCC1CCCC1 MCULE-1793791278 [1,0,0,1,0,0|2,0,0]=4 1541 B9R1.12 CNCCC1CCCC1 MCULE-3968080543 [1,0,0,1,0,0|2,0,0]=4 1542 B9R1.12 CNCCC1CCCO1 MCULE-7311615257 [1,0,0,1,0,0|1,0,0]=3 1543 B9R1.12 CNCCC1CCCO1 MCULE-8833199856 [1,0,0,1,0,0|1,0,0]=3 1544 B9R1.12 CNCCC1OCCO1 MCULE-6125926841 [1,0,0,1,0,0|2,0,0]=4 1545 B9R1.12 COCCC1CCCN1 MCULE-8497546481 [1,0,0,1,0,0|2,0,0]=4 1546 B9R1.12 COCC[C@H]1CCCN1 MCULE-8245777352 [1,0,0,1,0,0|2,0,0]=4 1547 B9R1.12 ClCCCC1CCCC1 MCULE-5161283359 [1,0,0,1,0,0|1,0,0]=3 1548 B9R1.12 ClCCCC1OCCO1 MCULE-5692195295 [1,0,0,1,0,0|2,0,0]=4 1549 B9R1.12 ClCCCN1CCCC1 MCULE-1815298239 [1,0,0,1,0,0|2,0,0]=4 1550 B9R1.12 ClCCCN1CCCC1 MCULE-5315327481 [1,0,0,1,0,0|2,0,0]=4 1551 B9R1.12 ClCCCN1CCCC1 MCULE-8262445040 [1,0,0,1,0,0|2,0,0]=4 1552 B9R1.12 ClCOCC1CCCO1 MCULE-8169237465 [1,0,0,1,0,0|2,0,0]=4 1553 B9R1.12 ICCCC1CCCC1 MCULE-3866409284 [1,0,0,1,0,0|1,0,0]=3 1554 B9R1.12 N#CCCC1CCCO1 MCULE-5845235976 [1,0,0,1,0,0|1,0,1]=4 1555 B9R1.12 NCCCC1CCCC1 MCULE-7501106700 [1,0,0,1,0,0|1,0,0]=3 1556 B9R1.12 NCCCC1CCCC1 MCULE-8651093743 [1,0,0,1,0,0|1,0,0]=3 1557 B9R1.12 NCCCC1CCOC1 MCULE-2790704688 [1,0,0,1,0,0|2,0,0]=4 1558 B9R1.12 NCCCC1CCOC1 MCULE-4180248181 [1,0,0,1,0,0|2,0,0]=4 1559 B9R1.12 NCCCN1CCCC1 MCULE-4697605807 [1,0,0,1,0,0|2,0,0]=4 1560 B9R1.12 NCCNC1CCCC1 MCULE-2661468507 [1,0,0,1,0,0|2,0,0]=4 1561 B9R1.12 NCCOC1CCCC1 MCULE-1605975480 [1,0,0,1,0,0|2,0,0]=4 1562 B9R1.12 NCCOC1CCCC1 MCULE-7549131009 [1,0,0,1,0,0|2,0,0]=4 1563 B9R1.12 NCCSC1CCCC1 MCULE-3319599022 [1,0,0,1,0,0|2,0,0]=4 1564 B9R1.12 NCCSC1CCCC1 MCULE-9295988589 [1,0,0,1,0,0|2,0,0]=4 1565 B9R1.12 O=CCCC1CCCC1 MCULE-4829140350 [1,0,0,1,0,0|0,0,2]=4 1566 B9R1.12 O=CCCC1CCCO1 MCULE-9471030052 [1,0,0,1,0,0|1,0,1]=4 1567 B9R1.12 OCCCC1CCCC1 MCULE-9661108637 [1,0,0,1,0,0|0,0,0]=2 1568 B9R1.12 OCCCC1CCCN1 MCULE-4973252647 [1,0,0,1,0,0|1,0,0]=3 1569 B9R1.12 OCCCC1CCCO1 MCULE-9721808816 [1,0,0,1,0,0|1,0,0]=3 1570 B9R1.12 OCCCC1CCNC1 MCULE-4410845788 [1,0,0,1,0,0|1,0,0]=3 1571 B9R1.12 OCCCC1OCCO1 MCULE-3402600084 [1,0,0,1,0,0|2,0,0]=4 1572 B9R1.12 OCCCN1CCCC1 MCULE-5527047033 [1,0,0,1,0,0|1,0,0]=3 1573 B9R1.12 OCCCN1CCCC1 MCULE-6648445240 [1,0,0,1,0,0|1,0,0]=3 1574 B9R1.12 OCCNC1CCCC1 MCULE-3464126624 [1,0,0,1,0,0|1,0,0]=3 1575 B9R1.12 OCCNC1CCCC1 MCULE-4344653097 [1,0,0,1,0,0|1,0,0]=3 1576 B9R1.12 OCCOC1CCCC1 MCULE-7114927075 [1,0,0,1,0,0|1,0,0]=3 1577 B9R1.12 OCCOC1CCOC1 MCULE-6665065123 [1,0,0,1,0,0|2,0,0]=4 1578 B9R1.14 C1(CCCN1CC)CN MCULE-1632851101 [1,0,0,1,0,0|2,0,0]=4 1579 B9R1.14 CCC1CCCC1CN MCULE-1703862248 [1,0,0,1,0,0|1,0,0]=3 1580 B9R1.14 CCC1CNCC1CC MCULE-7269079242 [1,0,0,1,0,0|2,0,0]=4 1581 B9R1.14 CCC1CNCC1CO MCULE-2035722014 [1,0,0,1,0,0|1,0,0]=3 1582 B9R1.14 CCC1NCCC1CO MCULE-7281322099 [1,0,0,1,0,0|1,0,0]=3 1583 B9R1.14 CCN1CCCC1CBr MCULE-8960383969 [1,0,0,1,0,0|2,0,0]=4 1584 B9R1.14 CCN1CCCC1CBr MCULE-9469918424 [1,0,0,1,0,0|2,0,0]=4 1585 B9R1.14 CCN1CCCC1CCl MCULE-5314736307 [1,0,0,1,0,0|2,0,0]=4 1586 B9R1.14 CCN1CCCC1CCl MCULE-6817965623 [1,0,0,1,0,0|2,0,0]=4 1587 B9R1.14 CCN1CCCC1CN MCULE-1467093162 [1,0,0,1,0,0|2,0,0]=4 1588 B9R1.14 CCN1CCCC1CN MCULE-2325368331 [1,0,0,1,0,0|2,0,0]=4 1589 B9R1.14 CCN1CCCC1CO MCULE-6449869915 [1,0,0,1,0,0|1,0,0]=3 1590 B9R1.14 CCN1CCC[C@@H]1CN MCULE-2586519534 [1,0,0,1,0,0|2,0,0]=4 1591 B9R1.14 CCN1CCC[C@@H]1CN MCULE-5061870530 [1,0,0,1,0,0|2,0,0]=4 1592 B9R1.14 CCN1CCC[C@@H]1CN MCULE-7851632258 [1,0,0,1,0,0|2,0,0]=4 1593 B9R1.14 CCN1CCC[C@@H]1CN MCULE-9126913022 [1,0,0,1,0,0|2,0,0]=4 1594 B9R1.14 CCN1CCC[C@@H]1CN MCULE-9952350630 [1,0,0,1,0,0|2,0,0]=4 1595 B9R1.14 CCN1CCC[C@@H]1CO MCULE-3480163864 [1,0,0,1,0,0|1,0,0]=3 1596 B9R1.14 CCN1CCC[C@H]1CN MCULE-2049657109 [1,0,0,1,0,0|2,0,0]=4 1597 B9R1.14 CCN1CCC[C@H]1CN MCULE-2687343014 [1,0,0,1,0,0|2,0,0]=4 1598 B9R1.14 CCN1CCC[C@H]1CN MCULE-5343183437 [1,0,0,1,0,0|2,0,0]=4 1599 B9R1.14 CCN1CCC[C@H]1CN MCULE-6647099625 [1,0,0,1,0,0|2,0,0]=4 1600 B9R1.14 CCN1CCC[C@H]1CO MCULE-1120119069 [1,0,0,1,0,0|1,0,0]=3 1601 B9R1.14 CCN1CCC[C@H]1CO MCULE-6346417572 [1,0,0,1,0,0|1,0,0]=3 1602 B9R1.14 CC[C@H]1CNC[C@@H]1CO MCULE-1076286750 [1,0,0,1,0,0|1,0,0]=3 1603 B9R1.14 CC[C@H]1CNC[C@@H]1CO MCULE-9319128709 [1,0,0,1,0,0|1,0,0]=3 1604 B9R1.14 COC1CCCC1CN MCULE-9251673750 [1,0,0,1,0,0|2,0,0]=4 1605 B9R1.14 OCC1CNCC1CO MCULE-3216303466 [1,0,0,1,0,0|2,0,0]=4 1606 B9R1.14 OCC1CNCC1CO MCULE-8556792970 [1,0,0,1,0,0|2,0,0]=4 1607 B9R1.14 OC[C@@H]1CNC[C@@H]1CO MCULE-5441133280 [1,0,0,1,0,0|2,0,0]=4 1608 B9R1.14 OC[C@@H]1CNC[C@@H]1CO MCULE-8785740812 [1,0,0,1,0,0|2,0,0]=4 1609 B9R1.14 OC[C@@H]1CNC[C@H]1CO MCULE-1923940000 [1,0,0,1,0,0|2,0,0]=4 1610 B9R1.14 OC[C@@H]1CNC[C@H]1CO MCULE-8086146822 [1,0,0,1,0,0|2,0,0]=4 1611 B9R1.14 OC[C@H]1CNC[C@@H]1CO MCULE-3807624796 [1,0,0,1,0,0|2,0,0]=4 1612 B9R1.14 OC[C@H]1CNC[C@@H]1CO MCULE-7784303809 [1,0,0,1,0,0|2,0,0]=4 1613 B9R1.15 C#CC1CCCCC1C MCULE-6198776424 [1,0,0,1,0,0|1,0,1]=4 1614 B9R1.15 C#CC1CCCCC1O MCULE-6683374669 [1,0,0,1,0,0|0,0,2]=4 1615 B9R1.15 C=CC1CCCCC1O MCULE-8134168493 [1,0,0,1,0,0|0,0,2]=4 1616 B9R1.15 CC1=C(CCCC1)CO MCULE-8750813787 [1,0,0,1,0,0|0,0,2]=4 1617 B9R1.15 CC1CC=CCC1CO MCULE-7534551137 [1,0,0,1,0,0|0,0,2]=4 1618 B9R1.15 CC1CCCCC1=NO MCULE-1706609645 [1,0,0,1,0,0|1,0,1]=4 1619 B9R1.15 CC1CCCCC1C=O MCULE-5772126890 [1,0,0,1,0,0|0,0,2]=4 1620 B9R1.15 CC1CCCCC1CBr MCULE-8034060072 [1,0,0,1,0,0|1,0,0]=3 1621 B9R1.15 CC1CCCCC1CN MCULE-2749107040 [1,0,0,1,0,0|1,0,0]=3 1622 B9R1.15 CC1CCCCC1NN MCULE-1627711305 [1,0,0,1,0,0|2,0,0]=4 1623 B9R1.15 CC1CCCCC1NN MCULE-6482426688 [1,0,0,1,0,0|2,0,0]=4 1624 B9R1.15 CC1CCCCC1NN MCULE-6532690515 [1,0,0,1,0,0|2,0,0]=4 1625 B9R1.15 CC1CCCNC1CN MCULE-6481829543 [1,0,0,1,0,0|2,0,0]=4 1626 B9R1.15 CC1CCCNC1CO MCULE-4408087733 [1,0,0,1,0,0|1,0,0]=3 1627 B9R1.15 CC1CCNCC1CO MCULE-7653018616 [1,0,0,1,0,0|1,0,0]=3 1628 B9R1.15 CC1COCCC1CN MCULE-3656342813 [1,0,0,1,0,0|2,0,0]=4 1629 B9R1.15 CC1NCCCC1CO MCULE-2033869519 [1,0,0,1,0,0|1,0,0]=3 1630 B9R1.15 CC1OCCNC1CO MCULE-1741355006 [1,0,0,1,0,0|2,0,0]=4 1631 B9R1.15 CC1OCCNC1CO MCULE-9766545086 [1,0,0,1,0,0|2,0,0]=4 1632 B9R1.15 CCC1CCCCC1=O MCULE-2493543558 [1,0,0,1,0,0|0,0,2]=4 1633 B9R1.15 CCC1CCCCC1Br MCULE-1178311442 [1,0,0,1,0,0|1,0,0]=3 1634 B9R1.15 CCC1CCCCC1C MCULE-1792942786 [1,0,0,1,0,0|1,0,0]=3 1635 B9R1.15 CCC1CCCCC1N MCULE-3637799906 [1,0,0,1,0,0|1,0,0]=3 1636 B9R1.15 CCC1CCCCC1O MCULE-7514335194 [1,0,0,1,0,0|0,0,0]=2 1637 B9R1.15 CCC1COCCC1N MCULE-9616117607 [1,0,0,1,0,0|2,0,0]=4 1638 B9R1.15 CCC1COCCC1O MCULE-9521346817 [1,0,0,1,0,0|1,0,0]=3 1639 B9R1.15 CC\1CCCC/C1=N/O MCULE-2965052832 [1,0,0,1,0,0|1,0,1]=4 1640 B9R1.15 CN1CCCCC1CBr MCULE-3728031205 [1,0,0,1,0,0|2,0,0]=4 1641 B9R1.15 CN1CCCCC1CBr MCULE-6733933371 [1,0,0,1,0,0|2,0,0]=4 1642 B9R1.15 CN1CCCCC1CCl MCULE-1207908283 [1,0,0,1,0,0|2,0,0]=4 1643 B9R1.15 CN1CCCCC1CCl MCULE-8530079563 [1,0,0,1,0,0|2,0,0]=4 1644 B9R1.15 CN1CCCCC1CN MCULE-7056988540 [1,0,0,1,0,0|2,0,0]=4 1645 B9R1.15 CN1CCCCC1CN MCULE-7969324848 [1,0,0,1,0,0|2,0,0]=4 1646 B9R1.15 CN1CCCCC1CN MCULE-9107319494 [1,0,0,1,0,0|2,0,0]=4 1647 B9R1.15 CN1CCCCC1CO MCULE-6705032794 [1,0,0,1,0,0|1,0,0]=3 1648 B9R1.15 CN1CCCCC1CO MCULE-7433359891 [1,0,0,1,0,0|1,0,0]=3 1649 B9R1.15 CN1CCCC[C@@H]1CO MCULE-4169808027 [1,0,0,1,0,0|1,0,0]=3 1650 B9R1.15 CN1CCCC[C@@H]1CO MCULE-5806828736 [1,0,0,1,0,0|1,0,0]=3 1651 B9R1.15 CN1CCCC[C@H]1CO MCULE-5720351306 [1,0,0,1,0,0|1,0,0]=3 1652 B9R1.15 CN1CCCC[C@H]1CO MCULE-6512254506 [1,0,0,1,0,0|1,0,0]=3 1653 B9R1.15 CN1CCNCC1CO MCULE-7112745401 [1,0,0,1,0,0|2,0,0]=4 1654 B9R1.15 CN1CCNCC1CO MCULE-8816850395 [1,0,0,1,0,0|2,0,0]=4 1655 B9R1.15 CN1CCOCC1CO MCULE-2139047530 [1,0,0,1,0,0|2,0,0]=4 1656 B9R1.15 CN1CCOCC1CO MCULE-4226067396 [1,0,0,1,0,0|2,0,0]=4 1657 B9R1.15 CN1CCOCC1CO MCULE-9641882387 [1,0,0,1,0,0|2,0,0]=4 1658 B9R1.15 CN1CCOC[C@@H]1CO MCULE-6676365616 [1,0,0,1,0,0|2,0,0]=4 1659 B9R1.15 CN1CCOC[C@@H]1CO MCULE-7199870435 [1,0,0,1,0,0|2,0,0]=4 1660 B9R1.15 CN1CCOC[C@H]1CO MCULE-1567784253 [1,0,0,1,0,0|2,0,0]=4 1661 B9R1.15 CN1CCOC[C@H]1CO MCULE-4386696956 [1,0,0,1,0,0|2,0,0]=4 1662 B9R1.15 CN1CCOC[C@H]1CO MCULE-4994265717 [1,0,0,1,0,0|2,0,0]=4 1663 B9R1.15 CN1CCOC[C@H]1CO MCULE-9355808488 [1,0,0,1,0,0|2,0,0]=4 1664 B9R1.15 CNC1CCCCC1C MCULE-2012338656 [1,0,0,1,0,0|2,0,0]=4 1665 B9R1.15 CNC1CCCCC1C MCULE-4226953987 [1,0,0,1,0,0|2,0,0]=4 1666 B9R1.15 CNC1CCCCC1O MCULE-4436069957 [1,0,0,1,0,0|1,0,0]=3 1667 B9R1.15 CNC1CCCCC1O MCULE-5405173336 [1,0,0,1,0,0|1,0,0]=3 1668 B9R1.15 CN[C@@H]1CCCC[C@@H]1C MCULE-5411502617 [1,0,0,1,0,0|2,0,0]=4 1669 B9R1.15 CN[C@@H]1CCCC[C@@H]1O MCULE-1137921028 [1,0,0,1,0,0|1,0,0]=3 1670 B9R1.15 CN[C@@H]1CCCC[C@H]1O MCULE-3605342765 [1,0,0,1,0,0|1,0,0]=3 1671 B9R1.15 CN[C@@H]1CCCC[C@H]1O MCULE-5222257369 [1,0,0,1,0,0|1,0,0]=3 1672 B9R1.15 CN[C@@H]1CCCC[C@H]1O MCULE-5595138673 [1,0,0,1,0,0|1,0,0]=3 1673 B9R1.15 CN[C@@H]1CCCC[C@H]1O MCULE-8677073091 [1,0,0,1,0,0|1,0,0]=3 1674 B9R1.15 CN[C@H]1CCCC[C@@H]1O MCULE-1707284588 [1,0,0,1,0,0|1,0,0]=3 1675 B9R1.15 CN[C@H]1CCCC[C@@H]1O MCULE-2780832664 [1,0,0,1,0,0|1,0,0]=3 1676 B9R1.15 CN[C@H]1CCCC[C@@H]1O MCULE-5064297221 [1,0,0,1,0,0|1,0,0]=3 1677 B9R1.15 CN[C@H]1CCCC[C@H]1C MCULE-9095592965 [1,0,0,1,0,0|2,0,0]=4 1678 B9R1.15 CN[C@H]1CCCC[C@H]1O MCULE-1705616364 [1,0,0,1,0,0|1,0,0]=3 1679 B9R1.15 CN[C@H]1CCCC[C@H]1O MCULE-9104661315 [1,0,0,1,0,0|1,0,0]=3 1680 B9R1.15 COC1CCCCC1N MCULE-1737804569 [1,0,0,1,0,0|2,0,0]=4 1681 B9R1.15 COC1CCCCC1N MCULE-2194963487 [1,0,0,1,0,0|2,0,0]=4 1682 B9R1.15 COC1CCCCC1O MCULE-9502513295 [1,0,0,1,0,0|1,0,0]=3 1683 B9R1.15 COC1CCNCC1O MCULE-4844568872 [1,0,0,1,0,0|2,0,0]=4 1684 B9R1.15 COC1CCNCC1O MCULE-5658669344 [1,0,0,1,0,0|2,0,0]=4 1685 B9R1.15 COC1COCCC1O MCULE-4002896267 [1,0,0,1,0,0|2,0,0]=4 1686 B9R1.15 CO[C@@H]1CCCC[C@@H]1N MCULE-1989542198 [1,0,0,1,0,0|2,0,0]=4 1687 B9R1.15 CO[C@@H]1CCCC[C@@H]1N MCULE-6852448083 [1,0,0,1,0,0|2,0,0]=4 1688 B9R1.15 CO[C@@H]1CCCC[C@H]1Br MCULE-6359637259 [1,0,0,1,0,0|2,0,0]=4 1689 B9R1.15 CO[C@@H]1CCCC[C@H]1I MCULE-4229510302 [1,0,0,1,0,0|2,0,0]=4 1690 B9R1.15 CO[C@@H]1CCCC[C@H]1N MCULE-2893854338 [1,0,0,1,0,0|2,0,0]=4 1691 B9R1.15 CO[C@@H]1CCCC[C@H]1N MCULE-9329529471 [1,0,0,1,0,0|2,0,0]=4 1692 B9R1.15 CO[C@@H]1CCNC[C@@H]1O MCULE-1786216428 [1,0,0,1,0,0|2,0,0]=4 1693 B9R1.15 CO[C@@H]1CCNC[C@@H]1O MCULE-5747785572 [1,0,0,1,0,0|2,0,0]=4 1694 B9R1.15 CO[C@@H]1CCNC[C@@H]1O MCULE-8933003557 [1,0,0,1,0,0|2,0,0]=4 1695 B9R1.15 CO[C@@H]1CCNC[C@@H]1O MCULE-9963782997 [1,0,0,1,0,0|2,0,0]=4 1696 B9R1.15 CO[C@H]1CCCC[C@@H]1N MCULE-2586194317 [1,0,0,1,0,0|2,0,0]=4 1697 B9R1.15 CO[C@H]1CCCC[C@@H]1N MCULE-3721985129 [1,0,0,1,0,0|2,0,0]=4 1698 B9R1.15 CO[C@H]1CCCC[C@@H]1N MCULE-5933697798 [1,0,0,1,0,0|2,0,0]=4 1699 B9R1.15 CO[C@H]1CCCC[C@@H]1N MCULE-8173559541 [1,0,0,1,0,0|2,0,0]=4 1700 B9R1.15 CO[C@H]1CCCC[C@@H]1O MCULE-5178021878 [1,0,0,1,0,0|1,0,0]=3 1701 B9R1.15 CO[C@H]1CCCC[C@H]1N MCULE-1897256905 [1,0,0,1,0,0|2,0,0]=4 1702 B9R1.15 CO[C@H]1CCCC[C@H]1N MCULE-2520513048 [1,0,0,1,0,0|2,0,0]=4 1703 B9R1.15 CO[C@H]1CCNC[C@@H]1O MCULE-6153348705 [1,0,0,1,0,0|2,0,0]=4 1704 B9R1.15 CO[C@H]1CCNC[C@@H]1O MCULE-8285848321 [1,0,0,1,0,0|2,0,0]=4 1705 B9R1.15 CO[C@H]1CCNC[C@@H]1O MCULE-8316883665 [1,0,0,1,0,0|2,0,0]=4 1706 B9R1.15 CO[C@H]1CCNC[C@@H]1O MCULE-8980786259 [1,0,0,1,0,0|2,0,0]=4 1707 B9R1.15 CSC1CCCCC1O MCULE-1801870498 [1,0,0,1,0,0|1,0,0]=3 1708 B9R1.15 C[C@@H]1OCCN[C@H]1CO MCULE-2713680724 [1,0,0,1,0,0|2,0,0]=4 1709 B9R1.15 C[C@@H]1OCCN[C@H]1CO