0 B10R0.4 C#CCCCCCCC(=O)O MCULE-9844370313 [0,0,0,0,0,0|0,0,2]=2 1 B10R0.4 C#CCOCCOCC(=O)O MCULE-2117769924 [0,0,0,0,0,0|2,0,2]=4 2 B10R0.4 C(=CC(=O)O)CCCCCC MCULE-5063564829 [0,0,0,0,0,0|0,0,2]=2 3 B10R0.4 C=C(Br)CCCCCCC#N MCULE-8248431627 [0,0,0,0,0,0|3,0,1]=4 4 B10R0.4 C=C(Br)CCCCCCCC MCULE-6632348327 [0,0,0,0,0,0|2,0,0]=2 5 B10R0.4 C=C(Br)CCCCCCCCl MCULE-7158264521 [0,0,0,0,0,0|3,0,0]=3 6 B10R0.4 C=C(C)CCCCCCC#N MCULE-2126378309 [0,0,0,0,0,0|3,0,1]=4 7 B10R0.4 C=C(C)CCCCCCCC MCULE-2486247417 [0,0,0,0,0,0|2,0,0]=2 8 B10R0.4 C=C(C)CCCCCCCCl MCULE-1277821807 [0,0,0,0,0,0|3,0,0]=3 9 B10R0.4 C=C(Cl)CCCCCCC#N MCULE-8532485839 [0,0,0,0,0,0|3,0,1]=4 10 B10R0.4 C=C(Cl)CCCCCCCC MCULE-5745154351 [0,0,0,0,0,0|2,0,0]=2 11 B10R0.4 C=C(Cl)CCCCCCCCl MCULE-2676680423 [0,0,0,0,0,0|3,0,0]=3 12 B10R0.4 C=CCCCCCCB(O)O MCULE-3369080117 [0,0,0,0,0,0|1,0,3]=4 13 B10R0.4 C=CCCCCCCC(=C)C MCULE-8947679436 [0,0,0,0,0,0|2,0,2]=4 14 B10R0.4 C=CCCCCCCC(=O)C MCULE-3952725967 [0,0,0,0,0,0|1,0,2]=3 15 B10R0.4 C=CCCCCCCC(=O)O MCULE-3663585072 [0,0,0,0,0,0|0,0,2]=2 16 B10R0.4 C=CCCCCCCC(C)O MCULE-8946172514 [0,0,0,0,0,0|1,0,3]=4 17 B10R0.4 C=CCCCCCCN(=O)=O MCULE-6691073121 [0,0,0,0,0,0|1,0,3]=4 18 B10R0.4 C=CCCCCCC[C@@H](C)O MCULE-8592463039 [0,0,0,0,0,0|1,0,3]=4 19 B10R0.4 C=CCCCCCC[C@@H](C)O MCULE-9140993826 [0,0,0,0,0,0|1,0,3]=4 20 B10R0.4 C=CCCCCCC[C@H](C)O MCULE-8109598857 [0,0,0,0,0,0|1,0,3]=4 21 B10R0.4 C=CCCCCCOC(=O)C MCULE-7198359038 [0,0,0,0,0,0|2,0,2]=4 22 B10R0.4 C=CCOCCOCC(=O)O MCULE-8100852333 [0,0,0,0,0,0|2,0,2]=4 23 B10R0.4 CC(=O)CCCCCCCO MCULE-6975960500 [0,0,0,0,0,0|2,0,0]=2 24 B10R0.4 CC(=O)NCCCCCCN MCULE-6988947031 [0,0,0,0,0,0|3,0,0]=3 25 B10R0.4 CC(=O)OCCCCCCBr MCULE-9658847674 [0,0,0,0,0,0|3,0,0]=3 26 B10R0.4 CC(=O)OCCCCCCCl MCULE-2777138332 [0,0,0,0,0,0|3,0,0]=3 27 B10R0.4 CC(=O)SCCCCCCN MCULE-6118060031 [0,0,0,0,0,0|3,0,0]=3 28 B10R0.4 CC(=O)SCCCCCCN MCULE-7116355086 [0,0,0,0,0,0|3,0,0]=3 29 B10R0.4 CC(C)CCCCCCCO MCULE-6712139024 [0,0,0,0,0,0|3,0,1]=4 30 B10R0.4 CCCC/C=C/COC(=O)C MCULE-5121036018 [0,0,0,0,0,0|2,0,2]=4 31 B10R0.4 CCCCC/C=C/CC(=O)O MCULE-1378284129 [0,0,0,0,0,0|0,0,2]=2 32 B10R0.4 CCCCC=CCOC(=O)C MCULE-9678532361 [0,0,0,0,0,0|2,0,2]=4 33 B10R0.4 CCCCCC/C=C/B(O)O MCULE-2505509869 [0,0,0,0,0,0|1,0,3]=4 34 B10R0.4 CCCCCC/C=C/C(=O)O MCULE-8167234483 [0,0,0,0,0,0|0,0,2]=2 35 B10R0.4 CCCCCC=CCC(=O)O MCULE-5507503933 [0,0,0,0,0,0|0,0,2]=2 36 B10R0.4 CCCCCCC=CB(O)O MCULE-9573755662 [0,0,0,0,0,0|1,0,3]=4 37 B10R0.4 CCCCCCC=CC(=O)C MCULE-7025674174 [0,0,0,0,0,0|1,0,2]=3 38 B10R0.4 CCCCCCCCB(O)O MCULE-9483383226 [0,0,0,0,0,0|1,0,1]=2 39 B10R0.4 CCCCCCCCC(=N)N MCULE-1846296312 [0,0,0,0,0,0|2,0,0]=2 40 B10R0.4 CCCCCCCCC(=O)C MCULE-6168357226 [0,0,0,0,0,0|1,0,0]=1 41 B10R0.4 CCCCCCCCC(=O)Cl MCULE-7596715750 [0,0,0,0,0,0|1,0,0]=1 42 B10R0.4 CCCCCCCCC(=O)N MCULE-6415702858 [0,0,0,0,0,0|1,0,0]=1 43 B10R0.4 CCCCCCCCC(=O)O MCULE-4736597375 [0,0,0,0,0,0|0,0,0]=0 44 B10R0.4 CCCCCCCCC(=O)[O-] MCULE-1077439841 [0,0,0,0,0,0|0,0,1]=1 45 B10R0.4 CCCCCCCCC(C)C MCULE-3505579656 [0,0,0,0,0,0|2,0,1]=3 46 B10R0.4 CCCCCCCCC(C)O MCULE-3577613701 [0,0,0,0,0,0|1,0,1]=2 47 B10R0.4 CCCCCCCCN(=O)=O MCULE-2507397154 [0,0,0,0,0,0|1,0,1]=2 48 B10R0.4 CCCCCCCCN(C)C MCULE-2841483956 [0,0,0,0,0,0|3,0,0]=3 49 B10R0.4 CCCCCCCCN(C)C MCULE-8695073136 [0,0,0,0,0,0|3,0,0]=3 50 B10R0.4 CCCCCCCC[C@@H](C)Br MCULE-8624556030 [0,0,0,0,0,0|2,0,1]=3 51 B10R0.4 CCCCCCCC[C@@H](C)O MCULE-6511994487 [0,0,0,0,0,0|1,0,1]=2 52 B10R0.4 CCCCCCCC[C@H](C)O MCULE-7200709868 [0,0,0,0,0,0|1,0,1]=2 53 B10R0.4 CCCCCCCNC(=O)C MCULE-3916780915 [0,0,0,0,0,0|2,0,0]=2 54 B10R0.4 CCCCCCCNC(=S)N MCULE-7534812314 [0,0,0,0,0,0|2,1,0]=3 55 B10R0.4 CCCCCCCOC(=O)C MCULE-7061891812 [0,0,0,0,0,0|2,0,0]=2 56 B10R0.4 CCCCCCCOC(=O)Cl MCULE-9018506867 [0,0,0,0,0,0|2,0,0]=2 57 B10R0.4 CCCCCCCOC(=S)[S-] MCULE-1608327732 [0,0,0,0,0,0|1,2,0]=3 58 B10R0.4 CCCCCCCOC(=S)[S-] MCULE-7650100616 [0,0,0,0,0,0|1,2,0]=3 59 B10R0.4 CCCCCCCSC(=[NH2+])N MCULE-2803933619 [0,0,0,0,0,0|3,0,0]=3 60 B10R0.4 CCCCCCCSC(=[NH2+])N MCULE-5565074928 [0,0,0,0,0,0|3,0,0]=3 61 B10R0.4 CCCCCCNCC(=O)O MCULE-3361498309 [0,0,0,0,0,0|1,0,0]=1 62 B10R0.4 CCCCCCNCC(C)O MCULE-5617215322 [0,0,0,0,0,0|2,0,1]=3 63 B10R0.4 CCCCCCOCC(=O)O MCULE-6951993364 [0,0,0,0,0,0|1,0,0]=1 64 B10R0.4 CCCCCCSCC(=O)O MCULE-5086023021 [0,0,0,0,0,0|1,0,0]=1 65 B10R0.4 CCCCOCCOC(=O)C MCULE-4906127008 [0,0,0,0,0,0|3,0,0]=3 66 B10R0.4 CCCCSCCCC(=O)O MCULE-5928316679 [0,0,0,0,0,0|1,0,0]=1 67 B10R0.4 CCCCSCCSC(=N)N MCULE-3434333786 [0,0,0,0,0,0|4,0,0]=4 68 B10R0.4 CCCCSCCSC(=N)N MCULE-8139259062 [0,0,0,0,0,0|4,0,0]=4 69 B10R0.4 CCOCCCCCC(=O)O MCULE-9514442276 [0,0,0,0,0,0|1,0,0]=1 70 B10R0.4 CCOCCOCCC(=O)O MCULE-7483626719 [0,0,0,0,0,0|2,0,0]=2 71 B10R0.4 CN(C)CCCCCCCN MCULE-9345898285 [0,0,0,0,0,0|4,0,0]=4 72 B10R0.4 COCCCCCCN(=O)=O MCULE-3117222018 [0,0,0,0,0,0|2,0,1]=3 73 B10R0.4 COCCCNCCC(=O)N MCULE-2468408250 [0,0,0,0,0,0|3,0,0]=3 74 B10R0.4 COCCCOCCC(=O)O MCULE-5178930362 [0,0,0,0,0,0|2,0,0]=2 75 B10R0.4 COCCOCCOC(=O)C MCULE-6392138253 [0,0,0,0,0,0|4,0,0]=4 76 B10R0.4 CSCCCCCCC(=O)O MCULE-9976800222 [0,0,0,0,0,0|1,0,0]=1 77 B10R0.4 N#N=NCCCCCC(=O)O MCULE-1473761098 [0,0,0,0,0,0|3,0,0]=3 78 B10R0.4 N#N=NCCOCCC(=O)O MCULE-2033309776 [0,0,0,0,0,0|4,0,0]=4 79 B10R0.4 NC(=O)CCCCCCCBr MCULE-4427479699 [0,0,0,0,0,0|2,0,0]=2 80 B10R0.4 NCCCCCCCC(=O)O MCULE-2737882810 [0,0,0,0,0,0|1,0,0]=1 81 B10R0.4 NCCCCCCCC(=O)O MCULE-4269382976 [0,0,0,0,0,0|1,0,0]=1 82 B10R0.4 NCCCCCCNC(=O)O MCULE-3865214371 [0,0,0,0,0,0|2,0,0]=2 83 B10R0.4 NCCCNCCCC(=O)O MCULE-2780784491 [0,0,0,0,0,0|2,0,0]=2 84 B10R0.4 NCCCNCCCC(=O)O MCULE-8488597292 [0,0,0,0,0,0|2,0,0]=2 85 B10R0.4 NCCOCCOCC(=O)O MCULE-8111157626 [0,0,0,0,0,0|3,0,0]=3 86 B10R0.4 NCCOCCOCC(=O)O MCULE-9455562840 [0,0,0,0,0,0|3,0,0]=3 87 B10R0.4 NCCSSCCNC(=O)O MCULE-5576549611 [0,0,0,0,0,0|4,0,0]=4 88 B10R0.4 O=C(Cl)CCCCCCCBr MCULE-5775098735 [0,0,0,0,0,0|2,0,0]=2 89 B10R0.4 O=C(O)CCCCCCCBr MCULE-6425557416 [0,0,0,0,0,0|1,0,0]=1 90 B10R0.4 O=C(O)CCCCCCCO MCULE-1839591073 [0,0,0,0,0,0|1,0,0]=1 91 B10R0.4 O=C(O)CCCCCCCS MCULE-6555950664 [0,0,0,0,0,0|1,0,0]=1 92 B10R0.4 O=C(O)COCCOCCCl MCULE-2275317201 [0,0,0,0,0,0|3,0,0]=3 93 B10R0.4 O=C(O)COCCOCCO MCULE-1507756107 [0,0,0,0,0,0|3,0,0]=3 94 B10R0.4 O=C([O-])COCCOCCO MCULE-7695579733 [0,0,0,0,0,0|3,0,1]=4 95 B10R0.4 O=CCCCCCCC(=O)O MCULE-3146118588 [0,0,0,0,0,0|1,0,1]=2 96 B10R0.4 O=CNCCCCCC(=O)O MCULE-1392572274 [0,0,0,0,0,0|2,0,1]=3 97 B10R0.4 O=N(=O)CCCCCCCO MCULE-6021483764 [0,0,0,0,0,0|2,0,1]=3 98 B10R0.4 [C@H](C)(O)CCCCCCCC MCULE-7849954701 [0,0,0,0,0,0|1,0,1]=2 99 B9R0.2 C#CCCCCCC(=O)O MCULE-4594227399 [1,0,0,0,0,0|0,0,2]=3 100 B9R0.2 C=C(Br)CCCCCCC MCULE-7091252982 [1,0,0,0,0,0|2,0,0]=3 101 B9R0.2 C=C(Br)CCCCCCCl MCULE-7125450966 [1,0,0,0,0,0|3,0,0]=4 102 B9R0.2 C=C(C)CCCCCCC MCULE-6074571960 [1,0,0,0,0,0|2,0,0]=3 103 B9R0.2 C=C(C)CCCCCCCl MCULE-8555589200 [1,0,0,0,0,0|3,0,0]=4 104 B9R0.2 C=C(Cl)CCCCCCC MCULE-4513303196 [1,0,0,0,0,0|2,0,0]=3 105 B9R0.2 C=C(Cl)CCCCCCCl MCULE-6627377695 [1,0,0,0,0,0|3,0,0]=4 106 B9R0.2 C=CCCCCCC(=O)C MCULE-7133840219 [1,0,0,0,0,0|1,0,2]=4 107 B9R0.2 C=CCCCCCC(=O)O MCULE-6571932731 [1,0,0,0,0,0|0,0,2]=3 108 B9R0.2 C=CCOCCCC(=O)O MCULE-5276221892 [1,0,0,0,0,0|1,0,2]=4 109 B9R0.2 CC(=O)CCCCCCN MCULE-5842243037 [1,0,0,0,0,0|2,0,0]=3 110 B9R0.2 CC(=O)CCCCCCN MCULE-6017408205 [1,0,0,0,0,0|2,0,0]=3 111 B9R0.2 CC(=O)NCCCCCCl MCULE-9253955715 [1,0,0,0,0,0|3,0,0]=4 112 B9R0.2 CC(=O)NCCCCCN MCULE-6340089295 [1,0,0,0,0,0|3,0,0]=4 113 B9R0.2 CC(=O)NCCCCCN MCULE-9533682248 [1,0,0,0,0,0|3,0,0]=4 114 B9R0.2 CC(=O)OCCCCCBr MCULE-2710815321 [1,0,0,0,0,0|3,0,0]=4 115 B9R0.2 CC(=O)OCCCCCCl MCULE-4259346820 [1,0,0,0,0,0|3,0,0]=4 116 B9R0.2 CC(=O)SCCCCCBr MCULE-3706830993 [1,0,0,0,0,0|3,0,0]=4 117 B9R0.2 CCCC/C=C/CC(=O)O MCULE-3008379579 [1,0,0,0,0,0|0,0,2]=3 118 B9R0.2 CCCC=CCCC(=O)O MCULE-8091554117 [1,0,0,0,0,0|0,0,2]=3 119 B9R0.2 CCCCC#CCC(=O)O MCULE-2685341100 [1,0,0,0,0,0|0,0,2]=3 120 B9R0.2 CCCCC/C=C/C(=O)C MCULE-4810438787 [1,0,0,0,0,0|1,0,2]=4 121 B9R0.2 CCCCC/C=C/C(=O)O MCULE-5661205729 [1,0,0,0,0,0|0,0,2]=3 122 B9R0.2 CCCCC=CCC(=O)N MCULE-7054762763 [1,0,0,0,0,0|1,0,2]=4 123 B9R0.2 CCCCC=CCC(=O)O MCULE-1531958630 [1,0,0,0,0,0|0,0,2]=3 124 B9R0.2 CCCCCC#CC(=O)O MCULE-1860076106 [1,0,0,0,0,0|0,0,2]=3 125 B9R0.2 CCCCCC=CC(=O)C MCULE-2447853309 [1,0,0,0,0,0|1,0,2]=4 126 B9R0.2 CCCCCC=CC(=O)O MCULE-6969617806 [1,0,0,0,0,0|0,0,2]=3 127 B9R0.2 CCCCCCCB(O)O MCULE-2487835239 [1,0,0,0,0,0|1,0,1]=3 128 B9R0.2 CCCCCCCC(=N)N MCULE-8703701987 [1,0,0,0,0,0|2,0,0]=3 129 B9R0.2 CCCCCCCC(=O)C MCULE-9635928766 [1,0,0,0,0,0|1,0,0]=2 130 B9R0.2 CCCCCCCC(=O)Cl MCULE-9979489292 [1,0,0,0,0,0|1,0,0]=2 131 B9R0.2 CCCCCCCC(=O)N MCULE-8774193381 [1,0,0,0,0,0|1,0,0]=2 132 B9R0.2 CCCCCCCC(=O)O MCULE-5193957469 [1,0,0,0,0,0|0,0,0]=1 133 B9R0.2 CCCCCCCC(=O)[O-] MCULE-3608650495 [1,0,0,0,0,0|0,0,1]=2 134 B9R0.2 CCCCCCCC(=O)[O-] MCULE-8227046407 [1,0,0,0,0,0|0,0,1]=2 135 B9R0.2 CCCCCCCC(C)Br MCULE-1086603851 [1,0,0,0,0,0|2,0,1]=4 136 B9R0.2 CCCCCCCC(C)C MCULE-6606361985 [1,0,0,0,0,0|2,0,1]=4 137 B9R0.2 CCCCCCCC(C)N MCULE-7510062756 [1,0,0,0,0,0|2,0,1]=4 138 B9R0.2 CCCCCCCC(C)O MCULE-5218382339 [1,0,0,0,0,0|1,0,1]=3 139 B9R0.2 CCCCCCCN(=O)=O MCULE-3345030651 [1,0,0,0,0,0|1,0,1]=3 140 B9R0.2 CCCCCCCN(C)C MCULE-8135887454 [1,0,0,0,0,0|3,0,0]=4 141 B9R0.2 CCCCCCC[C@@H](C)N MCULE-4735169409 [1,0,0,0,0,0|2,0,1]=4 142 B9R0.2 CCCCCCC[C@H](C)O MCULE-6211597611 [1,0,0,0,0,0|1,0,1]=3 143 B9R0.2 CCCCCCNC(=O)N MCULE-4236638652 [1,0,0,0,0,0|2,0,0]=3 144 B9R0.2 CCCCCCNC(=S)N MCULE-1507775926 [1,0,0,0,0,0|2,1,0]=4 145 B9R0.2 CCCCCCOC(=O)C MCULE-7353613022 [1,0,0,0,0,0|2,0,0]=3 146 B9R0.2 CCCCCCOC(=O)Cl MCULE-3135055168 [1,0,0,0,0,0|2,0,0]=3 147 B9R0.2 CCCCCCOC(=O)N MCULE-3909923308 [1,0,0,0,0,0|2,0,0]=3 148 B9R0.2 CCCCCCOC(=S)[S-] MCULE-1848031601 [1,0,0,0,0,0|1,2,0]=4 149 B9R0.2 CCCCCCOC(=S)[S-] MCULE-2674237730 [1,0,0,0,0,0|1,2,0]=4 150 B9R0.2 CCCCCCSC(=N)N MCULE-5637553864 [1,0,0,0,0,0|3,0,0]=4 151 B9R0.2 CCCCCCSC(=N)N MCULE-7474503542 [1,0,0,0,0,0|3,0,0]=4 152 B9R0.2 CCCCCCSC(=[NH2+])N MCULE-5793664409 [1,0,0,0,0,0|3,0,0]=4 153 B9R0.2 CCCCCNCC(=O)N MCULE-1817354788 [1,0,0,0,0,0|2,0,0]=3 154 B9R0.2 CCCCCNCC(=O)N MCULE-5558188497 [1,0,0,0,0,0|2,0,0]=3 155 B9R0.2 CCCCCOCC(=O)O MCULE-8190672624 [1,0,0,0,0,0|1,0,0]=2 156 B9R0.2 CCCCOCCC(=O)O MCULE-3735085695 [1,0,0,0,0,0|1,0,0]=2 157 B9R0.2 CCCCSCCC(=O)O MCULE-7414288717 [1,0,0,0,0,0|1,0,0]=2 158 B9R0.2 CCCOCCCC(=O)O MCULE-8829980105 [1,0,0,0,0,0|1,0,0]=2 159 B9R0.2 CCCOCCOC(=O)Cl MCULE-3909524059 [1,0,0,0,0,0|3,0,0]=4 160 B9R0.2 CCCSCCCC(=O)O MCULE-9850452520 [1,0,0,0,0,0|1,0,0]=2 161 B9R0.2 CCNCCCCC(=O)O MCULE-1386195341 [1,0,0,0,0,0|1,0,0]=2 162 B9R0.2 CCNCCCCC(=O)O MCULE-1922836400 [1,0,0,0,0,0|1,0,0]=2 163 B9R0.2 CCOCCCCC(=O)O MCULE-8522289104 [1,0,0,0,0,0|1,0,0]=2 164 B9R0.2 CCOCCOCC(=O)O MCULE-2273372397 [1,0,0,0,0,0|2,0,0]=3 165 B9R0.2 CNCCCCCC(=O)O MCULE-8016435275 [1,0,0,0,0,0|1,0,0]=2 166 B9R0.2 CNCCOCCC(=O)O MCULE-6581967922 [1,0,0,0,0,0|2,0,0]=3 167 B9R0.2 COCCCCCC(=O)O MCULE-1769987918 [1,0,0,0,0,0|1,0,0]=2 168 B9R0.2 COCCCCOC(=O)C MCULE-4352807618 [1,0,0,0,0,0|3,0,0]=4 169 B9R0.2 COCCCOCC(=O)O MCULE-7774967166 [1,0,0,0,0,0|2,0,0]=3 170 B9R0.2 COCCNCCC(=O)N MCULE-2441989659 [1,0,0,0,0,0|3,0,0]=4 171 B9R0.2 COCCNCCC(=O)O MCULE-3571993123 [1,0,0,0,0,0|2,0,0]=3 172 B9R0.2 COCCOCCC(=O)O MCULE-5125891492 [1,0,0,0,0,0|2,0,0]=3 173 B9R0.2 CSCCCCCC(=O)O MCULE-9069370044 [1,0,0,0,0,0|1,0,0]=2 174 B9R0.2 C[NH2+]CCCCCC(=O)O MCULE-8971339830 [1,0,0,0,0,0|1,0,0]=2 175 B9R0.2 N#CCCCCCC(=O)O MCULE-6510846674 [1,0,0,0,0,0|1,0,1]=3 176 B9R0.2 N#CCCNCCC(=O)O MCULE-5749626028 [1,0,0,0,0,0|2,0,1]=4 177 B9R0.2 N#N=NCCCCC(=O)O MCULE-6676414217 [1,0,0,0,0,0|3,0,0]=4 178 B9R0.2 NC(=O)CCCCCCO MCULE-7432797193 [1,0,0,0,0,0|2,0,0]=3 179 B9R0.2 NC(=O)CCNCCCO