MCULE-4338380603 [1,0,0,1,0,0|2,0,0]=4 1710 B9R1.15 C[C@@H]1OCCN[C@H]1CO MCULE-7590170950 [1,0,0,1,0,0|2,0,0]=4 1711 B9R1.15 C[C@@H]1OCCN[C@H]1CO MCULE-8556273106 [1,0,0,1,0,0|2,0,0]=4 1712 B9R1.15 C[C@@H]\1CCCC/C1=N/O MCULE-8176246926 [1,0,0,1,0,0|1,0,1]=4 1713 B9R1.15 C[C@H]1CCCN[C@@H]1CO MCULE-1290896647 [1,0,0,1,0,0|1,0,0]=3 1714 B9R1.15 C[C@H]1CCCN[C@@H]1CO MCULE-3602411590 [1,0,0,1,0,0|1,0,0]=3 1715 B9R1.15 C[C@H]1NCCC[C@H]1CO MCULE-6295458608 [1,0,0,1,0,0|1,0,0]=3 1716 B9R1.15 C[C@H]1OCCN[C@@H]1CO MCULE-2162620553 [1,0,0,1,0,0|2,0,0]=4 1717 B9R1.15 C[C@H]1OCCN[C@@H]1CO MCULE-4393718690 [1,0,0,1,0,0|2,0,0]=4 1718 B9R1.15 C[C@H]1OCCN[C@@H]1CO MCULE-6427512664 [1,0,0,1,0,0|2,0,0]=4 1719 B9R1.15 C[C@H]1OCCN[C@@H]1CO MCULE-6736855904 [1,0,0,1,0,0|2,0,0]=4 1720 B9R1.15 C[C@H]1OCCN[C@@H]1CO MCULE-8696304905 [1,0,0,1,0,0|2,0,0]=4 1721 B9R1.15 C[C@H]1OCCN[C@@H]1CO MCULE-9103105556 [1,0,0,1,0,0|2,0,0]=4 1722 B9R1.15 N#CC1CCCCC1O MCULE-6629804837 [1,0,0,1,0,0|1,0,1]=4 1723 B9R1.15 N#C[C@@H]1CCCC[C@H]1O MCULE-4635617312 [1,0,0,1,0,0|1,0,1]=4 1724 B9R1.15 NC1CCCCC1CO MCULE-5262753422 [1,0,0,1,0,0|1,0,0]=3 1725 B9R1.15 NC1CCCCC1CO MCULE-9191988425 [1,0,0,1,0,0|1,0,0]=3 1726 B9R1.15 NC1CCOCC1CO MCULE-7912086901 [1,0,0,1,0,0|2,0,0]=4 1727 B9R1.15 NC1COCCC1CO MCULE-3392980000 [1,0,0,1,0,0|2,0,0]=4 1728 B9R1.15 NC1COCCC1CO MCULE-8617350186 [1,0,0,1,0,0|2,0,0]=4 1729 B9R1.15 NCC1CCCCC1F MCULE-5222863833 [1,0,0,1,0,0|2,0,0]=4 1730 B9R1.15 NCC1CCCCC1F MCULE-5775855535 [1,0,0,1,0,0|2,0,0]=4 1731 B9R1.15 NCC1CCCCC1N MCULE-1706815858 [1,0,0,1,0,0|2,0,0]=4 1732 B9R1.15 NCC1CCCCC1N MCULE-4873726709 [1,0,0,1,0,0|2,0,0]=4 1733 B9R1.15 NCC1CCCCC1O MCULE-3106014100 [1,0,0,1,0,0|1,0,0]=3 1734 B9R1.15 NCC1CCNCC1O MCULE-3055394995 [1,0,0,1,0,0|2,0,0]=4 1735 B9R1.15 NCC1CCNCC1O MCULE-6224685083 [1,0,0,1,0,0|2,0,0]=4 1736 B9R1.15 NC[C@@H]1CCNC[C@@H]1O MCULE-2628011610 [1,0,0,1,0,0|2,0,0]=4 1737 B9R1.15 NC[C@@H]1CCNC[C@@H]1O MCULE-4130182685 [1,0,0,1,0,0|2,0,0]=4 1738 B9R1.15 NC[C@@H]1CCNC[C@@H]1O MCULE-4171309495 [1,0,0,1,0,0|2,0,0]=4 1739 B9R1.15 NC[C@@H]1CCNC[C@@H]1O MCULE-9652322332 [1,0,0,1,0,0|2,0,0]=4 1740 B9R1.15 NC[C@@H]1CCNC[C@H]1O MCULE-2431660086 [1,0,0,1,0,0|2,0,0]=4 1741 B9R1.15 NC[C@@H]1CCNC[C@H]1O MCULE-5301710683 [1,0,0,1,0,0|2,0,0]=4 1742 B9R1.15 NC[C@H]1CCCC[C@@H]1O MCULE-1443897301 [1,0,0,1,0,0|1,0,0]=3 1743 B9R1.15 NC[C@H]1CCCC[C@@H]1O MCULE-4382665718 [1,0,0,1,0,0|1,0,0]=3 1744 B9R1.15 NC[C@H]1CCNC[C@@H]1O MCULE-7451941473 [1,0,0,1,0,0|2,0,0]=4 1745 B9R1.15 NC[C@H]1CCNC[C@@H]1O MCULE-8077996531 [1,0,0,1,0,0|2,0,0]=4 1746 B9R1.15 NNC1CCCCC1O MCULE-1144773369 [1,0,0,1,0,0|2,0,0]=4 1747 B9R1.15 NNC1CCCCC1O MCULE-8337335745 [1,0,0,1,0,0|2,0,0]=4 1748 B9R1.15 NN[C@@H]1CCCC[C@H]1O MCULE-1480471068 [1,0,0,1,0,0|2,0,0]=4 1749 B9R1.15 NN[C@@H]1CCCC[C@H]1O MCULE-3427466844 [1,0,0,1,0,0|2,0,0]=4 1750 B9R1.15 NN[C@@H]1CCCC[C@H]1O MCULE-3752922997 [1,0,0,1,0,0|2,0,0]=4 1751 B9R1.15 NN[C@@H]1CCCC[C@H]1O MCULE-4432854577 [1,0,0,1,0,0|2,0,0]=4 1752 B9R1.15 NN[C@H]1CCCC[C@@H]1O MCULE-4369531684 [1,0,0,1,0,0|2,0,0]=4 1753 B9R1.15 N[C@@H]1CCCC[C@@H]1CO MCULE-2333094825 [1,0,0,1,0,0|1,0,0]=3 1754 B9R1.15 N[C@@H]1CCCC[C@@H]1CO MCULE-6100111885 [1,0,0,1,0,0|1,0,0]=3 1755 B9R1.15 N[C@@H]1CCCC[C@H]1CO MCULE-2541489944 [1,0,0,1,0,0|1,0,0]=3 1756 B9R1.15 N[C@@H]1CCCC[C@H]1CO MCULE-4358798149 [1,0,0,1,0,0|1,0,0]=3 1757 B9R1.15 N[C@@H]1CCCC[C@H]1CO MCULE-6886498483 [1,0,0,1,0,0|1,0,0]=3 1758 B9R1.15 N[C@@H]1CCCC[C@H]1CO MCULE-9434700277 [1,0,0,1,0,0|1,0,0]=3 1759 B9R1.15 N[C@H]1CCCC[C@H]1CO MCULE-7191404876 [1,0,0,1,0,0|1,0,0]=3 1760 B9R1.15 N[C@H]1CCCC[C@H]1CO MCULE-8159159865 [1,0,0,1,0,0|1,0,0]=3 1761 B9R1.15 N[C@H]1COCC[C@H]1CO MCULE-5880045699 [1,0,0,1,0,0|2,0,0]=4 1762 B9R1.15 N[C@H]1COCC[C@H]1CO MCULE-8504787876 [1,0,0,1,0,0|2,0,0]=4 1763 B9R1.15 O=C1CCCCC1CO MCULE-1345678838 [1,0,0,1,0,0|1,0,1]=4 1764 B9R1.15 OC1CCCCC1CBr MCULE-3516289492 [1,0,0,1,0,0|1,0,0]=3 1765 B9R1.15 OCC1CCCCC1O MCULE-1945714569 [1,0,0,1,0,0|1,0,0]=3 1766 B9R1.15 OCC1CCNCC1F MCULE-2928396204 [1,0,0,1,0,0|2,0,0]=4 1767 B9R1.15 OCC1CCNCC1F MCULE-4498079199 [1,0,0,1,0,0|2,0,0]=4 1768 B9R1.15 OCC1CCNCC1O MCULE-7571515188 [1,0,0,1,0,0|2,0,0]=4 1769 B9R1.15 OCC1CCNCC1O MCULE-8029631005 [1,0,0,1,0,0|2,0,0]=4 1770 B9R1.15 OCC1CNCCC1O MCULE-1394638729 [1,0,0,1,0,0|2,0,0]=4 1771 B9R1.15 OCC1CNCCC1O MCULE-3316949664 [1,0,0,1,0,0|2,0,0]=4 1772 B9R1.15 OCC1NCCCC1O MCULE-4567185313 [1,0,0,1,0,0|2,0,0]=4 1773 B9R1.15 OCC1NCCCC1O MCULE-6603271501 [1,0,0,1,0,0|2,0,0]=4 1774 B9R1.15 OC[C@@H]1CCNC[C@@H]1F MCULE-2280671949 [1,0,0,1,0,0|2,0,0]=4 1775 B9R1.15 OC[C@@H]1CCNC[C@@H]1F MCULE-5182685629 [1,0,0,1,0,0|2,0,0]=4 1776 B9R1.15 OC[C@@H]1CCNC[C@@H]1F MCULE-6426816664 [1,0,0,1,0,0|2,0,0]=4 1777 B9R1.15 OC[C@@H]1CCNC[C@@H]1F MCULE-6911928107 [1,0,0,1,0,0|2,0,0]=4 1778 B9R1.15 OC[C@@H]1CCNC[C@@H]1F MCULE-7067705943 [1,0,0,1,0,0|2,0,0]=4 1779 B9R1.15 OC[C@@H]1CCNC[C@@H]1O MCULE-3094062800 [1,0,0,1,0,0|2,0,0]=4 1780 B9R1.15 OC[C@@H]1CCNC[C@@H]1O MCULE-6303448234 [1,0,0,1,0,0|2,0,0]=4 1781 B9R1.15 OC[C@@H]1CCNC[C@@H]1O MCULE-6793824447 [1,0,0,1,0,0|2,0,0]=4 1782 B9R1.15 OC[C@@H]1CCNC[C@@H]1O MCULE-9672123449 [1,0,0,1,0,0|2,0,0]=4 1783 B9R1.15 OC[C@@H]1CCNC[C@H]1O MCULE-2277053036 [1,0,0,1,0,0|2,0,0]=4 1784 B9R1.15 OC[C@@H]1CCNC[C@H]1O MCULE-4840185571 [1,0,0,1,0,0|2,0,0]=4 1785 B9R1.15 OC[C@H]1CCNC[C@@H]1O MCULE-1589442124 [1,0,0,1,0,0|2,0,0]=4 1786 B9R1.15 OC[C@H]1CCNC[C@@H]1O MCULE-5378098662 [1,0,0,1,0,0|2,0,0]=4 1787 B9R1.15 OC[C@H]1CCNC[C@@H]1O MCULE-5907126780 [1,0,0,1,0,0|2,0,0]=4 1788 B9R1.15 OC[C@H]1CCNC[C@@H]1O MCULE-6675818472 [1,0,0,1,0,0|2,0,0]=4 1789 B9R1.15 OC[C@H]1CCNC[C@H]1F MCULE-3084007189 [1,0,0,1,0,0|2,0,0]=4 1790 B9R1.15 OC[C@H]1CCNC[C@H]1F MCULE-6039491253 [1,0,0,1,0,0|2,0,0]=4 1791 B9R1.15 OC[C@H]1CCNC[C@H]1F MCULE-6077710469 [1,0,0,1,0,0|2,0,0]=4 1792 B9R1.15 OC[C@H]1CCNC[C@H]1F MCULE-7212928624 [1,0,0,1,0,0|2,0,0]=4 1793 B9R1.15 OC[C@H]1CCNC[C@H]1F MCULE-8482961967 [1,0,0,1,0,0|2,0,0]=4 1794 B9R1.15 OC[C@H]1CCNC[C@H]1O MCULE-1138683406 [1,0,0,1,0,0|2,0,0]=4 1795 B9R1.15 OC[C@H]1CCNC[C@H]1O MCULE-2009456098 [1,0,0,1,0,0|2,0,0]=4 1796 B9R1.15 OC[C@H]1CCNC[C@H]1O MCULE-6847756490 [1,0,0,1,0,0|2,0,0]=4 1797 B9R1.15 OC[C@H]1CCNC[C@H]1O MCULE-8689272206 [1,0,0,1,0,0|2,0,0]=4 1798 B9R1.15 OC[C@H]1CNCC[C@H]1O MCULE-1702794715 [1,0,0,1,0,0|2,0,0]=4 1799 B9R1.15 OC[C@H]1CNCC[C@H]1O MCULE-9636833446 [1,0,0,1,0,0|2,0,0]=4 1800 B9R1.15 [C@H]1(CNCC[C@H]1CN)O MCULE-2780379872 [1,0,0,1,0,0|2,0,0]=4 1801 B9R1.15 [C@H]1(CNCC[C@H]1CN)O MCULE-6533831464 [1,0,0,1,0,0|2,0,0]=4 1802 B9R1.15 [C@H]1(CNCC[C@H]1CO)O MCULE-6865852051 [1,0,0,1,0,0|2,0,0]=4 1803 B9R1.16 C=CCCCC1CC1O MCULE-3233207097 [1,0,0,1,0,0|0,0,2]=4 1804 B9R1.17 BrCCCOC1CCC1 MCULE-1795381815 [1,0,0,1,0,0|2,0,0]=4 1805 B9R1.17 BrCCOCC1CCC1 MCULE-3787422053 [1,0,0,1,0,0|2,0,0]=4 1806 B9R1.17 CCCCCC1CNC1 MCULE-1187200413 [1,0,0,1,0,0|2,0,0]=4 1807 B9R1.17 CCCCCC1CNC1 MCULE-2508948694 [1,0,0,1,0,0|2,0,0]=4 1808 B9R1.17 NCCCCN1CCC1 MCULE-4009925572 [1,0,0,1,0,0|2,0,0]=4 1809 B9R1.17 NCCCOC1CCC1 MCULE-2258599306 [1,0,0,1,0,0|2,0,0]=4 1810 B9R1.17 NCCOCC1CCC1 MCULE-2834054291 [1,0,0,1,0,0|2,0,0]=4 1811 B9R1.17 NCCOCC1CCC1 MCULE-8028920848 [1,0,0,1,0,0|2,0,0]=4 1812 B9R1.17 OCCCNC1CCC1 MCULE-6573690465 [1,0,0,1,0,0|1,0,0]=3 1813 B9R1.17 OCCCNC1COC1 MCULE-5500778025 [1,0,0,1,0,0|2,0,0]=4 1814 B9R1.17 OCCCOC1CCC1 MCULE-8275221962 [1,0,0,1,0,0|1,0,0]=3 1815 B9R1.17 OCCCOC1COC1 MCULE-4049269381 [1,0,0,1,0,0|2,0,0]=4 1816 B9R1.17 OCCNCC1CCC1 MCULE-4723097347 [1,0,0,1,0,0|1,0,0]=3 1817 B9R1.17 OCCOCC1CCC1 MCULE-7887769719 [1,0,0,1,0,0|1,0,0]=3 1818 B9R1.33 CC1CCCC1CCO MCULE-1752596263 [1,0,0,1,0,0|0,0,0]=2 1819 B9R1.33 CC1CCCN1CCN MCULE-8945723829 [1,0,0,1,0,0|2,0,0]=4 1820 B9R1.33 CCCC1CCCC1=O MCULE-6186440440 [1,0,0,1,0,0|0,0,2]=4 1821 B9R1.33 CCNC1COCC1O MCULE-7678905536 [1,0,0,1,0,0|2,0,0]=4 1822 B9R1.33 CCN[C@H]1COC[C@@H]1O MCULE-1056741017 [1,0,0,1,0,0|2,0,0]=4 1823 B9R1.33 CCN[C@H]1COC[C@@H]1O MCULE-9348333209 [1,0,0,1,0,0|2,0,0]=4 1824 B9R1.33 CCOC1CCCC1N MCULE-1724274632 [1,0,0,1,0,0|2,0,0]=4 1825 B9R1.33 CCSC1CCCC1N MCULE-9127222601 [1,0,0,1,0,0|2,0,0]=4 1826 B9R1.33 CN1CCCC1CCCl MCULE-3811312100 [1,0,0,1,0,0|2,0,0]=4 1827 B9R1.33 CN1CCCC1CCCl MCULE-7223827292 [1,0,0,1,0,0|2,0,0]=4 1828 B9R1.33 CN1CCCC1CCN MCULE-3891304044 [1,0,0,1,0,0|2,0,0]=4 1829 B9R1.33 CN1CCCC1CCN MCULE-7026227753 [1,0,0,1,0,0|2,0,0]=4 1830 B9R1.33 CN1CCCC1CCO MCULE-3612604787 [1,0,0,1,0,0|1,0,0]=3 1831 B9R1.33 CN1CCC[C@@H]1CCN MCULE-3057368635 [1,0,0,1,0,0|2,0,0]=4 1832 B9R1.33 CN1CCC[C@@H]1CCN MCULE-6920346222 [1,0,0,1,0,0|2,0,0]=4 1833 B9R1.33 CN1CCC[C@@H]1CCN MCULE-9361017838 [1,0,0,1,0,0|2,0,0]=4 1834 B9R1.33 CN1CCC[C@@H]1CCO MCULE-4024477366 [1,0,0,1,0,0|1,0,0]=3 1835 B9R1.33 CN1CCC[C@@H]1CCO MCULE-6759736828 [1,0,0,1,0,0|1,0,0]=3 1836 B9R1.33 CN1CCC[C@H]1CCN MCULE-3471635074 [1,0,0,1,0,0|2,0,0]=4 1837 B9R1.33 CN1CCC[C@H]1CCN MCULE-5692291515 [1,0,0,1,0,0|2,0,0]=4 1838 B9R1.33 CN1CCC[C@H]1CCN MCULE-5695739693 [1,0,0,1,0,0|2,0,0]=4 1839 B9R1.33 CN1CCC[C@H]1CCN MCULE-5859217243 [1,0,0,1,0,0|2,0,0]=4 1840 B9R1.33 CN1CCC[C@H]1CCO MCULE-6063605807 [1,0,0,1,0,0|1,0,0]=3 1841 B9R1.33 CN1CCC[C@H]1CCO MCULE-8959854431 [1,0,0,1,0,0|1,0,0]=3 1842 B9R1.33 CNCC1CCCC1O MCULE-1707127587 [1,0,0,1,0,0|1,0,0]=3 1843 B9R1.33 COCC1CCCC1N MCULE-2339282845 [1,0,0,1,0,0|2,0,0]=4 1844 B9R1.33 COC[C@@H]1CCC[C@@H]1N MCULE-2489009816 [1,0,0,1,0,0|2,0,0]=4 1845 B9R1.33 COC[C@@H]1CCC[C@@H]1N MCULE-5278260852 [1,0,0,1,0,0|2,0,0]=4 1846 B9R1.33 COC[C@H]1CCC[C@H]1N MCULE-1111361143 [1,0,0,1,0,0|2,0,0]=4 1847 B9R1.33 COC[C@H]1CCC[C@H]1N MCULE-2193207837 [1,0,0,1,0,0|2,0,0]=4 1848 B9R1.33 NC1CCCC1CCO MCULE-4115683269 [1,0,0,1,0,0|1,0,0]=3 1849 B9R1.33 OCCC1CCCC1O MCULE-2038693822 [1,0,0,1,0,0|1,0,0]=3 1850 B9R1.50 BrC1CCCCCCC1 MCULE-9261673111 [1,0,0,1,0,0|1,0,0]=3 1851 B9R1.50 NC1CCCCCCC1 MCULE-6537375543 [1,0,0,1,0,0|1,0,0]=3 1852 B9R1.50 NC1CCCCCNC1 MCULE-8217686828 [1,0,0,1,0,0|2,0,0]=4 1853 B9R1.50 O=C1CCCCCCC1 MCULE-1352803313 [1,0,0,1,0,0|0,0,2]=4 1854 B9R1.50 O=C1CCCCCCO1 MCULE-5149380112 [1,0,0,1,0,0|1,0,1]=4 1855 B9R1.50 OC1C=CCCCCC1 MCULE-1181214133 [1,0,0,1,0,0|0,0,2]=4 1856 B9R1.50 OC1CCC=CCCC1 MCULE-1736825337 [1,0,0,1,0,0|0,0,2]=4 1857 B9R1.50 OC1CCC=CCCC1 MCULE-6297988885 [1,0,0,1,0,0|0,0,2]=4 1858 B9R1.50 OC1CCCCCCC1 MCULE-7379371136 [1,0,0,1,0,0|0,0,0]=2 1859 B9R1.50 OC1CNCCCNC1 MCULE-3177425947 [1,0,0,1,0,0|2,0,0]=4 1860 B9R1.50 OC1CNCCCNC1 MCULE-5698562435 [1,0,0,1,0,0|2,0,0]=4 1861 B9R1.50 OC1CSCCCSC1 MCULE-8296129342 [1,0,0,1,0,0|2,0,0]=4 1862 B9R1.50 O[C@@H]1CCC=CCCC1 MCULE-2143953157 [1,0,0,1,0,0|0,0,2]=4 1863 B9R1.50 O[C@H]1CCC=CCCC1 MCULE-9747750449 [1,0,0,1,0,0|0,0,2]=4 1864 B9R1.83 BrCCCCCC1CC1 MCULE-9842709492 [1,0,0,1,0,0|1,0,0]=3 1865 B9R1.83 BrCCCOCC1CC1 MCULE-9124002570 [1,0,0,1,0,0|2,0,0]=4 1866 B9R1.83 C=CCCCCC1CO1 MCULE-4552301872 [1,0,0,1,0,0|0,0,2]=4 1867 B9R1.83 CCCCCCC1CO1 MCULE-5253323325 [1,0,0,1,0,0|0,0,0]=2 1868 B9R1.83 CCCCCC[C@H]1CO1 MCULE-2693826692 [1,0,0,1,0,0|0,0,0]=2 1869 B9R1.83 CCCCOCC1CO1 MCULE-6294765769 [1,0,0,1,0,0|1,0,0]=3 1870 B9R1.83 COCCOCC1CO1 MCULE-3263450391 [1,0,0,1,0,0|2,0,0]=4 1871 B9R1.83 NCCCOCC1CC1 MCULE-8775774364 [1,0,0,1,0,0|2,0,0]=4 1872 B9R1.83 OCCCCNC1CC1 MCULE-7073557287 [1,0,0,1,0,0|1,0,0]=3 1873 B9R1.83 OCCCNCC1CC1 MCULE-4930726062 [1,0,0,1,0,0|1,0,0]=3 1874 B9R1.83 OCCCOCC1CC1 MCULE-1186093976 [1,0,0,1,0,0|1,0,0]=3 1875 B9R1.83 OCCCOCC1CO1 