MCULE-1089880795 [1,0,0,0,0,0|3,0,0]=4 180 B9R0.2 NC(=O)CCNCCCO MCULE-8808474432 [1,0,0,0,0,0|3,0,0]=4 181 B9R0.2 NCCCCCCC(=O)N MCULE-9587339996 [1,0,0,0,0,0|2,0,0]=3 182 B9R0.2 NCCCCCCC(=O)O MCULE-6089872609 [1,0,0,0,0,0|1,0,0]=2 183 B9R0.2 NCCCCCCC(=O)O MCULE-7769232328 [1,0,0,0,0,0|1,0,0]=2 184 B9R0.2 NCCSSCCC(=O)O MCULE-2378332819 [1,0,0,0,0,0|3,0,0]=4 185 B9R0.2 NCCSSCCC(=O)O MCULE-4249865017 [1,0,0,0,0,0|3,0,0]=4 186 B9R0.2 NOCCCCCC(=O)O MCULE-3221083368 [1,0,0,0,0,0|2,0,0]=3 187 B9R0.2 NOCCCCCC(=O)O MCULE-6721085396 [1,0,0,0,0,0|2,0,0]=3 188 B9R0.2 NOCCCCCC(=O)O MCULE-7170875932 [1,0,0,0,0,0|2,0,0]=3 189 B9R0.2 O=C(O)CCCCCCBr MCULE-3980379488 [1,0,0,0,0,0|1,0,0]=2 190 B9R0.2 O=C(O)CCCCCCF MCULE-7539264820 [1,0,0,0,0,0|1,0,0]=2 191 B9R0.2 O=C(O)CCCCCCO MCULE-7270362706 [1,0,0,0,0,0|1,0,0]=2 192 B9R0.2 O=C(O)CCCCCCS MCULE-5659986053 [1,0,0,0,0,0|1,0,0]=2 193 B9R0.2 O=C(O)CCCNCCO MCULE-8202070706 [1,0,0,0,0,0|2,0,0]=3 194 B9R0.2 O=C(O)CNCCCCO MCULE-6377863888 [1,0,0,0,0,0|2,0,0]=3 195 B9R0.2 O=CCCCCCC(=O)O MCULE-1442157793 [1,0,0,0,0,0|1,0,1]=3 196 B9R0.2 O=N(=O)CCCCCCBr MCULE-2338252232 [1,0,0,0,0,0|2,0,1]=4 197 B9R0.2 O=N(=O)CCCCCCCl MCULE-9710639685 [1,0,0,0,0,0|2,0,1]=4 198 B9R0.2 O=N(=O)CCCCCCO MCULE-4612254871 [1,0,0,0,0,0|2,0,1]=4 199 B9R0.2 OB(O)CCCCCCBr MCULE-2961009060 [1,0,0,0,0,0|2,0,1]=4 200 B9R0.2 P(=O)([O-])OCCCCCC MCULE-6311367116 [1,0,0,0,0,0|2,0,1]=4 201 B9R0.2 [NH2+]=C(N)SCCCCCC MCULE-3527944138 [1,0,0,0,0,0|3,0,0]=4 202 B9R0.45 BrCCCCCCCCBr MCULE-7960475988 [1,0,0,0,0,0|2,0,1]=4 203 B9R0.45 C#CCCCCCCCC MCULE-3452683648 [1,0,0,0,0,0|1,0,1]=3 204 B9R0.45 C#CCCCCCCCI MCULE-7418177661 [1,0,0,0,0,0|2,0,1]=4 205 B9R0.45 C#CCCCCCCCO MCULE-8834112591 [1,0,0,0,0,0|0,0,3]=4 206 B9R0.45 C#CCOCCCCC=O MCULE-7005816289 [1,0,0,0,0,0|1,0,2]=4 207 B9R0.45 C(=C\CCCCCO)\CC MCULE-7910166129 [1,0,0,0,0,0|0,0,3]=4 208 B9R0.45 C=CCCCCCCC#N MCULE-9683735042 [1,0,0,0,0,0|2,0,1]=4 209 B9R0.45 C=CCCCCCCC=C MCULE-5867550577 [1,0,0,0,0,0|1,0,2]=4 210 B9R0.45 C=CCCCCCCC=O MCULE-4979248929 [1,0,0,0,0,0|0,0,2]=3 211 B9R0.45 C=CCCCCCCCBr MCULE-6324921683 [1,0,0,0,0,0|2,0,0]=3 212 B9R0.45 C=CCCCCCCCC MCULE-1391753135 [1,0,0,0,0,0|1,0,0]=2 213 B9R0.45 C=CCCCCCCCCl MCULE-3438052360 [1,0,0,0,0,0|2,0,0]=3 214 B9R0.45 C=CCCCCCCCN MCULE-5068886534 [1,0,0,0,0,0|2,0,0]=3 215 B9R0.45 C=CCCCCCCCN MCULE-7639889154 [1,0,0,0,0,0|2,0,0]=3 216 B9R0.45 C=CCCCCCCCO MCULE-9611510472 [1,0,0,0,0,0|2,0,0]=3 217 B9R0.45 C=CCCNCCCCO MCULE-4909275740 [1,0,0,0,0,0|3,0,0]=4 218 B9R0.45 CC#CCCCCCCC MCULE-9888604196 [1,0,0,0,0,0|1,0,2]=4 219 B9R0.45 CC/C=C\CCCCC=O MCULE-6517193376 [1,0,0,0,0,0|0,0,2]=3 220 B9R0.45 CC=CCCCCCCC MCULE-6461098537 [1,0,0,0,0,0|1,0,1]=3 221 B9R0.45 CCC=CCCCCC=O MCULE-5419350827 [1,0,0,0,0,0|0,0,2]=3 222 B9R0.45 CCC=CCCCCCO MCULE-1504274864 [1,0,0,0,0,0|0,0,3]=4 223 B9R0.45 CCCCC#CCCCO MCULE-1298739911 [1,0,0,0,0,0|0,0,3]=4 224 B9R0.45 CCCCC/C=C\CCO MCULE-4434068395 [1,0,0,0,0,0|0,0,3]=4 225 B9R0.45 CCCCCC#CCCO MCULE-7189083538 [1,0,0,0,0,0|0,0,3]=4 226 B9R0.45 CCCCCC/C=C/C=O MCULE-5281758989 [1,0,0,0,0,0|0,0,2]=3 227 B9R0.45 CCCCCC/C=C/CO MCULE-1969100525 [1,0,0,0,0,0|0,0,3]=4 228 B9R0.45 CCCCCC/C=C\CO MCULE-4688229291 [1,0,0,0,0,0|0,0,3]=4 229 B9R0.45 CCCCCC=CCCO MCULE-4969061256 [1,0,0,0,0,0|0,0,3]=4 230 B9R0.45 CCCCCCC#CCO MCULE-7144291083 [1,0,0,0,0,0|0,0,3]=4 231 B9R0.45 CCCCCCC=CC=O MCULE-8114348514 [1,0,0,0,0,0|0,0,2]=3 232 B9R0.45 CCCCCCC=CCO MCULE-8666977236 [1,0,0,0,0,0|0,0,3]=4 233 B9R0.45 CCCCCCCCC#N MCULE-9980153452 [1,0,0,0,0,0|1,0,1]=3 234 B9R0.45 CCCCCCCCC=O MCULE-9888879952 [1,0,0,0,0,0|0,0,0]=1 235 B9R0.45 CCCCCCCCCBr MCULE-1405697483 [1,0,0,0,0,0|1,0,1]=3 236 B9R0.45 CCCCCCCCCC MCULE-6071426098 [1,0,0,0,0,0|1,0,1]=3 237 B9R0.45 CCCCCCCCCCl MCULE-6711902685 [1,0,0,0,0,0|1,0,1]=3 238 B9R0.45 CCCCCCCCCF MCULE-9584148452 [1,0,0,0,0,0|1,0,1]=3 239 B9R0.45 CCCCCCCCCI MCULE-8717337450 [1,0,0,0,0,0|1,0,1]=3 240 B9R0.45 CCCCCCCCCN MCULE-5395407299 [1,0,0,0,0,0|1,0,1]=3 241 B9R0.45 CCCCCCCCCO MCULE-4020281400 [1,0,0,0,0,0|0,0,1]=2 242 B9R0.45 CCCCCCCCCS MCULE-1070515106 [1,0,0,0,0,0|0,1,1]=3 243 B9R0.45 CCCCCCCCNC MCULE-6996288442 [1,0,0,0,0,0|2,0,0]=3 244 B9R0.45 CCCCCCCCOC MCULE-4646070035 [1,0,0,0,0,0|2,0,0]=3 245 B9R0.45 CCCCCCCCSC MCULE-5517176664 [1,0,0,0,0,0|2,0,0]=3 246 B9R0.45 CCCCCCCN=C=O MCULE-8681396809 [1,0,0,0,0,0|1,0,1]=3 247 B9R0.45 CCCCCCCN=C=S MCULE-2877179378 [1,0,0,0,0,0|1,1,1]=4 248 B9R0.45 CCCCCCCN=N#N MCULE-7837723655 [1,0,0,0,0,0|3,0,0]=4 249 B9R0.45 CCCCCCCNC=O MCULE-7638122818 [1,0,0,0,0,0|1,0,0]=2 250 B9R0.45 CCCCCCCNCC MCULE-3055645322 [1,0,0,0,0,0|2,0,1]=4 251 B9R0.45 CCCCCCCOC=O MCULE-6396391540 [1,0,0,0,0,0|1,0,0]=2 252 B9R0.45 CCCCCCNCCN MCULE-2521807905 [1,0,0,0,0,0|2,0,1]=4 253 B9R0.45 CCCCCCNCCN MCULE-5886608711 [1,0,0,0,0,0|2,0,1]=4 254 B9R0.45 CCCCCCNCCO MCULE-6828996225 [1,0,0,0,0,0|1,0,1]=3 255 B9R0.45 CCCCCCOCCCl MCULE-5675234570 [1,0,0,0,0,0|2,0,1]=4 256 B9R0.45 CCCCCCOCCO MCULE-1339769602 [1,0,0,0,0,0|1,0,1]=3 257 B9R0.45 CCCCCCSCCO MCULE-3331753796 [1,0,0,0,0,0|1,0,1]=3 258 B9R0.45 CCCCCNCCC#N MCULE-6878613771 [1,0,0,0,0,0|2,0,1]=4 259 B9R0.45 CCCCCNCCCC MCULE-4324738465 [1,0,0,0,0,0|2,0,1]=4 260 B9R0.45 CCCCCNCCNC MCULE-3521145032 [1,0,0,0,0,0|3,0,0]=4 261 B9R0.45 CCCCCOCCC#N MCULE-7711243368 [1,0,0,0,0,0|2,0,1]=4 262 B9R0.45 CCCCCOCCCO MCULE-3048029561 [1,0,0,0,0,0|1,0,1]=3 263 B9R0.45 CCCCNCCCCO MCULE-1748671401 [1,0,0,0,0,0|1,0,1]=3 264 B9R0.45 CCCCOCCCCO MCULE-1926189258 [1,0,0,0,0,0|1,0,1]=3 265 B9R0.45 CCCC[NH2+]CCCCCl MCULE-2045714641 [1,0,0,0,0,0|2,0,1]=4 266 B9R0.45 CCCC[NH2+]CCCCCl MCULE-2222567485 [1,0,0,0,0,0|2,0,1]=4 267 B9R0.45 CCCNCCOCCO MCULE-9598749389 [1,0,0,0,0,0|2,0,1]=4 268 B9R0.45 CCCOCCOCCO MCULE-8416880348 [1,0,0,0,0,0|2,0,1]=4 269 B9R0.45 CNCCCCCCNC MCULE-8440815147 [1,0,0,0,0,0|3,0,0]=4 270 B9R0.45 CNCCCNCCCO MCULE-9778642064 [1,0,0,0,0,0|2,0,1]=4 271 B9R0.45 COCCCCCCOC MCULE-8796987038 [1,0,0,0,0,0|3,0,0]=4 272 B9R0.45 COCCCOCCCO MCULE-6516268580 [1,0,0,0,0,0|2,0,1]=4 273 B9R0.45 COCCNCCCCO MCULE-8413188192 [1,0,0,0,0,0|2,0,1]=4 274 B9R0.45 ClCCCCCCCCCl MCULE-7522868799 [1,0,0,0,0,0|2,0,1]=4 275 B9R0.45 ICCCCCCCCI MCULE-6544838106 [1,0,0,0,0,0|2,0,1]=4 276 B9R0.45 N#CCCCCCCCBr MCULE-5175952413 [1,0,0,0,0,0|2,0,1]=4 277 B9R0.45 NCCCCCCCCBr MCULE-6623783968 [1,0,0,0,0,0|2,0,1]=4 278 B9R0.45 NCCCCCCCCBr MCULE-9911947498 [1,0,0,0,0,0|2,0,1]=4 279 B9R0.45 NCCCCCCCCN MCULE-1106731228 [1,0,0,0,0,0|2,0,1]=4 280 B9R0.45 NCCCCCCCCN MCULE-9889097856 [1,0,0,0,0,0|2,0,1]=4 281 B9R0.45 NCCCCCCCCO MCULE-1230018398 [1,0,0,0,0,0|1,0,1]=3 282 B9R0.45 NCCNCCCCCO MCULE-7178121419 [1,0,0,0,0,0|2,0,1]=4 283 B9R0.45 NCCNCCCCCO MCULE-8348628451 [1,0,0,0,0,0|2,0,1]=4 284 B9R0.45 O=CCCCCCCC=O MCULE-6545234470 [1,0,0,0,0,0|1,0,1]=3 285 B9R0.45 OCCCCCCCCBr MCULE-2005797184 [1,0,0,0,0,0|1,0,1]=3 286 B9R0.45 OCCCCCCCCCl MCULE-8776830410 [1,0,0,0,0,0|1,0,1]=3 287 B9R0.45 OCCCCCCCCI MCULE-7793639517 [1,0,0,0,0,0|1,0,1]=3 288 B9R0.45 OCCCCCCCCO MCULE-7897417838 [1,0,0,0,0,0|1,0,1]=3 289 B9R0.45 OCCCCCCCCS MCULE-8372814979 [1,0,0,0,0,0|1,0,1]=3 290 B9R0.45 SCCCCCCCCS MCULE-5325130158 [1,0,0,0,0,0|1,1,1]=4 291 B9R0.45 [NH2+](CCCC)CCCCC MCULE-5314318531 [1,0,0,0,0,0|2,0,1]=4 292 B11R0.2 C=C(C)CC(C)CCCCCC MCULE-9270463569 [0,1,0,0,0,0|2,0,0]=3 293 B11R0.2 CCC/C=C\CC(N)CC(=O)O MCULE-9494795833 [0,1,0,0,0,0|0,0,2]=3 294 B11R0.2 CCCCCCC(=O)CC(=O)C MCULE-1947947048 [0,1,0,0,0,0|1,0,1]=3 295 B11R0.2 CCCCCCC(=O)CC(=O)O MCULE-9513160139 [0,1,0,0,0,0|0,0,1]=2 296 B11R0.2 CCCCCCC(C)CC(=O)O MCULE-4777686649 [0,1,0,0,0,0|0,0,0]=1 297 B11R0.2 CCCCCCC(C)CC(C)C MCULE-7789928086 [0,1,0,0,0,0|2,0,1]=4 298 B11R0.2 CCCCCCC(C)OC(=O)C MCULE-6230359539 [0,1,0,0,0,0|2,0,0]=3 299 B11R0.2 CCCCCCC(N)CC(=O)O MCULE-6987665804 [0,1,0,0,0,0|0,0,0]=1 300 B11R0.2 CCCCCCC(N)CC(=O)O MCULE-8299240038 [0,1,0,0,0,0|0,0,0]=1 301 B11R0.2 CCCCCCC(O)CC(=O)O MCULE-8278468713 [0,1,0,0,0,0|0,0,0]=1 302 B11R0.2 CCCCCCN(C)CC(=O)O MCULE-5638671142 [0,1,0,0,0,0|1,0,0]=2 303 B11R0.2 CCCCCCN(C)CC(=O)O MCULE-6664823722 [0,1,0,0,0,0|1,0,0]=2 304 B11R0.2 CCCCCOC(=O)CC(=O)C MCULE-7604289070 [0,1,0,0,0,0|2,0,1]=4 305 B11R0.30 C=C(Br)CCCCCCC(=O)O MCULE-6895852201 [0,1,0,0,0,0|0,0,2]=3 306 B11R0.30 C=C(C)CCCCCCC(=O)O MCULE-4818988928 [0,1,0,0,0,0|0,0,1]=2 307 B11R0.30 C=C(C)CCCCCOC(=O)C MCULE-3589037568 [0,1,0,0,0,0|2,0,1]=4 308 B11R0.30 C=C(Cl)CCCCCCC(=O)O MCULE-6082663554 [0,1,0,0,0,0|0,0,2]=3 309 B11R0.30 CC(=O)CCCCCCC(=O)C MCULE-3854362746 [0,1,0,0,0,0|1,0,1]=3 310 B11R0.30 CC(=O)CCCCCCC(=O)O MCULE-6390414263 [0,1,0,0,0,0|0,0,1]=2 311 B11R0.30 CC(=O)NCCCCCC(=O)Cl MCULE-3079585004 [0,1,0,0,0,0|2,0,1]=4 312 B11R0.30 CC(=O)NCCCCCC(=O)O MCULE-2324288602 [0,1,0,0,0,0|1,0,1]=3 313 B11R0.30 CC(=O)SCCCCCC(=O)O MCULE-7058924302 [0,1,0,0,0,0|1,0,1]=3 314 B11R0.30 CC(C)/C=C\CCCCC(=O)O MCULE-3685314454 [0,1,0,0,0,0|0,0,2]=3 315 B11R0.30 CC(C)C=CCCCCC(=O)Cl MCULE-1586192501 [0,1,0,0,0,0|1,0,2]=4 316 B11R0.30 CC(C)C=CCCCCC(=O)O MCULE-9153738942 [0,1,0,0,0,0|0,0,2]=3 317 B11R0.30 CC(C)CCCCCCC(=O)O MCULE-7144406547 [0,1,0,0,0,0|0,0,0]=1 318 B11R0.30 CC(C)CCCCCON(=O)=O MCULE-5981508495 [0,1,0,0,0,0|2,0,1]=4 319 B11R0.30 CC(O)CCCCCCC(=O)O MCULE-7012579621 [0,1,0,0,0,0|0,0,0]=1 320 B11R0.30 CN(C)CCCCCCC(=O)O MCULE-5163840640 [0,1,0,0,0,0|1,0,0]=2 321 B11R0.30 CN(C)CCCCCCC(=O)O MCULE-5248234243 [0,1,0,0,0,0|1,0,0]=2 322 B11R0.30 CN(C)CCCNCCC(=O)N MCULE-3885776939 [0,1,0,0,0,0|3,0,0]=4 323 B11R0.30 CN(C)CCCNCCC(=O)N MCULE-9578509352 [0,1,0,0,0,0|3,0,0]=4 324 B11R0.30 N=C(N)NCCCCCC(=O)O MCULE-3719990664 [0,1,0,0,0,0|2,0,1]=4 325 B11R0.30 N=C(N)NCCCCCC(=O)O MCULE-6681139380 [0,1,0,0,0,0|2,0,1]=4 326 B11R0.30 NC(=O)NCCCCCC(=O)O MCULE-5723327422 [0,1,0,0,0,0|2,0,1]=4 327 B11R0.30 O=C(Cl)CCCCCCC(=O)Cl MCULE-1634153909 [0,1,0,0,0,0|2,0,1]=4 328 B11R0.30 O=C(O)CCCCCCC(=O)O MCULE-1380155289 [0,1,0,0,0,0|1,0,1]=3 329 B11R0.30 O=C(O)CCCCNCC(=O)O MCULE-2095125616 [0,1,0,0,0,0|2,0,1]=4 330 B11R0.30 O=C(O)CCCCNCC(=O)O MCULE-2375984351 [0,1,0,0,0,0|2,0,1]=4 331 B11R0.30 O=C(O)CCCNCCC(=O)O MCULE-6189914759 [0,1,0,0,0,0|2,0,1]=4 332 B11R0.30 O=C(O)CCCNCCC(=O)O MCULE-8504773832 [0,1,0,0,0,0|2,0,1]=4 333 B11R0.40 C=C(C=O)CCCCCCCC MCULE-1736101056 [0,1,0,0,0,0|1,0,0]=2 334 B11R0.40 C=CC(=O)NCCCCCCN MCULE-5613068538 [0,1,0,0,0,0|3,0,0]=4 335 B11R0.40 C=CC(=O)OCCCCCCBr MCULE-5257957188 [0,1,0,0,0,0|3,0,0]=4 336 B11R0.40 C=CC(=O)OCCCCCCO MCULE-8684012773 [0,1,0,0,0,0|3,0,0]=4 337 B11R0.40 C=CS(=O)CCCCCCCC MCULE-1360438768 [0,1,0,0,0,0|2,0,0]=3 338 B11R0.40 CCCCC/C=C/CC(=O)OC MCULE-2579151246 [0,1,0,0,0,0|0,0,2]=3 339 B11R0.40 CCCCCCC#CC(=O)OC MCULE-7877194626 [0,1,0,0,0,0|0,0,2]=3 340 B11R0.40 CCCCCCC=CC(=O)OC MCULE-3102057992 [0,1,0,0,0,0|0,0,2]=3 341 B11R0.40 CCCCCCCCC(=O)C=O MCULE-2896760493 [0,1,0,0,0,0|0,0,1]=2 342 B11R0.40 CCCCCCCCC(=O)CC MCULE-9958837588 [0,1,0,0,0,0|1,0,0]=2 343 B11R0.40 CCCCCCCCC(=O)NN MCULE-6560373796 [0,1,0,0,0,0|1,0,0]=2 344 B11R0.40 CCCCCCCCC(=O)NO MCULE-7098688577 [0,1,0,0,0,0|0,0,0]=1 345 B11R0.40 CCCCCCCCC(=O)OC MCULE-4760106079 [0,1,0,0,0,0|0,0,0]=1 346 B11R0.40 CCCCCCCCC(Br)CBr MCULE-7825522302 [0,1,0,0,0,0|2,0,1]=4 347 B11R0.40 CCCCCCCCC(C)C#N MCULE-1011753357 [0,1,0,0,0,0|2,0,1]=4 348 B11R0.40 CCCCCCCCC(C)C=O MCULE-9301043210 [0,1,0,0,0,0|1,0,1]=3 349 B11R0.40 CCCCCCCCC(C)CO MCULE-6530142953 [0,1,0,0,0,0|1,0,1]=3 350 B11R0.40 CCCCCCCCC(Cl)CCl MCULE-6741925726 [0,1,0,0,0,0|2,0,1]=4 351 B11R0.40 CCCCCCCCC(N)CO MCULE-3838512887 [0,1,0,0,0,0|1,0,1]=3 352 B11R0.40 CCCCCCCCC(O)CC MCULE-7447063642 [0,1,0,0,0,0|1,0,1]=3 353 B11R0.40 CCCCCCCCC(O)CN MCULE-1386452336 [0,1,0,0,0,0|1,0,1]=3 354 B11R0.40 CCCCCCCCC(O)CO MCULE-4401791520 [0,1,0,0,0,0|0,0,2]=3 355 B11R0.40 CCCCCCCCC([NH3+])CO MCULE-9745638839 [0,1,0,0,0,0|1,0,1]=3 356 B11R0.40 CCCCCCCC[C@@H](Br)C=O MCULE-3823724408 [0,1,0,0,0,0|1,0,1]=3 357 B11R0.40 CCCCCCCC[C@@H](O)CO MCULE-3097644735 [0,1,0,0,0,0|0,0,2]=3 358 B11R0.40 CCCCCCCC[C@@H](O)CO MCULE-9306542938 [0,1,0,0,0,0|0,0,2]=3 359 B11R0.40 CCCCCCCC[C@H](C)C=O MCULE-7337993182 [0,1,0,0,0,0|1,0,1]=3 360 B11R0.40 CCCCCCCNC(=O)CBr MCULE-3010395952 [0,1,0,0,0,0|2,0,0]=3 361 B11R0.40 CCCCCCCOC(=O)CC MCULE-6239287032 [0,1,0,0,0,0|2,0,0]=3 362 B11R0.40 CCCCCCCOC(=O)CCl MCULE-6089837080 [0,1,0,0,0,0|2,0,0]=3 363 B11R0.40 CCCCCCCOC(=O)CS MCULE-3304894936 [0,1,0,0,0,0|1,1,0]=3 364 B11R0.40 CCCCCCOCC(O)CCl MCULE-9400857337 [0,1,0,0,0,0|2,0,1]=4 365 B11R0.40 CCCCCCOCC(O)CO MCULE-6836288154 [0,1,0,0,0,0|1,0,2]=4 366 B11R0.40 CCCCOCCNC(=O)CCl MCULE-1053170511 [0,1,0,0,0,0|3,0,0]=4 367 B11R0.40 CCCCOCCOC(=O)CN MCULE-1848119209 [0,1,0,0,0,0|3,0,0]=4 368 B11R0.40 CCCCOCCOC(=O)CN MCULE-3516651131 [0,1,0,0,0,0|3,0,0]=4 369 B11R0.40 CCCCOCCOC(=O)NC MCULE-3584012789 [0,1,0,0,0,0|3,0,0]=4 370 B11R0.40 CNC(=O)CCNCCCOC MCULE-2191403434 [0,1,0,0,0,0|3,0,0]=4 371 B11R0.40 COC(=O)CCCCCCC#N MCULE-5476473532 [0,1,0,0,0,0|1,0,1]=3 372 B11R0.40 COC(=O)CCCCCCC=O MCULE-8693929860 [0,1,0,0,0,0|1,0,1]=3 373 B11R0.40 COC(=O)CCCCCCCBr MCULE-5537473467 [0,1,0,0,0,0|1,0,0]=2 374 B11R0.40 COC(=O)CCCCCCCCl MCULE-1981178961 [0,1,0,0,0,0|1,0,0]=2 375 B11R0.40 COC(=O)CCCCCCCN MCULE-3361449332 [0,1,0,0,0,0|1,0,0]=2 376 B11R0.40 COC(=O)CCCCCCCN MCULE-5266446188 [0,1,0,0,0,0|1,0,0]=2 377 B11R0.40 COC(=O)CCCCCCCO MCULE-4577508073 [0,1,0,0,0,0|1,0,0]=2 378 B11R0.40 COC(=O)CCCCCN=C=O MCULE-2366405696 [0,1,0,0,0,0|2,0,1]=4 379 B11R0.40 COC(=O)CCCCCN=N#N MCULE-7319229848 [0,1,0,0,0,0|3,0,0]=4 380 B11R0.40 COCCCNCCC(=O)NN MCULE-2348751239 [0,1,0,0,0,0|3,0,0]=4 381 B11R0.40 COCCCNCCC(=O)OC MCULE-4020268298 [0,1,0,0,0,0|2,0,0]=3 382 B11R0.40 OCCCCCCCC(O)CO MCULE-9195681013 [0,1,0,0,0,0|1,0,2]=4 383 B11R0.42 C=CCCCCCC(N)C(=O)O MCULE-1162188913 [0,1,0,0,0,0|0,0,2]=3 384 B11R0.42 C=CCCCCCC(N)C(=O)O MCULE-3131667346 [0,1,0,0,0,0|0,0,2]=3 385 B11R0.42 C=CCCCCCC(N)C(=O)O MCULE-4888632865 [0,1,0,0,0,0|0,0,2]=3 386 B11R0.42 C=CCCCCC[C@@H](N)C(=O)O MCULE-5391769158 [0,1,0,0,0,0|0,0,2]=3 387 B11R0.42 C=CCCCCC[C@@H](N)C(=O)O MCULE-5861402789 [0,1,0,0,0,0|0,0,2]=3 388 B11R0.42 C=CCCCCC[C@@H](N)C(=O)O MCULE-8081984411 [0,1,0,0,0,0|0,0,2]=3 389 B11R0.42 C=CCCCCC[C@@H](N)C(=O)O MCULE-8137198974 [0,1,0,0,0,0|0,0,2]=3 390 B11R0.42 C=CCCCCC[C@H](N)C(=O)O MCULE-1233544353 [0,1,0,0,0,0|0,0,2]=3 391 B11R0.42 C=CCCCCC[C@H](N)C(=O)O MCULE-3790089576 [0,1,0,0,0,0|0,0,2]=3 392 B11R0.42 C=CCCCCC[C@H](N)C(=O)O MCULE-8748986273 [0,1,0,0,0,0|0,0,2]=3 393 B11R0.42 C=CCCCCC[C@H](N)C(=O)O MCULE-9105977293 [0,1,0,0,0,0|0,0,2]=3 394 B11R0.42 C=CCCCCOC(C)C(=O)O MCULE-8528579246 [0,1,0,0,0,0|1,0,2]=4 395 B11R0.42 C=CCCCCO[C@H](C)C(=O)O MCULE-4315372330 [0,1,0,0,0,0|1,0,2]=4 396 B11R0.42 C=CCCCCO[C@H](C)C(=O)O MCULE-9381984847 [0,1,0,0,0,0|1,0,2]=4 397 B11R0.42 CCCCCCCC(C)C(=O)C MCULE-1764436007 [0,1,0,0,0,0|1,0,0]=2 398 B11R0.42 CCCCCCCC(C)C(=O)O MCULE-1400601550 [0,1,0,0,0,0|0,0,0]=1 399 B11R0.42 CCCCCCCC(C)C(C)C MCULE-1381751569 [0,1,0,0,0,0|2,0,1]=4 400 B11R0.42 CCCCCCCC(N)C(=O)O MCULE-4518631723 [0,1,0,0,0,0|0,0,0]=1 401 B11R0.42 CCCCCCC[C@@H](N)C(=O)O MCULE-7367412741 [0,1,0,0,0,0|0,0,0]=1 402 B11R0.42 CCCCCCC[C@H](N)C(=O)O MCULE-4025079053 [0,1,0,0,0,0|0,0,0]=1 403 B11R0.42 CCCCCCC[C@H](N)C(=O)O MCULE-4061410149 [0,1,0,0,0,0|0,0,0]=1 404 B11R0.42 CCCCCCOC(C)C(=O)O MCULE-5771954047 [0,1,0,0,0,0|1,0,0]=2 405 B11R0.42 CCCCSCCC(N)C(=O)O MCULE-9943276345 [0,1,0,0,0,0|1,0,0]=2 406 B11R0.42 CCCCSCC[C@@H](N)C(=O)O MCULE-5947369888 [0,1,0,0,0,0|1,0,0]=2 407 B11R0.42 CCCCSCC[C@H](N)C(=O)O MCULE-6636715475 [0,1,0,0,0,0|1,0,0]=2 408 B11R0.42 CCOCCNCC(C)C(=O)O MCULE-1411337428 [0,1,0,0,0,0|2,0,0]=3 409 B11R0.42 CCOCCNCC(C)C(=O)O MCULE-9110675077 [0,1,0,0,0,0|2,0,0]=3 410 B11R0.42 NC(CCCCNC=O)C(=O)O MCULE-1951015462 [0,1,0,0,0,0|2,0,1]=4 411 B11R0.42 N[C@@H](CCCCN=[N+]=[N-])C(=O)O MCULE-1235238069 [0,1,0,0,0,0|3,0,0]=4 412 B11R0.42 N[C@@H](CCCCNC=O)C(=O)O MCULE-4391601903 [0,1,0,0,0,0|2,0,1]=4 413 B11R0.42 N[C@@H](CCCCNC=O)C(=O)O MCULE-4927440935 [0,1,0,0,0,0|2,0,1]=4 414 B11R0.42 [N-]=[N+]=NCCCC[C@@H](N)C(=O)O MCULE-4439689174 [0,1,0,0,0,0|3,0,0]=4 415 B11R0.42 [N-]=[N+]=NCCCC[C@@H]([NH3+])C(=O)O MCULE-9695888606 [0,1,0,0,0,0|3,0,0]=4 416 B11R0.42 [N-]=[N+]=NCCCC[C@H](N)C(=O)O MCULE-2268932366 [0,1,0,0,0,0|3,0,0]=4 417 B11R0.42 [N-]=[N+]=NCCCC[C@H](N)C(=O)O MCULE-5050271888 [0,1,0,0,0,0|3,0,0]=4 418 B11R0.42 [N-]=[N+]=NCCCC[C@H](N)C(=O)O MCULE-5569498677 [0,1,0,0,0,0|3,0,0]=4 419 B11R0.46 C=C(C)CCC(C)CCCCC MCULE-6425071148 [0,1,0,0,0,0|2,0,0]=3 420 B11R0.46 CCCCCC(=O)CCC(=O)O MCULE-5964650416 [0,1,0,0,0,0|0,0,1]=2 421 B11R0.46 CCCCCC(=O)NCC(=O)O MCULE-3960557642 [0,1,0,0,0,0|1,0,1]=3 422 B11R0.46 CCCCCC(C)CCC(=O)O MCULE-3703948906 [0,1,0,0,0,0|0,0,0]=1 423 B11R0.46 CCCCCC(O)/C=C/C(=O)O MCULE-9091234698 [0,1,0,0,0,0|0,0,2]=3 424 B11R0.46 CCCCCC(O)C=CC(=O)O MCULE-5393476184 [0,1,0,0,0,0|0,0,2]=3 425 B11R0.46 CCCCCC(O)CCC(=O)N MCULE-6288630989 [0,1,0,0,0,0|1,0,0]=2 426 B11R0.46 CCCCCN(C)CCC(=O)O MCULE-4617741875 [0,1,0,0,0,0|1,0,0]=2 427 B11R0.46 CCCCCN(C)CCC(=O)O MCULE-9023573702 [0,1,0,0,0,0|1,0,0]=2 428 B11R0.46 CCCCNC(=O)CCC(=O)O MCULE-8929331080 [0,1,0,0,0,0|1,0,1]=3 429 B11R0.46 CCCCOC(=O)CCC(=O)C MCULE-7095079350 [0,1,0,0,0,0|2,0,1]=4 430 B11R0.46 COCCNC(=O)CCC(=O)O MCULE-5237282596 [0,1,0,0,0,0|2,0,1]=4 431 B11R0.46 COCCOC(=O)CCC(=O)O MCULE-8329962069 [0,1,0,0,0,0|2,0,1]=4 432 B11R0.46 NCCCNC(=O)CCC(=O)O MCULE-6552625300 [0,1,0,0,0,0|2,0,1]=4 433 B11R0.111 CCC(=O)CCCCCC(=O)O MCULE-8603570043 [0,1,0,0,0,0|0,0,1]=2 434 B11R0.111 CCC(C)CCCCCC(=O)O MCULE-5195758876 [0,1,0,0,0,0|0,0,0]=1 435 B11R0.111 COC(=O)CCCCCC(=O)O MCULE-7307151830 [0,1,0,0,0,0|1,0,1]=3 436 B11R0.111 O=C(O)CCCSCC(O)CO MCULE-6771933903 [0,1,0,0,0,0|2,0,0]=3 437 B11R0.147 C=CCCC(=O)CCCC(=O)O MCULE-5745610877 [0,1,0,0,0,0|0,0,3]=4 438 B11R0.147 CCCCC(=O)CCCC(=O)O MCULE-4828153043 [0,1,0,0,0,0|0,0,1]=2 439 B11R0.147 CCCCC(C)CCCC(=O)O MCULE-8642965123 [0,1,0,0,0,0|0,0,0]=1 440 B11R0.147 CCCC[C@@H](C)CCC=C(C)C MCULE-6446802470 [0,1,0,0,0,0|2,0,1]=4 441 B11R0.147 CCCNC(=O)CCCC(=O)O MCULE-5121990390 [0,1,0,0,0,0|1,0,1]=3 442 B11R0.147 CCCNC(=O)COCC(=O)O MCULE-4624994372 [0,1,0,0,0,0|2,0,1]=4 443 B11R0.148 C#CCCCCCC=CC(=O)O MCULE-2997617474 [0,1,0,0,0,0|0,0,3]=4 444 B11R0.148 C#CCCCCCCCC(=O)O MCULE-1292545040 [0,1,0,0,0,0|0,0,1]=2 445 B11R0.148 C#CCOCCOCCC(=O)O MCULE-5101359772 [0,1,0,0,0,0|1,0,2]=4 446 B11R0.148 C=C(Br)CCCCCCCC#N MCULE-9330962697 [0,1,0,0,0,0|2,0,1]=4 447 B11R0.148 C=C(Br)CCCCCCCCC MCULE-3332268450 [0,1,0,0,0,0|2,0,0]=3 448 B11R0.148 C=C(C)CCCCCCCC#N MCULE-9047905081 [0,1,0,0,0,0|2,0,1]=4 449 B11R0.148 C=C(C)CCCCCCCCC MCULE-1709497926 [0,1,0,0,0,0|2,0,0]=3 450 B11R0.148 C=C(Cl)CCCCCCCC#N MCULE-1260885724 [0,1,0,0,0,0|2,0,1]=4 451 B11R0.148 C=C(Cl)CCCCCCCCC MCULE-9304719526 [0,1,0,0,0,0|2,0,0]=3 452 B11R0.148 C=CCCCCCCCC(=C)C MCULE-4065354989 [0,1,0,0,0,0|2,0,1]=4 453 B11R0.148 C=CCCCCCCCC(=O)O MCULE-3892173219 [0,1,0,0,0,0|0,0,1]=2 454 B11R0.148 C=CCCCCCCOC(=O)C MCULE-2561625191 [0,1,0,0,0,0|1,0,2]=4 455 B11R0.148 C=CCCOCCCCC(=O)O MCULE-6026091154 [0,1,0,0,0,0|0,0,2]=3 456 B11R0.148 C=CCOCCCCCC(=O)O MCULE-9227890338 [0,1,0,0,0,0|0,0,2]=3 457 B11R0.148 C=CCOCCOCCC(=O)O MCULE-8239467569 [0,1,0,0,0,0|1,0,2]=4 458 B11R0.148 CC(=O)CCCCCCCCBr MCULE-8502798206 [0,1,0,0,0,0|1,0,0]=2 459 B11R0.148 CC(=O)OCCCCCCC=O MCULE-8513857573 [0,1,0,0,0,0|2,0,1]=4 460 B11R0.148 CC(C)CCCCCCCCO MCULE-9926933955 [0,1,0,0,0,0|2,0,1]=4 461 B11R0.148 CC(O)CCCCCCCCO MCULE-6820244164 [0,1,0,0,0,0|1,0,1]=3 462 B11R0.148 CCC=CCC=CCCC(=O)O MCULE-4088771773 [0,1,0,0,0,0|0,0,3]=4 463 B11R0.148 CCCC/C=C\CCOC(=O)C MCULE-5044870920 [0,1,0,0,0,0|1,0,2]=4 464 B11R0.148 CCCCC/C=C/CCC(=O)O MCULE-1356880290 [0,1,0,0,0,0|0,0,1]=2 465 B11R0.148 CCCCC=CCCOC(=O)C MCULE-8921990055 [0,1,0,0,0,0|1,0,2]=4 466 B11R0.148 CCCCCC/C=C/CC(=O)O MCULE-1834860815 [0,1,0,0,0,0|0,0,1]=2 467 B11R0.148 CCCCCC=CCCC(=O)O MCULE-1637451620 [0,1,0,0,0,0|0,0,1]=2 468 B11R0.148 CCCCCCC/C=C/B(O)O MCULE-2344159611 [0,1,0,0,0,0|1,0,2]=4 469 B11R0.148 CCCCCCC/C=C/C(=O)O MCULE-3189731619 [0,1,0,0,0,0|0,0,1]=2 470 B11R0.148 CCCCCCC/C=C\C(=O)O MCULE-5508964733 [0,1,0,0,0,0|0,0,1]=2 471 B11R0.148 CCCCCCC=CCC(=O)O MCULE-5816262119 [0,1,0,0,0,0|0,0,1]=2 472 B11R0.148 CCCCCCCC=CB(O)O MCULE-8165065119 [0,1,0,0,0,0|1,0,2]=4 473 B11R0.148 CCCCCCCC=CC(=O)O MCULE-9648702049 [0,1,0,0,0,0|0,0,1]=2 474 B11R0.148 CCCCCCCCCC(=N)N MCULE-6113298447 [0,1,0,0,0,0|2,0,0]=3 475 B11R0.148 CCCCCCCCCC(=N)N MCULE-7599360964 [0,1,0,0,0,0|2,0,0]=3 476 B11R0.148 CCCCCCCCCC(=O)C MCULE-6858373499 [0,1,0,0,0,0|1,0,0]=2 477 B11R0.148 CCCCCCCCCC(=O)Cl MCULE-4226412977 [0,1,0,0,0,0|1,0,0]=2 478 B11R0.148 CCCCCCCCCC(=O)F MCULE-1839398331 [0,1,0,0,0,0|1,0,0]=2 479 B11R0.148 CCCCCCCCCC(=O)N MCULE-1159230758 [0,1,0,0,0,0|1,0,0]=2 480 B11R0.148 CCCCCCCCCC(=O)O MCULE-3914949169 [0,1,0,0,0,0|0,0,0]=1 481 B11R0.148 CCCCCCCCCC(=O)O MCULE-7204730113 [0,1,0,0,0,0|0,0,0]=1 482 B11R0.148 CCCCCCCCCC(=O)[O-] MCULE-2720595773 [0,1,0,0,0,0|0,0,1]=2 483 B11R0.148 CCCCCCCCCC(=O)[O-] MCULE-7398604282 [0,1,0,0,0,0|0,0,1]=2 484 B11R0.148 CCCCCCCCCC(C)C MCULE-1079534714 [0,1,0,0,0,0|2,0,1]=4 485 B11R0.148 CCCCCCCCCC(C)N MCULE-8277808063 [0,1,0,0,0,0|2,0,1]=4 486 B11R0.148 CCCCCCCCCC(C)O MCULE-8628471202 [0,1,0,0,0,0|1,0,1]=3 487 B11R0.148 CCCCCCCCCC(S)S MCULE-7049062381 [0,1,0,0,0,0|0,2,1]=4 488 B11R0.148 CCCCCCCCCN(=O)=O MCULE-5909474153 [0,1,0,0,0,0|1,0,1]=3 489 B11R0.148 CCCCCCCCN=C(N)N MCULE-8281267777 [0,1,0,0,0,0|2,0,0]=3 490 B11R0.148 CCCCCCCCN=C(N)N MCULE-9658902055 [0,1,0,0,0,0|2,0,0]=3 491 B11R0.148 CCCCCCCCNC(=O)N MCULE-1005292011 [0,1,0,0,0,0|1,0,0]=2 492 B11R0.148 CCCCCCCCNC(=S)N MCULE-3981792857 [0,1,0,0,0,0|1,1,0]=3 493 B11R0.148 CCCCCCCCOC(=O)C MCULE-8590238161 [0,1,0,0,0,0|1,0,0]=2 494 B11R0.148 CCCCCCCCOC(=O)Cl MCULE-2623966790 [0,1,0,0,0,0|1,0,0]=2 495 B11R0.148 CCCCCCCCOC(=S)[S-] MCULE-4226166972 [0,1,0,0,0,0|0,2,0]=3 496 B11R0.148 CCCCCCCCOC(=S)[S-] MCULE-7459596444 [0,1,0,0,0,0|0,2,0]=3 497 B11R0.148 CCCCCCCNCC(=O)O MCULE-2155508761 [0,1,0,0,0,0|0,0,0]=1 498 B11R0.148 CCCCCCCNCC(=O)O MCULE-8805007132 [0,1,0,0,0,0|0,0,0]=1 499 B11R0.148 CCCCCCCSCC(=O)O MCULE-7218313490 [0,1,0,0,0,0|0,0,0]=1 500 B11R0.148 CCCCOCCOCC(=O)O MCULE-3118678736 [0,1,0,0,0,0|1,0,0]=2 501 B11R0.148 CCCCOCCOCC(C)O MCULE-2011202774 [0,1,0,0,0,0|2,0,1]=4 502 B11R0.148 CCCCSCCCCC(=O)O MCULE-1665011362 [0,1,0,0,0,0|0,0,0]=1 503 B11R0.148 CCOCCOCCCC(=O)O MCULE-5210306588 [0,1,0,0,0,0|1,0,0]=2 504 B11R0.148 CCOCCOCCOC(=O)C MCULE-2995602513 [0,1,0,0,0,0|3,0,0]=4 505 B11R0.148 CN(C)CCCCCCCCN MCULE-6651981566 [0,1,0,0,0,0|3,0,0]=4 506 B11R0.148 CN(C)CCCCCCCCO MCULE-5273481320 [0,1,0,0,0,0|3,0,0]=4 507 B11R0.148 COCCOCCOCC(=O)Cl MCULE-3746882663 [0,1,0,0,0,0|3,0,0]=4 508 B11R0.148 COCCOCCOCC(=O)O MCULE-8142044106 [0,1,0,0,0,0|2,0,0]=3 509 B11R0.148 N#N=NCCCCCCC(=O)O MCULE-5582413457 [0,1,0,0,0,0|2,0,0]=3 510 B11R0.148 N=C(N)NCCCCCCCN MCULE-1860175405 [0,1,0,0,0,0|3,0,0]=4 511 B11R0.148 N=C(N)NCCCCCCCN MCULE-8627758688 [0,1,0,0,0,0|3,0,0]=4 512 B11R0.148 NC(=O)CCCCCCCCCl MCULE-4533445908 [0,1,0,0,0,0|1,0,0]=2 513 B11R0.148 NCCCCCCCCC(=O)O MCULE-9064856591 [0,1,0,0,0,0|0,0,0]=1 514 B11R0.148 NCCOCCOCCC(=O)O MCULE-7286284064 [0,1,0,0,0,0|2,0,0]=3 515 B11R0.148 NCCOCCOCCC(=O)O MCULE-8782232340 [0,1,0,0,0,0|2,0,0]=3 516 B11R0.148 O=C(O)CCCCCCCCBr MCULE-2459167157 [0,1,0,0,0,0|0,0,0]=1 517 B11R0.148 O=C(O)CCCCCCCCCl MCULE-9010808862 [0,1,0,0,0,0|0,0,0]=1 518 B11R0.148 O=C(O)CCCCCCCCO MCULE-6121514710 [0,1,0,0,0,0|0,0,0]=1 519 B11R0.148 O=C(O)CCOCCOCCBr MCULE-3253906029 [0,1,0,0,0,0|2,0,0]=3 520 B11R0.148 O=C(O)CCOCCOCCO MCULE-9797832183 [0,1,0,0,0,0|2,0,0]=3 521 B11R0.148 O=C(O)CCOCCOCCS MCULE-1627429574 [0,1,0,0,0,0|2,0,0]=3 522 B11R0.148 O=CCCCCCCCC(=O)O MCULE-8345312745 [0,1,0,0,0,0|0,0,1]=2 523 