MCULE-9629508633 [1,0,0,1,0,0|2,0,0]=4 1876 B9R1.83 OCCCSCC1CC1 MCULE-6467928586 [1,0,0,1,0,0|1,0,0]=3 1877 B9R1.83 OCCNCCC1CC1 MCULE-2523773581 [1,0,0,1,0,0|1,0,0]=3 1878 B9R1.89 BrCC1CCCCCC1 MCULE-3804149088 [1,0,0,1,0,0|1,0,0]=3 1879 B9R1.89 BrCC1OCCCCO1 MCULE-3435142846 [1,0,0,1,0,0|2,0,0]=4 1880 B9R1.89 C#CC1CCCCCC1 MCULE-7810681377 [1,0,0,1,0,0|1,0,1]=4 1881 B9R1.89 CCC1CCCCCN1 MCULE-9043964617 [1,0,0,1,0,0|1,0,0]=3 1882 B9R1.89 CCC1CCCNCC1 MCULE-1208066309 [1,0,0,1,0,0|2,0,0]=4 1883 B9R1.89 CCC1CNCCCO1 MCULE-5736441757 [1,0,0,1,0,0|1,0,0]=3 1884 B9R1.89 CCN1CCCCCC1 MCULE-1193924766 [1,0,0,1,0,0|2,0,0]=4 1885 B9R1.89 CNC1CCCCCC1 MCULE-3477928342 [1,0,0,1,0,0|2,0,0]=4 1886 B9R1.89 CNC1CCCCCC1 MCULE-9182986806 [1,0,0,1,0,0|2,0,0]=4 1887 B9R1.89 ClCC1CCCCCN1 MCULE-7509075716 [1,0,0,1,0,0|2,0,0]=4 1888 B9R1.89 ClCC1CCCCCN1 MCULE-9950332690 [1,0,0,1,0,0|2,0,0]=4 1889 B9R1.89 FCC1CCNCCO1 MCULE-2885724612 [1,0,0,1,0,0|2,0,0]=4 1890 B9R1.89 FCC1CCNCCO1 MCULE-5255949130 [1,0,0,1,0,0|2,0,0]=4 1891 B9R1.89 FCC1CNCCCO1 MCULE-4304507356 [1,0,0,1,0,0|2,0,0]=4 1892 B9R1.89 FCC1CNCCCO1 MCULE-5204425397 [1,0,0,1,0,0|2,0,0]=4 1893 B9R1.89 ICC1CCCCCO1 MCULE-8717458528 [1,0,0,1,0,0|1,0,0]=3 1894 B9R1.89 N#CC1CCCCCC1 MCULE-4572641162 [1,0,0,1,0,0|1,0,1]=4 1895 B9R1.89 NCC1CCCCCC1 MCULE-6071072186 [1,0,0,1,0,0|1,0,0]=3 1896 B9R1.89 NCC1CCCCCC1 MCULE-8981470928 [1,0,0,1,0,0|1,0,0]=3 1897 B9R1.89 NCC1CCCCNC1 MCULE-7705035602 [1,0,0,1,0,0|2,0,0]=4 1898 B9R1.89 NCC1CCCCNC1 MCULE-8170909949 [1,0,0,1,0,0|2,0,0]=4 1899 B9R1.89 NNC1CCCCCC1 MCULE-1821259900 [1,0,0,1,0,0|2,0,0]=4 1900 B9R1.89 NNC1CCCCCC1 MCULE-6325204009 [1,0,0,1,0,0|2,0,0]=4 1901 B9R1.89 NNC1CCCCCC1 MCULE-7894671218 [1,0,0,1,0,0|2,0,0]=4 1902 B9R1.89 O=CC1CCCCCC1 MCULE-2750232256 [1,0,0,1,0,0|0,0,2]=4 1903 B9R1.89 OCC1CCC=CCC1 MCULE-1974756879 [1,0,0,1,0,0|0,0,2]=4 1904 B9R1.89 OCC1CCCCCC1 MCULE-1749370417 [1,0,0,1,0,0|0,0,0]=2 1905 B9R1.89 OCC1CCCCCC1 MCULE-2629813419 [1,0,0,1,0,0|0,0,0]=2 1906 B9R1.89 OCC1CCCCCN1 MCULE-1586506984 [1,0,0,1,0,0|1,0,0]=3 1907 B9R1.89 OCC1CCCCNC1 MCULE-1649629703 [1,0,0,1,0,0|1,0,0]=3 1908 B9R1.89 OCC1CCCCNC1 MCULE-6297064506 [1,0,0,1,0,0|1,0,0]=3 1909 B9R1.89 OCC1CCCNCC1 MCULE-1276268438 [1,0,0,1,0,0|1,0,0]=3 1910 B9R1.89 OCC1CCCNCC1 MCULE-6937244427 [1,0,0,1,0,0|1,0,0]=3 1911 B9R1.89 OCC1CCNCCO1 MCULE-9176508562 [1,0,0,1,0,0|2,0,0]=4 1912 B9R1.89 OCC1CNCCCO1 MCULE-7903525804 [1,0,0,1,0,0|2,0,0]=4 1913 B9R1.89 OCC1CNCCCO1 MCULE-9908272497 [1,0,0,1,0,0|2,0,0]=4 1914 B9R1.89 OCC1CNCCOC1 MCULE-9049672869 [1,0,0,1,0,0|2,0,0]=4 1915 B9R1.89 OCC1COCCOC1 MCULE-3330785002 [1,0,0,1,0,0|2,0,0]=4 1916 B9R1.89 OC[C@@H]1CCCCCN1 MCULE-3068262302 [1,0,0,1,0,0|1,0,0]=3 1917 B9R1.89 OC[C@@H]1CNCCCO1 MCULE-3544932007 [1,0,0,1,0,0|2,0,0]=4 1918 B9R1.89 OC[C@@H]1CNCCCO1 MCULE-4726628241 [1,0,0,1,0,0|2,0,0]=4 1919 B9R1.89 OC[C@@H]1CNCCCO1 MCULE-5225680882 [1,0,0,1,0,0|2,0,0]=4 1920 B9R1.89 OC[C@@H]1CNCCCO1 MCULE-5475510815 [1,0,0,1,0,0|2,0,0]=4 1921 B9R1.89 OC[C@H]1CNCCCO1 MCULE-2922219127 [1,0,0,1,0,0|2,0,0]=4 1922 B9R1.89 OC[C@H]1CNCCCO1 MCULE-3177968218 [1,0,0,1,0,0|2,0,0]=4 1923 B9R1.89 OC[C@H]1CNCCCO1 MCULE-3793527665 [1,0,0,1,0,0|2,0,0]=4 1924 B9R1.89 OC[C@H]1CNCCCO1 MCULE-7260252629 [1,0,0,1,0,0|2,0,0]=4 1925 B9R1.89 ON=C1CCCCCC1 MCULE-4992018002 [1,0,0,1,0,0|1,0,1]=4 1926 B9R1.103 C1CCCCNCCC1 MCULE-3201088280 [1,0,0,1,0,0|1,0,0]=3 1927 B9R1.1 CCC1CCC(CC1)C MCULE-2653372010 [1,0,0,1,0,0|2,0,0]=4 1928 B9R1.1 CCC1CCC(CC1)N MCULE-3699342075 [1,0,0,1,0,0|2,0,0]=4 1929 B9R1.1 CCC1CCC(CC1)N MCULE-8941706723 [1,0,0,1,0,0|2,0,0]=4 1930 B9R1.1 CCC1CCC(CC1)O MCULE-8097752772 [1,0,0,1,0,0|1,0,0]=3 1931 B9R1.1 CCC1CNC(CO1)C MCULE-7865619397 [1,0,0,1,0,0|2,0,0]=4 1932 B9R1.1 CCN1CCC(CC1)O MCULE-9813710535 [1,0,0,1,0,0|2,0,0]=4 1933 B9R1.1 CC[C@H]1CC[C@@H](CC1)N MCULE-4018920391 [1,0,0,1,0,0|2,0,0]=4 1934 B9R1.1 CC[C@H]1CC[C@@H](CC1)N MCULE-6650148008 [1,0,0,1,0,0|2,0,0]=4 1935 B9R1.1 CC[C@H]1CC[C@@H](CC1)O MCULE-2707983247 [1,0,0,1,0,0|1,0,0]=3 1936 B9R1.1 CC[C@H]1CC[C@H](CC1)N MCULE-9970355250 [1,0,0,1,0,0|2,0,0]=4 1937 B9R1.1 CC[C@H]1CC[C@H](CC1)O MCULE-2491233696 [1,0,0,1,0,0|1,0,0]=3 1938 B9R1.1 CNC1CCC(CC1)O MCULE-4830228871 [1,0,0,1,0,0|2,0,0]=4 1939 B9R1.1 CNC1CCC(CC1)O MCULE-6477610530 [1,0,0,1,0,0|2,0,0]=4 1940 B9R1.1 CN[C@H]1CC[C@@H](CC1)O MCULE-1022113223 [1,0,0,1,0,0|2,0,0]=4 1941 B9R1.1 CN[C@H]1CC[C@@H](CC1)O MCULE-1356433778 [1,0,0,1,0,0|2,0,0]=4 1942 B9R1.1 CN[C@H]1CC[C@H](CC1)O MCULE-1490699426 [1,0,0,1,0,0|2,0,0]=4 1943 B9R1.1 CN[C@H]1CC[C@H](CC1)O MCULE-7508857663 [1,0,0,1,0,0|2,0,0]=4 1944 B9R1.1 COC1CCC(CC1)O MCULE-7486081080 [1,0,0,1,0,0|2,0,0]=4 1945 B9R1.1 CO[C@H]1CC[C@@H](CC1)O MCULE-6913861887 [1,0,0,1,0,0|2,0,0]=4 1946 B9R1.1 NC1CCC(OC1)CO MCULE-4245301257 [1,0,0,1,0,0|2,0,0]=4 1947 B9R1.1 NC1CCC(OC1)CO MCULE-4483575448 [1,0,0,1,0,0|2,0,0]=4 1948 B9R1.1 NCC1CCC(CC1)O MCULE-1773102107 [1,0,0,1,0,0|2,0,0]=4 1949 B9R1.1 NCC1CCC(CC1)O MCULE-3605496824 [1,0,0,1,0,0|2,0,0]=4 1950 B9R1.1 NCC1CCC(CO1)O MCULE-3286854000 [1,0,0,1,0,0|1,0,0]=3 1951 B9R1.1 NC[C@H]1CC[C@@H](CC1)O MCULE-3725371515 [1,0,0,1,0,0|2,0,0]=4 1952 B9R1.1 NC[C@H]1CC[C@@H](CC1)O MCULE-3796180406 [1,0,0,1,0,0|2,0,0]=4 1953 B9R1.1 NC[C@H]1CC[C@H](CC1)O MCULE-6015230551 [1,0,0,1,0,0|2,0,0]=4 1954 B9R1.1 NC[C@H]1CC[C@H](CC1)O MCULE-9189660845 [1,0,0,1,0,0|2,0,0]=4 1955 B9R1.1 N[C@@H]1CC[C@H](OC1)CO MCULE-5075594203 [1,0,0,1,0,0|2,0,0]=4 1956 B9R1.1 N[C@@H]1CC[C@H](OC1)CO MCULE-6987959950 [1,0,0,1,0,0|2,0,0]=4 1957 B9R1.1 N[C@H]1CC[C@H](OC1)CO MCULE-2411909324 [1,0,0,1,0,0|2,0,0]=4 1958 B9R1.1 OC1CCC(CC1)CCl MCULE-3310167491 [1,0,0,1,0,0|2,0,0]=4 1959 B9R1.1 OCC1CCC(CC1)O MCULE-2821884453 [1,0,0,1,0,0|2,0,0]=4 1960 B9R1.1 OCC1CCC(CO1)O MCULE-4333559257 [1,0,0,1,0,0|1,0,0]=3 1961 B9R1.1 OC[C@H]1CC[C@@H](CC1)O MCULE-4903112146 [1,0,0,1,0,0|2,0,0]=4 1962 B9R1.1 OC[C@H]1CC[C@H](CC1)O MCULE-5364161264 [1,0,0,1,0,0|2,0,0]=4 1963 B9R1.2 C1(CCCN(C1)C)CO MCULE-7393298394 [1,0,0,1,0,0|2,0,0]=4 1964 B9R1.2 CC1CC(CCO1)CO MCULE-1147018894 [1,0,0,1,0,0|2,0,0]=4 1965 B9R1.2 CC1CCCC(C1)CBr MCULE-4436738297 [1,0,0,1,0,0|2,0,0]=4 1966 B9R1.2 CC1CCCC(C1)CN MCULE-5692325071 [1,0,0,1,0,0|2,0,0]=4 1967 B9R1.2 CC1CCCC(C1)CO MCULE-5618525751 [1,0,0,1,0,0|1,0,0]=3 1968 B9R1.2 CC1CCCC(N1)CO MCULE-1132392693 [1,0,0,1,0,0|1,0,0]=3 1969 B9R1.2 CC1CCCC(O1)CN MCULE-9065375307 [1,0,0,1,0,0|1,0,0]=3 1970 B9R1.2 CC1CNCC(C1)CO MCULE-1604083581 [1,0,0,1,0,0|2,0,0]=4 1971 B9R1.2 CC1CNCC(O1)CO MCULE-6915504187 [1,0,0,1,0,0|1,0,0]=3 1972 B9R1.2 CCC1CCCC(C1)C MCULE-6755768980 [1,0,0,1,0,0|2,0,0]=4 1973 B9R1.2 CCC1CNCC(O1)C MCULE-6402129304 [1,0,0,1,0,0|2,0,0]=4 1974 B9R1.2 CC[C@@H]1CCC[C@@H](N1)C MCULE-4368459266 [1,0,0,1,0,0|2,0,0]=4 1975 B9R1.2 CC[C@H]1CNC[C@H](O1)C MCULE-1726802726 [1,0,0,1,0,0|2,0,0]=4 1976 B9R1.2 CN1CCCC(C1)CO MCULE-1489029640 [1,0,0,1,0,0|2,0,0]=4 1977 B9R1.2 CN1CCC[C@@H](C1)CO MCULE-7399583774 [1,0,0,1,0,0|2,0,0]=4 1978 B9R1.2 CN1CCC[C@@H](C1)CO MCULE-9308847454 [1,0,0,1,0,0|2,0,0]=4 1979 B9R1.2 CN1CCC[C@H](C1)CO MCULE-1288636914 [1,0,0,1,0,0|2,0,0]=4 1980 B9R1.2 CN1CCC[C@H](C1)CO MCULE-7586480861 [1,0,0,1,0,0|2,0,0]=4 1981 B9R1.2 C[C@@H]1CNC[C@H](O1)CO MCULE-4030187082 [1,0,0,1,0,0|1,0,0]=3 1982 B9R1.2 C[C@@H]1CNC[C@H](O1)CO MCULE-8521542499 [1,0,0,1,0,0|1,0,0]=3 1983 B9R1.2 C[C@@H]1C[C@@H](CCN1)CO MCULE-8058559032 [1,0,0,1,0,0|2,0,0]=4 1984 B9R1.2 C[C@@H]1C[C@@H](CCN1)CO MCULE-9351987850 [1,0,0,1,0,0|2,0,0]=4 1985 B9R1.2 C[C@H]1CNC[C@H](O1)CO MCULE-6331587635 [1,0,0,1,0,0|1,0,0]=3 1986 B9R1.2 C[C@H]1CNC[C@H](O1)CO MCULE-6791243811 [1,0,0,1,0,0|1,0,0]=3 1987 B9R1.2 NC1CCCC(C1)CO MCULE-1724466395 [1,0,0,1,0,0|2,0,0]=4 1988 B9R1.2 NC1CCCC(C1)CO MCULE-8087216563 [1,0,0,1,0,0|2,0,0]=4 1989 B9R1.2 N[C@@H]1CCC[C@@H](C1)CO MCULE-1617324917 [1,0,0,1,0,0|2,0,0]=4 1990 B9R1.2 N[C@@H]1CCC[C@@H](C1)CO MCULE-8272213010 [1,0,0,1,0,0|2,0,0]=4 1991 B9R1.2 N[C@@H]1CCC[C@H](C1)CO MCULE-2296534416 [1,0,0,1,0,0|2,0,0]=4 1992 B9R1.2 N[C@@H]1CCC[C@H](C1)CO MCULE-5952407491 [1,0,0,1,0,0|2,0,0]=4 1993 B9R1.2 N[C@@H]1CCC[C@H](C1)CO MCULE-6614147143 [1,0,0,1,0,0|2,0,0]=4 1994 B9R1.2 N[C@H]1CCC[C@@H](C1)CO MCULE-2015163295 [1,0,0,1,0,0|2,0,0]=4 1995 B9R1.2 N[C@H]1CCC[C@@H](C1)CO MCULE-3293475931 [1,0,0,1,0,0|2,0,0]=4 1996 B9R1.2 N[C@H]1CCC[C@H](C1)CO MCULE-1868841620 [1,0,0,1,0,0|2,0,0]=4 1997 B9R1.2 N[C@H]1CCC[C@H](C1)CO MCULE-6949082967 [1,0,0,1,0,0|2,0,0]=4 1998 B9R1.2 N[C@H]1CCC[C@H](C1)CO MCULE-9275476449 [1,0,0,1,0,0|2,0,0]=4 1999 B9R1.2 [C@H]1(CNC[C@@H](O1)CO)C MCULE-4259776230 [1,0,0,1,0,0|1,0,0]=3 2000 B9R1.3 C1(CCNC(C1C)C)O MCULE-7157710103 [1,0,0,1,0,0|2,0,0]=4 2001 B9R1.3 C1(CCNC(C1C)C)O MCULE-8288554330 [1,0,0,1,0,0|2,0,0]=4 2002 B9R1.3 CC1CCCC(C1C)C MCULE-9375072995 [1,0,0,1,0,0|2,0,0]=4 2003 B9R1.3 CC1CCCC(C1C)N MCULE-7085283833 [1,0,0,1,0,0|2,0,0]=4 2004 B9R1.3 CC1CCCC(C1C)O MCULE-1285216829 [1,0,0,1,0,0|1,0,0]=3 2005 B9R1.3 CC1CCCC(C1N)C MCULE-4904455493 [1,0,0,1,0,0|2,0,0]=4 2006 B9R1.3 CC1CCCC(C1N)C MCULE-9589109711 [1,0,0,1,0,0|2,0,0]=4 2007 B9R1.3 CC1CCCC(C1O)C MCULE-8568932421 [1,0,0,1,0,0|1,0,0]=3 2008 B9R1.3 CC1CNCC(C1O)C MCULE-6809685999 [1,0,0,1,0,0|2,0,0]=4 2009 B9R1.3 CC1CNCC(C1O)C MCULE-8043720997 [1,0,0,1,0,0|2,0,0]=4 2010 B9R1.3 CC1OCCC(C1O)O MCULE-6494583965 [1,0,0,1,0,0|1,0,0]=3 2011 B9R1.3 C[C@@H]1CNC[C@@H]([C@@H]1O)O MCULE-4065345114 [1,0,0,1,0,0|1,0,0]=3 2012 B9R1.3 C[C@@H]1CNC[C@@H]([C@@H]1O)O MCULE-5732596905 [1,0,0,1,0,0|1,0,0]=3 2013 B9R1.3 C[C@H]1CNC[C@@H]([C@@H]1O)O MCULE-3640440568 [1,0,0,1,0,0|1,0,0]=3 2014 B9R1.3 C[C@H]1CNC[C@@H]([C@@H]1O)O MCULE-9501528896 [1,0,0,1,0,0|1,0,0]=3 2015 B9R1.3 NC1C(CCCC1O)O MCULE-1978359416 [1,0,0,1,0,0|2,0,0]=4 2016 B9R1.3 N[C@@H]1CCC[C@H]([C@@H]1O)O MCULE-7294484287 [1,0,0,1,0,0|1,0,0]=3 2017 B9R1.3 N[C@H]1CCC[C@@H]([C@@H]1O)O MCULE-4901407173 [1,0,0,1,0,0|1,0,0]=3 2018 B9R1.3 N[C@H]1CCC[C@H]([C@@H]1O)O MCULE-2706489441 [1,0,0,1,0,0|1,0,0]=3 2019 B9R1.3 OC1CCCC(C1O)O MCULE-2835511427 [1,0,0,1,0,0|1,0,0]=3 2020 B9R1.3 [C@@H]1(CCC[C@H]([C@@H]1N)O)O MCULE-9327450801 [1,0,0,1,0,0|2,0,0]=4 2021 B9R1.7 CCCC1OCC(O1)C MCULE-3762914452 [1,0,0,1,0,0|2,0,0]=4 2022 B9R1.7 COCC1CC(CN1)O MCULE-1719796553 [1,0,0,1,0,0|2,0,0]=4 2023 B9R1.7 COCC1CC(CN1)O MCULE-2828004706 [1,0,0,1,0,0|2,0,0]=4 2024 B9R1.7 COC[C@@H]1C[C@@H](CN1)O MCULE-4903855773 [1,0,0,1,0,0|2,0,0]=4 2025 B9R1.7 COC[C@@H]1C[C@@H](CN1)O MCULE-5035930973 [1,0,0,1,0,0|2,0,0]=4 2026 B9R1.7 COC[C@@H]1C[C@H](CN1)O MCULE-1656210028 [1,0,0,1,0,0|2,0,0]=4 2027 B9R1.7 COC[C@@H]1C[C@H](CN1)O MCULE-8717772588 [1,0,0,1,0,0|2,0,0]=4 2028 B9R1.7 COC[C@H]1C[C@H](CN1)O MCULE-7483280166 [1,0,0,1,0,0|2,0,0]=4 2029 B9R1.7 COC[C@H]1C[C@H](CN1)O MCULE-7672691308 [1,0,0,1,0,0|2,0,0]=4 2030 B9R1.7 NCCC1CC[C@H](C1)O MCULE-3758609813 [1,0,0,1,0,0|2,0,0]=4 2031 B9R1.7 NCC[C@H]1CC[C@H](C1)O MCULE-7245034683 [1,0,0,1,0,0|2,0,0]=4 2032 B9R1.11 C#CC(O)C1CCCC1 MCULE-2991189926 [1,0,0,1,0,0|1,0,1]=4 2033 B9R1.11 C=CC(O)C1CCCC1 MCULE-8096299119 [1,0,0,1,0,0|1,0,1]=4 2034 B9R1.11 CC(CBr)C1CCCC1 MCULE-7239123079 [1,0,0,1,0,0|2,0,0]=4 2035 B9R1.11 CC(CO)N1CCCC1 MCULE-2818984547 [1,0,0,1,0,0|2,0,0]=4 2036 B9R1.11 CCC(N)C1CCCC1 MCULE-2018376160 [1,0,0,1,0,0|2,0,0]=4 2037 B9R1.11 C[C@@H](CO)N1CCCC1 MCULE-3412759469 [1,0,0,1,0,0|2,0,0]=4 2038 B9R1.11 C[C@H](CO)N1CCCC1 MCULE-3282668740 [1,0,0,1,0,0|2,0,0]=4 2039 B9R1.11 NC(CO)C1CCCC1 MCULE-3542083676 [1,0,0,1,0,0|1,0,0]=3 2040 B9R1.11 NC(CO)C1CCCC1 MCULE-5931245443 [1,0,0,1,0,0|1,0,0]=3 2041 B9R1.11 NC(CO)C1CCCO1 MCULE-1115414738 [1,0,0,1,0,0|2,0,0]=4 2042 B9R1.11 NC(CO)C1CCOC1 MCULE-3949685203 [1,0,0,1,0,0|2,0,0]=4 2043 B9R1.11 NC(CO)C1CCOC1 MCULE-7535404270 [1,0,0,1,0,0|2,0,0]=4 2044 B9R1.11 NCC(F)C1CCCC1 MCULE-2563707089 [1,0,0,1,0,0|2,0,0]=4 2045 B9R1.11 NCC(F)C1CCCC1 MCULE-5929697460 [1,0,0,1,0,0|2,0,0]=4 2046 B9R1.11 NCC(N)C1CCCC1 MCULE-6437780642 [1,0,0,1,0,0|2,0,0]=4 2047 B9R1.11 NCC(O)C1CCCC1 MCULE-1826088467 [1,0,0,1,0,0|1,0,0]=3 2048 B9R1.11 NCC(O)C1CCCC1 MCULE-5186127631 [1,0,0,1,0,0|1,0,0]=3 2049 B9R1.11 NCC(O)C1CCCO1 MCULE-1674634827 [1,0,0,1,0,0|2,0,0]=4 2050 B9R1.11 NCC(O)C1CCOC1 MCULE-2353712692 [1,0,0,1,0,0|2,0,0]=4 2051 B9R1.11 NCC(O)C1CCOC1 MCULE-2647033518 [1,0,0,1,0,0|2,0,0]=4 2052 B9R1.11 N[C@H](CO)C1CCCC1 MCULE-1672080667 [1,0,0,1,0,0|1,0,0]=3 2053 B9R1.11 N[C@H](CO)C1CCCC1 MCULE-2468572391 [1,0,0,1,0,0|1,0,0]=3 2054 B9R1.11 N[C@H](CO)C1CCCC1 MCULE-9200212417 [1,0,0,1,0,0|1,0,0]=3 2055 B9R1.21 CCN1CCC(C1)CO MCULE-9507301668 [1,0,0,1,0,0|2,0,0]=4 2056 B9R1.21 CCN1CC[C@@H](C1)CO MCULE-4701790174 [1,0,0,1,0,0|2,0,0]=4 2057 B9R1.21 CCN1CC[C@H](C1)CO MCULE-2438276159 [1,0,0,1,0,0|2,0,0]=4 2058 B9R1.21 NCC1CCC(O1)CN MCULE-4000228398 [1,0,0,1,0,0|2,0,0]=4 2059 B9R1.21 NC[C@@H]1CC[C@@H](O1)CN MCULE-4187719094 [1,0,0,1,0,0|2,0,0]=4 2060 B9R1.21 OCC1CCC(N1)CO MCULE-1103775354 [1,0,0,1,0,0|2,0,0]=4 2061 B9R1.21 OCC1CCC(O1)CO MCULE-3334782559 [1,0,0,1,0,0|1,0,0]=3 2062 B9R1.21 OC[C@@H]1CC[C@@H](O1)CO MCULE-5217154467 [1,0,0,1,0,0|1,0,0]=3 2063 B9R1.49 CC1CCCC(CC1)N MCULE-7634847223 [1,0,0,1,0,0|2,0,0]=4 2064 B9R1.49 CC1CCCC(NC1)C MCULE-1631903049 [1,0,0,1,0,0|2,0,0]=4 2065 B9R1.49 CN1CCCC(CC1)O MCULE-6133611762 [1,0,0,1,0,0|2,0,0]=4 2066 B9R1.49 CN1CCCC(CC1)O MCULE-6589317799 [1,0,0,1,0,0|2,0,0]=4 2067 B9R1.49 CN1CCC[C@@H](CC1)O MCULE-2532340714 [1,0,0,1,0,0|2,0,0]=4 2068 B9R1.49 CN1CCC[C@H](CC1)O MCULE-6867682041 [1,0,0,1,0,0|2,0,0]=4 2069 B9R1.49 NC1CCCC(CC1)O MCULE-5371360262 [1,0,0,1,0,0|2,0,0]=4 2070 B9R1.49 NC1CCCC(CC1)O MCULE-7262958041 [1,0,0,1,0,0|2,0,0]=4 2071 B9R1.49 N[C@@H]1CCC[C@@H](CC1)O MCULE-1133973283 [1,0,0,1,0,0|2,0,0]=4 2072 B9R1.49 N[C@@H]1CCC[C@@H](CC1)O MCULE-4169090989 [1,0,0,1,0,0|2,0,0]=4 2073 B9R1.49 N[C@@H]1CCC[C@H](CC1)O MCULE-2007393276 [1,0,0,1,0,0|2,0,0]=4 2074 B9R1.49 N[C@H]1CCC[C@@H](CC1)O MCULE-2524209060 [1,0,0,1,0,0|2,0,0]=4 2075 B9R1.49 N[C@H]1CCC[C@H](CC1)O MCULE-3889106863 [1,0,0,1,0,0|2,0,0]=4 2076 B9R1.58 CCOC1CC(C1)CO MCULE-8200075252 [1,0,0,1,0,0|2,0,0]=4 2077 B9R1.79 NC(CO)CC1CCC1 MCULE-2309333579 [1,0,0,1,0,0|1,0,0]=3 2078 B9R1.79 NC(CO)CC1CCC1 MCULE-6676177211 [1,0,0,1,0,0|1,0,0]=3 2079 B9R1.79 NCC(F)CC1CCC1 MCULE-6989081385 [1,0,0,1,0,0|2,0,0]=4 2080 B9R1.79 NCC(F)CC1CCC1 MCULE-8217653310 [1,0,0,1,0,0|2,0,0]=4 2081 B9R1.118 C#CC1(CCCCC1)O MCULE-8943429628 [1,0,0,1,0,0|1,0,1]=4 2082 B9R1.118 C=CC1(CCCCC1)O MCULE-7521116261 [1,0,0,1,0,0|1,0,1]=4 2083 B9R1.118 CC1(CCCCC1)CBr MCULE-2357240305 [1,0,0,1,0,0|2,0,0]=4 2084 B9R1.118 CC1(CCCCC1)CCl MCULE-9584097812 [1,0,0,1,0,0|2,0,0]=4 2085 B9R1.118 CC1(CCCCC1)CN MCULE-1723013704 [1,0,0,1,0,0|2,0,0]=4 2086 B9R1.118 CC1(CCCCC1)CO MCULE-7082905261 [1,0,0,1,0,0|1,0,0]=3 2087 B9R1.118 CC1(CCCCC1)CS MCULE-4716166156 [1,0,0,1,0,0|1,1,0]=4 2088 B9R1.118 CC1(CCCCN1)CO MCULE-2480758252 [1,0,0,1,0,0|2,0,0]=4 2089 B9R1.118 CC1(CCCCN1)CO MCULE-4992390900 [1,0,0,1,0,0|2,0,0]=4 2090 B9R1.118 CC1(CCCCO1)CO MCULE-1474953219 [1,0,0,1,0,0|2,0,0]=4 2091 B9R1.118 CC1(CCCNC1)CO MCULE-7859652987 [1,0,0,1,0,0|2,0,0]=4 2092 B9R1.118 CC1(CCCNC1)CO MCULE-9138617665 [1,0,0,1,0,0|2,0,0]=4 2093 B9R1.118 CC1(CCCOC1)CO MCULE-5818698089 [1,0,0,1,0,0|2,0,0]=4 2094 B9R1.118 CC1(CCNCC1)CO MCULE-4193945417 [1,0,0,1,0,0|2,0,0]=4 2095 B9R1.118 CC1(CCNCC1)CO MCULE-6270876419 [1,0,0,1,0,0|2,0,0]=4 2096 B9R1.118 CC1(CCOCC1)CO MCULE-5535447172 [1,0,0,1,0,0|2,0,0]=4 2097 B9R1.118 CCC1(CCCCC1)Cl MCULE-5513648578 [1,0,0,1,0,0|2,0,0]=4 2098 B9R1.118 CCC1(CCCCC1)N MCULE-3886661042 [1,0,0,1,0,0|2,0,0]=4 2099 B9R1.118 CCC1(CCCCC1)N MCULE-3921643203 [1,0,0,1,0,0|2,0,0]=4 2100 B9R1.118 CCC1(CCCCC1)O MCULE-9314704343 [1,0,0,1,0,0|1,0,0]=3 2101 B9R1.118 CCC1(CCCNC1)O MCULE-2359766186 [1,0,0,1,0,0|2,0,0]=4 2102 B9R1.118 CCC1(CCCNC1)O MCULE-4654641315 [1,0,0,1,0,0|2,0,0]=4 2103 B9R1.118 CCC1(CCNCC1)O MCULE-5103122746 [1,0,0,1,0,0|2,0,0]=4 2104 B9R1.118 CCC1(CCNCC1)O MCULE-8900140051 [1,0,0,1,0,0|2,0,0]=4 2105 B9R1.118 C[C@@]1(CCCNC1)CO MCULE-2002234086 [1,0,0,1,0,0|2,0,0]=4 2106 B9R1.118 C[C@@]1(CCCNC1)CO MCULE-7671897310 [1,0,0,1,0,0|2,0,0]=4 2107 B9R1.118 FC1(CCCCC1)CBr MCULE-6400317289 [1,0,0,1,0,0|2,0,0]=4 2108 B9R1.118 N#CC1(CCCCC1)O MCULE-5791427313 [1,0,0,1,0,0|1,0,1]=4 2109 B9R1.118 NC1(CCCCC1)CO MCULE-5010483791 [1,0,0,1,0,0|1,0,0]=3 2110 B9R1.118 NC1(CCCCC1)CO MCULE-9568898546 [1,0,0,1,0,0|1,0,0]=3 2111 B9R1.118 NC1(CCNCC1)CO MCULE-4957450788 [1,0,0,1,0,0|2,0,0]=4 2112 B9R1.118 NC1(CCNCC1)CO MCULE-8808091761 [1,0,0,1,0,0|2,0,0]=4 2113 B9R1.118 NC1(CCOCC1)CO MCULE-5523370445 [1,0,0,1,0,0|2,0,0]=4 2114 B9R1.118 NC1(CCOCC1)CO MCULE-7081316740 [1,0,0,1,0,0|2,0,0]=4 2115 B9R1.118 NC1(CCSCC1)CO MCULE-3751635501 [1,0,0,1,0,0|2,0,0]=4 2116 B9R1.118 NC1(CCSCC1)CO MCULE-5887780207 [1,0,0,1,0,0|2,0,0]=4 2117 B9R1.118 NCC1(CCCCC1)F MCULE-7965775019 [1,0,0,1,0,0|2,0,0]=4 2118 B9R1.118 NCC1(CCCCC1)F MCULE-8275233201 [1,0,0,1,0,0|2,0,0]=4 2119 B9R1.118 NCC1(CCCCC1)N MCULE-1440012619 [1,0,0,1,0,0|2,0,0]=4 2120 B9R1.118 NCC1(CCCCC1)N MCULE-4904885698 [1,0,0,1,0,0|2,0,0]=4 2121 B9R1.118 NCC1(CCCCC1)N MCULE-5203944425 [1,0,0,1,0,0|2,0,0]=4 2122 B9R1.118 NCC1(CCCCC1)O MCULE-2235926257 [1,0,0,1,0,0|1,0,0]=3 2123 B9R1.118 NCC1(CCCCC1)O MCULE-3554445977 [1,0,0,1,0,0|1,0,0]=3 2124 B9R1.118 NCC1(CCCOC1)O MCULE-3380684017 [1,0,0,1,0,0|2,0,0]=4 2125 B9R1.118 NCC1(CCNCC1)O MCULE-2751818260 [1,0,0,1,0,0|2,0,0]=4 2126 B9R1.118 NCC1(CCOCC1)O MCULE-2766533080 [1,0,0,1,0,0|2,0,0]=4 2127 B9R1.118 NCC1(CCOCC1)O MCULE-9208911413 [1,0,0,1,0,0|2,0,0]=4 2128 B9R1.118 NCC1(CCSCC1)O MCULE-9397305788 [1,0,0,1,0,0|2,0,0]=4 2129 B9R1.118 OC1(CCCCC1)CBr MCULE-3269466977 [1,0,0,1,0,0|1,0,0]=3 2130 B9R1.118 OC1(CCCNC1)CF MCULE-8890034237 [1,0,0,1,0,0|2,0,0]=4 2131 B9R1.118 OC1(CCCNC1)CF MCULE-9294734195 [1,0,0,1,0,0|2,0,0]=4 2132 B9R1.118 OC1(CCNCC1)CF MCULE-5603599172 [1,0,0,1,0,0|2,0,0]=4 2133 B9R1.118 OC1(CCNCC1)CF MCULE-7125873306 [1,0,0,1,0,0|2,0,0]=4 2134 B9R1.118 OC1(CCOCC1)CBr MCULE-2440342395 [1,0,0,1,0,0|2,0,0]=4 2135 B9R1.118 OCC1(CCCCC1)F MCULE-6893319227 [1,0,0,1,0,0|1,0,0]=3 2136 B9R1.118 OCC1(CCCCC1)O MCULE-4401054903 [1,0,0,1,0,0|0,0,0]=2 2137 B9R1.118 OCC1(CCCCC1)S MCULE-4689452330 [1,0,0,1,0,0|0,1,0]=3 2138 B9R1.118 OCC1(CCCNC1)F MCULE-1604953146 [1,0,0,1,0,0|2,0,0]=4 2139 B9R1.118 OCC1(CCCNC1)F MCULE-2701254971 [1,0,0,1,0,0|2,0,0]=4 2140 B9R1.118 OCC1(CCCNC1)O MCULE-2181561679 [1,0,0,1,0,0|1,0,0]=3 2141 B9R1.118 OCC1(CCCNC1)O MCULE-5468132031 [1,0,0,1,0,0|1,0,0]=3 2142 B9R1.118 OCC1(CCCOC1)F MCULE-7902519614 [1,0,0,1,0,0|2,0,0]=4 2143 B9R1.118 OCC1(CCNCC1)F MCULE-1911530330 [1,0,0,1,0,0|2,0,0]=4 2144 B9R1.118 OCC1(CCNCC1)F MCULE-6594830680 [1,0,0,1,0,0|2,0,0]=4 2145 B9R1.118 OCC1(CCNCC1)O MCULE-5825046102 [1,0,0,1,0,0|1,0,0]=3 2146 B9R1.118 OCC1(CCNCC1)O MCULE-9697641993 [1,0,0,1,0,0|1,0,0]=3 2147 B9R1.118 OCC1(CCOCC1)F MCULE-6397920040 [1,0,0,1,0,0|2,0,0]=4 2148 B9R1.118 OCC1(CCOCC1)O MCULE-9700422902 [1,0,0,1,0,0|1,0,0]=3 2149 B9R1.118 OCC1(CCSCC1)O MCULE-9917132643 [1,0,0,1,0,0|1,0,0]=3 2150 B9R1.118 OC[C@@]1(CCCNC1)F MCULE-1828463699 [1,0,0,1,0,0|2,0,0]=4 2151 B9R1.118 OC[C@]1(CCCNC1)F MCULE-1994723738 [1,0,0,1,0,0|2,0,0]=4 2152 B9R1.118 OC[C@]1(CCCNC1)F MCULE-5822647493 [1,0,0,1,0,0|2,0,0]=4 2153 B9R1.118 OC[C@]1(CCCNC1)F MCULE-6498345493 [1,0,0,1,0,0|2,0,0]=4 2154 B9R1.118 OC[C@]1(CCCNC1)F MCULE-7704795376 [1,0,0,1,0,0|2,0,0]=4 2155 B9R1.132 OCC1NCC(C1O)O MCULE-7093172739 [1,0,0,1,0,0|2,0,0]=4 2156 B9R1.132 OCC1NCC(C1O)O MCULE-9377849443 [1,0,0,1,0,0|2,0,0]=4 2157 B9R1.132 OCC1OCC(C1O)O MCULE-6035918255 [1,0,0,1,0,0|2,0,0]=4 2158 B9R1.132 OC[C@@H]1OC[C@H]([C@H]1O)O MCULE-5977248366 [1,0,0,1,0,0|2,0,0]=4 2159 B9R1.132 OC[C@H]1NC[C@@H]([C@@H]1O)O MCULE-1707860323 [1,0,0,1,0,0|2,0,0]=4 2160 B9R1.132 OC[C@H]1NC[C@@H]([C@@H]1O)O MCULE-3279393618 [1,0,0,1,0,0|2,0,0]=4 2161 B9R1.132 OC[C@H]1NC[C@@H]([C@@H]1O)O MCULE-8001939489 [1,0,0,1,0,0|2,0,0]=4 2162 B9R1.132 OC[C@H]1NC[C@@H]([C@@H]1O)O MCULE-9735967120 [1,0,0,1,0,0|2,0,0]=4 2163 B9R1.132 OC[C@H]1NC[C@H]([C@@H]1O)O MCULE-2264267716 [1,0,0,1,0,0|2,0,0]=4 2164 B9R1.132 OC[C@H]1NC[C@H]([C@@H]1O)O MCULE-3690741497 [1,0,0,1,0,0|2,0,0]=4 2165 B9R1.132 OC[C@H]1NC[C@H]([C@H]1O)O MCULE-1695946114 [1,0,0,1,0,0|2,0,0]=4 2166 B9R1.132 OC[C@H]1NC[C@H]([C@H]1O)O MCULE-4767198765 [1,0,0,1,0,0|2,0,0]=4 2167 B9R1.132 OC[C@H]1NC[C@H]([C@H]1O)O MCULE-7740799111 [1,0,0,1,0,0|2,0,0]=4 2168 B9R1.132 OC[C@H]1NC[C@H]([C@H]1O)O MCULE-9816210484 [1,0,0,1,0,0|2,0,0]=4 2169 B9R1.132 OC[C@H]1OC[C@@H]([C@@H]1O)O MCULE-2426542638 [1,0,0,1,0,0|2,0,0]=4 2170 B9R1.132 OC[C@H]1OC[C@@H]([C@H]1O)O MCULE-2697830391 [1,0,0,1,0,0|2,0,0]=4 2171 B9R1.132 OC[C@H]1OC[C@@H]([C@H]1O)O MCULE-3664631398 [1,0,0,1,0,0|2,0,0]=4 2172 B9R1.132 OC[C@H]1SC[C@@H]([C@@H]1O)O MCULE-5460809648 [1,0,0,1,0,0|2,0,0]=4 2173 B9R1.202 CC1CCCC1(C)CN MCULE-5501074724 [1,0,0,1,0,0|2,0,0]=4 2174 B9R1.202 CC1CCCC1(O)CN MCULE-5192081064 [1,0,0,1,0,0|1,0,0]=3 2175 B9R1.202 CC1CNCC1(C)CO MCULE-3212764422 [1,0,0,1,0,0|2,0,0]=4 2176 B9R1.202 CC1CNCC1(C)CO MCULE-9218006550 [1,0,0,1,0,0|2,0,0]=4 2177 B9R1.202 CC1OCCC1(O)CN MCULE-1109816284 [1,0,0,1,0,0|2,0,0]=4 2178 B9R1.6 CC(=O)C1CCCCC1 MCULE-3582349091 [1,0,0,1,0,0|0,0,2]=4 2179 B9R1.6 CC(Br)C1CCCCC1 MCULE-5485461450 [1,0,0,1,0,0|1,0,0]=3 2180 B9R1.6 CC(Br)C1CCOCC1 MCULE-2885349407 [1,0,0,1,0,0|2,0,0]=4 2181 B9R1.6 CC(C)C1CCCCC1 MCULE-6669359076 [1,0,0,1,0,0|1,0,0]=3 2182 B9R1.6 CC(C)C1CCCCN1 MCULE-3649476695 [1,0,0,1,0,0|2,0,0]=4 2183 B9R1.6 CC(C)C1CCCCN1 MCULE-8304532068 [1,0,0,1,0,0|2,0,0]=4 2184 B9R1.6 CC(C)C1CCCNC1 MCULE-3359180558 [1,0,0,1,0,0|2,0,0]=4 2185 B9R1.6 CC(C)C1CCCNC1 MCULE-3374264203 [1,0,0,1,0,0|2,0,0]=4 2186 B9R1.6 CC(C)C1CCNCC1 MCULE-1833211783 [1,0,0,1,0,0|2,0,0]=4 2187 B9R1.6 CC(C)C1CCNCC1 MCULE-6057674641 [1,0,0,1,0,0|2,0,0]=4 2188 B9R1.6 CC(N)C1CCCCC1 MCULE-1505914332 [1,0,0,1,0,0|1,0,0]=3 2189 B9R1.6 CC(N)C1CCCCC1 MCULE-2391650892 [1,0,0,1,0,0|1,0,0]=3 2190 B9R1.6 CC(N)C1CCCCC1 MCULE-4413711215 [1,0,0,1,0,0|1,0,0]=3 2191 B9R1.6 CC(N)C1CCCCN1 MCULE-2177574791 [1,0,0,1,0,0|2,0,0]=4 2192 B9R1.6 CC(N)C1CCCCO1 MCULE-8387374309 [1,0,0,1,0,0|2,0,0]=4 2193 B9R1.6 CC(N)C1CCCCO1 MCULE-9971513933 [1,0,0,1,0,0|2,0,0]=4 2194 B9R1.6 CC(N)C1CCCNC1 MCULE-8605982838 [1,0,0,1,0,0|2,0,0]=4 2195 B9R1.6 CC(N)C1CCOCC1 MCULE-5593271672 [1,0,0,1,0,0|2,0,0]=4 2196 B9R1.6 CC(N)C1CCOCC1 MCULE-5702288480 [1,0,0,1,0,0|2,0,0]=4 2197 B9R1.6 CC(O)C1CCCCC1 MCULE-5078012753 [1,0,0,1,0,0|0,0,0]=2 2198 B9R1.6 CC(O)C1CCCCN1 MCULE-2559324365 [1,0,0,1,0,0|1,0,0]=3 2199 B9R1.6 CC(O)C1CCCNC1 MCULE-2671166499 [1,0,0,1,0,0|1,0,0]=3 2200 B9R1.6 CC(O)C1CCCNC1 MCULE-3528761801 [1,0,0,1,0,0|1,0,0]=3 2201 B9R1.6 CC(O)C1CCNCC1 MCULE-4584203332 [1,0,0,1,0,0|1,0,0]=3 2202 B9R1.6 CC(O)C1CCNCC1 MCULE-5499145407 [1,0,0,1,0,0|1,0,0]=3 2203 B9R1.6 CC(O)C1CCNCC1 MCULE-6172957789 [1,0,0,1,0,0|1,0,0]=3 2204 B9R1.6 CC(O)C1CCNCC1 MCULE-9287143291 [1,0,0,1,0,0|1,0,0]=3 2205 B9R1.6 CC(O)C1CCOCC1 MCULE-9618372743 [1,0,0,1,0,0|1,0,0]=3 2206 B9R1.6 CC(O)C1CNCCN1 MCULE-7562437820 [1,0,0,1,0,0|2,0,0]=4 2207 B9R1.6 CC(O)C1CNCCO1 MCULE-5611108274 [1,0,0,1,0,0|2,0,0]=4 2208 B9R1.6 CC(S)C1CCCCC1 MCULE-3622234308 [1,0,0,1,0,0|0,1,0]=3 2209 B9R1.6 CN(C)C1CCCCC1 MCULE-9944021193 [1,0,0,1,0,0|2,0,0]=4 2210 B9R1.6 CN(N)C1CCCCC1 MCULE-6781931520 [1,0,0,1,0,0|2,0,0]=4 2211 B9R1.6 CN(N)C1CCCCC1 MCULE-9101477929 [1,0,0,1,0,0|2,0,0]=4 2212 B9R1.6 CS(=O)C1CCCCC1 MCULE-4263908685 [1,0,0,1,0,0|1,0,1]=4 2213 B9R1.6 C[C@@H](N)C1CCCCC1 MCULE-3071844374 [1,0,0,1,0,0|1,0,0]=3 2214 B9R1.6 C[C@@H](N)C1CCCCC1 MCULE-6526660266 [1,0,0,1,0,0|1,0,0]=3 2215 B9R1.6 C[C@@H](N)C1CCCCC1 MCULE-8321480556 [1,0,0,1,0,0|1,0,0]=3 2216 B9R1.6 C[C@@H](N)C1CCCCC1 MCULE-8767179050 [1,0,0,1,0,0|1,0,0]=3 2217 B9R1.6 C[C@@H](N)C1CCCCO1 MCULE-3320469003 [1,0,0,1,0,0|2,0,0]=4 2218 B9R1.6 C[C@@H](N)C1CCCCO1 MCULE-9895193081 [1,0,0,1,0,0|2,0,0]=4 2219 B9R1.6 C[C@@H](N)C1CCOCC1 MCULE-4515239461 [1,0,0,1,0,0|2,0,0]=4 2220 B9R1.6 C[C@@H](N)C1CCOCC1 MCULE-6385146166 [1,0,0,1,0,0|2,0,0]=4 2221 B9R1.6 C[C@@H](N)C1CCOCC1 MCULE-6860563920 [1,0,0,1,0,0|2,0,0]=4 2222 B9R1.6 C[C@@H](O)C1CCCCC1 MCULE-4304404236 [1,0,0,1,0,0|0,0,0]=2 2223 B9R1.6 C[C@@H](O)C1CCCCC1 MCULE-7854211857 [1,0,0,1,0,0|0,0,0]=2 2224 B9R1.6 C[C@@H](O)C1CCNCC1 MCULE-1752623068 [1,0,0,1,0,0|1,0,0]=3 2225 B9R1.6 C[C@@H](O)C1CCNCC1 MCULE-2316047131 [1,0,0,1,0,0|1,0,0]=3 2226 B9R1.6 C[C@@H](O)C1CCNCC1 MCULE-9451593770 [1,0,0,1,0,0|1,0,0]=3 2227 B9R1.6 C[C@@H](O)C1CCOCC1 MCULE-1246138653 [1,0,0,1,0,0|1,0,0]=3 2228 B9R1.6 C[C@@H](O)C1CCOCC1 MCULE-5178620559 [1,0,0,1,0,0|1,0,0]=3 2229 B9R1.6 C[C@@H](O)[C@H]1CNCCN1 MCULE-2168214783 [1,0,0,1,0,0|2,0,0]=4 2230 B9R1.6 C[C@@H](O)[C@H]1CNCCN1 MCULE-8290718551 [1,0,0,1,0,0|2,0,0]=4 2231 B9R1.6 C[C@H](N)C1CCCCC1 MCULE-1031735669 [1,0,0,1,0,0|1,0,0]=3 2232 B9R1.6 C[C@H](N)C1CCCCC1 MCULE-3061879771 [1,0,0,1,0,0|1,0,0]=3 2233 B9R1.6 C[C@H](N)C1CCCCC1 MCULE-7933942708 [1,0,0,1,0,0|1,0,0]=3 2234 B9R1.6 C[C@H](N)C1CCCCC1 MCULE-8070329731 [1,0,0,1,0,0|1,0,0]=3 2235 B9R1.6 C[C@H](N)C1CCOCC1 MCULE-3755735101 [1,0,0,1,0,0|2,0,0]=4 2236 B9R1.6 C[C@H](N)C1CCOCC1 MCULE-7744978094 [1,0,0,1,0,0|2,0,0]=4 2237 B9R1.6 C[C@H](N)C1CCOCC1 MCULE-8529221046 [1,0,0,1,0,0|2,0,0]=4 2238 B9R1.6 C[C@H](O)C1CCCCC1 MCULE-9702860419 [1,0,0,1,0,0|0,0,0]=2 2239 B9R1.6 C[C@H](O)C1CCNCC1 MCULE-2198012011 [1,0,0,1,0,0|1,0,0]=3 2240 B9R1.6 C[C@H](O)C1CCNCC1 MCULE-7131345979 [1,0,0,1,0,0|1,0,0]=3 2241 B9R1.6 C[C@H](O)C1CCOCC1 MCULE-4135856134 [1,0,0,1,0,0|1,0,0]=3 2242 B9R1.6 O=C(O)C1CCCCC1 MCULE-2193918964 [1,0,0,1,0,0|0,0,2]=4 2243 B9R1.6 O=S(O)C1CCCCC1 MCULE-2447383910 [1,0,0,1,0,0|1,0,1]=4 2244 B9R1.6 OB(O)C1CCCCC1 MCULE-7463281328 [1,0,0,1,0,0|1,0,0]=3 2245 B9R1.6 OB(O)C1CCCNC1 MCULE-9145993336 [1,0,0,1,0,0|2,0,0]=4 2246 B9R1.6 OB(O)C1CCCOC1 MCULE-5502913518 [1,0,0,1,0,0|2,0,0]=4 2247 B9R1.6 OB(O)C1CCNCC1 MCULE-6477872801 [1,0,0,1,0,0|2,0,0]=4 2248 B9R1.6 OB(O)C1CCNCC1 MCULE-6629356175 [1,0,0,1,0,0|2,0,0]=4 2249 B9R1.6 OB(O)C1CCOCC1 MCULE-5917553399 [1,0,0,1,0,0|2,0,0]=4 2250 B9R1.9 COCCN1CC(C1)O MCULE-3307968235 [1,0,0,1,0,0|2,0,0]=4 2251 B9R1.9 NCCCN1CC(C1)O MCULE-8415029828 [1,0,0,1,0,0|2,0,0]=4 2252 B9R1.9 OC1CN(C1)CCCF MCULE-3734847421 [1,0,0,1,0,0|2,0,0]=4 2253 B9R1.13 CC(=O)CC1CCCC1 MCULE-5830536761 [1,0,0,1,0,0|0,0,2]=4 2254 B9R1.13 CC(C)CC1CCCN1 MCULE-1997095742 [1,0,0,1,0,0|2,0,0]=4 2255 B9R1.13 CC(C)CC1CCCN1 MCULE-6128010231 [1,0,0,1,0,0|2,0,0]=4 2256 B9R1.13 CC(C)CC1CCNC1 MCULE-5350353606 [1,0,0,1,0,0|2,0,0]=4 2257 B9R1.13 CC(C)CC1CCNC1 MCULE-9967174010 [1,0,0,1,0,0|2,0,0]=4 2258 B9R1.13 CC(C)NC1CCCC1 MCULE-4690363657 [1,0,0,1,0,0|2,0,0]=4 2259 B9R1.13 CC(C)NC1CCCC1 MCULE-4763641972 [1,0,0,1,0,0|2,0,0]=4 2260 B9R1.13 CC(Cl)CC1CCOC1 MCULE-4225742998 [1,0,0,1,0,0|2,0,0]=4 2261 B9R1.13 CC(N)CC1CCCC1 MCULE-7070144052 [1,0,0,1,0,0|1,0,0]=3 2262 B9R1.13 CC(N)CC1CCCO1 MCULE-7603248274 [1,0,0,1,0,0|2,0,0]=4 2263 B9R1.13 CC(N)CC1CCOC1 MCULE-6823189326 [1,0,0,1,0,0|2,0,0]=4 2264 B9R1.13 CC(N)CN1CCCC1 MCULE-3580195064 [1,0,0,1,0,0|2,0,0]=4 2265 B9R1.13 CC(N)CN1CCCC1 MCULE-8859795461 [1,0,0,1,0,0|2,0,0]=4 2266 B9R1.13 CC(O)CC1CCCN1 MCULE-7800705257 [1,0,0,1,0,0|1,0,0]=3 2267 B9R1.13 CC(O)CC1CCOC1 MCULE-4873864951 [1,0,0,1,0,0|1,0,0]=3 2268 B9R1.13 CC(O)CN1CCCC1 MCULE-9204952142 [1,0,0,1,0,0|1,0,0]=3 2269 B9R1.13 C[C@H](N)CN1CCCC1 MCULE-3878391581 [1,0,0,1,0,0|2,0,0]=4 2270 B9R1.13 C[C@H](N)CN1CCCC1 MCULE-9482061465 [1,0,0,1,0,0|2,0,0]=4 2271 B9R1.13 C[C@H](O)CN1CCCC1 MCULE-5532103843 [1,0,0,1,0,0|1,0,0]=3 2272 B9R1.13 O=C(O)CC1CCCC1 MCULE-1115751804 [1,0,0,1,0,0|0,0,2]=4 2273 B9R1.13 OB(O)CC1CCCC1 MCULE-5721807920 [1,0,0,1,0,0|1,0,0]=3 2274 B9R1.24 CC1(CCCC1CN)C MCULE-2825475131 [1,0,0,1,0,0|2,0,0]=4 2275 B9R1.24 CC1(CCCC1CO)C MCULE-4941414251 [1,0,0,1,0,0|2,0,0]=4 2276 B9R1.24 CC1(CCCC1CO)N MCULE-2343642043 [1,0,0,1,0,0|2,0,0]=4 2277 B9R1.24 CC1(CCCC1CO)N MCULE-9579192803 [1,0,0,1,0,0|2,0,0]=4 2278 B9R1.40 CC1(CCCCC1N)C MCULE-5951764286 [1,0,0,1,0,0|2,0,0]=4 2279 B9R1.40 CC1(CCCCC1N)O MCULE-5300265774 [1,0,0,1,0,0|1,0,0]=3 2280 B9R1.40 CC1(CCCCC1O)C MCULE-1365001070 [1,0,0,1,0,0|2,0,0]=4 2281 B9R1.40 CC1(CCNCC1F)O MCULE-5705747944 [1,0,0,1,0,0|2,0,0]=4 2282 B9R1.40 CC1(CCNCC1F)O MCULE-9734438039 [1,0,0,1,0,0|2,0,0]=4 2283 B9R1.40 CC1(CCOCC1O)O MCULE-9069325911 [1,0,0,1,0,0|2,0,0]=4 2284 B9R1.40 CC1CCCCC1(C)N MCULE-4488389841 [1,0,0,1,0,0|1,0,0]=3 2285 B9R1.40 CC1CCCCC1(F)F MCULE-7532748980 [1,0,0,1,0,0|2,0,0]=4 2286 B9R1.40 CC1CCNCC1(C)C MCULE-9805063465 [1,0,0,1,0,0|2,0,0]=4 2287 B9R1.40 CC1CCNCC1(C)O MCULE-6091048331 [1,0,0,1,0,0|1,0,0]=3 2288 B9R1.40 CC1CCNCC1(C)O MCULE-7827878467 [1,0,0,1,0,0|1,0,0]=3 2289 B9R1.40 CC1CNCCC1(C)O MCULE-3050558506 [1,0,0,1,0,0|1,0,0]=3 2290 B9R1.40 CC1CNCCC1(C)O MCULE-7122670765 [1,0,0,1,0,0|1,0,0]=3 2291 B9R1.40 CC1NCCCC1(C)C MCULE-8207946127 [1,0,0,1,0,0|2,0,0]=4 2292 B9R1.40 C[C@@H]1CCNC[C@@]1(C)O MCULE-2566777989 [1,0,0,1,0,0|1,0,0]=3 2293 B9R1.40 C[C@@H]1CCNC[C@@]1(C)O MCULE-7280139378 [1,0,0,1,0,0|1,0,0]=3 2294 B9R1.40 C[C@@H]1CCNC[C@]1(C)O MCULE-1559795322 [1,0,0,1,0,0|1,0,0]=3 2295 B9R1.40 C[C@@H]1CCNC[C@]1(C)O MCULE-6569914928 [1,0,0,1,0,0|1,0,0]=3 2296 B9R1.40 C[C@@]1(CCOC[C@H]1O)O MCULE-3803598208 [1,0,0,1,0,0|2,0,0]=4 2297 B9R1.40 C[C@H]1CCNC[C@@]1(C)O MCULE-1130241051 [1,0,0,1,0,0|1,0,0]=3 2298 B9R1.40 C[C@H]1CCNC[C@@]1(C)O MCULE-3222740777 [1,0,0,1,0,0|1,0,0]=3 2299 B9R1.40 C[C@H]1CCNC[C@]1(C)O MCULE-1911925525 [1,0,0,1,0,0|1,0,0]=3 2300 B9R1.40 C[C@H]1CCNC[C@]1(C)O MCULE-9810022632 [1,0,0,1,0,0|1,0,0]=3 2301 B9R1.40 C[C@]1(CCNC[C@@H]1F)O MCULE-4175201190 [1,0,0,1,0,0|2,0,0]=4 2302 B9R1.40 OC1(CCOCC1F)O MCULE-5129581737 [1,0,0,1,0,0|2,0,0]=4 2303 B9R1.40 OC1(CCOC[C@@H]1F)O MCULE-4768109328 [1,0,0,1,0,0|2,0,0]=4 2304 B9R1.40 [C@@H]1(CNCC[C@@]1(C)O)F MCULE-9928833237 [1,0,0,1,0,0|2,0,0]=4 2305 B9R1.41 CC(C)C1CCCC1N MCULE-5814373788 [1,0,0,1,0,0|2,0,0]=4 2306 B9R1.41 CC(O)C1CCCN1C MCULE-1709841217 [1,0,0,1,0,0|1,0,0]=3 2307 B9R1.41 CC1CCCC1C(=O)O MCULE-5150428001 [1,0,0,1,0,0|0,0,2]=4 2308 B9R1.41 C[C@H](O)[C@@H]1CCCN1C MCULE-3481136719 [1,0,0,1,0,0|1,0,0]=3 2309 B9R1.41 C[C@H](O)[C@@H]1CCCN1C MCULE-8355283874 [1,0,0,1,0,0|1,0,0]=3 2310 B9R1.48 CC1CCCCC(=O)C1 MCULE-5791948972 [1,0,0,1,0,0|0,0,2]=4 2311 B9R1.48 CC1CCCCC(N1)C MCULE-5797406782 [1,0,0,1,0,0|1,0,0]=3 2312 B9R1.48 CN1CCCCC(C1)N MCULE-8384083495 [1,0,0,1,0,0|2,0,0]=4 2313 B9R1.48 CN1CCOCC(C1)O MCULE-1541124940 [1,0,0,1,0,0|2,0,0]=4 2314 B9R1.48 CN1CCOCC(C1)O MCULE-6224231752 [1,0,0,1,0,0|2,0,0]=4 2315 B9R1.48 C[C@@H]1CCCC[C@H](N1)C MCULE-7954748247 [1,0,0,1,0,0|1,0,0]=3 2316 B9R1.48 C[C@H]1CCCC[C@@H](N1)C MCULE-2719547061 [1,0,0,1,0,0|1,0,0]=3 2317 B9R1.48 C[C@H]1CCCC[C@H](N1)C MCULE-7122277223 [1,0,0,1,0,0|1,0,0]=3 2318 B9R1.48 NC1CCCCC(C1)O MCULE-5548192102 [1,0,0,1,0,0|1,0,0]=3 2319 B9R1.48 NC1CCCCC(C1)O MCULE-8953029807 [1,0,0,1,0,0|1,0,0]=3 2320 B9R1.48 N[C@@H]1CCCC[C@@H](C1)O MCULE-7609350144 [1,0,0,1,0,0|1,0,0]=3 2321 B9R1.48 N[C@@H]1CCCC[C@@H](C1)O MCULE-9626764594 [1,0,0,1,0,0|1,0,0]=3 2322 B9R1.48 N[C@@H]1CCCC[C@H](C1)O MCULE-4772681431 [1,0,0,1,0,0|1,0,0]=3 2323 B9R1.48 N[C@@H]1CCCC[C@H](C1)O MCULE-6968396232 [1,0,0,1,0,0|1,0,0]=3 2324 B9R1.48 N[C@H]1CCCC[C@@H](C1)O MCULE-4503660630 [1,0,0,1,0,0|1,0,0]=3 2325 B9R1.48 N[C@H]1CCCC[C@@H](C1)O MCULE-4564760854 [1,0,0,1,0,0|1,0,0]=3 2326 B9R1.48 N[C@H]1CCCC[C@H](C1)O MCULE-2271050688 [1,0,0,1,0,0|1,0,0]=3 2327 B9R1.48 N[C@H]1CCCC[C@H](C1)O MCULE-7801993304 [1,0,0,1,0,0|1,0,0]=3 2328 B9R1.59 CCCC1CC1C(=O)O MCULE-5011491615 [1,0,0,1,0,0|0,0,2]=4 2329 B9R1.59 CCC[C@@H]1C[C@@H]1C(=O)O MCULE-8208745989 [1,0,0,1,0,0|0,0,2]=4 2330 B9R1.59 CCC[C@@H]1C[C@H]1C(=O)O MCULE-1448060038 [1,0,0,1,0,0|0,0,2]=4 2331 B9R1.59 CCC[C@H]1C[C@H]1C(=O)O MCULE-6634735984 [1,0,0,1,0,0|0,0,2]=4 2332 B9R1.67 CC(O)CC1CCC1=O MCULE-5157418140 [1,0,0,1,0,0|1,0,1]=4 2333 B9R1.77 CC1(CC1CCCO)C MCULE-7584967346 [1,0,0,1,0,0|2,0,0]=4 2334 B9R1.77 CC1(C[C@@H]1CCCBr)C MCULE-9247146400 [1,0,0,1,0,0|2,0,0]=4 2335 B9R1.84 CC(C)NCC1CCC1 MCULE-3956788595 [1,0,0,1,0,0|2,0,0]=4 2336 B9R1.84 CC(C)NCC1CCC1 MCULE-5029492953 [1,0,0,1,0,0|2,0,0]=4 2337 B9R1.84 O=C(O)CCC1CCC1 MCULE-5780532364 [1,0,0,1,0,0|0,0,2]=4 2338 B9R1.85 CC(C)CCNC1CC1 MCULE-5912195683 [1,0,0,1,0,0|2,0,0]=4 2339 B9R1.85 CC(C)CCNC1CC1 MCULE-6493421017 [1,0,0,1,0,0|2,0,0]=4 2340 B9R1.85 CC(C)CNCC1CC1 MCULE-2546937575 [1,0,0,1,0,0|2,0,0]=4 2341 B9R1.85 CC(C)CNCC1CC1 MCULE-3801277935 [1,0,0,1,0,0|2,0,0]=4 2342 B9R1.85 CC(N)COCC1CC1 MCULE-9401123532 [1,0,0,1,0,0|2,0,0]=4 2343 B9R1.85 O=C(O)CCCC1CC1 MCULE-4019156455 [1,0,0,1,0,0|0,0,2]=4 2344 B9R1.86 CCC1CC1CC(=O)O MCULE-9659162510 [1,0,0,1,0,0|0,0,2]=4 2345 B9R1.148 CC1(CCCCCC1)N MCULE-1779116362 [1,0,0,1,0,0|1,0,0]=3 2346 B9R1.148 CC1(CCCCCC1)N MCULE-5391477735 [1,0,0,1,0,0|1,0,0]=3 2347 B9R1.148 CC1(CCCCCC1)O MCULE-5108307354 [1,0,0,1,0,0|0,0,0]=2 2348 B9R1.148 CC1(CCCCNC1)C MCULE-5568533519 [1,0,0,1,0,0|2,0,0]=4 2349 B9R1.148 CC1(CCCCNC1)F MCULE-2828709987 [1,0,0,1,0,0|2,0,0]=4 2350 B9R1.148 CC1(CCCCNC1)F MCULE-5791441123 [1,0,0,1,0,0|2,0,0]=4 2351 B9R1.148 CC1(CCCCNC1)O MCULE-3442956887 [1,0,0,1,0,0|1,0,0]=3 2352 B9R1.148 CC1(CCCCNC1)O MCULE-8578810557 [1,0,0,1,0,0|1,0,0]=3 2353 B9R1.148 CC1(CCCNCC1)C MCULE-6478466697 [1,0,0,1,0,0|2,0,0]=4 2354 B9R1.148 CC1(CCCNCC1)C MCULE-8225608765 [1,0,0,1,0,0|2,0,0]=4 2355 B9R1.148 CC1(CCCNCC1)F MCULE-7938264867 [1,0,0,1,0,0|2,0,0]=4 2356 B9R1.148 CC1(CCCNCC1)F MCULE-8871866901 [1,0,0,1,0,0|2,0,0]=4 2357 B9R1.148 CC1(CCCNCC1)O MCULE-5871089190 [1,0,0,1,0,0|1,0,0]=3 2358 B9R1.148 CC1(CCCNCC1)O MCULE-9618304213 [1,0,0,1,0,0|1,0,0]=3 2359 B9R1.148 CC1(CNCCOC1)O MCULE-5821906686 [1,0,0,1,0,0|2,0,0]=4 2360 B9R1.148 CC1(CNCCOC1)O MCULE-7620136387 [1,0,0,1,0,0|2,0,0]=4 2361 B9R1.148 C[C@@]1(CCCNCC1)O MCULE-2380155794 [1,0,0,1,0,0|1,0,0]=3 2362 B9R1.148 C[C@@]1(CCCNCC1)O MCULE-8167005767 [1,0,0,1,0,0|1,0,0]=3 2363 B9R1.148 C[N+]1(CCCCCC1)C MCULE-1829260472 [1,0,0,1,0,0|2,0,0]=4 2364 B9R1.148 C[N+]1(CCCCCC1)C MCULE-7950987433 [1,0,0,1,0,0|2,0,0]=4 2365 B11R1.4 BrCCCCCC1OCCO1 MCULE-8481039787 [0,1,0,1,0,0|2,0,0]=4 2366 B11R1.4 CCCCCCC1OCCO1 MCULE-4454812568 [0,1,0,1,0,0|1,0,0]=3 2367 B11R1.16 C/C=C/C(O)C1CCCCC1 MCULE-8388524100 [0,1,0,1,0,0|1,0,1]=4 2368 B11R1.16 CC(CCO)C1CCNCC1 MCULE-4667043187 [0,1,0,1,0,0|2,0,0]=4 2369 B11R1.16 CC=CC(O)C1CCCCC1 MCULE-5525729146 [0,1,0,1,0,0|1,0,1]=4 2370 B11R1.16 CCCC(N)C1CCCCC1 MCULE-6305435948 [0,1,0,1,0,0|2,0,0]=4 2371 B11R1.16 CCCC(O)C1CCCCC1 MCULE-3498852587 [0,1,0,1,0,0|1,0,0]=3 2372 B11R1.16 CNCC(C)C1CCCCC1 MCULE-4133409108 [0,1,0,1,0,0|2,0,0]=4 2373 B11R1.16 CNCC(C)C1CCCCC1 MCULE-5714312893 [0,1,0,1,0,0|2,0,0]=4 2374 B11R1.16 COCC(C)C1CCNCC1 MCULE-8557987202 [0,1,0,1,0,0|2,0,0]=4 2375 B11R1.16 COCC(C)C1CCNCC1 MCULE-9125222604 [0,1,0,1,0,0|2,0,0]=4 2376 B11R1.16 COCC(N)C1CCCOC1 MCULE-7227780316 [0,1,0,1,0,0|2,0,0]=4 2377 B11R1.16 COCC(N)C1CCOCC1 MCULE-1769870668 [0,1,0,1,0,0|2,0,0]=4 2378 B11R1.16 NC(CCO)C1CCCCC1 MCULE-7245890915 [0,1,0,1,0,0|1,0,0]=3 2379 B11R1.16 NC(CCO)C1CCCCC1 MCULE-9884454535 [0,1,0,1,0,0|1,0,0]=3 2380 B11R1.16 NC(CCO)C1CCOCC1 MCULE-2681332250 [0,1,0,1,0,0|2,0,0]=4 2381 B11R1.16 NC(CCO)C1CCOCC1 MCULE-5518851913 [0,1,0,1,0,0|2,0,0]=4 2382 B11R1.16 NCCC(O)C1CCCCC1 MCULE-3023173021 [0,1,0,1,0,0|1,0,0]=3 2383 B11R1.16 O=C(CCO)C1CCCCC1 MCULE-2427892471 [0,1,0,1,0,0|0,0,2]=4 2384 B11R1.16 O=CCC(O)C1CCCCC1 MCULE-1523208411 [0,1,0,1,0,0|0,0,1]=3 2385 B11R1.16 OCCC(O)C1CCNCC1 MCULE-8204754878 [0,1,0,1,0,0|1,0,0]=3 2386 B11R1.26 COC1CCCCCCC1N MCULE-2038984012 [0,1,0,1,0,0|1,0,0]=3 2387 B11R1.30 CN(CCO)CC1CCCC1 MCULE-7621451892 [0,1,0,1,0,0|2,0,0]=4 2388 B11R1.81 CCCC1CCC(CC1O)C MCULE-8092215749 [0,1,0,1,0,0|1,0,0]=3 2389 B11R1.101 NC1CCCCCCCCC1 MCULE-7140828852 [0,1,0,1,0,0|2,0,0]=4 2390 B11R1.101 NC1CCCCCCCCC1 MCULE-9762725860 [0,1,0,1,0,0|2,0,0]=4 2391 B11R1.117 C=CCC1CCCCCCC1 MCULE-5863038923 [0,1,0,1,0,0|2,0,0]=4 2392 B11R1.117 CNCC1CCCCCCC1 MCULE-3882363434 [0,1,0,1,0,0|2,0,0]=4 2393 B11R1.117 NCCC1CCCCCCC1 MCULE-5038195827 [0,1,0,1,0,0|2,0,0]=4 2394 B11R1.117 NCCC1CCCCCCC1 MCULE-9743664308 [0,1,0,1,0,0|2,0,0]=4 2395 B11R1.127 CCOC1CCC(O1)OCC MCULE-4343258004 [0,1,0,1,0,0|2,0,0]=4 2396 B11R1.127 COCC1CCC(N1)COC MCULE-2821499582 [0,1,0,1,0,0|2,0,0]=4 2397 B11R1.127 COC[C@H]1CC[C@@H](N1)COC MCULE-9297339716 [0,1,0,1,0,0|2,0,0]=4 2398 B11R1.180 CCCCCC1CCCC1O MCULE-7690407093 [0,1,0,1,0,0|1,0,0]=3 2399 B11R1.189 CCCN1CCCC(C1)CN MCULE-6248259699 [0,1,0,1,0,0|2,0,0]=4 2400 B11R1.189 CCCN1CCCC(C1)CO MCULE-9984784416 [0,1,0,1,0,0|1,0,0]=3 2401 B11R1.189 NCCN1CCCC(C1)CO MCULE-5781068198 [0,1,0,1,0,0|2,0,0]=4 2402 B11R1.779 CNCC1(CCCCCC1)O MCULE-3086055624 [0,1,0,1,0,0|1,0,0]=3 2403 B11R1.779 CNCC1(CCCCCC1)O MCULE-8624621987 [0,1,0,1,0,0|1,0,0]=3 2404 B11R1.779 COCC1(CCCNCC1)O MCULE-9598261809 [0,1,0,1,0,0|1,0,0]=3 2405 B11R1.8 OCC1CC(CC(C1O)Cl)Cl MCULE-3853525351 [0,1,0,1,0,0|2,0,0]=4 2406 B11R1.8 OCC1OC(CC(C1O)O)O MCULE-7274763429 [0,1,0,1,0,0|2,0,0]=4 2407 B11R1.8 OC[C@H]1OC(C[C@H]([C@@H]1O)O)O MCULE-5781268479 [0,1,0,1,0,0|2,0,0]=4 2408 B11R1.8 OC[C@H]1OC(C[C@H]([C@@H]1O)O)O MCULE-6452818005 [0,1,0,1,0,0|2,0,0]=4 2409 B11R1.8 OC[C@H]1OC(C[C@H]([C@H]1O)O)O MCULE-2042257317 [0,1,0,1,0,0|2,0,0]=4 2410 B11R1.8 OC[C@H]1OC(C[C@H]([C@H]1O)O)O MCULE-7003907088 [0,1,0,1,0,0|2,0,0]=4 2411 B11R1.9 CC1CC(CC(C1)CO)CN MCULE-2329484638 [0,1,0,1,0,0|2,0,0]=4 2412 B11R1.40 C=CC(O)CC1CCOCC1 MCULE-2978231355 [0,1,0,1,0,0|1,0,1]=4 2413 B11R1.40 CC(CN)CN1CCCCC1 MCULE-8071751178 [0,1,0,1,0,0|2,0,0]=4 2414 B11R1.40 CC(CO)CC1CCCCC1 MCULE-5710897696 [0,1,0,1,0,0|1,0,0]=3 2415 B11R1.40 CC(CO)CC1CCNCC1 MCULE-7484862437 [0,1,0,1,0,0|1,0,0]=3 2416 B11R1.40 CC(CO)CC1CCOCC1 MCULE-4998013729 [0,1,0,1,0,0|1,0,0]=3 2417 B11R1.40 CC(CO)CN1CCCCC1 MCULE-3743748086 [0,1,0,1,0,0|1,0,0]=3 2418 B11R1.40 CC(CO)CN1CCOCC1 MCULE-5378895649 [0,1,0,1,0,0|2,0,0]=4 2419 B11R1.40 CC(CO)NC1CCSCC1 MCULE-2140309732 [0,1,0,1,0,0|2,0,0]=4 2420 B11R1.40 CCC(C)CC1CCCNC1 MCULE-8245657992 [0,1,0,1,0,0|2,0,0]=4 2421 B11R1.40 CCC(N)CN1CCCCC1 MCULE-3344689905 [0,1,0,1,0,0|2,0,0]=4 2422 B11R1.40 CCC(O)CN1CCOCC1 MCULE-8909548791 [0,1,0,1,0,0|2,0,0]=4 2423 B11R1.40 NC(CO)CC1CCCCC1 MCULE-8374243800 [0,1,0,1,0,0|1,0,0]=3 2424 B11R1.40 NC(CO)CC1CCOCC1 MCULE-5607116203 [0,1,0,1,0,0|1,0,0]=3 2425 B11R1.40 NC(CO)CN1CCCCC1 MCULE-1973513857 [0,1,0,1,0,0|1,0,0]=3 2426 B11R1.40 NC(CO)CN1CCCCC1 MCULE-9613799240 [0,1,0,1,0,0|1,0,0]=3 2427 B11R1.40 NC(CO)CN1CCOCC1 MCULE-2044997045 [0,1,0,1,0,0|2,0,0]=4 2428 B11R1.40 NC(CO)CN1CCOCC1 MCULE-8287427942 [0,1,0,1,0,0|2,0,0]=4 2429 B11R1.40 NCC(O)CN1CCCCC1 MCULE-6375121843 [0,1,0,1,0,0|1,0,0]=3 2430 B11R1.40 NCC(O)CN1CCOCC1 MCULE-4103775287 [0,1,0,1,0,0|2,0,0]=4 2431 B11R1.40 NC[C@@H](O)CN1CCCCC1 MCULE-8632677540 [0,1,0,1,0,0|1,0,0]=3 2432 B11R1.40 NC[C@@H](O)CN1CCCCC1 MCULE-8670957212 [0,1,0,1,0,0|1,0,0]=3 2433 B11R1.40 NC[C@@H](O)CN1CCOCC1 MCULE-8182192710 [0,1,0,1,0,0|2,0,0]=4 2434 B11R1.40 NC[C@H](O)CN1CCCCC1 MCULE-2669625296 [0,1,0,1,0,0|1,0,0]=3 2435 B11R1.40 NC[C@H](O)CN1CCCCC1 MCULE-9216441178 [0,1,0,1,0,0|1,0,0]=3 2436 B11R1.40 NC[C@H](O)CN1CCOCC1 MCULE-1194361625 [0,1,0,1,0,0|2,0,0]=4 2437 B11R1.40 NC[C@H](O)CN1CCOCC1 MCULE-9083423408 [0,1,0,1,0,0|2,0,0]=4 2438 B11R1.40 N[C@@H](CO)CC1CCCCC1 MCULE-4544384276 [0,1,0,1,0,0|1,0,0]=3 2439 B11R1.40 N[C@@H](CO)CC1CCCCC1 MCULE-6032597145 [0,1,0,1,0,0|1,0,0]=3 2440 B11R1.40 N[C@H](CO)CC1CCCCC1 MCULE-1723145852 [0,1,0,1,0,0|1,0,0]=3 2441 B11R1.40 N[C@H](CO)CC1CCCCC1 MCULE-5455203223 [0,1,0,1,0,0|1,0,0]=3 2442 B11R1.40 N[C@H](CO)CC1CCCCC1 MCULE-6610942551 [0,1,0,1,0,0|1,0,0]=3 2443 B11R1.40 N[C@H](CO)CC1CCCCC1 MCULE-9072100331 [0,1,0,1,0,0|1,0,0]=3 2444 B11R1.40 O=C(CO)NC1CCCCC1 MCULE-5032379156 [0,1,0,1,0,0|0,0,2]=4 2445 B11R1.40 OCC(O)CN1CCCCC1 MCULE-6175373474 [0,1,0,1,0,0|0,0,0]=2 2446 B11R1.40 OCC(O)CN1CCNCC1 MCULE-6539636041 [0,1,0,1,0,0|1,0,0]=3 2447 B11R1.40 OCC(O)CN1CCOCC1 MCULE-3216890500 [0,1,0,1,0,0|1,0,0]=3 2448 B11R1.40 [NH3+]C(CO)CC1CCCCC1 MCULE-8144051276 [0,1,0,1,0,0|1,0,0]=3 2449 B11R1.214 CCCCN1CCC(C1)CN MCULE-5954372620 [0,1,0,1,0,0|2,0,0]=4 2450 B11R1.214 CCCCN1CCC(C1)CN MCULE-9738182159 [0,1,0,1,0,0|2,0,0]=4 2451 B11R1.214 COCCN1CCC(C1)CO MCULE-2099618793 [0,1,0,1,0,0|2,0,0]=4 2452 B11R1.222 CC(CN)N1CCCCC1C MCULE-1967756086 [0,1,0,1,0,0|2,0,0]=4 2453 B11R1.222 CC(CO)N1CCCCC1C MCULE-1887060610 [0,1,0,1,0,0|1,0,0]=3 2454 B11R1.222 CN1CCCCC1C(O)CO MCULE-4046188550 [0,1,0,1,0,0|0,0,0]=2 2455 B11R1.1052 CCC1(CC(SCC1C)C)O MCULE-7201917585 [0,1,0,1,0,0|2,0,0]=4 2456 B11R1.12 BrCC(CBr)C1CCCCC1 MCULE-9899181979 [0,1,0,1,0,0|2,0,0]=4 2457 B11R1.12 C#CC(CO)N1CCCCC1 MCULE-7122936799 [0,1,0,1,0,0|2,0,0]=4 2458 B11R1.12 C=CC(CO)N1CCCCC1 MCULE-8079268051 [0,1,0,1,0,0|2,0,0]=4 2459 B11R1.12 COC(C=O)C1CCCCC1 MCULE-4823823476 [0,1,0,1,0,0|0,0,2]=4 2460 B11R1.12 COC(CBr)C1CCCCC1 MCULE-8388261631 [0,1,0,1,0,0|1,0,0]=3 2461 B11R1.12 COC(CN)C1CCCCC1 MCULE-3562788860 [0,1,0,1,0,0|1,0,0]=3 2462 B11R1.12 COC(CN)C1CCCOC1 MCULE-5741797670 [0,1,0,1,0,0|2,0,0]=4 2463 B11R1.12 COC(CN)C1CCOCC1 MCULE-4634779005 [0,1,0,1,0,0|2,0,0]=4 2464 B11R1.12 COC(CO)C1CCCCC1 MCULE-9738859952 [0,1,0,1,0,0|0,0,0]=2 2465 B11R1.12 COC(CO)C1CCOCC1 MCULE-7795924872 [0,1,0,1,0,0|1,0,0]=3 2466 B11R1.12 NCC(CO)C1CCCCC1 MCULE-3722805591 [0,1,0,1,0,0|1,0,0]=3 2467 B11R1.12 NCC(CO)C1CCOCC1 MCULE-7156499153 [0,1,0,1,0,0|2,0,0]=4 2468 B11R1.12 NCC(CO)N1CCCCC1 MCULE-2441354275 [0,1,0,1,0,0|2,0,0]=4 2469 B11R1.12 OCC(CO)C1CCCCC1 MCULE-1482252755 [0,1,0,1,0,0|0,0,0]=2 2470 B11R1.12 OCC(CO)C1CCNCC1 MCULE-2380660444 [0,1,0,1,0,0|1,0,0]=3 2471 B11R1.12 OCC(CO)C1CCNCC1 MCULE-8377490163 [0,1,0,1,0,0|1,0,0]=3 2472 B11R1.12 OCC(CO)C1CCOCC1 MCULE-8815501407 [0,1,0,1,0,0|1,0,0]=3 2473 B11R1.12 OCC(CO)N1CCCCC1 MCULE-5959027774 [0,1,0,1,0,0|1,0,0]=3 2474 B11R1.12 OCC(CO)N1CCCCC1 MCULE-7985185143 [0,1,0,1,0,0|1,0,0]=3 2475 B11R1.83 C#C[C@H]1CC[C@@H](CC1)CCC MCULE-7682879932 [0,1,0,1,0,0|2,0,0]=4 2476 B11R1.83 C=C[C@H]1CC[C@@H](CC1)CCC MCULE-3361144366 [0,1,0,1,0,0|2,0,0]=4 2477 B11R1.83 CCCC1CCC(CC1)C=O MCULE-4527567700 [0,1,0,1,0,0|1,0,1]=4 2478 B11R1.83 CCCC1CCC(CC1)NC MCULE-2141911585 [0,1,0,1,0,0|2,0,0]=4 2479 B11R1.83 CCC[C@H]1CC[C@@H](CC1)C=O MCULE-1639712702 [0,1,0,1,0,0|1,0,1]=4 2480 B11R1.83 CCC[C@H]1CC[C@@H](CC1)CBr MCULE-9138303579 [0,1,0,1,0,0|2,0,0]=4 2481 B11R1.83 CCC[C@H]1CC[C@@H](CC1)CN MCULE-6808842685 [0,1,0,1,0,0|2,0,0]=4 2482 B11R1.83 CCC[C@H]1CC[C@@H](CC1)CN MCULE-7715033630 [0,1,0,1,0,0|2,0,0]=4 2483 B11R1.83 CCC[C@H]1CC[C@@H](CC1)CO MCULE-6766255613 [0,1,0,1,0,0|1,0,0]=3 2484 B11R1.83 COC1CCC(CC1)CCN MCULE-1984508335 [0,1,0,1,0,0|2,0,0]=4 2485 B11R1.83 COCC1CCC(CC1)CO MCULE-8392515292 [0,1,0,1,0,0|2,0,0]=4 2486 B11R1.84 NCC(CO)CC1CCCC1 MCULE-5327389642 [0,1,0,1,0,0|1,0,0]=3 2487 B11R1.267 CCC1CCCC(C1=O)CC MCULE-1677091968 [0,1,0,1,0,0|1,0,1]=4 2488 B11R1.381 CN1CCCCC(C1=O)CO MCULE-4905221236 [0,1,0,1,0,0|1,0,1]=4 2489 B11R1.381 CN[C@@H]1CCCC[C@H]([C@@H]1O)O MCULE-5900059446 [0,1,0,1,0,0|0,0,0]=2 2490 B11R1.1155 CNC1(CCCCCC1)CO MCULE-9059601742 [0,1,0,1,0,0|1,0,0]=3 2491 B11R1.1155 COC1(CCCCCC1)C=O MCULE-2926435851 [0,1,0,1,0,0|0,0,2]=4 2492 B11R1.1155 COC1(CCCCCC1)CN MCULE-6280274304 [0,1,0,1,0,0|1,0,0]=3 2493 B11R1.1155 COC1(CCCCCC1)CO MCULE-8681502262 [0,1,0,1,0,0|0,0,0]=2 2494 B11R1.20 CC(C)CC1CCC(CC1)N MCULE-8859359539 [0,1,0,1,0,0|2,0,0]=4 2495 B11R1.20 CC(C)CC1CCC(CC1)N MCULE-9652630171 [0,1,0,1,0,0|2,0,0]=4 2496 B11R1.20 CC(C)CN1CCC(CC1)O MCULE-9955050082 [0,1,0,1,0,0|2,0,0]=4 2497 B11R1.23 CC1CCCN(C1)C(C)CO MCULE-8338751816 [0,1,0,1,0,0|2,0,0]=4 2498 B11R1.43 CC(C)CN1CCC(C1)CO MCULE-9845519394 [0,1,0,1,0,0|2,0,0]=4 2499 B11R1.266 CC(C)C1CC(CCO1)CO MCULE-6145121225 [0,1,0,1,0,0|2,0,0]=4 2500 B11R1.266 CC(C)N1CCCC(C1)CO MCULE-3416274190 [0,1,0,1,0,0|2,0,0]=4 2501 B11R1.266 CC(C)N1CCCC(C1)CO MCULE-8971147419 [0,1,0,1,0,0|2,0,0]=4 2502 B11R1.266 CCC1CCCC(N1)C(=O)O MCULE-7713794654 [0,1,0,1,0,0|1,0,1]=4 2503 B11R1.565 CC(C)C1CCCC(CC1)N MCULE-7650397016 [0,1,0,1,0,0|2,0,0]=4 2504 B11R1.22 CC1CCC(CC1)C(N)CO MCULE-7106374070 [0,1,0,1,0,0|1,0,0]=3 2505 B11R1.22 CCC(C)C1CCC(CC1)N MCULE-2849824546 [0,1,0,1,0,0|2,0,0]=4 2506 B11R1.22 CN1CCC(CC1)C(N)CO MCULE-6250308042 [0,1,0,1,0,0|2,0,0]=4 2507 B11R1.499 O[C@@H]1CNC[C@H]([C@H]([C@@H]1O)O)O MCULE-8987981516 [0,1,0,1,0,0|2,0,0]=4 2508 B11R1.499 O[C@@H]1CNC[C@H]([C@H]([C@@H]1O)O)O MCULE-9783362158 [0,1,0,1,0,0|2,0,0]=4 2509 B11R1.499 O[C@H]1CNC[C@@H]([C@@H]([C@H]1O)O)O MCULE-3882000131 [0,1,0,1,0,0|2,0,0]=4 2510 B11R1.499 O[C@H]1CNC[C@@H]([C@@H]([C@H]1O)O)O MCULE-4280217220 [0,1,0,1,0,0|2,0,0]=4 2511 B11R1.499 O[C@H]1CNC[C@H]([C@@H]([C@H]1O)O)O MCULE-1327782318 [0,1,0,1,0,0|2,0,0]=4 2512 B11R1.499 O[C@H]1CNC[C@H]([C@@H]([C@H]1O)O)O MCULE-2814792865 [0,1,0,1,0,0|2,0,0]=4 2513 B11R1.865 C1(NCC(C1O)O)C(O)CO MCULE-8182773216 [0,1,0,1,0,0|2,0,0]=4 2514 B11R1.865 C1(NCC(C1O)O)C(O)CO MCULE-9438696630 [0,1,0,1,0,0|2,0,0]=4 2515 B11R1.865 OC[C@@H](O)[C@H]1OC[C@@H]([C@H]1O)O MCULE-9196823700 [0,1,0,1,0,0|2,0,0]=4 2516 B11R1.865 [C@@H]1(NC[C@H]([C@H]1O)O)[C@H](O)CO MCULE-6385831394 [0,1,0,1,0,0|2,0,0]=4 2517 B11R1.865 [C@@H]1(NC[C@H]([C@H]1O)O)[C@H](O)CO MCULE-7164777003 [0,1,0,1,0,0|2,0,0]=4 2518 B11R1.970 CCN1CCCC(C1)(O)CN MCULE-2616420038 [0,1,0,1,0,0|2,0,0]=4 2519 B11R1.7 CC(C)(CN)C1CCCCC1 MCULE-7524157111 [0,1,0,1,0,0|2,0,0]=4 2520 B11R1.7 CC(C)(CO)C1CCNCC1 MCULE-7984200795 [0,1,0,1,0,0|2,0,0]=4 2521 B11R1.7 CC(C)(CO)C1CCOCC1 MCULE-4008950912 [0,1,0,1,0,0|2,0,0]=4 2522 B11R1.7 CC(N)(CO)C1CCCCC1 MCULE-8268967695 [0,1,0,1,0,0|1,0,0]=3 2523 B11R1.7 OCC(F)(F)C1CCOCC1 MCULE-1807478272 [0,1,0,1,0,0|2,0,0]=4 2524 B11R1.82 CC1(CCC(OC1)CCN)C MCULE-3046648125 [0,1,0,1,0,0|2,0,0]=4 2525 B11R1.82 CCCC1CCC(CC1)(F)F MCULE-4027177054 [0,1,0,1,0,0|2,0,0]=4 2526 B11R1.139 CC(N)(CO)COC1CCC1 MCULE-7175095480 [0,1,0,1,0,0|2,0,0]=4 2527 B11R1.410 NC1(CCCCCCC1)CO MCULE-2886971346 [0,1,0,1,0,0|1,0,0]=3 2528 B11R1.410 NC1(CCCCCCC1)CO MCULE-4333936151 [0,1,0,1,0,0|1,0,0]=3 2529 B11R1.410 NCC1(CCCCCCC1)O MCULE-5986482769 [0,1,0,1,0,0|1,0,0]=3 2530 B11R1.568 NC1CCCCCCC1(F)F MCULE-1541290186 [0,1,0,1,0,0|2,0,0]=4 