B11R0.148 O=N(=O)CCCCCCCCBr MCULE-5806801538 [0,1,0,0,0,0|1,0,1]=3 524 B11R0.148 O=N(=O)CCCCCCCCO MCULE-3641883800 [0,1,0,0,0,0|1,0,1]=3 525 B11R0.159 CCCCCCCCC(C)(C)C MCULE-9346167511 [0,1,0,0,0,0|2,0,1]=4 526 B11R0.159 CCCCCCCCP(=O)(Cl)Cl MCULE-8094082819 [0,1,0,0,0,0|2,0,0]=3 527 B11R0.159 CCCCCCCCP(=O)(O)O MCULE-2397771742 [0,1,0,0,0,0|1,0,0]=2 528 B11R0.159 CCCCCCCCS(=O)(=O)Cl MCULE-7906722324 [0,1,0,0,0,0|1,0,1]=3 529 B11R0.159 CCCCCCCCS(=O)(=O)N MCULE-8276362302 [0,1,0,0,0,0|1,0,1]=3 530 B11R0.159 CCCCCCCCS(=O)(=O)O MCULE-2083628454 [0,1,0,0,0,0|1,0,0]=2 531 B11R0.159 CCCCCCCCS(=O)(=O)[O-] MCULE-9017426987 [0,1,0,0,0,0|1,0,1]=3 532 B11R0.159 CCCCCCCC[N+](C)(C)C MCULE-8224932542 [0,1,0,0,0,0|3,0,0]=4 533 B11R0.159 CCCCCCCC[N+](C)(C)C MCULE-8271976836 [0,1,0,0,0,0|3,0,0]=4 534 B11R0.159 CCCCCCCC[N+](C)(C)C MCULE-9239605360 [0,1,0,0,0,0|3,0,0]=4 535 B11R0.159 CCCCCCCC[Si](C)(C)Cl MCULE-8932096350 [0,1,0,0,0,0|2,1,0]=4 536 B11R0.159 CCCCCCCC[Si](C)(Cl)Cl MCULE-3522647741 [0,1,0,0,0,0|2,1,0]=4 537 B11R0.159 CCCCCCCC[Si](Cl)(Cl)Cl MCULE-6843028892 [0,1,0,0,0,0|2,1,0]=4 538 B11R0.159 CCCCCCCOS(=O)(=O)O MCULE-8923295424 [0,1,0,0,0,0|2,0,0]=3 539 B11R0.159 CCCCCCCOS(=O)(=O)[O-] MCULE-7971963876 [0,1,0,0,0,0|2,0,1]=4 540 B11R0.159 CCCCOCCOP(=O)(O)O MCULE-9697884879 [0,1,0,0,0,0|3,0,0]=4 541 B11R0.176 CCCC(=O)CCCCC(=O)O MCULE-8623857142 [0,1,0,0,0,0|0,0,1]=2 542 B11R0.176 CCCC(=O)OCCCC(=O)C MCULE-4762451697 [0,1,0,0,0,0|2,0,1]=4 543 B11R0.176 CCOC(=O)CCCCC(=O)Cl MCULE-7603618670 [0,1,0,0,0,0|2,0,1]=4 544 B11R0.176 CCOC(=O)CCCCC(=O)N MCULE-5102294443 [0,1,0,0,0,0|2,0,1]=4 545 B11R0.176 CCOC(=O)CCCCC(=O)O MCULE-2798201385 [0,1,0,0,0,0|1,0,1]=3 546 B11R0.176 CCOC(=O)NCCCC(=O)O MCULE-4728011360 [0,1,0,0,0,0|2,0,1]=4 547 B11R0.176 O=C(O)CCCCC(Cl)CCCl MCULE-3578422199 [0,1,0,0,0,0|1,0,0]=2 548 B11R0.176 O=C(O)CCCCC(O)CCO MCULE-6457534836 [0,1,0,0,0,0|1,0,0]=2 549 B11R0.176 O=C(O)CCCCC(S)CCS MCULE-3176735035 [0,1,0,0,0,0|1,0,0]=2 550 B11R0.176 O=C(O)CCCC[C@@H](S)CCS MCULE-1048565718 [0,1,0,0,0,0|1,0,0]=2 551 B11R1.24 CCCCC1=CC(=O)CCC1 MCULE-9500356684 [0,0,0,1,0,0|1,0,1]=3 552 B11R1.24 CCCCC1CC(=O)CCN1 MCULE-2065402619 [0,0,0,1,0,0|2,0,0]=3 553 B11R1.24 CCCCC1CC(=O)CCN1 MCULE-4896789576 [0,0,0,1,0,0|2,0,0]=3 554 B11R1.24 CCCCC1CCCC(=O)O1 MCULE-5855223168 [0,0,0,1,0,0|0,0,0]=1 555 B11R1.27 CCCCCC1C=CC(=O)O1 MCULE-7215901584 [0,0,0,1,0,0|0,0,2]=3 556 B11R1.27 CCCCCC1CCC(=O)O1 MCULE-8658118167 [0,0,0,1,0,0|0,0,0]=1 557 B11R1.27 CCCCCC1OCC(O1)C MCULE-9583652455 [0,0,0,1,0,0|2,0,1]=4 558 B11R1.27 CCCCC[C@H]1CCC(=O)O1 MCULE-5773106371 [0,0,0,1,0,0|0,0,0]=1 559 B11R1.27 O=C1CCC(O1)CCCCCl MCULE-9831879802 [0,0,0,1,0,0|1,0,0]=2 560 B11R1.53 CC(=O)N1CCCCC1CN MCULE-8318370610 [0,0,0,1,0,0|3,0,0]=4 561 B11R1.53 CC(=O)N1CCCCC1CO MCULE-4895074095 [0,0,0,1,0,0|3,0,0]=4 562 B11R1.53 CCC1=C(CCCO1)C(=O)O MCULE-9099684173 [0,0,0,1,0,0|1,0,2]=4 563 B11R1.53 CCC1CCCCC1C(=O)O MCULE-7668550184 [0,0,0,1,0,0|0,0,0]=1 564 B11R1.53 CCN1CCCCC1C(=O)O MCULE-4498923070 [0,0,0,1,0,0|1,0,0]=2 565 B11R1.53 CCN1CCCCC1C(=O)O MCULE-7899898030 [0,0,0,1,0,0|1,0,0]=2 566 B11R1.53 CCN1CCOCC1C(=O)N MCULE-4735060568 [0,0,0,1,0,0|3,0,0]=4 567 B11R1.53 CCN1CCOCC1C(=O)O MCULE-5700522196 [0,0,0,1,0,0|2,0,0]=3 568 B11R1.53 COC1CCCCC1C(=O)O MCULE-6019948868 [0,0,0,1,0,0|1,0,0]=2 569 B11R1.53 NC(=O)[C@H]1CCCC[C@@H]1CO MCULE-2660751861 [0,0,0,1,0,0|2,0,0]=3 570 B11R1.53 NC[C@@H]1CCCC[C@@H]1C(=O)O MCULE-1165595049 [0,0,0,1,0,0|1,0,0]=2 571 B11R1.53 NC[C@@H]1CCCC[C@@H]1C(=O)O MCULE-4991619146 [0,0,0,1,0,0|1,0,0]=2 572 B11R1.53 O=NN1CCCCC1C(=O)O MCULE-4341720324 [0,0,0,1,0,0|3,0,0]=4 573 B11R1.57 C=CC1CCCC1CC(=O)O MCULE-4540266032 [0,0,0,1,0,0|0,0,2]=3 574 B11R1.57 O=C(O)CN1CCCC1CBr MCULE-5679582185 [0,0,0,1,0,0|2,0,0]=3 575 B11R1.57 O=C(O)CN1CCCC1CCl MCULE-2614095966 [0,0,0,1,0,0|2,0,0]=3 576 B11R1.57 O=C(O)CN1CCCC1CI MCULE-2547746402 [0,0,0,1,0,0|2,0,0]=3 577 B11R1.57 O=C(O)CN1CCCC1CO MCULE-9577753530 [0,0,0,1,0,0|2,0,0]=3 578 B11R1.57 O=C(O)CN1CCC[C@H]1CO MCULE-1472111718 [0,0,0,1,0,0|2,0,0]=3 579 B11R1.86 CC(=O)CC1CCCCC1=O MCULE-3575915774 [0,0,0,1,0,0|2,0,1]=4 580 B11R1.86 CC(=O)CC1CCCCN1C MCULE-7888596089 [0,0,0,1,0,0|2,0,0]=3 581 B11R1.86 CC(=O)CN1CCCCC1C MCULE-6918556290 [0,0,0,1,0,0|2,0,0]=3 582 B11R1.86 CC(=O)C[C@H]1CCCCN1C MCULE-2452733660 [0,0,0,1,0,0|2,0,0]=3 583 B11R1.86 CC(=O)NC1CCCCC1Br MCULE-4216605693 [0,0,0,1,0,0|3,0,0]=4 584 B11R1.86 CC(=O)NC1CCCCC1Cl MCULE-7255544865 [0,0,0,1,0,0|3,0,0]=4 585 B11R1.86 CC(=O)NC1CCCCC1N MCULE-7889648713 [0,0,0,1,0,0|3,0,0]=4 586 B11R1.86 CC(=O)N[C@@H]1CCCC[C@H]1Cl MCULE-5801087784 [0,0,0,1,0,0|3,0,0]=4 587 B11R1.86 CC(=O)N[C@@H]1CCCC[C@H]1N MCULE-8588938231 [0,0,0,1,0,0|3,0,0]=4 588 B11R1.86 CC(=O)N[C@H]1CCCC[C@H]1Cl MCULE-8672156380 [0,0,0,1,0,0|3,0,0]=4 589 B11R1.86 CC(=O)OC1CCCCC1C MCULE-6335382849 [0,0,0,1,0,0|2,0,0]=3 590 B11R1.86 CC(O)CC1CCCCN1C MCULE-3186311886 [0,0,0,1,0,0|2,0,1]=4 591 B11R1.86 CC(O)CN1CCCCC1C MCULE-5130807894 [0,0,0,1,0,0|2,0,1]=4 592 B11R1.86 CC1CCCCC1CC(=O)N MCULE-3919731608 [0,0,0,1,0,0|1,0,0]=2 593 B11R1.86 CC1CCCCC1CC(=O)O MCULE-8512937446 [0,0,0,1,0,0|0,0,0]=1 594 B11R1.86 CC1CCCCC1NC(=O)N MCULE-8304088077 [0,0,0,1,0,0|2,0,0]=3 595 B11R1.86 CC1CCCCN1CC(=O)N MCULE-2830131206 [0,0,0,1,0,0|2,0,0]=3 596 B11R1.86 CC1CCCCN1CC(=O)O MCULE-6978091572 [0,0,0,1,0,0|1,0,0]=2 597 B11R1.86 CC1CCCCN1CC(=O)O MCULE-8958981548 [0,0,0,1,0,0|1,0,0]=2 598 B11R1.86 CC1CCNCC1CC(=O)O MCULE-2573262395 [0,0,0,1,0,0|1,0,0]=2 599 B11R1.86 CC1CCNCC1CC(=O)O MCULE-6926994477 [0,0,0,1,0,0|1,0,0]=2 600 B11R1.86 CC1CNCCC1CC(=O)O MCULE-7212738787 [0,0,0,1,0,0|1,0,0]=2 601 B11R1.86 CC1CNCCN1CC(=O)O MCULE-5720133491 [0,0,0,1,0,0|2,0,0]=3 602 B11R1.86 CC1CNCCN1CC(=O)O MCULE-8861054343 [0,0,0,1,0,0|2,0,0]=3 603 B11R1.86 CN1CCCCC1CC(=O)O MCULE-3316980419 [0,0,0,1,0,0|1,0,0]=2 604 B11R1.86 CN1CCCCC1CC(=O)O MCULE-8860551772 [0,0,0,1,0,0|1,0,0]=2 605 B11R1.86 C[C@H](O)C[C@@H]1CCCCN1C MCULE-1823823531 [0,0,0,1,0,0|2,0,1]=4 606 B11R1.86 C[C@H](O)C[C@@H]1CCCCN1C MCULE-4140894566 [0,0,0,1,0,0|2,0,1]=4 607 B11R1.86 C[C@H](O)C[C@H]1CCCCN1C MCULE-2144718958 [0,0,0,1,0,0|2,0,1]=4 608 B11R1.86 C[C@H](O)C[C@H]1CCCCN1C MCULE-4299162576 [0,0,0,1,0,0|2,0,1]=4 609 B11R1.86 C[C@H]1CNCCN1CC(=O)O MCULE-1627398404 [0,0,0,1,0,0|2,0,0]=3 610 B11R1.86 C[C@H]1CNCCN1CC(=O)O MCULE-6677242580 [0,0,0,1,0,0|2,0,0]=3 611 B11R1.86 NC(=O)CC1CCCCC1=O MCULE-3971347881 [0,0,0,1,0,0|2,0,1]=4 612 B11R1.86 NC1CCOCC1CC(=O)O MCULE-4690300395 [0,0,0,1,0,0|2,0,0]=3 613 B11R1.86 O=C(Cl)CC1CCCCC1=O MCULE-8631703568 [0,0,0,1,0,0|2,0,1]=4 614 B11R1.86 O=C(Cl)OC1CCCCC1Cl MCULE-2250699778 [0,0,0,1,0,0|3,0,0]=4 615 B11R1.86 O=C(Cl)O[C@@H]1CCCC[C@H]1F MCULE-4678998797 [0,0,0,1,0,0|3,0,0]=4 616 B11R1.86 O=C(O)CC1CCCCC1=O MCULE-2872066455 [0,0,0,1,0,0|1,0,1]=3 617 B11R1.86 O=C(O)CN1CCCCC1=O MCULE-6673893259 [0,0,0,1,0,0|2,0,1]=4 618 B11R1.86 O=C(O)C[C@@H]1CCCC[C@H]1O MCULE-4350134748 [0,0,0,1,0,0|1,0,0]=2 619 B11R1.86 O=C(O)C[C@H]1CCCC[C@@H]1O MCULE-6436496571 [0,0,0,1,0,0|1,0,0]=2 620 B11R1.90 CC1=[N+](CCS1)CCC(=O)O MCULE-2045356735 [0,0,0,1,0,0|2,0,1]=4 621 B11R1.90 CC1=[N+](CCS1)CCC(=O)O MCULE-6874001868 [0,0,0,1,0,0|2,0,1]=4 622 B11R1.90 CN1CCCC1C=CC(=O)O MCULE-1495822214 [0,0,0,1,0,0|1,0,2]=4 623 B11R1.90 CN1CCCC1C=CC(=O)O MCULE-8579112538 [0,0,0,1,0,0|1,0,2]=4 624 B11R1.90 CN1CCCC1CCC(=O)O MCULE-2208326711 [0,0,0,1,0,0|1,0,0]=2 625 B11R1.90 CN1CCCC1CCC(=O)O MCULE-5781640008 [0,0,0,1,0,0|1,0,0]=2 626 B11R1.90 CN1CCC[C@@H]1/C=C/C(=O)O MCULE-1511363062 [0,0,0,1,0,0|1,0,2]=4 627 B11R1.90 CN1CCC[C@@H]1/C=C/C(=O)O MCULE-9589594414 [0,0,0,1,0,0|1,0,2]=4 628 B11R1.90 CN1CCC[C@@H]1C=CC(=O)O MCULE-8234680020 [0,0,0,1,0,0|1,0,2]=4 629 B11R1.90 CN1CCC[C@@H]1C=CC(=O)O MCULE-9849714798 [0,0,0,1,0,0|1,0,2]=4 630 B11R1.90 O=C(O)CCC1CCOC1=O MCULE-3104209963 [0,0,0,1,0,0|2,0,1]=4 631 B11R1.90 O=C(O)CCN1CCCC1=O MCULE-7932887984 [0,0,0,1,0,0|2,0,1]=4 632 B11R1.91 C=C(Br)CNC1CCCCC1 MCULE-4193740039 [0,0,0,1,0,0|3,0,0]=4 633 B11R1.91 C=C(Br)CNC1CCCCC1 MCULE-8122447871 [0,0,0,1,0,0|3,0,0]=4 634 B11R1.91 CC(=O)CCC1CCCCC1 MCULE-1125647515 [0,0,0,1,0,0|1,0,0]=2 635 B11R1.91 CC(=O)CCN1CCCCC1 MCULE-4455809617 [0,0,0,1,0,0|2,0,0]=3 636 B11R1.91 CC(=O)CCN1CCCCC1 MCULE-7961876637 [0,0,0,1,0,0|2,0,0]=3 637 B11R1.91 CC(=O)CCN1CCNCC1 MCULE-2822686097 [0,0,0,1,0,0|3,0,0]=4 638 B11R1.91 CC(=O)CCN1CCNCC1 MCULE-4333462634 [0,0,0,1,0,0|3,0,0]=4 639 B11R1.91 CC(=O)CCN1CCOCC1 MCULE-7551262567 [0,0,0,1,0,0|3,0,0]=4 640 B11R1.91 CC(=O)NCC1CCCCN1 MCULE-3105845304 [0,0,0,1,0,0|3,0,0]=4 641 B11R1.91 CC(=O)NCC1CCCCN1 MCULE-9646759433 [0,0,0,1,0,0|3,0,0]=4 642 B11R1.91 CC(=O)NCC1CCCNC1 MCULE-2486103137 [0,0,0,1,0,0|3,0,0]=4 643 B11R1.91 CC(=O)NCC1CCNCC1 MCULE-1534192859 [0,0,0,1,0,0|3,0,0]=4 644 B11R1.91 CC(=O)NCC1CCNCC1 MCULE-3811620113 [0,0,0,1,0,0|3,0,0]=4 645 B11R1.91 CC(=O)NCC1CCNCC1 MCULE-4719188960 [0,0,0,1,0,0|3,0,0]=4 646 B11R1.91 CC(=O)OCC1CCCCC1 MCULE-4442955915 [0,0,0,1,0,0|2,0,0]=3 647 B11R1.91 CC(=O)OCC1CCCCO1 MCULE-2769100863 [0,0,0,1,0,0|3,0,0]=4 648 B11R1.91 CC(=O)OCC1CCCNC1 MCULE-3753425352 [0,0,0,1,0,0|3,0,0]=4 649 B11R1.91 CC(=O)OCC1CCCNC1 MCULE-8547366652 [0,0,0,1,0,0|3,0,0]=4 650 B11R1.91 CC(=O)OCC1CCNCC1 MCULE-2805518931 [0,0,0,1,0,0|3,0,0]=4 651 B11R1.91 CC(=O)OCC1CCNCC1 MCULE-5312831696 [0,0,0,1,0,0|3,0,0]=4 652 B11R1.91 CC(N)CCC1CCCCC1 MCULE-1575737383 [0,0,0,1,0,0|2,0,1]=4 653 B11R1.91 CC(O)CCC1CCCCC1 MCULE-3809271591 [0,0,0,1,0,0|1,0,1]=3 654 B11R1.91 CC(O)CNC1CCCCC1 MCULE-3346298684 [0,0,0,1,0,0|2,0,1]=4 655 B11R1.91 N=C(N)CCN1CCCCC1 MCULE-4187671201 [0,0,0,1,0,0|3,0,0]=4 656 B11R1.91 N=C(N)CCN1CCCCC1 MCULE-6812707919 [0,0,0,1,0,0|3,0,0]=4 657 B11R1.91 N=C(N)CCN1CCCCC1 MCULE-8802863643 [0,0,0,1,0,0|3,0,0]=4 658 B11R1.91 N=C(N)NCC1CCCCC1 MCULE-5333495230 [0,0,0,1,0,0|3,0,0]=4 659 B11R1.91 N=C(N)NCC1CCCCC1 MCULE-6218164374 [0,0,0,1,0,0|3,0,0]=4 660 B11R1.91 N=C(N)SCC1CCCCC1 MCULE-3283728567 [0,0,0,1,0,0|3,0,0]=4 661 B11R1.91 N=C(N)SCC1CCCCC1 MCULE-5965577672 [0,0,0,1,0,0|3,0,0]=4 662 B11R1.91 NC(=O)CCC1CCCCC1 MCULE-7177254920 [0,0,0,1,0,0|1,0,0]=2 663 B11R1.91 NC(=O)CCC1CCCNC1 MCULE-2731987615 [0,0,0,1,0,0|2,0,0]=3 664 B11R1.91 NC(=O)CCC1CCCNC1 MCULE-3357409507 [0,0,0,1,0,0|2,0,0]=3 665 B11R1.91 NC(=O)CCC1CCNCC1 MCULE-2541342686 [0,0,0,1,0,0|2,0,0]=3 666 B11R1.91 NC(=O)CCC1CCNCC1 MCULE-7868367948 [0,0,0,1,0,0|2,0,0]=3 667 B11R1.91 NC(=O)CCN1CCNCC1 MCULE-4237492785 [0,0,0,1,0,0|3,0,0]=4 668 B11R1.91 NC(=O)CCN1CCNCC1 MCULE-5604364402 [0,0,0,1,0,0|3,0,0]=4 669 B11R1.91 NC(=O)CCN1CCNCC1 MCULE-5899238397 [0,0,0,1,0,0|3,0,0]=4 670 B11R1.91 NC(=O)CCN1CCOCC1 MCULE-3358887716 [0,0,0,1,0,0|3,0,0]=4 671 B11R1.91 NC(=O)CNC1CCOCC1 MCULE-5022669900 [0,0,0,1,0,0|3,0,0]=4 672 B11R1.91 NC(=O)CNC1CCOCC1 MCULE-8465760828 [0,0,0,1,0,0|3,0,0]=4 673 B11R1.91 NC(=O)COC1CCCCC1 MCULE-3634561714 [0,0,0,1,0,0|2,0,0]=3 674 B11R1.91 NC(=O)COC1CCNCC1 MCULE-1994833226 [0,0,0,1,0,0|3,0,0]=4 675 B11R1.91 NC(=O)COC1CCNCC1 MCULE-7267285811 [0,0,0,1,0,0|3,0,0]=4 676 B11R1.91 NC(=O)CSC1CCCCC1 MCULE-9968891969 [0,0,0,1,0,0|2,0,0]=3 677 B11R1.91 NC(=O)NCC1CCCCC1 MCULE-8898827465 [0,0,0,1,0,0|2,0,0]=3 678 B11R1.91 NC(=O)NCC1CCCCN1 MCULE-4059522603 [0,0,0,1,0,0|3,0,0]=4 679 B11R1.91 NC(=O)NCC1CCCCN1 MCULE-8786655844 [0,0,0,1,0,0|3,0,0]=4 680 B11R1.91 NC(=O)NCC1CCCNC1 MCULE-6134280325 [0,0,0,1,0,0|3,0,0]=4 681 B11R1.91 NC(=S)CCN1CCCCC1 MCULE-2768225485 [0,0,0,1,0,0|2,1,0]=4 682 B11R1.91 NC(=S)NCC1CCCCC1 MCULE-6421127685 [0,0,0,1,0,0|2,1,0]=4 683 B11R1.91 O=C(Cl)CCC1CCCCC1 MCULE-7905035887 [0,0,0,1,0,0|1,0,0]=2 684 B11R1.91 O=C(Cl)OCC1CCCCC1 MCULE-5198631423 [0,0,0,1,0,0|2,0,0]=3 685 B11R1.91 O=C(Cl)OCC1CCOCC1 MCULE-6985131043 [0,0,0,1,0,0|3,0,0]=4 686 B11R1.91 O=C(O)/C=C/C1CCCCC1 MCULE-3408838682 [0,0,0,1,0,0|0,0,2]=3 687 B11R1.91 O=C(O)/C=N/N1CCCCC1 MCULE-4664019093 [0,0,0,1,0,0|2,0,1]=4 688 B11R1.91 O=C(O)/C=N/N1CCCCC1 MCULE-7026085314 [0,0,0,1,0,0|2,0,1]=4 689 B11R1.91 O=C(O)C#CC1CCCCC1 MCULE-5082053122 [0,0,0,1,0,0|0,0,2]=3 690 B11R1.91 O=C(O)C#CC1CCCNC1 MCULE-1364265807 [0,0,0,1,0,0|1,0,2]=4 691 B11R1.91 O=C(O)C#CC1CCCNC1 MCULE-8856789307 [0,0,0,1,0,0|1,0,2]=4 692 B11R1.91 O=C(O)C#CC1CCCOC1 MCULE-2694768491 [0,0,0,1,0,0|1,0,2]=4 693 B11R1.91 O=C(O)C#CC1CCNCC1 MCULE-8935690041 [0,0,0,1,0,0|1,0,2]=4 694 B11R1.91 O=C(O)C#CC1CCNCC1 MCULE-9868136962 [0,0,0,1,0,0|1,0,2]=4 695 B11R1.91 O=C(O)C#CC1CCOCC1 MCULE-8516095327 [0,0,0,1,0,0|1,0,2]=4 696 B11R1.91 O=C(O)C=CC1CCCCC1 MCULE-4284204201 [0,0,0,1,0,0|0,0,2]=3 697 B11R1.91 O=C(O)C=CC1CCOCC1 MCULE-1964035700 [0,0,0,1,0,0|1,0,2]=4 698 B11R1.91 O=C(O)CCC1=CCCCC1 MCULE-1237781222 [0,0,0,1,0,0|0,0,2]=3 699 B11R1.91 O=C(O)CCC1CCCCC1 MCULE-6857024600 [0,0,0,1,0,0|0,0,0]=1 700 B11R1.91 O=C(O)CCC1CCCCN1 MCULE-9745963762 [0,0,0,1,0,0|1,0,0]=2 701 B11R1.91 O=C(O)CCC1CCCCN1 MCULE-9799515880 [0,0,0,1,0,0|1,0,0]=2 702 B11R1.91 O=C(O)CCC1CCCCO1 MCULE-7131400209 [0,0,0,1,0,0|1,0,0]=2 703 B11R1.91 O=C(O)CCC1CCCNC1 MCULE-7924528861 [0,0,0,1,0,0|1,0,0]=2 704 B11R1.91 O=C(O)CCC1CCCNC1 MCULE-8138582183 [0,0,0,1,0,0|1,0,0]=2 705 B11R1.91 O=C(O)CCC1CCCOC1 MCULE-2925847386 [0,0,0,1,0,0|1,0,0]=2 706 B11R1.91 O=C(O)CCC1CCNCC1 MCULE-2827451677 [0,0,0,1,0,0|1,0,0]=2 707 B11R1.91 O=C(O)CCC1CCNCC1 MCULE-4045148324 [0,0,0,1,0,0|1,0,0]=2 708 B11R1.91 O=C(O)CCC1CCOCC1 MCULE-6529848078 [0,0,0,1,0,0|1,0,0]=2 709 B11R1.91 O=C(O)CCC1CNCCN1 MCULE-1513049995 [0,0,0,1,0,0|2,0,0]=3 710 B11R1.91 O=C(O)CCC1CNCCN1 MCULE-4856628745 [0,0,0,1,0,0|2,0,0]=3 711 B11R1.91 O=C(O)CCC1CNCCN1 MCULE-8947965996 [0,0,0,1,0,0|2,0,0]=3 712 B11R1.91 O=C(O)CCC1CNCCO1 MCULE-4290804660 [0,0,0,1,0,0|2,0,0]=3 713 B11R1.91 O=C(O)CCC1CNCCO1 MCULE-8003417383 [0,0,0,1,0,0|2,0,0]=3 714 B11R1.91 O=C(O)CCC1COCCN1 MCULE-2173241934 [0,0,0,1,0,0|2,0,0]=3 715 B11R1.91 O=C(O)CCC1COCCN1 MCULE-4800776369 [0,0,0,1,0,0|2,0,0]=3 716 B11R1.91 O=C(O)CCC1COCCO1 MCULE-8260042590 [0,0,0,1,0,0|2,0,0]=3 717 B11R1.91 O=C(O)CCC1OCCCO1 MCULE-5410285503 [0,0,0,1,0,0|2,0,0]=3 718 B11R1.91 O=C(O)CCN1CCCCC1 MCULE-4134014685 [0,0,0,1,0,0|1,0,0]=2 719 B11R1.91 O=C(O)CCN1CCCCC1 MCULE-8800912377 [0,0,0,1,0,0|1,0,0]=2 720 B11R1.91 O=C(O)CCN1CCCCO1 MCULE-2996089701 [0,0,0,1,0,0|2,0,0]=3 721 B11R1.91 O=C(O)CCN1CCCCO1 MCULE-3766668240 [0,0,0,1,0,0|2,0,0]=3 722 B11R1.91 O=C(O)CCN1CCNCC1 MCULE-2278927702 [0,0,0,1,0,0|2,0,0]=3 723 B11R1.91 O=C(O)CCN1CCNCC1 MCULE-7245019533 [0,0,0,1,0,0|2,0,0]=3 724 B11R1.91 O=C(O)CCN1CCOCC1 MCULE-1023466735 [0,0,0,1,0,0|2,0,0]=3 725 B11R1.91 O=C(O)CCN1CCOCC1 MCULE-7724278716 [0,0,0,1,0,0|2,0,0]=3 726 B11R1.91 O=C(O)CCN1CCOCC1 MCULE-8465184362 [0,0,0,1,0,0|2,0,0]=3 727 B11R1.91 O=C(O)CCN1CCSCC1 MCULE-5978659919 [0,0,0,1,0,0|2,0,0]=3 728 B11R1.91 O=C(O)CCN1CCSCC1 MCULE-8911727730 [0,0,0,1,0,0|2,0,0]=3 729 B11R1.91 O=C(O)CC[C@@H]1CNCCO1 MCULE-1561801705 [0,0,0,1,0,0|2,0,0]=3 730 B11R1.91 O=C(O)CC[C@@H]1CNCCO1 MCULE-1829190625 [0,0,0,1,0,0|2,0,0]=3 731 B11R1.91 O=C(O)CC[C@H]1CNCCO1 MCULE-4904929048 [0,0,0,1,0,0|2,0,0]=3 732 B11R1.91 O=C(O)CC[C@H]1CNCCO1 MCULE-9655711335 [0,0,0,1,0,0|2,0,0]=3 733 B11R1.91 O=C(O)CNC1=NCCCC1 MCULE-3814369220 [0,0,0,1,0,0|2,0,1]=4 734 B11R1.91 O=C(O)CNC1CCCCC1 MCULE-5220210342 [0,0,0,1,0,0|1,0,0]=2 735 B11R1.91 O=C(O)CNC1CCCCC1 MCULE-9313520636 [0,0,0,1,0,0|1,0,0]=2 736 B11R1.91 O=C(O)CNC1CCOCC1 MCULE-7657301692 [0,0,0,1,0,0|2,0,0]=3 737 B11R1.91 O=C(O)COC1CCCCC1 MCULE-9015047559 [0,0,0,1,0,0|1,0,0]=2 738 B11R1.91 O=C(O)COC1CCCOC1 MCULE-6982251312 [0,0,0,1,0,0|2,0,0]=3 739 B11R1.91 O=C(O)COC1CCNCC1 MCULE-8120083070 [0,0,0,1,0,0|2,0,0]=3 740 B11R1.91 O=C(O)COC1CCNCC1 MCULE-9462178764 [0,0,0,1,0,0|2,0,0]=3 741 B11R1.91 O=C(O)COC1CCOCC1 MCULE-2803382098 [0,0,0,1,0,0|2,0,0]=3 742 B11R1.91 O=C(O)CSC1CCCCC1 MCULE-2242180425 [0,0,0,1,0,0|1,0,0]=2 743 B11R1.91 O=C(O)CSC1CCCCO1 MCULE-8580492168 [0,0,0,1,0,0|2,0,0]=3 744 B11R1.91 O=C([O-])CCN1CCOCC1 MCULE-7377834147 [0,0,0,1,0,0|2,0,1]=4 745 B11R1.91 O=N(=O)CCC1CCCCC1 MCULE-2759348903 [0,0,0,1,0,0|1,0,1]=3 746 B11R1.91 O=N(=O)CCC1CCOCC1 MCULE-7297881653 [0,0,0,1,0,0|2,0,1]=4 747 B11R1.91 OB(O)CCC1CCCCC1 MCULE-6802710012 [0,0,0,1,0,0|1,0,1]=3 748 B11R1.99 CCCCCCCCC1CO1 MCULE-5254067206 [0,0,0,1,0,0|1,0,1]=3 749 B11R1.99 CCCCCCCC[C@@H]1CO1 MCULE-1956936475 [0,0,0,1,0,0|1,0,1]=3 750 B11R1.99 CCCCCCOCC1CO1 MCULE-4928959956 [0,0,0,1,0,0|2,0,1]=4 751 B11R1.99 CCCCCCOC[C@H]1CO1 MCULE-7895281836 [0,0,0,1,0,0|2,0,1]=4 752 B11R1.101 NC1CCCCCCCCC1 MCULE-7140828852 [0,0,0,1,0,0|2,0,1]=4 753 B11R1.101 NC1CCCCCCCCC1 MCULE-9762725860 [0,0,0,1,0,0|2,0,1]=4 754 B11R1.101 O=C1CCCCCCCCC1 MCULE-7431354983 [0,0,0,1,0,0|1,0,0]=2 755 B11R1.101 O=C1CCCCCCCCN1 MCULE-4805310836 [0,0,0,1,0,0|1,0,0]=2 756 B11R1.101 O=C1CCNCCCCCN1 MCULE-1892904766 [0,0,0,1,0,0|2,0,0]=3 757 B11R1.101 O=C1CCNCCOCCN1 MCULE-3042541612 [0,0,0,1,0,0|3,0,0]=4 758 B11R1.107 O=C1CCCCCCC(=O)O1 MCULE-6826256328 [0,0,0,1,0,0|1,0,1]=3 759 B11R1.110 C=CCC1CCCCC(=O)N1 MCULE-4154492300 [0,0,0,1,0,0|1,0,2]=4 760 B11R1.110 NCCC1CCCCC(=O)N1 MCULE-2147581863 [0,0,0,1,0,0|2,0,0]=3 761 B11R1.110 NCCC1CCCCC(=O)N1 MCULE-8292359667 [0,0,0,1,0,0|2,0,0]=3 762 B11R1.143 CN1CCCCCC1C(=O)O MCULE-2653542021 [0,0,0,1,0,0|1,0,0]=2 763 B11R1.143 CN1CCCCCC1C(=O)O MCULE-3417099605 [0,0,0,1,0,0|1,0,0]=2 764 B11R1.143 NC1CCCCCC1C(=O)O MCULE-8944650297 [0,0,0,1,0,0|1,0,0]=2 765 B11R1.143 NC1CCCCCC1C(=O)O MCULE-9787960494 [0,0,0,1,0,0|1,0,0]=2 766 B11R1.172 N=C(N)CCCN1CCCC1 MCULE-5697873737 [0,0,0,1,0,0|3,0,0]=4 767 B11R1.172 N=C(N)CCCN1CCCC1 MCULE-6267828551 [0,0,0,1,0,0|3,0,0]=4 768 B11R1.172 NC(=O)CCNC1CCCC1 MCULE-2584575010 [0,0,0,1,0,0|2,0,0]=3 769 B11R1.172 NC(=O)COCC1CCCO1 MCULE-9083267384 [0,0,0,1,0,0|3,0,0]=4 770 B11R1.172 O=C(O)/C=C/CN1CCCC1 MCULE-3615621151 [0,0,0,1,0,0|1,0,2]=4 771 B11R1.172 O=C(O)C=CCN1CCCC1 MCULE-2006760435 [0,0,0,1,0,0|1,0,2]=4 772 B11R1.172 O=C(O)C=CCN1CCCC1 MCULE-5434934175 [0,0,0,1,0,0|1,0,2]=4 773 B11R1.172 O=C(O)CCCC1CCCC1 MCULE-5735094397 [0,0,0,1,0,0|0,0,0]=1 774 B11R1.172 O=C(O)CCCC1CCSS1 MCULE-1919221477 [0,0,0,1,0,0|2,0,0]=3 775 B11R1.172 O=C(O)CCCN1CCCC1 MCULE-7995654522 [0,0,0,1,0,0|1,0,0]=2 776 B11R1.172 O=C(O)CCCN1CCCC1 MCULE-9746290578 [0,0,0,1,0,0|1,0,0]=2 777 B11R1.172 O=C(O)CCNC1=NCCC1 MCULE-2370524888 [0,0,0,1,0,0|2,0,1]=4 778 B11R1.172 O=C(O)CCNC1CCCC1 MCULE-1657479625 [0,0,0,1,0,0|1,0,0]=2 779 B11R1.172 O=C(O)CCNC1CCCC1 MCULE-3083688470 [0,0,0,1,0,0|1,0,0]=2 780 B11R1.172 O=C(O)CCSC1CCCC1 MCULE-1998655965 [0,0,0,1,0,0|1,0,0]=2 781 B11R1.172 O=C(O)COCC1CCCC1 MCULE-5915220179 [0,0,0,1,0,0|1,0,0]=2 782 B11R1.172 O=C(O)COCC1CCCN1 MCULE-4455185085 [0,0,0,1,0,0|2,0,0]=3 783 B11R1.172 O=C(O)COCC1CCCN1 MCULE-9900773670 [0,0,0,1,0,0|2,0,0]=3 784 B11R1.172 O=C(O)COCC1CCCO1 MCULE-6503346834 [0,0,0,1,0,0|2,0,0]=3 785 B11R1.172 O=C(O)COCC1CCOC1 MCULE-8544806817 [0,0,0,1,0,0|2,0,0]=3 786 B11R1.172 O=C(O)CSCC1CCCO1 MCULE-5372517414 [0,0,0,1,0,0|2,0,0]=3 787 B11R1.172 O=C([O-])CCCC1CCSS1 MCULE-7764773644 [0,0,0,1,0,0|2,0,1]=4 788 B11R1.193 C=CCN1CCCC1C(=O)O MCULE-2345747350 [0,0,0,1,0,0|1,0,2]=4 789 B11R1.193 C=CCN1CCC[C@H]1C(=O)O MCULE-2257750734 [0,0,0,1,0,0|1,0,2]=4 790 B11R1.193 C=CCN1CCC[C@H]1C(=O)O MCULE-8484836425 [0,0,0,1,0,0|1,0,2]=4 791 B11R1.193 CC#CN1CCC[C@@H]1C(=O)O MCULE-1628681516 [0,0,0,1,0,0|1,0,2]=4 792 B11R1.193 CC#CN1CCC[C@@H]1C(=O)O MCULE-5550975983 [0,0,0,1,0,0|1,0,2]=4 793 B11R1.193 CC#CN1CCC[C@H]1C(=O)O MCULE-6393272421 [0,0,0,1,0,0|1,0,2]=4 794 B11R1.193 CC#CN1CCC[C@H]1C(=O)O MCULE-9353428167 [0,0,0,1,0,0|1,0,2]=4 795 B11R1.193 CCCC1CCCC1C(=O)O MCULE-1492543766 [0,0,0,1,0,0|0,0,0]=1 796 B11R1.193 CCCC1CCNC1C(=O)O MCULE-3288508053 [0,0,0,1,0,0|1,0,0]=2 797 B11R1.193 CCCC1CCNC1C(=O)O MCULE-8057933085 [0,0,0,1,0,0|1,0,0]=2 798 B11R1.193 CCCN1CCCC1C(=O)O MCULE-8751998851 [0,0,0,1,0,0|1,0,0]=2 799 B11R1.193 CCCN1CCC[C@H]1C(=O)O MCULE-2240941812 [0,0,0,1,0,0|1,0,0]=2 800 B11R1.193 CCCN1CCC[C@H]1C(=O)O MCULE-4921696951 [0,0,0,1,0,0|1,0,0]=2 801 B11R1.193 CNCC1CCCN1C(=O)C MCULE-3584683470 [0,0,0,1,0,0|3,0,0]=4 802 B11R1.193 CNC[C@@H]1CCCN1C(=O)C MCULE-2334999714 [0,0,0,1,0,0|3,0,0]=4 803 B11R1.193 O=C(O)C1CNCC1CCO MCULE-3831742896 [0,0,0,1,0,0|2,0,0]=3 804 B11R1.271 CC(=O)OCC1CCC1CO MCULE-3822015939 [0,0,0,1,0,0|3,0,0]=4 805 B11R1.271 CC(=O)OC[C@@H]1CC[C@@H]1CO MCULE-5099941328 [0,0,0,1,0,0|3,0,0]=4 806 B11R1.271 CC(=O)OC[C@@H]1CC[C@H]1CO MCULE-3952027442 [0,0,0,1,0,0|3,0,0]=4 807 B11R1.271 CC(=O)OC[C@@H]1CC[C@H]1CO MCULE-7127600773 [0,0,0,1,0,0|3,0,0]=4 808 B11R1.271 CC(=O)OC[C@H]1CC[C@H]1CO MCULE-1827946489 [0,0,0,1,0,0|3,0,0]=4 809 B11R1.706 CC(=O)C1CCCCCCC1 MCULE-7453374150 [0,0,0,1,0,0|1,0,0]=2 810 B11R1.706 O=C(O)C1CCC=CCCC1 MCULE-1202438669 [0,0,0,1,0,0|0,0,2]=3 811 B11R1.706 O=C(O)C1CCCCCCC1 MCULE-7220278799 [0,0,0,1,0,0|0,0,0]=1 812 B11R1.706 O=C(O)C1CCCCCCN1 MCULE-2852082428 [0,0,0,1,0,0|1,0,0]=2 813 B11R1.706 O=C(O)C1CCCCCCN1 MCULE-2931630393 [0,0,0,1,0,0|1,0,0]=2 814 B11R1.742 C=C(Br)CN1CCCCCC1 MCULE-9156946050 [0,0,0,1,0,0|3,0,0]=4 815 B11R1.742 C=C(C)CC1CCCCCC1 MCULE-6590200380 [0,0,0,1,0,0|2,0,0]=3 816 B11R1.742 CC(=O)CC1CCCCCN1 MCULE-2355996760 [0,0,0,1,0,0|2,0,0]=3 817 B11R1.742 CC(=O)CN1CCCCCC1 MCULE-5319693118 [0,0,0,1,0,0|2,0,0]=3 818 B11R1.742 CC(=O)CN1CCCCCC1 MCULE-8763178253 [0,0,0,1,0,0|2,0,0]=3 819 B11R1.742 CC(=O)NC1CCCCCC1 MCULE-3697459369 [0,0,0,1,0,0|2,0,0]=3 820 B11R1.742 CC(O)CC1CCCCCN1 MCULE-7390078108 [0,0,0,1,0,0|2,0,1]=4 821 B11R1.742 CC(O)CN1CCCCCC1 MCULE-8415141576 [0,0,0,1,0,0|2,0,1]=4 822 B11R1.742 N=C(N)CN1CCCCCC1 MCULE-4265756441 [0,0,0,1,0,0|3,0,0]=4 823 B11R1.742 N=C(N)CN1CCCCCC1 MCULE-8129093841 [0,0,0,1,0,0|3,0,0]=4 824 B11R1.742 N=C(N)NC1CCCCCC1 MCULE-1664678210 [0,0,0,1,0,0|3,0,0]=4 825 B11R1.742 N=C(N)NC1CCCCCC1 MCULE-4607928506 [0,0,0,1,0,0|3,0,0]=4 826 B11R1.742 NC(=O)CN1CCCCCC1 MCULE-5945622165 [0,0,0,1,0,0|2,0,0]=3 827 B11R1.742 NC(=O)CN1CCCNCC1 MCULE-5276262579 [0,0,0,1,0,0|3,0,0]=4 828 B11R1.742 NC(=O)CN1CCCNCC1 MCULE-6950928492 [0,0,0,1,0,0|3,0,0]=4 829 B11R1.742 NC(=O)NC1CCCCCC1 MCULE-7737326688 [0,0,0,1,0,0|2,0,0]=3 830 B11R1.742 NC(=S)NC1CCCCCC1 MCULE-1359160421 [0,0,0,1,0,0|2,1,0]=4 831 B11R1.742 O=C(O)C=C1CCCCCC1 MCULE-5228387881 [0,0,0,1,0,0|0,0,2]=3 832 B11R1.742 O=C(O)CC1CCC=CCC1 MCULE-8122130448 [0,0,0,1,0,0|0,0,2]=3 833 B11R1.742 O=C(O)CC1CCCCCC1 MCULE-3247091796 [0,0,0,1,0,0|0,0,0]=1 834 B11R1.742 O=C(O)CC1CCCNCC1 MCULE-1259156999 [0,0,0,1,0,0|1,0,0]=2 835 B11R1.742 O=C(O)CC1CCCNCC1 MCULE-8862658650 [0,0,0,1,0,0|1,0,0]=2 836 B11R1.742 O=C(O)CC1CCCOCC1 MCULE-7663320476 [0,0,0,1,0,0|1,0,0]=2 837 B11R1.742 O=C(O)CN1CCCCCC1 MCULE-1178025352 [0,0,0,1,0,0|1,0,0]=2 838 B11R1.742 O=C(O)CN1CCCCCC1 MCULE-1252489424 [0,0,0,1,0,0|1,0,0]=2 839 B11R1.742 O=C(O)CN1CCCNCC1 MCULE-7410717770 [0,0,0,1,0,0|2,0,0]=3 840 B11R1.742 O=C(O)CN1CCCNCC1 MCULE-8199207666 [0,0,0,1,0,0|2,0,0]=3 841 B11R1.742 O=C(O)CN1CSCCSC1 MCULE-4152013932 [0,0,0,1,0,0|3,0,0]=4 842 B8R0.4 BrCCCCCCCBr MCULE-4094304263 [2,0,0,0,0,0|2,0,0]=4 843 B8R0.4 C#CCCCCCC=O MCULE-6168802703 [2,0,0,0,0,0|0,0,2]=4 844 B8R0.4 C#CCCCCCCC MCULE-5881425113 [2,0,0,0,0,0|0,0,2]=4 845 B8R0.4 C#CCCCCCCO MCULE-9399870702 [2,0,0,0,0,0|0,0,2]=4 846 B8R0.4 C=CCCCCCC=O MCULE-9514877352 [2,0,0,0,0,0|0,0,2]=4 847 B8R0.4 C=CCCCCCCBr MCULE-6451772855 [2,0,0,0,0,0|1,0,1]=4 848 B8R0.4 C=CCCCCCCC MCULE-8103203416 [2,0,0,0,0,0|0,0,1]=3 849 B8R0.4 C=CCCCCCCCl MCULE-2359680024 [2,0,0,0,0,0|1,0,1]=4 850 B8R0.4 C=CCCCCCCI MCULE-2548377676 [2,0,0,0,0,0|1,0,1]=4 851 B8R0.4 C=CCCCCCCN MCULE-3465800348 [2,0,0,0,0,0|1,0,1]=4 852 B8R0.4 C=CCCCCCCN MCULE-9820466293 [2,0,0,0,0,0|1,0,1]=4 853 B8R0.4 C=CCCCCCCO MCULE-8561904793 [2,0,0,0,0,0|0,0,2]=4 854 B8R0.4 C=CCCCCCNC MCULE-9487840122 [2,0,0,0,0,0|1,0,1]=4 855 B8R0.4 CC=CCCCCCC MCULE-2766900913 [2,0,0,0,0,0|1,0,1]=4 856 B8R0.4 CCC=CCCCCO MCULE-2496486842 [2,0,0,0,0,0|0,0,2]=4 857 B8R0.4 CCCC/C=C\CCO