2531 B11R1.568 NC1CCCCCCC1(F)F MCULE-5690239430 [0,1,0,1,0,0|2,0,0]=4 2532 B11R1.1 C1(CCC(CC1)CCCC)N MCULE-7865667566 [0,1,0,1,0,0|2,0,0]=4 2533 B11R1.1 CCCCC1CCC(CC1)O MCULE-6254197353 [0,1,0,1,0,0|1,0,0]=3 2534 B11R1.1 CCCCN1CCC(CC1)C MCULE-6057560610 [0,1,0,1,0,0|2,0,0]=4 2535 B11R1.1 CCCCN1CCC(CC1)N MCULE-5909115834 [0,1,0,1,0,0|2,0,0]=4 2536 B11R1.1 CCCCN1CCC(CC1)N MCULE-9041252090 [0,1,0,1,0,0|2,0,0]=4 2537 B11R1.1 CCCCN1CCC(CC1)O MCULE-8232589720 [0,1,0,1,0,0|1,0,0]=3 2538 B11R1.1 CCCO[C@H]1CC[C@@H](CC1)N MCULE-8634608463 [0,1,0,1,0,0|2,0,0]=4 2539 B11R1.1 CNCCN1CCC(CC1)O MCULE-2486029485 [0,1,0,1,0,0|2,0,0]=4 2540 B11R1.1 CNCCN1CCC(CC1)O MCULE-9437830130 [0,1,0,1,0,0|2,0,0]=4 2541 B11R1.1 COCCN1CCC(CC1)O MCULE-3641128150 [0,1,0,1,0,0|2,0,0]=4 2542 B11R1.1 NCCCN1CCC(CC1)O MCULE-3328438806 [0,1,0,1,0,0|2,0,0]=4 2543 B11R1.1 NCCCN1CCC(CC1)O MCULE-9186261856 [0,1,0,1,0,0|2,0,0]=4 2544 B11R1.1 OC1CCC(CC1)NCCF MCULE-6608620022 [0,1,0,1,0,0|2,0,0]=4 2545 B11R1.1 OC1CCN(CC1)CCCCl MCULE-9397662139 [0,1,0,1,0,0|2,0,0]=4 2546 B11R1.1 OC1CCN(CC1)CCCF MCULE-8605662263 [0,1,0,1,0,0|2,0,0]=4 2547 B11R1.1 [C@@H]1(CC[C@@H](CC1)CCCC)O MCULE-2232182383 [0,1,0,1,0,0|1,0,0]=3 2548 B11R1.27 CCCCCC1OCC(O1)C MCULE-9583652455 [0,1,0,1,0,0|1,0,0]=3 2549 B11R1.47 CCCCCCOC1CNC1 MCULE-3800407294 [0,1,0,1,0,0|2,0,0]=4 2550 B11R1.852 CC(CN)N1CCCCCC1 MCULE-7487563304 [0,1,0,1,0,0|2,0,0]=4 2551 B11R1.852 CC(CO)C1CCCCCC1 MCULE-7395158775 [0,1,0,1,0,0|1,0,0]=3 2552 B11R1.852 CC(CO)N1CCCNCC1 MCULE-4473774833 [0,1,0,1,0,0|2,0,0]=4 2553 B11R1.852 O=C(CO)N1CCCCCC1 MCULE-3681107148 [0,1,0,1,0,0|0,0,2]=4 2554 B11R1.35 CC(CC1CCCC1)C(=O)O MCULE-4740416028 [0,1,0,1,0,0|1,0,1]=4 2555 B11R1.35 NC(CC1CCCC1)C(=O)O MCULE-2541402745 [0,1,0,1,0,0|1,0,1]=4 2556 B11R1.35 NC(CC1CCCC1)C(=O)O MCULE-3851918025 [0,1,0,1,0,0|1,0,1]=4 2557 B11R1.35 N[C@@H](CC1CCCC1)C(=O)O MCULE-1482788952 [0,1,0,1,0,0|1,0,1]=4 2558 B11R1.35 N[C@@H](CC1CCCC1)C(=O)O MCULE-8118301255 [0,1,0,1,0,0|1,0,1]=4 2559 B11R1.35 N[C@H](CC1CCCC1)C(=O)O MCULE-2021631405 [0,1,0,1,0,0|1,0,1]=4 2560 B11R1.35 N[C@H](CC1CCCC1)C(=O)O MCULE-6544324630 [0,1,0,1,0,0|1,0,1]=4 2561 B11R1.35 O=C(O)C(F)CC1CCCC1 MCULE-9273579138 [0,1,0,1,0,0|1,0,1]=4 2562 B11R1.36 CC(C(=O)O)C1CCCCC1 MCULE-7073762782 [0,1,0,1,0,0|1,0,1]=4 2563 B11R1.36 CC(C)C(Br)C1CCCCC1 MCULE-1793358410 [0,1,0,1,0,0|2,0,0]=4 2564 B11R1.36 CC(C)C(O)C1CCCCC1 MCULE-6415047729 [0,1,0,1,0,0|1,0,0]=3 2565 B11R1.36 CC(C)C(O)C1CCNCC1 MCULE-2061650451 [0,1,0,1,0,0|2,0,0]=4 2566 B11R1.36 CC(C)C(O)C1CCNCC1 MCULE-3233317724 [0,1,0,1,0,0|2,0,0]=4 2567 B11R1.36 CC(N)C(C)C1CCCCC1 MCULE-2548782093 [0,1,0,1,0,0|2,0,0]=4 2568 B11R1.36 CC(O)C(C)N1CCCCC1 MCULE-2504110554 [0,1,0,1,0,0|2,0,0]=4 2569 B11R1.36 C[C@@H](C(=O)O)C1CCCCC1 MCULE-1380670662 [0,1,0,1,0,0|1,0,1]=4 2570 B11R1.36 C[C@H](C(=O)O)C1CCCCC1 MCULE-6704404403 [0,1,0,1,0,0|1,0,1]=4 2571 B11R1.36 NC(C(=O)O)C1CCCCC1 MCULE-1846014205 [0,1,0,1,0,0|1,0,1]=4 2572 B11R1.36 NC(C(=O)O)C1CCCCC1 MCULE-2033801873 [0,1,0,1,0,0|1,0,1]=4 2573 B11R1.36 NC(C(=O)O)C1CCCCC1 MCULE-4412820367 [0,1,0,1,0,0|1,0,1]=4 2574 B11R1.36 NC(C(=O)O)C1CCCCC1 MCULE-6865831162 [0,1,0,1,0,0|1,0,1]=4 2575 B11R1.36 NC(C(F)F)C1CCCCC1 MCULE-4068326645 [0,1,0,1,0,0|2,0,0]=4 2576 B11R1.36 NC(C(F)F)C1CCCCC1 MCULE-6798866372 [0,1,0,1,0,0|2,0,0]=4 2577 B11R1.36 N[C@@H](C(=O)O)C1CCCCC1 MCULE-3443210425 [0,1,0,1,0,0|1,0,1]=4 2578 B11R1.36 N[C@@H](C(=O)O)C1CCCCC1 MCULE-4731070853 [0,1,0,1,0,0|1,0,1]=4 2579 B11R1.36 N[C@@H](C(=O)O)C1CCCCC1 MCULE-6698336499 [0,1,0,1,0,0|1,0,1]=4 2580 B11R1.36 N[C@@H](C(=O)O)C1CCCCC1 MCULE-6855404620 [0,1,0,1,0,0|1,0,1]=4 2581 B11R1.36 N[C@H](C(=O)O)C1CCCCC1 MCULE-1545974835 [0,1,0,1,0,0|1,0,1]=4 2582 B11R1.36 N[C@H](C(=O)O)C1CCCCC1 MCULE-1933038118 [0,1,0,1,0,0|1,0,1]=4 2583 B11R1.36 N[C@H](C(=O)O)C1CCCCC1 MCULE-2164840222 [0,1,0,1,0,0|1,0,1]=4 2584 B11R1.36 N[C@H](C(=O)O)C1CCCCC1 MCULE-9858528992 [0,1,0,1,0,0|1,0,1]=4 2585 B11R1.36 N[C@H](C(=O)O)C1CCCCC1 MCULE-9914793144 [0,1,0,1,0,0|1,0,1]=4 2586 B11R1.36 O=C(O)C(F)C1CCCCC1 MCULE-1489080540 [0,1,0,1,0,0|1,0,1]=4 2587 B11R1.36 O=C(O)C(O)C1CCCCC1 MCULE-1137791149 [0,1,0,1,0,0|0,0,1]=3 2588 B11R1.36 O=C(O)C(O)C1CCCNC1 MCULE-1767872209 [0,1,0,1,0,0|1,0,1]=4 2589 B11R1.36 O=C(O)C(O)C1CCCNC1 MCULE-6745265789 [0,1,0,1,0,0|1,0,1]=4 2590 B11R1.36 O=C(O)C(O)C1CCOCC1 MCULE-5923962415 [0,1,0,1,0,0|1,0,1]=4 2591 B11R1.36 O=C(O)[C@@H](O)C1CCCCC1 MCULE-2724503390 [0,1,0,1,0,0|0,0,1]=3 2592 B11R1.36 O=C(O)[C@@H](O)C1CCCCC1 MCULE-6659758826 [0,1,0,1,0,0|0,0,1]=3 2593 B11R1.36 O=C(O)[C@@H](O)C1CCOCC1 MCULE-6979522096 [0,1,0,1,0,0|1,0,1]=4 2594 B11R1.36 O=C(O)[C@H](O)C1CCCCC1 MCULE-2949323528 [0,1,0,1,0,0|0,0,1]=3 2595 B11R1.36 O=C(O)[C@H](O)C1CCCCC1 MCULE-3804932181 [0,1,0,1,0,0|0,0,1]=3 2596 B11R1.36 [C@H](N)(C(=O)O)C1CCCCC1 MCULE-2416228483 [0,1,0,1,0,0|1,0,1]=4 2597 B11R1.211 CCCCC1CC(C1)C(=O)O MCULE-5371999709 [0,1,0,1,0,0|1,0,1]=4 2598 B11R1.421 CCC1CCCC1(C)C(=O)O MCULE-6788329721 [0,1,0,1,0,0|1,0,1]=4 2599 B11R1.520 CC1CCCCC1(N)C(=O)O MCULE-7674467260 [0,1,0,1,0,0|1,0,1]=4 2600 B11R1.520 CC1CCCCC1(O)C(=O)O MCULE-4831471383 [0,1,0,1,0,0|0,0,1]=3 2601 B11R1.706 O=C(O)C1CCCCCCC1 MCULE-7220278799 [0,1,0,1,0,0|1,0,1]=4 2602 B11R1.706 O=C(O)C1CCCCCCN1 MCULE-2852082428 [0,1,0,1,0,0|1,0,1]=4 2603 B11R1.706 O=C(O)C1CCCCCCN1 MCULE-2931630393 [0,1,0,1,0,0|1,0,1]=4 2604 B11R1.737 CC1(CCCCCC1)C(=O)O MCULE-3584192725 [0,1,0,1,0,0|1,0,1]=4 2605 B11R1.737 NC(=O)C1(CCCCCC1)O MCULE-4135482773 [0,1,0,1,0,0|0,0,2]=4 2606 B11R1.737 NC1(CCCCCC1)C(=O)O MCULE-6498749639 [0,1,0,1,0,0|1,0,1]=4 2607 B11R1.737 O=C(O)C1(CCCCCC1)O MCULE-7470096721 [0,1,0,1,0,0|0,0,1]=3 2608 B11R1.187 CCOC1CC(C(O1)CO)O MCULE-2861181296 [0,1,0,1,0,0|1,0,0]=3 2609 B11R1.278 COC1OCC(C(C1O)O)O MCULE-6740446867 [0,1,0,1,0,0|2,0,0]=4 2610 B11R1.278 COC1OC[C@H]([C@@H]([C@H]1O)O)O MCULE-2720801334 [0,1,0,1,0,0|2,0,0]=4 2611 B11R1.278 CO[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O MCULE-5796880776 [0,1,0,1,0,0|2,0,0]=4 2612 B11R1.278 CO[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O MCULE-6235124009 [0,1,0,1,0,0|2,0,0]=4 2613 B11R1.278 CO[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O MCULE-7418809072 [0,1,0,1,0,0|2,0,0]=4 2614 B11R1.278 CO[C@@H]1OC[C@H]([C@H]([C@@H]1O)O)O MCULE-4673979681 [0,1,0,1,0,0|2,0,0]=4 2615 B11R1.278 CO[C@@H]1OC[C@H]([C@H]([C@@H]1O)O)O MCULE-5778580556 [0,1,0,1,0,0|2,0,0]=4 2616 B11R1.278 CO[C@@H]1OC[C@H]([C@H]([C@H]1O)O)O MCULE-4929927436 [0,1,0,1,0,0|2,0,0]=4 2617 B11R1.278 CO[C@@H]1OC[C@H]([C@H]([C@H]1O)O)O MCULE-5655222799 [0,1,0,1,0,0|2,0,0]=4 2618 B11R1.278 CO[C@H]1OC[C@@H]([C@@H]([C@H]1O)O)O MCULE-1771033584 [0,1,0,1,0,0|2,0,0]=4 2619 B11R1.278 CO[C@H]1OC[C@@H]([C@@H]([C@H]1O)O)O MCULE-4531969040 [0,1,0,1,0,0|2,0,0]=4 2620 B11R1.278 CO[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O MCULE-4343547061 [0,1,0,1,0,0|2,0,0]=4 2621 B11R1.278 CO[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O MCULE-4503181663 [0,1,0,1,0,0|2,0,0]=4 2622 B11R1.278 CO[C@H]1OC[C@H]([C@@H]([C@H]1O)O)O MCULE-8187957553 [0,1,0,1,0,0|2,0,0]=4 2623 B11R1.278 OCC1NCC(C(C1O)O)O MCULE-8095897922 [0,1,0,1,0,0|2,0,0]=4 2624 B11R1.278 OCC1NCC(C(C1O)O)O MCULE-8945870725 [0,1,0,1,0,0|2,0,0]=4 2625 B11R1.278 OCC1OCC(C(C1O)O)O MCULE-4403765571 [0,1,0,1,0,0|2,0,0]=4 2626 B11R1.278 OCC1OCC([C@H]([C@@H]1O)O)O MCULE-1426082665 [0,1,0,1,0,0|2,0,0]=4 2627 B11R1.278 OC[C@@H]1NC[C@@H]([C@H]([C@@H]1O)O)O MCULE-6816426610 [0,1,0,1,0,0|2,0,0]=4 2628 B11R1.278 OC[C@H]1NC[C@@H]([C@H]([C@@H]1O)O)O MCULE-7821502238 [0,1,0,1,0,0|2,0,0]=4 2629 B11R1.278 OC[C@H]1NC[C@@H]([C@H]([C@@H]1O)O)O MCULE-7929596923 [0,1,0,1,0,0|2,0,0]=4 2630 B11R1.278 OC[C@H]1NC[C@@H]([C@H]([C@@H]1O)O)O MCULE-7935101104 [0,1,0,1,0,0|2,0,0]=4 2631 B11R1.278 OC[C@H]1NC[C@@H]([C@H]([C@@H]1O)O)O MCULE-8897116077 [0,1,0,1,0,0|2,0,0]=4 2632 B11R1.278 OC[C@H]1NC[C@@H]([C@H]([C@H]1O)O)O MCULE-3687609653 [0,1,0,1,0,0|2,0,0]=4 2633 B11R1.278 OC[C@H]1NC[C@@H]([C@H]([C@H]1O)O)O MCULE-3759351391 [0,1,0,1,0,0|2,0,0]=4 2634 B11R1.278 OC[C@H]1NC[C@@H]([C@H]([C@H]1O)O)O MCULE-6717850596 [0,1,0,1,0,0|2,0,0]=4 2635 B11R1.278 OC[C@H]1NC[C@@H]([C@H]([C@H]1O)O)O MCULE-9908232709 [0,1,0,1,0,0|2,0,0]=4 2636 B11R1.278 OC[C@H]1NC[C@H]([C@H]([C@@H]1O)O)O MCULE-1549794897 [0,1,0,1,0,0|2,0,0]=4 2637 B11R1.278 OC[C@H]1NC[C@H]([C@H]([C@@H]1O)O)O MCULE-3347277528 [0,1,0,1,0,0|2,0,0]=4 2638 B11R1.278 OC[C@H]1NC[C@H]([C@H]([C@@H]1O)O)O MCULE-3572681892 [0,1,0,1,0,0|2,0,0]=4 2639 B11R1.278 OC[C@H]1NC[C@H]([C@H]([C@@H]1O)O)O MCULE-4809870237 [0,1,0,1,0,0|2,0,0]=4 2640 B11R1.278 OC[C@H]1OC[C@@H]([C@H]([C@@H]1O)O)O MCULE-1084535328 [0,1,0,1,0,0|2,0,0]=4 2641 B11R1.278 OC[C@H]1OC[C@@H]([C@H]([C@@H]1O)O)O MCULE-3911794509 [0,1,0,1,0,0|2,0,0]=4 2642 B11R1.278 OC[C@H]1OC[C@H]([C@H]([C@@H]1O)O)O MCULE-5628459668 [0,1,0,1,0,0|2,0,0]=4 2643 B11R1.278 OC[C@H]1OC[C@H]([C@H]([C@@H]1O)O)O MCULE-8354002491 [0,1,0,1,0,0|2,0,0]=4 2644 B11R1.278 [C@@H]1(CO[C@@H]([C@@H]([C@@H]1O)O)CO)O MCULE-6342457653 [0,1,0,1,0,0|2,0,0]=4 2645 B11R1.878 O=C(CO)C1(CCCCC1)O MCULE-4883134314 [0,1,0,1,0,0|0,0,2]=4 2646 B11R1.15 CCOC(=O)C1CC(CO1)O MCULE-8930811806 [0,1,0,1,0,0|1,0,1]=4 2647 B11R1.1047 CC1CCC(C(C1)C)(C)CO MCULE-9245801250 [0,1,0,1,0,0|1,0,0]=3 2648 B11R1.1047 CC1CC[C@](C(C1)C)(C)CO MCULE-6266951039 [0,1,0,1,0,0|1,0,0]=3 2649 B11R1.1234 OCC[C@@]1(CC[C@@H](CC1)O)O MCULE-8570362975 [0,1,0,1,0,0|2,0,0]=4 2650 B11R1.1234 OCC[C@@]1(CC[C@H](CC1)O)O MCULE-2046557319 [0,1,0,1,0,0|2,0,0]=4 2651 B11R2.34 NC1CCC(CC1)C2CC2 MCULE-9923258318 [0,0,0,2,0,0|2,0,0]=4 2652 B11R2.34 OC1CCN(CC1)C2CC2 MCULE-7388045024 [0,0,0,2,0,0|2,0,0]=4 2653 B11R2.36 NC1CCC2CCCC2C1 MCULE-6297668988 [0,0,0,2,0,0|2,0,0]=4 2654 B11R2.36 NC1CCC2CCCN2C1 MCULE-3109955899 [0,0,0,2,0,0|2,0,0]=4 2655 B11R2.36 OC1CCC2CCCC2C1 MCULE-2299998001 [0,0,0,2,0,0|1,0,0]=3 2656 B11R2.36 OC1CCC2CCNC2C1 MCULE-4098034063 [0,0,0,2,0,0|2,0,0]=4 2657 B11R2.36 OC1CCC2CCNC2C1 MCULE-9733496903 [0,0,0,2,0,0|2,0,0]=4 2658 B11R2.36 OC1CCC2CNCC2C1 MCULE-3277908598 [0,0,0,2,0,0|2,0,0]=4 2659 B11R2.36 OC1CCC2CNCC2C1 MCULE-6585318459 [0,0,0,2,0,0|2,0,0]=4 2660 B11R2.36 OC1CCN2CCCC2C1 MCULE-6947197443 [0,0,0,2,0,0|2,0,0]=4 2661 B11R2.36 O[C@@H]1CC[C@@H]2CNC[C@@H]2C1 MCULE-1949148186 [0,0,0,2,0,0|2,0,0]=4 2662 B11R2.36 O[C@@H]1CC[C@@H]2CNC[C@@H]2C1 MCULE-4509044586 [0,0,0,2,0,0|2,0,0]=4 2663 B11R2.36 O[C@@H]1CC[C@H]2CNC[C@H]2C1 MCULE-2899991471 [0,0,0,2,0,0|2,0,0]=4 2664 B11R2.36 O[C@@H]1CC[C@H]2CNC[C@H]2C1 MCULE-7341763437 [0,0,0,2,0,0|2,0,0]=4 2665 B11R2.36 O[C@H]1CC[C@@H]2CCCN2C1 MCULE-3765797286 [0,0,0,2,0,0|1,0,0]=3 2666 B11R2.36 O[C@H]1CC[C@@H]2CCCN2C1 MCULE-6509722399 [0,0,0,2,0,0|1,0,0]=3 2667 B11R2.36 O[C@H]1CC[C@@H]2CNC[C@@H]2C1 MCULE-1974586543 [0,0,0,2,0,0|2,0,0]=4 2668 B11R2.36 O[C@H]1CC[C@@H]2CNC[C@@H]2C1 MCULE-3361755742 [0,0,0,2,0,0|2,0,0]=4 2669 B11R2.36 O[C@H]1CC[C@H]2CNC[C@H]2C1 MCULE-5959553924 [0,0,0,2,0,0|2,0,0]=4 2670 B11R2.36 O[C@H]1CC[C@H]2CNC[C@H]2C1 MCULE-8007024274 [0,0,0,2,0,0|2,0,0]=4 2671 B11R2.36 [C@H]12CCC(C[C@H]1CNC2)O MCULE-4314897063 [0,0,0,2,0,0|2,0,0]=4 2672 B11R2.36 [C@H]12CCC(C[C@H]1CNC2)O MCULE-5179051998 [0,0,0,2,0,0|2,0,0]=4 2673 B11R2.36 [C@H]12CC[C@@H](C[C@H]1CNC2)O MCULE-3219080891 [0,0,0,2,0,0|2,0,0]=4 2674 B11R2.36 [C@H]12CC[C@@H](C[C@H]1CNC2)O MCULE-6087664621 [0,0,0,2,0,0|2,0,0]=4 2675 B11R2.116 O[C@H]1CC[C@@H]2C[C@H]([C@H]1N2)O MCULE-2540814334 [0,0,0,2,0,0|2,0,0]=4 2676 B11R2.116 O[C@H]1C[C@H]2CC[C@H]([C@@H]1N2)O MCULE-1954659483 [0,0,0,2,0,0|2,0,0]=4 2677 B11R2.164 BrCC1CC2CCC1CC2 MCULE-8965587093 [0,0,0,2,0,0|2,0,0]=4 2678 B11R2.164 NCC1CC2CCC1CC2 MCULE-5693219709 [0,0,0,2,0,0|2,0,0]=4 2679 B11R2.164 NCC1CC2CCC1CC2 MCULE-6647106698 [0,0,0,2,0,0|2,0,0]=4 2680 B11R2.164 OCC1CC2CCC1CC2 MCULE-5766038887 [0,0,0,2,0,0|1,0,0]=3 2681 B11R2.164 OCC1CC2CCC1NC2 MCULE-9514446319 [0,0,0,2,0,0|2,0,0]=4 2682 B11R2.164 OCC1CC2CCC1NC2 MCULE-9705814392 [0,0,0,2,0,0|2,0,0]=4 2683 B11R2.164 OCC1CC2CCN1CC2 MCULE-8637862968 [0,0,0,2,0,0|2,0,0]=4 2684 B11R2.164 OCC1CN2CCC1CC2 MCULE-1136035515 [0,0,0,2,0,0|2,0,0]=4 2685 B11R2.164 OCC1CN2CCC1CC2 MCULE-6385278437 [0,0,0,2,0,0|2,0,0]=4 2686 B11R2.164 OC[C@H]1CN2CCC1CC2 MCULE-5044681044 [0,0,0,2,0,0|2,0,0]=4 2687 B11R2.742 CC1COC2(CCC2)CN1 MCULE-8902955374 [0,0,0,2,0,0|2,0,0]=4 2688 B11R2.742 NC1CCC2(CCC2)CC1 MCULE-3216909229 [0,0,0,2,0,0|2,0,0]=4 2689 B11R2.742 NC1CCC2(CCC2)CC1 MCULE-7674727405 [0,0,0,2,0,0|2,0,0]=4 2690 B11R2.742 OC1CCC2(CC1)CNC2 MCULE-4459027872 [0,0,0,2,0,0|2,0,0]=4 2691 B11R2.742 OC1CCC2(CC1)CNC2 MCULE-5753253993 [0,0,0,2,0,0|2,0,0]=4 2692 B11R2.742 OC1CCC2(CC1)COC2 MCULE-5776191638 [0,0,0,2,0,0|2,0,0]=4 2693 B11R2.742 OC1CCC2(CCC2)CC1 MCULE-7455633298 [0,0,0,2,0,0|1,0,0]=3 2694 B11R2.742 OC1CCC2(CCO2)CC1 MCULE-5111109703 [0,0,0,2,0,0|2,0,0]=4 2695 B11R2.106 OC1CCCC2C1CNC2 MCULE-1574578345 [0,0,0,2,0,0|2,0,0]=4 2696 B11R2.106 OC1CCCC2C1CNC2 MCULE-4236458833 [0,0,0,2,0,0|2,0,0]=4 2697 B11R2.106 OC1CCNC2C1CCC2 MCULE-2210743282 [0,0,0,2,0,0|2,0,0]=4 2698 B11R2.130 CC1C(CC2CCC1N2)O MCULE-1968753278 [0,0,0,2,0,0|2,0,0]=4 2699 B11R2.130 CC1C(CC2CCC1N2)O MCULE-7983254108 [0,0,0,2,0,0|2,0,0]=4 2700 B11R2.367 OC1C2CCC(C1O)CC2 MCULE-9910867655 [0,0,0,2,0,0|0,0,0]=2 2701 B11R2.367 OC1C2CCC(C1O)NC2 MCULE-3801140254 [0,0,0,2,0,0|1,0,0]=3 2702 B11R2.367 OC1C2CCC(C1O)NC2 MCULE-9126858644 [0,0,0,2,0,0|1,0,0]=3 2703 B11R2.565 OC1C2CCCC1CNC2 MCULE-6228232431 [0,0,0,2,0,0|2,0,0]=4 2704 B11R2.566 CN1C2CCCC1(CC2)O MCULE-5294433412 [0,0,0,2,0,0|2,0,0]=4 2705 B11R2.44 C1CCCC2NCC2CC1 MCULE-6825501365 [0,0,0,2,0,0|2,0,0]=4 2706 B11R2.1 CC1CNC2C1CCCC2 MCULE-4669953668 [0,0,0,2,0,0|2,0,0]=4 2707 B11R2.1 NC1COC2C1CCCC2 MCULE-1363829075 [0,0,0,2,0,0|1,0,0]=3 2708 B11R2.1 NC1COC2C1CCCC2 MCULE-8961596461 [0,0,0,2,0,0|1,0,0]=3 2709 B11R2.4 N[C@@H]1C[C@H]1C2CCCCC2 MCULE-3990781293 [0,0,0,2,0,0|2,0,0]=4 2710 B11R2.4 N[C@@H]1C[C@H]1C2CCCCC2 MCULE-5032209468 [0,0,0,2,0,0|2,0,0]=4 2711 B11R2.12 NC1CCC12CCCCC2 MCULE-6886541560 [0,0,0,2,0,0|2,0,0]=4 2712 B11R2.12 NC1CCC12CCCCC2 MCULE-7547619857 [0,0,0,2,0,0|2,0,0]=4 2713 B11R2.12 NC1COC12CCCCC2 MCULE-2378225923 [0,0,0,2,0,0|1,0,0]=3 2714 B11R2.12 NC1COC12CCOCC2 MCULE-3117485256 [0,0,0,2,0,0|2,0,0]=4 2715 B11R2.12 O=C1COC12CCCCC2 MCULE-3670246496 [0,0,0,2,0,0|0,0,2]=4 2716 B11R2.12 OC1CCC12CCCCC2 MCULE-3691147336 [0,0,0,2,0,0|1,0,0]=3 2717 B11R2.12 OC1CCC12CCOCC2 MCULE-3117551262 [0,0,0,2,0,0|2,0,0]=4 2718 B11R2.12 O[C@H]1CCC12CCCCC2 MCULE-5204946295 [0,0,0,2,0,0|1,0,0]=3 2719 B11R2.13 N#CC1OC12CCCCC2 MCULE-9369976321 [0,0,0,2,0,0|1,0,1]=4 2720 B11R2.13 NCC1CC12CCCCC2 MCULE-6077779260 [0,0,0,2,0,0|2,0,0]=4 2721 B11R2.13 NCC1CC12CCCCC2 MCULE-7048093929 [0,0,0,2,0,0|2,0,0]=4 2722 B11R2.13 OCC1CC12CCCCC2 MCULE-6238078443 [0,0,0,2,0,0|1,0,0]=3 2723 B11R2.13 OCC1CC12CCNCC2 MCULE-2003710184 [0,0,0,2,0,0|2,0,0]=4 2724 B11R2.13 OCC1CC12CCNCC2 MCULE-3353313079 [0,0,0,2,0,0|2,0,0]=4 2725 B11R2.40 NC1(CC1)C2CCCCC2 MCULE-7388088594 [0,0,0,2,0,0|2,0,0]=4 2726 B11R2.40 NC1(CC1)C2CCCCC2 MCULE-9828640180 [0,0,0,2,0,0|2,0,0]=4 2727 B11R2.40 OC1(CC1)C2CCCCN2 MCULE-6817970555 [0,0,0,2,0,0|2,0,0]=4 2728 B11R2.40 OC1(CC1)C2CCCNC2 MCULE-1141696449 [0,0,0,2,0,0|2,0,0]=4 2729 B11R2.40 OC1(CC1)C2CCCNC2 MCULE-3400275280 [0,0,0,2,0,0|2,0,0]=4 2730 B11R2.40 OC1(CC1)C2CCNCC2 MCULE-3736422257 [0,0,0,2,0,0|2,0,0]=4 2731 B11R2.40 OC1(CC1)C2CCNCC2 MCULE-5667120178 [0,0,0,2,0,0|2,0,0]=4 2732 B11R2.239 C1CC(CCN1)C2COC2 MCULE-1989285519 [0,0,0,2,0,0|2,0,0]=4 2733 B11R2.239 C1CC(CCN1)C2COC2 MCULE-4970551570 [0,0,0,2,0,0|2,0,0]=4 2734 B11R2.239 C1CC(CCN1)C2COC2 MCULE-8689576484 [0,0,0,2,0,0|2,0,0]=4 2735 B11R2.239 C1CCC(CC1)C2CCN2 MCULE-5925682172 [0,0,0,2,0,0|2,0,0]=4 2736 B11R2.239 C1CCC(CC1)C2CCN2 MCULE-8650852584 [0,0,0,2,0,0|2,0,0]=4 2737 B11R2.239 C1CCC(CC1)C2CNC2 MCULE-2242492292 [0,0,0,2,0,0|2,0,0]=4 2738 B11R2.239 C1CCC(CC1)C2CNC2 MCULE-7222566670 [0,0,0,2,0,0|2,0,0]=4 2739 B11R2.368 OC1C2CCCC(N2)C1O MCULE-4052923781 [0,0,0,2,0,0|1,0,0]=3 2740 B11R2.10 C12CNCCN1CC(C2)O MCULE-3186832794 [0,0,0,2,0,0|2,0,0]=4 2741 B11R2.10 C12CNCCN1CC(C2)O MCULE-9357209846 [0,0,0,2,0,0|2,0,0]=4 2742 B11R2.10 NC1CC2CCCCN2C1 MCULE-1370603896 [0,0,0,2,0,0|2,0,0]=4 2743 B11R2.10 OC1CC2CNCCN2C1 MCULE-4466671391 [0,0,0,2,0,0|2,0,0]=4 2744 B11R2.10 O[C@@H]1CC2CNCCN2C1 MCULE-2072326058 [0,0,0,2,0,0|2,0,0]=4 2745 B11R2.10 O[C@@H]1CC2CNCCN2C1 MCULE-2880041561 [0,0,0,2,0,0|2,0,0]=4 2746 B11R2.10 O[C@@H]1C[C@H]2CNCCN2C1 MCULE-5899366745 [0,0,0,2,0,0|2,0,0]=4 2747 B11R2.10 [C@@H]12CNCCN1C[C@@H](C2)O MCULE-1799667455 [0,0,0,2,0,0|2,0,0]=4 2748 B11R2.10 [C@@H]12CNCCN1C[C@@H](C2)O MCULE-8861158360 [0,0,0,2,0,0|2,0,0]=4 2749 B11R2.10 [C@@H]12CNCCN1C[C@H](C2)O MCULE-1375030821 [0,0,0,2,0,0|2,0,0]=4 2750 B11R2.10 [C@@H]12CNCCN1C[C@H](C2)O MCULE-1406273242 [0,0,0,2,0,0|2,0,0]=4 2751 B11R2.10 [C@@H]12CNCCN1C[C@H](C2)O MCULE-3401362561 [0,0,0,2,0,0|2,0,0]=4 2752 B11R2.10 [C@@H]12CNCCN1C[C@H](C2)O MCULE-4826879390 [0,0,0,2,0,0|2,0,0]=4 2753 B11R2.10 [C@@H]12CNCCN1C[C@H](C2)O MCULE-4957301000 [0,0,0,2,0,0|2,0,0]=4 2754 B11R2.10 [C@@H]12CNCCN1C[C@H](C2)O MCULE-6751214752 [0,0,0,2,0,0|2,0,0]=4 2755 B11R2.10 [C@H]12CNCCN1C[C@@H](C2)O MCULE-3495339257 [0,0,0,2,0,0|2,0,0]=4 2756 B11R2.10 [C@H]12CNCCN1C[C@@H](C2)O MCULE-4134762727 [0,0,0,2,0,0|2,0,0]=4 2757 B11R2.10 [C@H]12CNCCN1C[C@@H](C2)O MCULE-8169941296 [0,0,0,2,0,0|2,0,0]=4 2758 B11R2.10 [C@H]12CNCCN1C[C@@H](C2)O MCULE-9359538774 [0,0,0,2,0,0|2,0,0]=4 2759 B11R2.10 [C@H]12CNCCN1C[C@H](C2)O MCULE-1289897464 [0,0,0,2,0,0|2,0,0]=4 2760 B11R2.10 [C@H]12CNCCN1C[C@H](C2)O MCULE-5593184436 [0,0,0,2,0,0|2,0,0]=4 2761 B11R2.16 NCC1CC2CCC(C1)C2 MCULE-5715963664 [0,0,0,2,0,0|2,0,0]=4 2762 B11R2.16 OCC1CC2CCC(C1)N2 MCULE-6916010910 [0,0,0,2,0,0|2,0,0]=4 2763 B11R2.16 OCC1CC2CCC(C1)N2 MCULE-9073574170 [0,0,0,2,0,0|2,0,0]=4 2764 B11R2.16 OCC1CC2CCC(C1)O2 MCULE-8911405357 [0,0,0,2,0,0|2,0,0]=4 2765 B11R2.16 [C@@H]1(C[C@@H]2CC[C@H](C1)N2)CO MCULE-5734461427 [0,0,0,2,0,0|2,0,0]=4 2766 B11R2.16 [C@@H]12CC[C@@H](N1)C[C@@H](C2)CO MCULE-3127676033 [0,0,0,2,0,0|2,0,0]=4 2767 B11R2.16 [C@@H]12CC[C@@H](N1)C[C@@H](C2)CO MCULE-8932116310 [0,0,0,2,0,0|2,0,0]=4 2768 B11R2.16 [C@@H]12CC[C@@H](N1)C[C@H](C2)CO MCULE-8625377496 [0,0,0,2,0,0|2,0,0]=4 2769 B11R2.351 OC1CCN(C1)CC2CC2 MCULE-4256650133 [0,0,0,2,0,0|2,0,0]=4 2770 B11R2.748 NC1CCC2(C1)CCCC2 MCULE-6278271136 [0,0,0,2,0,0|2,0,0]=4 2771 B11R2.748 NC1COC2(C1)CCCC2 MCULE-2868969005 [0,0,0,2,0,0|1,0,0]=3 2772 B11R2.748 NC1COC2(C1)CCCC2 MCULE-7472681174 [0,0,0,2,0,0|1,0,0]=3 2773 B11R2.748 O=C1COC2(C1)CCCC2 MCULE-7817661622 [0,0,0,2,0,0|0,0,2]=4 2774 B11R2.748 OC1COC2(C1)CCCC2 MCULE-9192158570 [0,0,0,2,0,0|0,0,0]=2 2775 B11R2.748 OC1COC2(C1)CCNC2 MCULE-1350114091 [0,0,0,2,0,0|1,0,0]=3 2776 B11R2.748 OC1COC2(C1)CCNC2 MCULE-5824997038 [0,0,0,2,0,0|1,0,0]=3 2777 B11R2.748 O[C@@H]1COC2(C1)CCCC2 MCULE-9087093147 [0,0,0,2,0,0|0,0,0]=2 2778 B11R2.7 OC1CCC1N2CCCC2 MCULE-8382558561 [0,0,0,2,0,0|2,0,0]=4 2779 B11R2.15 ICC1CC2COCC2O1 MCULE-5697875493 [0,0,0,2,0,0|2,0,0]=4 2780 B11R2.15 NCC1CC2CCCC2O1 MCULE-2026690398 [0,0,0,2,0,0|1,0,0]=3 2781 B11R2.15 NCC1CC2CCCC2O1 MCULE-9921910983 [0,0,0,2,0,0|1,0,0]=3 2782 B11R2.15 OCC1CC2CNCC2O1 MCULE-4986325524 [0,0,0,2,0,0|1,0,0]=3 2783 B11R2.15 OCC1C[C@@H]2CNC[C@@H]2O1 MCULE-4375023657 [0,0,0,2,0,0|1,0,0]=3 2784 B11R2.15 OCC1C[C@H]2CNC[C@H]2O1 MCULE-5364634073 [0,0,0,2,0,0|1,0,0]=3 2785 B11R2.15 OCC1C[C@H]2CNC[C@H]2O1 MCULE-7082918551 [0,0,0,2,0,0|1,0,0]=3 2786 B11R2.15 OC[C@@H]1C[C@@H]2CCC[C@@H]2N1 MCULE-4306647728 [0,0,0,2,0,0|1,0,0]=3 2787 B11R2.15 [C@@H]12CCC[C@@H]1N[C@@H](C2)CO MCULE-5323132382 [0,0,0,2,0,0|1,0,0]=3 2788 B11R2.228 C#CC1(CC2CCC1C2)O MCULE-2754496911 [0,0,0,2,0,0|1,0,1]=4 2789 B11R2.228 CC1(CC2CCC1C2)CN MCULE-6321953937 [0,0,0,2,0,0|2,0,0]=4 2790 B11R2.237 C1CCC(C1)CC2CNC2 MCULE-5298329610 [0,0,0,2,0,0|2,0,0]=4 2791 B11R2.237 C1CCC(C1)CC2CNC2 MCULE-8200607032 [0,0,0,2,0,0|2,0,0]=4 2792 B11R2.985 OCC1CC2(C1)CCNC2 MCULE-9289382526 [0,0,0,2,0,0|2,0,0]=4 2793 B11R2.362 OC1CCC1NCC2CC2 MCULE-2073108728 [0,0,0,2,0,0|2,0,0]=4 2794 B11R2.362 O[C@@H]1CC[C@H]1OCC2CC2 MCULE-8042451768 [0,0,0,2,0,0|2,0,0]=4 2795 B11R2.512 O[C@@H]1CC[C@H]1OC2CCC2 MCULE-6416149998 [0,0,0,2,0,0|2,0,0]=4 2796 B11R2.1098 NCC12CCCC1CCC2 MCULE-1603938524 [0,0,0,2,0,0|2,0,0]=4 2797 B11R2.1098 NCC12CCCC1CCC2 MCULE-3837300076 [0,0,0,2,0,0|2,0,0]=4 2798 B11R2.1098 OCC12CCCC1CNC2 MCULE-8231266103 [0,0,0,2,0,0|2,0,0]=4 2799 B11R2.1098 OCC12CCCC1OCC2 MCULE-1055806217 [0,0,0,2,0,0|2,0,0]=4 2800 B11R2.1098 OCC12CCCN1CCC2 MCULE-2521405790 [0,0,0,2,0,0|2,0,0]=4 2801 B11R2.1098 OCC12CCCN1CCC2 MCULE-5199260730 [0,0,0,2,0,0|2,0,0]=4 2802 B11R2.1098 [C@@H]12CCC[C@@]1(CNC2)CO MCULE-3499897803 [0,0,0,2,0,0|2,0,0]=4 2803 B11R2.1098 [C@@H]12CCC[C@@]1(CNC2)CO MCULE-9182740765 [0,0,0,2,0,0|2,0,0]=4 2804 B11R2.1128 OC[C@]12CCC[C@]1(C2)CO MCULE-8315258046 [0,0,0,2,0,0|2,0,0]=4 2805 B11R2.1277 NCC1CCCC2(C1)CC2 MCULE-9058540644 [0,0,0,2,0,0|2,0,0]=4 2806 B11R2.1277 NCC1CCCC2(C1)CC2 MCULE-9870715569 [0,0,0,2,0,0|2,0,0]=4 2807 B11R2.1277 OCC1CCCC2(C1)CC2 MCULE-9891965897 [0,0,0,2,0,0|1,0,0]=3 2808 B11R2.1277 OC[C@H]1CCCC2(C1)CC2 MCULE-7564501414 [0,0,0,2,0,0|1,0,0]=3 2809 B11R2.1037 C1CCC2CCCC(C1)N2 MCULE-3080045089 [0,0,0,2,0,0|2,0,0]=4 2810 B11R2.1037 C1CCC2CCCC(C1)N2 MCULE-5144781623 [0,0,0,2,0,0|2,0,0]=4 2811 B11R2.432 NC1CC2CCC(C1)C2O MCULE-1304703648 [0,0,0,2,0,0|2,0,0]=4 2812 B11R2.432 NC1CC2CCC(C1)C2O MCULE-3947228894 [0,0,0,2,0,0|2,0,0]=4 2813 B11R2.21 BrCC1CCC(O1)C2CC2 MCULE-5815196814 [0,0,0,2,0,0|1,0,0]=3 2814 B11R2.21 ICC1CCC(O1)C2CC2 MCULE-2834040570 [0,0,0,2,0,0|1,0,0]=3 2815 B11R2.21 NCC1CCC(O1)C2CC2 MCULE-7137791231 [0,0,0,2,0,0|1,0,0]=3 2816 B11R2.21 NCC1CCC(O1)C2CC2 MCULE-9594176542 [0,0,0,2,0,0|1,0,0]=3 2817 B11R2.21 OCC1CCN(C1)C2CC2 MCULE-9459773919 [0,0,0,2,0,0|2,0,0]=4 2818 B11R2.191 ICC1OCC2C1OCC2 MCULE-6924746043 [0,0,0,2,0,0|2,0,0]=4 2819 B11R2.191 NC[C@H]1CC[C@H]2[C@@H]1CCC2 MCULE-6571164346 [0,0,0,2,0,0|2,0,0]=4 2820 B11R2.191 NC[C@H]1CC[C@H]2[C@@H]1CCC2 MCULE-9278602388 [0,0,0,2,0,0|2,0,0]=4 2821 B11R2.191 OCC1NCC2C1CNC2 MCULE-1618510665 [0,0,0,2,0,0|2,0,0]=4 2822 B11R2.191 OCC1NCC2C1CNC2 MCULE-5001639390 [0,0,0,2,0,0|2,0,0]=4 2823 B11R2.191 [C@@H]12CCCN1CC[C@H]2CO MCULE-9375281978 [0,0,0,2,0,0|2,0,0]=4 2824 B11R2.191 [C@H]12CCCN1CC[C@@H]2CO MCULE-9274497463 [0,0,0,2,0,0|2,0,0]=4 2825 B11R2.1009 ICC1CCC2(O1)CCC2 MCULE-7186676076 [0,0,0,2,0,0|1,0,0]=3 2826 B11R2.1009 ICC1CCC2(O1)COC2 MCULE-6748585573 [0,0,0,2,0,0|2,0,0]=4 2827 B11R2.1009 NCC1CCC2(O1)CCC2 MCULE-1800851985 [0,0,0,2,0,0|1,0,0]=3 2828 B11R2.1009 NCC1CCC2(O1)CCC2 MCULE-9035015796 [0,0,0,2,0,0|1,0,0]=3 2829 B11R2.1009 NCC1CCC2(O1)COC2 MCULE-4589551566 [0,0,0,2,0,0|2,0,0]=4 2830 B11R2.1009 OCC1CC2(CCC2)CO1 MCULE-5016865012 [0,0,0,2,0,0|2,0,0]=4 2831 B11R2.1009 OCC1COC2(C1)CCC2 MCULE-3697997813 [0,0,0,2,0,0|2,0,0]=4 2832 B11R2.1149 OCC12CCCN(C1)CC2 MCULE-4242143611 [0,0,0,2,0,0|2,0,0]=4 2833 B11R2.1149 OCC12CCCN(C1)CC2 MCULE-4821864559 [0,0,0,2,0,0|2,0,0]=4