MCULE-5021089657 [2,0,0,0,0,0|0,0,2]=4 858 B8R0.4 CCCCBCCCC MCULE-3163100787 [2,0,0,0,0,0|1,0,1]=4 859 B8R0.4 CCCCBCCCC MCULE-6578781762 [2,0,0,0,0,0|1,0,1]=4 860 B8R0.4 CCCCC#CCCO MCULE-6156677538 [2,0,0,0,0,0|0,0,2]=4 861 B8R0.4 CCCCC/C=C/C=O MCULE-9410244042 [2,0,0,0,0,0|0,0,2]=4 862 B8R0.4 CCCCC/C=C/CO MCULE-2538979274 [2,0,0,0,0,0|0,0,2]=4 863 B8R0.4 CCCCC=CCCO MCULE-5187523035 [2,0,0,0,0,0|0,0,2]=4 864 B8R0.4 CCCCCC#CC=O MCULE-6367130572 [2,0,0,0,0,0|0,0,2]=4 865 B8R0.4 CCCCCC#CCO MCULE-5966258062 [2,0,0,0,0,0|0,0,2]=4 866 B8R0.4 CCCCCC=CC=O MCULE-7640230490 [2,0,0,0,0,0|0,0,2]=4 867 B8R0.4 CCCCCC=CCO MCULE-7026544339 [2,0,0,0,0,0|0,0,2]=4 868 B8R0.4 CCCCCCC=CI MCULE-3614174427 [2,0,0,0,0,0|1,0,1]=4 869 B8R0.4 CCCCCCCC#N MCULE-3399476727 [2,0,0,0,0,0|1,0,1]=4 870 B8R0.4 CCCCCCCC=O MCULE-7111365457 [2,0,0,0,0,0|0,0,0]=2 871 B8R0.4 CCCCCCCCBr MCULE-7484248707 [2,0,0,0,0,0|1,0,0]=3 872 B8R0.4 CCCCCCCCC MCULE-1865327912 [2,0,0,0,0,0|0,0,1]=3 873 B8R0.4 CCCCCCCCCl MCULE-5953637232 [2,0,0,0,0,0|1,0,0]=3 874 B8R0.4 CCCCCCCCF MCULE-5641912511 [2,0,0,0,0,0|1,0,0]=3 875 B8R0.4 CCCCCCCCI MCULE-7304806902 [2,0,0,0,0,0|1,0,0]=3 876 B8R0.4 CCCCCCCCN MCULE-6095227778 [2,0,0,0,0,0|1,0,0]=3 877 B8R0.4 CCCCCCCCN MCULE-7012389700 [2,0,0,0,0,0|1,0,0]=3 878 B8R0.4 CCCCCCCCN MCULE-7076053015 [2,0,0,0,0,0|1,0,0]=3 879 B8R0.4 CCCCCCCCO MCULE-2656577895 [2,0,0,0,0,0|0,0,0]=2 880 B8R0.4 CCCCCCCCS MCULE-5212273874 [2,0,0,0,0,0|0,1,0]=3 881 B8R0.4 CCCCCCCNC MCULE-1143610772 [2,0,0,0,0,0|1,0,1]=4 882 B8R0.4 CCCCCCCNN MCULE-7800659587 [2,0,0,0,0,0|2,0,0]=4 883 B8R0.4 CCCCCCCON MCULE-6380236924 [2,0,0,0,0,0|2,0,0]=4 884 B8R0.4 CCCCCCCON MCULE-6581043184 [2,0,0,0,0,0|2,0,0]=4 885 B8R0.4 CCCCCCCSC MCULE-5211260102 [2,0,0,0,0,0|1,0,1]=4 886 B8R0.4 CCCCCCN=C=O MCULE-6808788959 [2,0,0,0,0,0|1,0,1]=4 887 B8R0.4 CCCCCCNC=O MCULE-3719637754 [2,0,0,0,0,0|1,0,0]=3 888 B8R0.4 CCCCCCOC=O MCULE-1329787181 [2,0,0,0,0,0|1,0,0]=3 889 B8R0.4 CCCCCCON=O MCULE-9048754026 [2,0,0,0,0,0|2,0,0]=4 890 B8R0.4 CCCCCCSCC MCULE-1449428108 [2,0,0,0,0,0|1,0,1]=4 891 B8R0.4 CCCCCNCCC MCULE-7697830316 [2,0,0,0,0,0|1,0,1]=4 892 B8R0.4 CCCCCNCCN MCULE-5873419228 [2,0,0,0,0,0|2,0,0]=4 893 B8R0.4 CCCCCNCCO MCULE-7662965930 [2,0,0,0,0,0|1,0,0]=3 894 B8R0.4 CCCCCOCCO MCULE-3393695257 [2,0,0,0,0,0|1,0,0]=3 895 B8R0.4 CCCCCSCCCl MCULE-7680431310 [2,0,0,0,0,0|2,0,0]=4 896 B8R0.4 CCCCCSCCO MCULE-1239137782 [2,0,0,0,0,0|1,0,0]=3 897 B8R0.4 CCCCNCCCC MCULE-1338595384 [2,0,0,0,0,0|1,0,1]=4 898 B8R0.4 CCCCNCCCC MCULE-4720016177 [2,0,0,0,0,0|1,0,1]=4 899 B8R0.4 CCCCNCCCC MCULE-6002936904 [2,0,0,0,0,0|1,0,1]=4 900 B8R0.4 CCCCNCCCC MCULE-8673755112 [2,0,0,0,0,0|1,0,1]=4 901 B8R0.4 CCCCNCCCCl MCULE-6595599220 [2,0,0,0,0,0|2,0,0]=4 902 B8R0.4 CCCCNCCCCl MCULE-8225115019 [2,0,0,0,0,0|2,0,0]=4 903 B8R0.4 CCCCNCCCN MCULE-6098022466 [2,0,0,0,0,0|2,0,0]=4 904 B8R0.4 CCCCNCCCO MCULE-7171357018 [2,0,0,0,0,0|1,0,0]=3 905 B8R0.4 CCCCOCCCC MCULE-8568026186 [2,0,0,0,0,0|1,0,1]=4 906 B8R0.4 CCCCOCCCN MCULE-2107763231 [2,0,0,0,0,0|2,0,0]=4 907 B8R0.4 CCCCOCCCO MCULE-2797403638 [2,0,0,0,0,0|1,0,0]=3 908 B8R0.4 CCCCSCCCC MCULE-3121918458 [2,0,0,0,0,0|1,0,1]=4 909 B8R0.4 CCCCSCCCN MCULE-6519812920 [2,0,0,0,0,0|2,0,0]=4 910 B8R0.4 CCCC[NH2+]CCCC MCULE-4333811997 [2,0,0,0,0,0|1,0,1]=4 911 B8R0.4 CCCC[NH2+]CCCC MCULE-8030655880 [2,0,0,0,0,0|1,0,1]=4 912 B8R0.4 CCCNCCCCN MCULE-1576152293 [2,0,0,0,0,0|2,0,0]=4 913 B8R0.4 CCCNCCCCN MCULE-2764845788 [2,0,0,0,0,0|2,0,0]=4 914 B8R0.4 CCCSCCCCN MCULE-7923615539 [2,0,0,0,0,0|2,0,0]=4 915 B8R0.4 CCNCCCCCN MCULE-1094310455 [2,0,0,0,0,0|2,0,0]=4 916 B8R0.4 CCNCCOCCO MCULE-3581305931 [2,0,0,0,0,0|2,0,0]=4 917 B8R0.4 CCOCCOCC=O MCULE-4431979706 [2,0,0,0,0,0|2,0,0]=4 918 B8R0.4 CCOCCOCCO MCULE-8940886567 [2,0,0,0,0,0|2,0,0]=4 919 B8R0.4 CCSCCOCCO MCULE-6785870605 [2,0,0,0,0,0|2,0,0]=4 920 B8R0.4 CNCCCCCCN MCULE-3241182046 [2,0,0,0,0,0|2,0,0]=4 921 B8R0.4 CNCCCCCCO MCULE-2582847385 [2,0,0,0,0,0|1,0,0]=3 922 B8R0.4 COCCCCCCBr MCULE-8590853100 [2,0,0,0,0,0|2,0,0]=4 923 B8R0.4 COCCCCCCO MCULE-5454628686 [2,0,0,0,0,0|1,0,0]=3 924 B8R0.4 COCCCNCCO MCULE-3069731145 [2,0,0,0,0,0|2,0,0]=4 925 B8R0.4 COCCCOCCO MCULE-7280677606 [2,0,0,0,0,0|2,0,0]=4 926 B8R0.4 COCCNCCCO MCULE-9359795449 [2,0,0,0,0,0|2,0,0]=4 927 B8R0.4 COCCOCCC=O MCULE-4095630051 [2,0,0,0,0,0|2,0,0]=4 928 B8R0.4 COCCOCCCO MCULE-7732325457 [2,0,0,0,0,0|2,0,0]=4 929 B8R0.4 CSCCCCCCN MCULE-3785645703 [2,0,0,0,0,0|2,0,0]=4 930 B8R0.4 CSCCCCCCO MCULE-1590282643 [2,0,0,0,0,0|1,0,0]=3 931 B8R0.4 ClCCCCCCCBr MCULE-6518226792 [2,0,0,0,0,0|2,0,0]=4 932 B8R0.4 ClCCCCCCCCl MCULE-9270407250 [2,0,0,0,0,0|2,0,0]=4 933 B8R0.4 NCCCCCCCBr MCULE-2103124315 [2,0,0,0,0,0|2,0,0]=4 934 B8R0.4 NCCCCCCCBr MCULE-9591138313 [2,0,0,0,0,0|2,0,0]=4 935 B8R0.4 NCCCCCCCN MCULE-3408586405 [2,0,0,0,0,0|2,0,0]=4 936 B8R0.4 NCCCCCCCO MCULE-6098435698 [2,0,0,0,0,0|1,0,0]=3 937 B8R0.4 NCCCCCCCO MCULE-8352830275 [2,0,0,0,0,0|1,0,0]=3 938 B8R0.4 NCCCCNCCO MCULE-5679490980 [2,0,0,0,0,0|2,0,0]=4 939 B8R0.4 NCCCNCCCO MCULE-1085206494 [2,0,0,0,0,0|2,0,0]=4 940 B8R0.4 NCCCOCCCO MCULE-9489688996 [2,0,0,0,0,0|2,0,0]=4 941 B8R0.4 NCCNCCCCO MCULE-1668134399 [2,0,0,0,0,0|2,0,0]=4 942 B8R0.4 NCCNCCCCO MCULE-8060063829 [2,0,0,0,0,0|2,0,0]=4 943 B8R0.4 O=CCCCCCC=O MCULE-7016999051 [2,0,0,0,0,0|1,0,1]=4 944 B8R0.4 O=CCCCCCCBr MCULE-3046622133 [2,0,0,0,0,0|1,0,0]=3 945 B8R0.4 OCCCCCCCBr MCULE-2559114853 [2,0,0,0,0,0|1,0,0]=3 946 B8R0.4 OCCCCCCCCl MCULE-4143586059 [2,0,0,0,0,0|1,0,0]=3 947 B8R0.4 OCCCCCCCI MCULE-3420024644 [2,0,0,0,0,0|1,0,0]=3 948 B8R0.4 OCCCCCCCO MCULE-1201837142 [2,0,0,0,0,0|1,0,0]=3 949 B8R0.4 OCCCNCCCO MCULE-1813882908 [2,0,0,0,0,0|2,0,0]=4 950 B8R0.4 OCCCNCCCO MCULE-4567401301 [2,0,0,0,0,0|2,0,0]=4 951 B8R0.4 OCCCOCCCCl MCULE-9999003892 [2,0,0,0,0,0|2,0,0]=4 952 B8R0.4 OCCCOCCCO MCULE-2894245516 [2,0,0,0,0,0|2,0,0]=4 953 B8R0.4 OCCCSCCCO MCULE-2025331376 [2,0,0,0,0,0|2,0,0]=4 954 B8R0.7 C#CCCCCC(=O)O MCULE-5828767633 [2,0,0,0,0,0|0,0,2]=4 955 B8R0.7 C=C(Br)CCCCCC MCULE-3502674829 [2,0,0,0,0,0|2,0,0]=4 956 B8R0.7 C=C(C)CCCCCC MCULE-2243788093 [2,0,0,0,0,0|2,0,0]=4 957 B8R0.7 C=C(Cl)CCCCCC MCULE-4545659103 [2,0,0,0,0,0|2,0,0]=4 958 B8R0.7 C=CCCCCC(=O)O MCULE-1991116122 [2,0,0,0,0,0|0,0,2]=4 959 B8R0.7 CC#CCCCC(=O)O MCULE-2531382210 [2,0,0,0,0,0|0,0,2]=4 960 B8R0.7 CC(=O)CCCCCBr MCULE-8946921118 [2,0,0,0,0,0|2,0,0]=4 961 B8R0.7 CC(=O)CCCCCN MCULE-3568024595 [2,0,0,0,0,0|2,0,0]=4 962 B8R0.7 CC(=O)CCCCCN MCULE-9938894581 [2,0,0,0,0,0|2,0,0]=4 963 B8R0.7 CC=CCCCC(=O)O MCULE-3300087433 [2,0,0,0,0,0|0,0,2]=4 964 B8R0.7 CCCC/C=C/C(=O)O MCULE-6916224344 [2,0,0,0,0,0|0,0,2]=4 965 B8R0.7 CCCC=CCC(=O)O MCULE-3879649411 [2,0,0,0,0,0|0,0,2]=4 966 B8R0.7 CCCCC#CC(=O)O MCULE-4160128187 [2,0,0,0,0,0|0,0,2]=4 967 B8R0.7 CCCCC=CC(=O)O MCULE-6837768730 [2,0,0,0,0,0|0,0,2]=4 968 B8R0.7 CCCCCCB(O)O MCULE-6503959495 [2,0,0,0,0,0|1,0,1]=4 969 B8R0.7 CCCCCCC(=O)C MCULE-1152821440 [2,0,0,0,0,0|1,0,0]=3 970 B8R0.7 CCCCCCC(=O)Cl MCULE-8559884798 [2,0,0,0,0,0|1,0,0]=3 971 B8R0.7 CCCCCCC(=O)N MCULE-1210996881 [2,0,0,0,0,0|1,0,0]=3 972 B8R0.7 CCCCCCC(=O)O MCULE-1489137568 [2,0,0,0,0,0|0,0,0]=2 973 B8R0.7 CCCCCCC(=O)[O-] MCULE-1711655800 [2,0,0,0,0,0|0,0,1]=3 974 B8R0.7 CCCCCCC(C)O MCULE-4635370769 [2,0,0,0,0,0|1,0,1]=4 975 B8R0.7 CCCCCCC(C)O MCULE-5095200181 [2,0,0,0,0,0|1,0,1]=4 976 B8R0.7 CCCCCCN(=O)=O MCULE-8283658415 [2,0,0,0,0,0|1,0,1]=4 977 B8R0.7 CCCCCC[C@@H](C)O MCULE-5245235461 [2,0,0,0,0,0|1,0,1]=4 978 B8R0.7 CCCCCC[C@@H](C)O MCULE-8537503782 [2,0,0,0,0,0|1,0,1]=4 979 B8R0.7 CCCCCC[C@H](C)O MCULE-2655815413 [2,0,0,0,0,0|1,0,1]=4 980 B8R0.7 CCCCCC[C@H](C)O MCULE-7784149103 [2,0,0,0,0,0|1,0,1]=4 981 B8R0.7 CCCCCNC(=O)N MCULE-3139270247 [2,0,0,0,0,0|2,0,0]=4 982 B8R0.7 CCCCCOC(=O)C MCULE-4911325533 [2,0,0,0,0,0|2,0,0]=4 983 B8R0.7 CCCCCOC(=O)Cl MCULE-2896207255 [2,0,0,0,0,0|2,0,0]=4 984 B8R0.7 CCCCNCC(=O)N MCULE-1276341431 [2,0,0,0,0,0|2,0,0]=4 985 B8R0.7 CCCCNCC(=O)N MCULE-6579402071 [2,0,0,0,0,0|2,0,0]=4 986 B8R0.7 CCCCNCC(=O)O MCULE-4725221957 [2,0,0,0,0,0|1,0,0]=3 987 B8R0.7 CCCCOCC(=O)O MCULE-9634255761 [2,0,0,0,0,0|1,0,0]=3 988 B8R0.7 CCCCSCC(=O)O MCULE-3580384865 [2,0,0,0,0,0|1,0,0]=3 989 B8R0.7 CCCNCCC(=O)N MCULE-2654608736 [2,0,0,0,0,0|2,0,0]=4 990 B8R0.7 CCCNCCC(=O)N MCULE-2683588523 [2,0,0,0,0,0|2,0,0]=4 991 B8R0.7 CCCNCCC(=O)O MCULE-3144740259 [2,0,0,0,0,0|1,0,0]=3 992 B8R0.7 CCCNCCC(=O)O MCULE-3866165037 [2,0,0,0,0,0|1,0,0]=3 993 B8R0.7 CCCOCCC(=O)O MCULE-1927238608 [2,0,0,0,0,0|1,0,0]=3 994 B8R0.7 CCCSCCC(=O)O MCULE-6454518290 [2,0,0,0,0,0|1,0,0]=3 995 B8R0.7 CCNCCCC(=O)O MCULE-7019386199 [2,0,0,0,0,0|1,0,0]=3 996 B8R0.7 CCNCCCC(=O)O MCULE-8568253592 [2,0,0,0,0,0|1,0,0]=3 997 B8R0.7 CCOCCCC(=O)O MCULE-9064011886 [2,0,0,0,0,0|1,0,0]=3 998 B8R0.7 CNCCCCC(=O)O MCULE-4298567521 [2,0,0,0,0,0|1,0,0]=3 999 B8R0.7 CNCCCCC(=O)O MCULE-5688320983 [2,0,0,0,0,0|1,0,0]=3 1000 B8R0.7 CNCCOCC(=O)O MCULE-5408672373 [2,0,0,0,0,0|2,0,0]=4 1001 B8R0.7 COCCCCC(=O)O MCULE-1268596288 [2,0,0,0,0,0|1,0,0]=3 1002 B8R0.7 COCCNCC(=O)O MCULE-2703110743 [2,0,0,0,0,0|2,0,0]=4 1003 B8R0.7 COCCNCC(=O)O MCULE-5854004501 [2,0,0,0,0,0|2,0,0]=4 1004 B8R0.7 COCCOCC(=O)O MCULE-2561278418 [2,0,0,0,0,0|2,0,0]=4 1005 B8R0.7 COCCSCC(=O)O MCULE-2908610834 [2,0,0,0,0,0|2,0,0]=4 1006 B8R0.7 CSCCCCC(=O)O MCULE-4498129620 [2,0,0,0,0,0|1,0,0]=3 1007 B8R0.7 CSCCNCC(=O)O MCULE-1747724833 [2,0,0,0,0,0|2,0,0]=4 1008 B8R0.7 CSCCNCC(=O)O MCULE-9991325079 [2,0,0,0,0,0|2,0,0]=4 1009 B8R0.7 CSCCOCC(=O)O MCULE-2038020159 [2,0,0,0,0,0|2,0,0]=4 1010 B8R0.7 CSSCCCC(=O)O MCULE-7947744639 [2,0,0,0,0,0|2,0,0]=4 1011 B8R0.7 N#CCCCCC(=O)O MCULE-1900756226 [2,0,0,0,0,0|1,0,1]=4 1012 B8R0.7 NC(=O)CCCCCBr MCULE-6938202710 [2,0,0,0,0,0|2,0,0]=4 1013 B8R0.7 NC(=O)CCCCCO MCULE-2654184294 [2,0,0,0,0,0|2,0,0]=4 1014 B8R0.7 NCCCCCC(=O)N MCULE-1692086577 [2,0,0,0,0,0|2,0,0]=4 1015 B8R0.7 NCCCCCC(=O)N MCULE-2191237198 [2,0,0,0,0,0|2,0,0]=4 1016 B8R0.7 NCCCCCC(=O)O MCULE-3640363033 [2,0,0,0,0,0|1,0,0]=3 1017 B8R0.7 NCCCCCC(=O)O MCULE-6389520144 [2,0,0,0,0,0|1,0,0]=3 1018 B8R0.7 NCCCCCC(=O)[O-] MCULE-7336458907 [2,0,0,0,0,0|1,0,1]=4 1019 B8R0.7 NCCCNCC(=O)O MCULE-6526080048 [2,0,0,0,0,0|2,0,0]=4 1020 B8R0.7 NCCCNCC(=O)O MCULE-6762903438 [2,0,0,0,0,0|2,0,0]=4 1021 B8R0.7 NCCCOCC(=O)O MCULE-6428539436 [2,0,0,0,0,0|2,0,0]=4 1022 B8R0.7 NCCNCCC(=O)O MCULE-6596967912 [2,0,0,0,0,0|2,0,0]=4 1023 B8R0.7 NCCOCCC(=O)O MCULE-8535110656 [2,0,0,0,0,0|2,0,0]=4 1024 B8R0.7 NCCOCCC(=O)O MCULE-9124828795 [2,0,0,0,0,0|2,0,0]=4 1025 B8R0.7 NCCSCCC(=O)O MCULE-5309234181 [2,0,0,0,0,0|2,0,0]=4 1026 B8R0.7 NOCCCCC(=O)O MCULE-2022616022 [2,0,0,0,0,0|2,0,0]=4 1027 B8R0.7 NOCCCCC(=O)O MCULE-9375312454 [2,0,0,0,0,0|2,0,0]=4 1028 B8R0.7 O=C(Cl)CCCCCBr MCULE-4314610726 [2,0,0,0,0,0|2,0,0]=4 1029 B8R0.7 O=C(Cl)CCCCCCl MCULE-4526081631 [2,0,0,0,0,0|2,0,0]=4 1030 B8R0.7 O=C(O)CCCCCBr MCULE-2086088700 [2,0,0,0,0,0|1,0,0]=3 1031 B8R0.7 O=C(O)CCCCCCl MCULE-3419329115 [2,0,0,0,0,0|1,0,0]=3 1032 B8R0.7 O=C(O)CCCCCF MCULE-6736431365 [2,0,0,0,0,0|1,0,0]=3 1033 B8R0.7 O=C(O)CCCCCO MCULE-9202536119 [2,0,0,0,0,0|1,0,0]=3 1034 B8R0.7 O=C(O)CCCCCS MCULE-1414350107 [2,0,0,0,0,0|1,0,0]=3 1035 B8R0.7 O=C(O)CCNCCO MCULE-6594831168 [2,0,0,0,0,0|2,0,0]=4 1036 B8R0.7 O=C(O)CCOCCBr MCULE-8991363781 [2,0,0,0,0,0|2,0,0]=4 1037 B8R0.7 O=C(O)CCOCCO MCULE-7271806926 [2,0,0,0,0,0|2,0,0]=4 1038 B8R0.7 O=C(O)CCOCCS MCULE-2136117046 [2,0,0,0,0,0|2,0,0]=4 1039 B8R0.7 O=C(O)CCSCCO MCULE-4689447674 [2,0,0,0,0,0|2,0,0]=4 1040 B8R0.7 O=C(O)COCCCBr MCULE-2393807719 [2,0,0,0,0,0|2,0,0]=4 1041 B8R0.7 O=C([O-])CCCCCCl MCULE-7341419838 [2,0,0,0,0,0|1,0,1]=4 1042 B8R0.7 O=C([O-])CCCCCO MCULE-5897469112 [2,0,0,0,0,0|1,0,1]=4 1043 B8R0.7 O=C([O-])CCCCCO MCULE-9397608140 [2,0,0,0,0,0|1,0,1]=4 1044 B8R0.7 O=CCCCCC(=O)O MCULE-8762346998 [2,0,0,0,0,0|1,0,1]=4 1045 B10R0.3 CCCC(=O)CCCC(=O)O MCULE-5554652459 [1,1,0,0,0,0|0,0,1]=3 1046 B10R0.3 CCCC(=O)NCCC(=O)O MCULE-9942655490 [1,1,0,0,0,0|1,0,1]=4 1047 B10R0.3 CCCC(C)CCCC(=O)C MCULE-6836595014 [1,1,0,0,0,0|1,0,0]=3 1048 B10R0.3 CCCC(C)CCCC(=O)O MCULE-9813732292 [1,1,0,0,0,0|0,0,0]=2 1049 B10R0.3 CCCC(C)CCOC(=O)C MCULE-7488303006 [1,1,0,0,0,0|2,0,0]=4 1050 B10R0.3 CCCC(O)CCCC(=O)O MCULE-6567242953 [1,1,0,0,0,0|0,0,0]=2 1051 B10R0.3 CCCC(S)CCOC(=O)C MCULE-9110387170 [1,1,0,0,0,0|2,0,0]=4 1052 B10R0.3 CCNC(=O)CCCC(=O)O MCULE-4769569674 [1,1,0,0,0,0|1,0,1]=4 1053 B10R0.3 CCOC(=O)CCCC(=O)O MCULE-2798972740 [1,1,0,0,0,0|1,0,1]=4 1054 B10R0.6 C=C(C)CC(C)CCCCC MCULE-9311251673 [1,1,0,0,0,0|2,0,0]=4 1055 B10R0.6 CCCCCC(=O)CC(=O)C MCULE-8236892696 [1,1,0,0,0,0|1,0,1]=4 1056 B10R0.6 CCCCCC(C)CC(=O)C MCULE-9366517192 [1,1,0,0,0,0|1,0,0]=3 1057 B10R0.6 CCCCCC(C)CC(=O)O MCULE-2066533125 [1,1,0,0,0,0|0,0,0]=2 1058 B10R0.6 CCCCCC(C)OC(=O)Cl MCULE-6347220296 [1,1,0,0,0,0|2,0,0]=4 1059 B10R0.6 CCCCCC(N)CC(=O)O MCULE-1332766356 [1,1,0,0,0,0|0,0,0]=2 1060 B10R0.6 CCCCCC(N)CC(=O)O MCULE-6217126659 [1,1,0,0,0,0|0,0,0]=2 1061 B10R0.6 CCCCCC(O)CC(=O)O MCULE-4825961688 [1,1,0,0,0,0|0,0,0]=2 1062 B10R0.6 CCCCC[C@@H](O)CC(=O)O MCULE-2570880673 [1,1,0,0,0,0|0,0,0]=2 1063 B10R0.6 CCCCC[C@H](O)CC(=O)O MCULE-3222730819 [1,1,0,0,0,0|0,0,0]=2 1064 B10R0.6 CCCCC[C@H](O)CC(=O)O MCULE-6407518730 [1,1,0,0,0,0|0,0,0]=2 1065 B10R0.6 NCCCC[C@H](N)CC(=O)O MCULE-4895569973 [1,1,0,0,0,0|1,0,0]=3 1066 B10R0.6 NCCCC[C@H](N)CC(=O)O MCULE-7821167225 [1,1,0,0,0,0|1,0,0]=3 1067 B10R0.6 NCCCC[C@H](N)CC(=O)O MCULE-8763571530 [1,1,0,0,0,0|1,0,0]=3 1068 B10R0.6 NCCCC[C@H](N)CC(=O)O MCULE-9870503005 [1,1,0,0,0,0|1,0,0]=3 1069 B10R0.22 CCCCCCCP(=O)(O)O MCULE-4624203907 [1,1,0,0,0,0|1,0,0]=3 1070 B10R0.22 CCCCCCCS(=O)(=O)Cl MCULE-4147478359 [1,1,0,0,0,0|1,0,1]=4 1071 B10R0.22 CCCCCCCS(=O)(=O)[O-] MCULE-3145802067 [1,1,0,0,0,0|1,0,1]=4 1072 B10R0.22 CCCCCCCS(=O)(=O)[O-] MCULE-5993854541 [1,1,0,0,0,0|1,0,1]=4 1073 B10R0.22 CCCCNCCS(=O)(=O)O MCULE-8200198538 [1,1,0,0,0,0|2,0,0]=4 1074 B10R0.22 NCCCCCCS(=O)(=O)O MCULE-3506394412 [1,1,0,0,0,0|2,0,0]=4 1075 B10R0.22 O=P(O)(O)CCCCCCBr MCULE-1779770763 [1,1,0,0,0,0|2,0,0]=4 1076 B10R0.55 CCC(=O)CCCCC(=O)O MCULE-8497826453 [1,1,0,0,0,0|0,0,1]=3 1077 B10R0.55 CCC(=O)NCCCC(=O)O MCULE-4434353680 [1,1,0,0,0,0|1,0,1]=4 1078 B10R0.55 CCC(C)CCCCC(=O)O MCULE-5735580085 [1,1,0,0,0,0|0,0,0]=2 1079 B10R0.55 CNC(=O)CCCCC(=O)O MCULE-3369426299 [1,1,0,0,0,0|1,0,1]=4 1080 B10R0.55 COC(=O)CCCCC(=O)O MCULE-2104484744 [1,1,0,0,0,0|1,0,1]=4 1081 B10R0.74 C#CCCCCCC(=O)OC MCULE-3816855542 [1,1,0,0,0,0|0,0,2]=4 1082 B10R0.74 C=CC(=O)OCCCCCC MCULE-5221212930 [1,1,0,0,0,0|2,0,0]=4 1083 B10R0.74 C=CC(O)CCCCCCC MCULE-2034118054 [1,1,0,0,0,0|1,0,1]=4 1084 B10R0.74 CCCCC/C=C/C(=O)OC MCULE-1812424019 [1,1,0,0,0,0|0,0,2]=4 1085 B10R0.74 CCCCCC#CC(=O)OC MCULE-8436103758 [1,1,0,0,0,0|0,0,2]=4 1086 B10R0.74 CCCCCC=CC(=O)OC MCULE-3787684558 [1,1,0,0,0,0|0,0,2]=4 1087 B10R0.74 CCCCCCCC(=O)CC MCULE-3418685291 [1,1,0,0,0,0|1,0,0]=3 1088 B10R0.74 CCCCCCCC(=O)NN MCULE-6629350924 [1,1,0,0,0,0|1,0,0]=3 1089 B10R0.74 CCCCCCCC(=O)NO MCULE-2604662374 [1,1,0,0,0,0|0,0,0]=2 1090 B10R0.74 CCCCCCCC(=O)N[O-] MCULE-1745709791 [1,1,0,0,0,0|0,0,1]=3 1091 B10R0.74 CCCCCCCC(=O)N[O-] MCULE-4610313780 [1,1,0,0,0,0|0,0,1]=3 1092 B10R0.74 CCCCCCCC(=O)OC MCULE-9368782203 [1,1,0,0,0,0|0,0,0]=2 1093 B10R0.74 CCCCCCCC(C)C=O MCULE-6740449093 [1,1,0,0,0,0|1,0,1]=4 1094 B10R0.74 CCCCCCCC(O)CC MCULE-5420300699 [1,1,0,0,0,0|1,0,1]=4 1095 B10R0.74 CCCCCCCC(O)CO MCULE-4511310759 [1,1,0,0,0,0|0,0,2]=4 1096 B10R0.74 CCCCCCNC(=O)CCl MCULE-9418401258 [1,1,0,0,0,0|2,0,0]=4 1097 B10R0.74 CCCCCCOC(=O)CC MCULE-7750085667 [1,1,0,0,0,0|2,0,0]=4 1098 B10R0.74 CCCCCCOC(=O)CCl MCULE-7320709801 [1,1,0,0,0,0|2,0,0]=4 1099 B10R0.74 CCCCCCOC(=O)CN MCULE-5357348178 [1,1,0,0,0,0|2,0,0]=4 1100 B10R0.74 CCCCCCOC(=O)CS MCULE-4845823799 [1,1,0,0,0,0|1,1,0]=4 1101 B10R0.74 CCCCCCOC(=O)C[NH3+] MCULE-4114261473 [1,1,0,0,0,0|2,0,0]=4 1102 B10R0.74 CCOCCSCC(=O)OC MCULE-6906722616 [1,1,0,0,0,0|2,0,0]=4 1103 B10R0.74 COC(=O)CCCCCC=O MCULE-1071696685 [1,1,0,0,0,0|1,0,1]=4 1104 B10R0.74 COC(=O)CCCCCCBr MCULE-5801566678 [1,1,0,0,0,0|1,0,0]=3 1105 B10R0.74 COC(=O)CCCCCCI MCULE-5629338002 [1,1,0,0,0,0|1,0,0]=3 1106 B10R0.74 COC(=O)CCCCCCN MCULE-3174162228 [1,1,0,0,0,0|1,0,0]=3 1107 B10R0.74 COC(=O)CCCCCCN MCULE-7552954472 [1,1,0,0,0,0|1,0,0]=3 1108 B10R0.74 COC(=O)CCCCCCO MCULE-1234987175 [1,1,0,0,0,0|1,0,0]=3 1109 B10R0.74 COC(=O)CCNCCCO MCULE-4138256366 [1,1,0,0,0,0|2,0,0]=4 1110 B10R0.74 COC(=O)CCOCCCO MCULE-5017264772 [1,1,0,0,0,0|2,0,0]=4 1111 B10R0.74 COCCNCCC(=O)OC MCULE-2355570615 [1,1,0,0,0,0|2,0,0]=4 1112 B10R0.74 COCCOCCC(=O)OC MCULE-5131212223 [1,1,0,0,0,0|2,0,0]=4 1113 B10R0.74 NNC(=O)CCCCCCCl MCULE-4836054847 [1,1,0,0,0,0|2,0,0]=4 1114 B10R0.75 C=CCCCCC(N)C(=O)O MCULE-9003674294 [1,1,0,0,0,0|0,0,2]=4 1115 B10R0.75 C=CCCCC[C@@H](N)C(=O)O MCULE-5424595854 [1,1,0,0,0,0|0,0,2]=4 1116 B10R0.75 C=CCCCC[C@@H](N)C(=O)O MCULE-7894205841 [1,1,0,0,0,0|0,0,2]=4 1117 B10R0.75 C=CCCCC[C@H](N)C(=O)O MCULE-6386840550 [1,1,0,0,0,0|0,0,2]=4 1118 B10R0.75 C=CCCCC[C@H](N)C(=O)O MCULE-8206632491 [1,1,0,0,0,0|0,0,2]=4 1119 B10R0.75 CCCCCCC(Br)C(=O)Br MCULE-8391154868 [1,1,0,0,0,0|1,0,0]=3 1120 B10R0.75 CCCCCCC(Br)C(=O)O MCULE-3532642872 [1,1,0,0,0,0|0,0,0]=2 1121 B10R0.75 CCCCCCC(C)C(=O)C MCULE-2296587993 [1,1,0,0,0,0|1,0,0]=3 1122 B10R0.75 CCCCCCC(C)C(=O)Cl MCULE-4801747974 [1,1,0,0,0,0|1,0,0]=3 1123 B10R0.75 CCCCCCC(C)C(=O)O MCULE-6664640382 [1,1,0,0,0,0|0,0,0]=2 1124 B10R0.75 CCCCCCC(F)C(=O)O MCULE-3865739259 [1,1,0,0,0,0|0,0,0]=2 1125 B10R0.75 CCCCCCC(N)C(=O)O MCULE-2527731470 [1,1,0,0,0,0|0,0,0]=2 1126 B10R0.75 CCCCCCC(N)C(=O)O MCULE-5498377990 [1,1,0,0,0,0|0,0,0]=2 1127 B10R0.75 CCCCCCC(O)C(=O)O MCULE-1679305682 [1,1,0,0,0,0|0,0,0]=2 1128 B10R0.75 CCCCCC[C@@H](N)C(=O)O MCULE-9163680563 [1,1,0,0,0,0|0,0,0]=2 1129 B10R0.75 CCCCCC[C@@H](N)C(=O)O MCULE-9959237270 [1,1,0,0,0,0|0,0,0]=2 1130 B10R0.75 CCCCCC[C@H](N)C(=O)O MCULE-6660531044 [1,1,0,0,0,0|0,0,0]=2 1131 B10R0.75 CCCCCC[C@H](N)C(=O)O MCULE-7151037911 [1,1,0,0,0,0|0,0,0]=2 1132 B10R0.75 CCCCSC[C@@H](N)C(=O)O MCULE-8737283640 [1,1,0,0,0,0|1,0,0]=3 1133 B10R0.75 CCCCSC[C@H](N)C(=O)O MCULE-5383064231 [1,1,0,0,0,0|1,0,0]=3 1134 B10R0.75 CCOCCOC(C)C(=O)O MCULE-1855650459 [1,1,0,0,0,0|2,0,0]=4 1135 B10R0.75 CNCCCCC(N)C(=O)O MCULE-5703952072 [1,1,0,0,0,0|1,0,0]=3 1136 B10R0.75 CNCCCCC(N)C(=O)O MCULE-8267439974 [1,1,0,0,0,0|1,0,0]=3 1137 B10R0.75 CNCCCC[C@H](N)C(=O)O MCULE-4130643324 [1,1,0,0,0,0|1,0,0]=3 1138 B10R0.75 CNCCCC[C@H](N)C(=O)O MCULE-5394599260 [1,1,0,0,0,0|1,0,0]=3 1139 B10R0.75 CNCCCC[C@H](N)C(=O)O MCULE-6328038825 [1,1,0,0,0,0|1,0,0]=3 1140 B10R0.75 CNCCCC[C@H](N)C(=O)O MCULE-6736060504 [1,1,0,0,0,0|1,0,0]=3 1141 B10R0.75 COCCSCC(N)C(=O)O MCULE-1808987613 [1,1,0,0,0,0|2,0,0]=4 1142 B10R0.75 NC(CSCCCO)C(=O)O MCULE-6250464318 [1,1,0,0,0,0|2,0,0]=4 1143 B10R0.75 NCCCCC[C@@H](N)C(=O)O MCULE-7846811170 [1,1,0,0,0,0|1,0,0]=3 1144 B10R0.75 NCCCCC[C@@H](N)C(=O)O MCULE-8562914837 [1,1,0,0,0,0|1,0,0]=3 1145 B10R0.75 NCCCCC[C@H](N)C(=O)O MCULE-4522889843 [1,1,0,0,0,0|1,0,0]=3 1146 B10R0.75 NCCCCC[C@H](N)C(=O)O MCULE-9026496023 [1,1,0,0,0,0|1,0,0]=3 1147 B10R0.75 NCCCSC[C@H](N)C(=O)O MCULE-9670718396 [1,1,0,0,0,0|2,0,0]=4 1148 B10R0.75 NCCC[Se]C[C@H](N)C(=O)O MCULE-4318104451 [1,1,0,0,0,0|2,0,0]=4 1149 B10R0.75 N[C@@H](CCSCCO)C(=O)O MCULE-2974080305 [1,1,0,0,0,0|2,0,0]=4 1150 B10R0.75 N[C@@H](CSCCCO)C(=O)O MCULE-1323141415 [1,1,0,0,0,0|2,0,0]=4 1151 B10R0.75 N[C@@H](CSCCCO)C(=O)O MCULE-8256841743 [1,1,0,0,0,0|2,0,0]=4 1152 B10R0.75 O=C(O)C(=O)CCCCCCl MCULE-5263490690 [1,1,0,0,0,0|1,0,1]=4 1153 B10R0.78 CCCCC(=O)CCC(=O)O MCULE-7337930692 [1,1,0,0,0,0|0,0,1]=3 1154 B10R0.78 CCCCC(=O)NCC(=O)O MCULE-9839707919 [1,1,0,0,0,0|1,0,1]=4 1155 B10R0.78 CCCCC(C)CCC(=O)O MCULE-2454273176 [1,1,0,0,0,0|0,0,0]=2 1156 B10R0.78 CCCCC(N)CCC(=O)O MCULE-2622598542 [1,1,0,0,0,0|0,0,0]=2 1157 B10R0.78 CCCCC(N)CCC(=O)O MCULE-5683869807 [1,1,0,0,0,0|0,0,0]=2 1158 B10R0.78 CCCCC(O)CCC(=O)O MCULE-6806538778 [1,1,0,0,0,0|0,0,0]=2 1159 B10R0.78 CCCCC(O)CCC(=O)[O-] MCULE-9148086354 [1,1,0,0,0,0|0,0,1]=3 1160 B10R0.78 CCCCN(C)CCC(=O)Cl MCULE-7206863872 [1,1,0,0,0,0|2,0,0]=4 1161 B10R0.78 CCCCN(C)CCC(=O)Cl MCULE-9921667039 [1,1,0,0,0,0|2,0,0]=4 1162 B10R0.78 CCCCN(C)CCC(=O)O MCULE-3286714152 [1,1,0,0,0,0|1,0,0]=3 1163 B10R0.78 CCCCS(=O)CCC(=O)O MCULE-7420971633 [1,1,0,0,0,0|1,0,0]=3 1164 B10R0.78 CCCC[C@H](C)CCC(=O)O MCULE-4790339661 [1,1,0,0,0,0|0,0,0]=2 1165 B10R0.78 CCCNC(=O)CCC(=O)O MCULE-3093591706 [1,1,0,0,0,0|1,0,1]=4 1166 B10R0.78 COCCN(C)CCC(=O)O MCULE-2595956640 [1,1,0,0,0,0|2,0,0]=4 1167 B10R0.78 COCCN(C)CCC(=O)O MCULE-5654625094 [1,1,0,0,0,0|2,0,0]=4 1168 B10R0.97 C=C(Br)CCCCCC(=O)O MCULE-1129581582 [1,1,0,0,0,0|0,0,2]=4 1169 B10R0.97 C=C(C)CCCCCC(=O)O MCULE-6091105789 [1,1,0,0,0,0|0,0,1]=3 1170 B10R0.97 C=C(C)CCCCCC(C)C MCULE-8542920974 [1,1,0,0,0,0|2,0,0]=4 1171 B10R0.97 C=C(Cl)CCCCCC(=O)O MCULE-6548751857 [1,1,0,0,0,0|0,0,2]=4 1172 B10R0.97 CC(=CCCCCC(=O)O)C MCULE-6679290438 [1,1,0,0,0,0|0,0,2]=4 1173 B10R0.97 CC(=O)CCCCCC(=O)Cl MCULE-9699420066 [1,1,0,0,0,0|1,0,1]=4 1174 B10R0.97 CC(=O)CCCCCC(=O)O MCULE-4488400468 [1,1,0,0,0,0|0,0,1]=3 1175 B10R0.97 CC(=O)NCCCCC(=O)O MCULE-6323800073 [1,1,0,0,0,0|1,0,1]=4 1176 B10R0.97 CC(C)CCCCCC(=O)O MCULE-6934503036 [1,1,0,0,0,0|0,0,0]=2 1177 B10R0.97 CC(C)CCCOCC(=O)O MCULE-7389478050 [1,1,0,0,0,0|1,0,0]=3 1178 B10R0.97 CC(O)CCCCCC(=O)O MCULE-8533691013 [1,1,0,0,0,0|0,0,0]=2 1179 B10R0.97 CN(C)CCCCCC(=O)O MCULE-1002014230 [1,1,0,0,0,0|1,0,0]=3 1180 B10R0.97 CN(C)CCCCCC(=O)O MCULE-2670396647 [1,1,0,0,0,0|1,0,0]=3 1181 B10R0.97 O=C(O)CCCCCC(=O)O MCULE-9618389016 [1,1,0,0,0,0|1,0,1]=4 1182 B10R0.97 O=C(O)CCCCCC(F)F MCULE-9302536317 [1,1,0,0,0,0|1,0,0]=3 1183 B10R0.97 O=C(O)CCCCCN(=O)=O MCULE-4861594242 [1,1,0,0,0,0|2,0,0]=4 1184 B10R0.1 C=CCC(C)CCCCCC MCULE-9669056285 [1,1,0,0,0,0|1,0,0]=3 1185 B10R0.1 CCCCCCC(C)CCBr MCULE-3565681476 [1,1,0,0,0,0|1,0,1]=4 1186 B10R0.1 CCCCCCC(C)CCC MCULE-7297649998 [1,1,0,0,0,0|1,0,1]=4 1187 B10R0.1 CCCCCCC(C)CCO MCULE-7361079557 [1,1,0,0,0,0|0,0,1]=3 1188 B10R0.1 CCCCCCC(C)N=C=O MCULE-5942468953 [1,1,0,0,0,0|1,0,1]=4 1189 B10R0.1 CCCCCCC(Cl)CCC MCULE-2067978007 [1,1,0,0,0,0|1,0,1]=4 1190 B10R0.1 CCCCCCC(O)CCC MCULE-2307566607 [1,1,0,0,0,0|1,0,1]=4 1191 B10R0.1 CCCCCCC(O)CCO MCULE-4512993407 [1,1,0,0,0,0|0,0,1]=3 1192 B10R0.1 CCCCCC[C@H](C)CCC MCULE-5233422494 [1,1,0,0,0,0|1,0,1]=4 1193 B10R0.1 CCCCCC[C@H](O)CCC MCULE-3592520258 [1,1,0,0,0,0|1,0,1]=4 1194 B10R0.1 CCCCCC[C@H](O)CCC MCULE-8969624714 [1,1,0,0,0,0|1,0,1]=4 1195 B10R0.1 CCOC(=O)CCCCC=O MCULE-7732334617 [1,1,0,0,0,0|1,0,1]=4 1196 B10R0.71 BrCCCCCCCCCBr MCULE-3406292941 [1,1,0,0,0,0|1,0,1]=4 1197 B10R0.71 C#CCCCCCCCCC MCULE-3352869074 [1,1,0,0,0,0|1,0,1]=4 1198 B10R0.71 C#CCCCCCCCCO MCULE-1465013673 [1,1,0,0,0,0|0,0,2]=4 1199 B10R0.71 C(=CCCCCO)CCCC MCULE-5192933185 [1,1,0,0,0,0|0,0,2]=4 1200 B10R0.71 C=CCCCCCCCC#N MCULE-1262733029 [1,1,0,0,0,0|1,0,1]=4 1201 B10R0.71 C=CCCCCCCCC=C MCULE-5336376495 [1,1,0,0,0,0|1,0,1]=4 1202 B10R0.71 C=CCCCCCCCC=O MCULE-2236196328 [1,1,0,0,0,0|0,0,1]=3 1203 B10R0.71 C=CCCCCCCCCBr MCULE-9645873151 [1,1,0,0,0,0|1,0,0]=3 1204 B10R0.71 C=CCCCCCCCCC MCULE-8437878932 [1,1,0,0,0,0|1,0,0]=3 1205 B10R0.71 C=CCCCCCCCCI MCULE-5534023915 [1,1,0,0,0,0|1,0,0]=3 1206 B10R0.71 C=CCCCCCCCCN MCULE-2867070960 [1,1,0,0,0,0|1,0,0]=3 1207 B10R0.71 C=CCCCCCCCCN MCULE-6734552056 [1,1,0,0,0,0|1,0,0]=3 1208 B10R0.71 C=CCCCCCCCCO MCULE-1808688008 [1,1,0,0,0,0|1,0,0]=3 1209 B10R0.71 C=CCCCCSCCCC MCULE-9557499584 [1,1,0,0,0,0|1,0,0]=3 1210 B10R0.71 C=CCOCCSCCCC MCULE-5814639814 [1,1,0,0,0,0|2,0,0]=4 1211 B10R0.71 C=COCCCCCCCC MCULE-9207967577 [1,1,0,0,0,0|1,0,0]=3 1212 B10R0.71 CCCC/C=C/CCCCO MCULE-8537897542 [1,1,0,0,0,0|0,0,2]=4 1213 B10R0.71 CCCC/C=C\CCCCO MCULE-8382129018 [1,1,0,0,0,0|0,0,2]=4 1214 B10R0.71 CCCCC#CCCCCO MCULE-2516123124 [1,1,0,0,0,0|0,0,2]=4 1215 B10R0.71 CCCCC/C=C/CCC=O MCULE-6310350913 [1,1,0,0,0,0|0,0,1]=3 1216 B10R0.71 CCCCC/C=C\CCC=O MCULE-2454675705 [1,1,0,0,0,0|0,0,1]=3 1217 B10R0.71 CCCCC/C=C\CCCO MCULE-5673742797 [1,1,0,0,0,0|0,0,2]=4 1218 B10R0.71 CCCCCC=CCCC=O MCULE-4591548304 [1,1,0,0,0,0|0,0,1]=3 1219 B10R0.71 CCCCCC=CCCCO MCULE-4774794120 [1,1,0,0,0,0|0,0,2]=4 1220 B10R0.71 CCCCCCC#CCCO MCULE-5377358049 [1,1,0,0,0,0|0,0,2]=4 1221 B10R0.71 CCCCCCC=CCCO MCULE-7637000822 [1,1,0,0,0,0|0,0,2]=4 1222 B10R0.71 CCCCCCCC#CCO MCULE-4211819006 [1,1,0,0,0,0|0,0,2]=4 1223 B10R0.71 CCCCCCCC=CC=O MCULE-8898697953 [1,1,0,0,0,0|0,0,1]=3 1224 B10R0.71 CCCCCCCC=CCO MCULE-3462895858 [1,1,0,0,0,0|0,0,1]=3 1225 B10R0.71 CCCCCCCCC#CBr MCULE-1192896759 [1,1,0,0,0,0|1,0,1]=4 1226 B10R0.71 CCCCCCCCC#CO MCULE-7543737628 [1,1,0,0,0,0|0,0,1]=3 1227 B10R0.71 CCCCCCCCCC#N MCULE-1090480870 [1,1,0,0,0,0|1,0,1]=4 1228 B10R0.71 CCCCCCCCCC=O MCULE-1782320282 [1,1,0,0,0,0|0,0,0]=2 1229 B10R0.71 CCCCCCCCCCBr MCULE-1805531766 [1,1,0,0,0,0|1,0,1]=4 1230 B10R0.71 CCCCCCCCCCC MCULE-7319807036 [1,1,0,0,0,0|1,0,1]=4 1231 B10R0.71 CCCCCCCCCCCl MCULE-7602190189 [1,1,0,0,0,0|1,0,1]=4 1232 B10R0.71 CCCCCCCCCCF MCULE-6490238051 [1,1,0,0,0,0|1,0,1]=4 1233 B10R0.71 CCCCCCCCCCI MCULE-6718970716 [1,1,0,0,0,0|1,0,1]=4 1234 B10R0.71 CCCCCCCCCCN MCULE-3389198970 [1,1,0,0,0,0|1,0,1]=4 1235 B10R0.71 CCCCCCCCCCO MCULE-7579570663 [1,1,0,0,0,0|0,0,1]=3 1236 B10R0.71 CCCCCCCCCCS MCULE-5945458624 [1,1,0,0,0,0|0,1,1]=4 1237 B10R0.71 CCCCCCCCCNC MCULE-3969866054 [1,1,0,0,0,0|1,0,1]=4 1238 B10R0.71 CCCCCCCCCNC MCULE-6631883657 [1,1,0,0,0,0|1,0,1]=4 1239 B10R0.71 CCCCCCCCCOC MCULE-3906263885 [1,1,0,0,0,0|0,0,1]=3 1240 B10R0.71 CCCCCCCCCON MCULE-2563186433 [1,1,0,0,0,0|0,0,1]=3 1241 B10R0.71 CCCCCCCCCSC MCULE-9001057781 [1,1,0,0,0,0|0,1,1]=4 1242 B10R0.71 CCCCCCCCN=C=O MCULE-8555471006 [1,1,0,0,0,0|0,0,1]=3 1243 B10R0.71 CCCCCCCCN=C=S MCULE-4775323786 [1,1,0,0,0,0|0,1,1]=4 1244 B10R0.71 CCCCCCCCN=N#N MCULE-4737472724 [1,1,0,0,0,0|2,0,0]=4 1245 B10R0.71 CCCCCCCCNC=O MCULE-5327203150 [1,1,0,0,0,0|0,0,0]=2 1246 B10R0.71 CCCCCCCCOC=O MCULE-6865253802 [1,1,0,0,0,0|0,0,0]=2 1247 B10R0.71 CCCCCCCCOCC MCULE-7803614357 [1,1,0,0,0,0|1,0,1]=4 1248 B10R0.71 CCCCCCCCOCCl MCULE-8103995676 [1,1,0,0,0,0|1,0,1]=4 1249 B10R0.71 CCCCCCCOCCCl MCULE-9608529645 [1,1,0,0,0,0|1,0,1]=4 1250 B10R0.71 CCCCCCCOCCO MCULE-4391734532 [1,1,0,0,0,0|0,0,1]=3 1251 B10R0.71 CCCCCCCOCCS MCULE-8215096371 [1,1,0,0,0,0|0,1,1]=4 1252 B10R0.71 CCCCCCCSCCO MCULE-5713036847 [1,1,0,0,0,0|0,0,1]=3 1253 B10R0.71 CCCCCCNCCC#N MCULE-2150602581 [1,1,0,0,0,0|1,0,1]=4 1254 B10R0.71 CCCCCCNCCCC MCULE-1698769182 [1,1,0,0,0,0|1,0,1]=4 1255 B10R0.71 CCCCCCNCCCCl MCULE-2065775862 [1,1,0,0,0,0|1,0,1]=4 1256 B10R0.71 CCCCCCNCCCN MCULE-7482733368 [1,1,0,0,0,0|1,0,1]=4 1257 B10R0.71 CCCCCC[NH2+]CCCCl MCULE-1476963531 [1,1,0,0,0,0|1,0,1]=4 1258 B10R0.71 CCCCCNCCCCC MCULE-6460289904 [1,1,0,0,0,0|1,0,1]=4 1259 B10R0.71 CCCCCNCCCCC MCULE-7466612345 [1,1,0,0,0,0|1,0,1]=4 1260 B10R0.71 CCCCCNCCCOC MCULE-8182280213 [1,1,0,0,0,0|1,0,1]=4 1261 B10R0.71 CCCCCOCCCCC MCULE-2510849143 [1,1,0,0,0,0|1,0,1]=4 1262 B10R0.71 CCCCCSCCCCC MCULE-3839664161 [1,1,0,0,0,0|1,0,1]=4 1263 B10R0.71 CCCCNCCOCCO MCULE-6722908845 [1,1,0,0,0,0|1,0,1]=4 1264 B10R0.71 CCCCOCCOCCO MCULE-9776383171 [1,1,0,0,0,0|1,0,1]=4 1265 B10R0.71 CCCCOCCSCCO MCULE-1950831912 [1,1,0,0,0,0|1,0,1]=4 1266 B10R0.71 CCCCSCCOCCO MCULE-8485842279 [1,1,0,0,0,0|1,0,1]=4 1267 B10R0.71 CCNCCCNCCCO MCULE-4185964299 [1,1,0,0,0,0|1,0,1]=4 1268 B10R0.71 COCCCCCCCCO MCULE-1529283698 [1,1,0,0,0,0|0,0,1]=3 1269 B10R0.71 ClCCCCCCCCCCl MCULE-3488427873 [1,1,0,0,0,0|1,0,1]=4 1270 B10R0.71 NCCCCCCCCCN MCULE-8114252394 [1,1,0,0,0,0|1,0,1]=4 1271 B10R0.71 NCCCCCCCCCO MCULE-2359018291 [1,1,0,0,0,0|0,0,1]=3 1272 B10R0.71 O=CCCCCCCCCBr MCULE-7863300341 [1,1,0,0,0,0|0,0,0]=2 1273 B10R0.71 OCCCCCCCCCBr MCULE-7708976482 [1,1,0,0,0,0|0,0,1]=3 1274 B10R0.71 OCCCCCCCCCCl MCULE-4637398536 [1,1,0,0,0,0|0,0,1]=3 1275 B10R0.71 OCCCCCCCCCI MCULE-6281256155 [1,1,0,0,0,0|0,0,1]=3 1276 B10R0.71 OCCCCCCCCCO MCULE-3258442969 [1,1,0,0,0,0|0,0,1]=3 1277 B10R0.71 OCCCCCCCCCS MCULE-3447886598 [1,1,0,0,0,0|0,0,1]=3 1278 B10R0.71 OCCCCCCOCCO MCULE-5642986797 [1,1,0,0,0,0|1,0,1]=4 1279 B10R0.71 OCCCCNCCCCO MCULE-8546417896 [1,1,0,0,0,0|1,0,1]=4 1280 B10R0.71 OCCCCOCCCCO MCULE-7966192236 [1,1,0,0,0,0|1,0,1]=4 1281 B10R0.71 OCCOCCCCCCCl MCULE-3240737723 [1,1,0,0,0,0|1,0,1]=4 1282 B10R0.71 SCCCCCCCCCS MCULE-1712418590 [1,1,0,0,0,0|0,1,1]=4 1283 B10R0.71 [NH2+](CCCC)CCCCCC MCULE-8926764515 [1,1,0,0,0,0|1,0,1]=4 1284 B10R0.91 C#CCCC(C)CCCCC MCULE-4124175821 [1,1,0,0,0,0|1,0,1]=4 1285 B10R0.91 C#CCCC(O)CCCCC MCULE-4675172890 [1,1,0,0,0,0|1,0,1]=4 1286 B10R0.91 C=CCCC(C)CCCCC MCULE-1706757342 [1,1,0,0,0,0|1,0,0]=3 1287 B10R0.91 CCCCC(C)CCCCO MCULE-9256284581 [1,1,0,0,0,0|0,0,1]=3 1288 B10R0.91 CCCCCC(C)CCC=O MCULE-9659356194 [1,1,0,0,0,0|0,0,0]=2 1289 B10R0.91 CCCCCC(C)CCCO MCULE-6947023752 [1,1,0,0,0,0|0,0,1]=3 1290 B10R0.91 CCCCCC(O)/C=C/C=O MCULE-7787544395 [1,1,0,0,0,0|0,0,2]=4 1291 B10R0.91 CCCCCC(O)C=CC=O MCULE-4013578316 [1,1,0,0,0,0|0,0,2]=4 1292 B10R0.91 CCCCCC(O)CCCC MCULE-4028571026 [1,1,0,0,0,0|1,0,1]=4 1293 B10R0.91 CCCCC[C@@H](C)CCCC MCULE-6344602419 [1,1,0,0,0,0|1,0,1]=4 1294 B10R0.91 CCCCC[C@H](O)CCCC MCULE-3767339379 [1,1,0,0,0,0|1,0,1]=4 1295 B10R0.91 CCCCC[C@H](O)CCCC MCULE-8364286143 [1,1,0,0,0,0|1,0,1]=4 1296 B12R0.2 CCCNC(=O)CC(C)CC(=O)O MCULE-4490714886 [0,2,0,0,0,0|1,0,1]=4 1297 B12R0.4 C=C(C)CC(C)CCCCCCC MCULE-8010438575 [0,2,0,0,0,0|2,0,0]=4 1298 B12R0.4 CCCCCCCC(C)CC(=O)O MCULE-8785424338 [0,2,0,0,0,0|0,0,0]=2 1299 B12R0.4 CCCCCCCC(C)OC(=O)C MCULE-5744025046 [0,2,0,0,0,0|1,0,0]=3 1300 B12R0.4 CCCCCCCC(N)CC(=O)O MCULE-6703111524 [0,2,0,0,0,0|0,0,0]=2 1301 B12R0.4 CCCCCCCC(N)CC(=O)O MCULE-7291666407 [0,2,0,0,0,0|0,0,0]=2 1302 B12R0.4 CCCCCCCC(O)CC(=O)O MCULE-4360629497 [0,2,0,0,0,0|0,0,0]=2 1303 B12R0.4 CCCCCCC[C@@H](O)CC(=O)O MCULE-9404172021 [0,2,0,0,0,0|0,0,0]=2 1304 B12R0.4 CCCCCCC[C@H](O)CC(=O)O MCULE-4030960180 [0,2,0,0,0,0|0,0,0]=2 1305 B12R0.4 CCCCCCOC(=O)CC(=O)C MCULE-9729311906 [0,2,0,0,0,0|1,0,1]=4 1306 B12R0.46 CCCCCCC(O)C(N)C(=O)O MCULE-6650393951 [0,2,0,0,0,0|0,0,0]=2 1307 B12R0.113 C=CC(=O)OC(C)CCCCCC MCULE-1718387963 [0,2,0,0,0,0|2,0,0]=4 1308 B12R0.113 CCCCCCC(C)NC(=O)CCl MCULE-4835194894 [0,2,0,0,0,0|2,0,0]=4 1309 B12R0.113 CCCCCCC(C)OC(=O)CCl MCULE-3342954243 [0,2,0,0,0,0|2,0,0]=4 1310 B12R0.113 CCCCCCC(O)CC(=O)OC MCULE-8995113646 [0,2,0,0,0,0|0,0,0]=2 1311 B12R0.113 CCCCCNC(C)CC(=O)OC MCULE-2558037544 [0,2,0,0,0,0|1,0,0]=3 1312 B12R0.113 CCOCCNC(C)CC(=O)OC MCULE-3461223376 [0,2,0,0,0,0|2,0,0]=4 1313 B12R0.113 COCCCNC(C)CC(=O)OC MCULE-1923960851 [0,2,0,0,0,0|2,0,0]=4 1314 B12R0.202 CCCCCCC(CC)CC(=O)O MCULE-4987267160 [0,2,0,0,0,0|0,0,0]=2 1315 B12R0.202 CCCCCCC(CC)OC(=O)C MCULE-1412061215 [0,2,0,0,0,0|2,0,0]=4 1316 B12R0.270 CC(=O)NCCC[C@@H](N)CC(=O)O MCULE-4886618146 [0,2,0,0,0,0|1,0,1]=4 1317 B12R0.272 CCCC(C)CCC(C)CC(=O)O MCULE-2907102374 [0,2,0,0,0,0|0,0,0]=2 1318 B12R0.42 C/C(=N/CCCC[C@H](N)C(=O)O)/N MCULE-7878147954 [0,2,0,0,0,0|1,0,1]=4 1319 B12R0.42 CC(=N)NCCCCC(N)C(=O)O MCULE-2748186789 [0,2,0,0,0,0|1,0,1]=4 1320 B12R0.42 CC(=N)NCCCCC(N)C(=O)O MCULE-6164256302 [0,2,0,0,0,0|1,0,1]=4 1321 B12R0.42 CC(=N)NCCCC[C@H](N)C(=O)O MCULE-2218386265 [0,2,0,0,0,0|1,0,1]=4 1322 B12R0.42 CC(=N)NCCCC[C@H](N)C(=O)O MCULE-5581195825 [0,2,0,0,0,0|1,0,1]=4 1323 B12R0.42 CC(=N)NCCCC[C@H](N)C(=O)O MCULE-8004298113 [0,2,0,0,0,0|1,0,1]=4 1324 B12R0.42 CC(=O)C(C)CCCCCC(=O)O MCULE-9391199319 [0,2,0,0,0,0|0,0,1]=3 1325 B12R0.42 CC(=O)CCCCCC(N)C(=O)O MCULE-8560922815 [0,2,0,0,0,0|0,0,1]=3 1326 B12R0.42 CC(=O)CCCCCC(N)C(=O)O MCULE-9405826819 [0,2,0,0,0,0|0,0,1]=3 1327 B12R0.42 CC(=O)NCCCCC(N)C(=O)O MCULE-4363164306 [0,2,0,0,0,0|1,0,1]=4 1328 B12R0.42 CC(=O)NCCCCC(N)C(=O)O MCULE-7418953050 [0,2,0,0,0,0|1,0,1]=4 1329 B12R0.42 CC(=O)NCCCC[C@@H](N)C(=O)O MCULE-2826730309 [0,2,0,0,0,0|1,0,1]=4 1330 B12R0.42 CC(=O)NCCCC[C@H](N)C(=O)O MCULE-2500699001 [0,2,0,0,0,0|1,0,1]=4 1331 B12R0.42 CC(=O)NCCCC[C@H](N)C(=O)O MCULE-2747158053 [0,2,0,0,0,0|1,0,1]=4 1332 B12R0.42 CC(=O)NCCCC[C@H](N)C(=O)O MCULE-8086021811 [0,2,0,0,0,0|1,0,1]=4 1333 B12R0.42 CC(=O)NCCCC[C@H](N)C(=O)O MCULE-9503615061 [0,2,0,0,0,0|1,0,1]=4 1334 B12R0.42 CC(C)C(=O)CCCCCC(=O)O MCULE-3942492343 [0,2,0,0,0,0|0,0,1]=3 1335 B12R0.42 CC(C)NCCCCC(N)C(=O)O MCULE-4725150112 [0,2,0,0,0,0|1,0,0]=3 1336 B12R0.42 CC(C)NCCCC[C@H](N)C(=O)O MCULE-1146954302 [0,2,0,0,0,0|1,0,0]=3 1337 B12R0.42 C[C@H](N)C(=O)CCCCCC(=O)O MCULE-3314826257 [0,2,0,0,0,0|0,0,1]=3 1338 B12R0.42 C[C@H](N)C(=O)CCCCCC(=O)O MCULE-9579447737 [0,2,0,0,0,0|0,0,1]=3 1339 B12R0.42 NC(CCCCCC(=O)O)C(=O)O MCULE-7949829956 [0,2,0,0,0,0|1,0,1]=4 1340 B12R0.42 N[C@@H](CCCCCC(=O)O)C(=O)O MCULE-2069821066 [0,2,0,0,0,0|1,0,1]=4 1341 B12R0.42 N[C@@H](CCCCCC(=O)O)C(=O)O MCULE-3495032122 [0,2,0,0,0,0|1,0,1]=4 1342 B12R0.42 N[C@H](CCCCCC(=O)O)C(=O)O MCULE-2692259414 [0,2,0,0,0,0|1,0,1]=4 1343 B12R0.42 N[C@H](CCCCCC(=O)O)C(=O)O MCULE-6806526657 [0,2,0,0,0,0|1,0,1]=4 1344 B12R0.42 [C@@H](N)(CCCCNC(=O)C)C(=O)O MCULE-9387648281 [0,2,0,0,0,0|1,0,1]=4 1345 B12R0.44 CC(=O)CCC(C)CCCC(C)C MCULE-1306948790 [0,2,0,0,0,0|1,0,0]=3 1346 B12R0.44 CC(C)CCCC(C)CCC(=O)O MCULE-4060617838 [0,2,0,0,0,0|0,0,0]=2 1347 B12R0.44 CC(C)CCNC(=O)CCC(=O)O MCULE-8549397879 [0,2,0,0,0,0|1,0,1]=4 1348 B12R0.44 CC(C)CNC(=O)CCCC(=O)O MCULE-7903541530 [0,2,0,0,0,0|1,0,1]=4 1349 B12R0.137 CC(C)(C)NCCCCCC(=O)O MCULE-3035916967 [0,2,0,0,0,0|1,0,0]=3 1350 B12R0.137 CC(C)(C)OCCNCCC(=O)O MCULE-1158896447 [0,2,0,0,0,0|2,0,0]=4 1351 B12R0.137 CC(C)(C)OCCOCCC(=O)O MCULE-4820014810 [0,2,0,0,0,0|2,0,0]=4 1352 B12R0.137 CS(=O)(=O)SCCCCCC(=O)O MCULE-3349898183 [0,2,0,0,0,0|2,0,0]=4 1353 B12R0.137 NS(=O)(=O)CCCCCCC(=O)O MCULE-5652448966 [0,2,0,0,0,0|2,0,0]=4 1354 B12R0.184 C=CC(=O)OCCCCCC(C)C MCULE-8483303249 [0,2,0,0,0,0|2,0,0]=4 1355 B12R0.184 C=CC(O)CCCCCCC(=O)O MCULE-2198484452 [0,2,0,0,0,0|0,0,1]=3 1356 B12R0.184 CC(C)CCCCCOC(=O)CS MCULE-1124478219 [0,2,0,0,0,0|1,1,0]=4 1357 B12R0.184 CCC(=O)CCCCCCC(=O)O MCULE-4717498477 [0,2,0,0,0,0|0,0,0]=2 1358 B12R0.184 CCC(C)CCCCCCC(=O)O MCULE-2900681210 [0,2,0,0,0,0|0,0,0]=2 1359 B12R0.184 COC(=O)CCCCCCC(=O)Cl MCULE-8021290059 [0,2,0,0,0,0|1,0,1]=4 1360 B12R0.184 COC(=O)CCCCCCC(=O)O MCULE-9793115364 [0,2,0,0,0,0|0,0,1]=3 1361 B12R0.184 COC(=O)CCCCCCC(C)C MCULE-3897074156 [0,2,0,0,0,0|0,0,0]=2 1362 B12R0.184 COC(=O)CCCCCOC(=O)C MCULE-6683368772 [0,2,0,0,0,0|1,0,1]=4 1363 B12R0.184 COC(=O)CCNCCCN(C)C MCULE-1963378628 [0,2,0,0,0,0|2,0,0]=4 1364 B12R0.184 O=C(O)CCCCCCC(=O)NO MCULE-8631395600 [0,2,0,0,0,0|1,0,1]=4 1365 B12R0.184 O=C(O)CCCCCNC(=O)CCl MCULE-7503199226 [0,2,0,0,0,0|1,0,1]=4 1366 B12R0.1 C=CCCCCCCC(=O)OCC MCULE-2529046007 [0,2,0,0,0,0|0,0,2]=4 1367 B12R0.1 CCCCCC=CCC(=O)OCC MCULE-2452505052 [0,2,0,0,0,0|0,0,2]=4 1368 B12R0.1 CCCCCCC#CC(=O)OCC MCULE-9938881189 [0,2,0,0,0,0|0,0,2]=4 1369 B12R0.1 CCCCCCC=CC(=O)OCC MCULE-4260025223 [0,2,0,0,0,0|0,0,2]=4 1370 B12R0.1 CCCCCCCCC(=O)NCO MCULE-9330858839 [0,2,0,0,0,0|0,0,0]=2 1371 B12R0.1 CCCCCCCCC(=O)OCC MCULE-5309868306 [0,2,0,0,0,0|0,0,0]=2 1372 B12R0.1 CCCCCCCCC(=O)OCCl MCULE-7482672748 [0,2,0,0,0,0|0,0,0]=2 1373 B12R0.1 CCCCCCCCC(O)CCC MCULE-4193341089 [0,2,0,0,0,0|1,0,1]=4 1374 B12R0.1 CCCCCCCCS(=O)CCCl MCULE-5342861128 [0,2,0,0,0,0|2,0,0]=4 1375 B12R0.1 CCCCCCCCS(=O)CCO MCULE-7963242650 [0,2,0,0,0,0|1,0,0]=3 1376 B12R0.1 CCCCCCCNC(=O)CC#N MCULE-2223444329 [0,2,0,0,0,0|2,0,0]=4 1377 B12R0.1 CCCCCCCOC(=O)CCC MCULE-5390225657 [0,2,0,0,0,0|2,0,0]=4 1378 B12R0.1 CCCCCNCCC(=O)OCC MCULE-6006388312 [0,2,0,0,0,0|1,0,0]=3 1379 B12R0.1 CCOC(=O)CCCCCCCBr MCULE-8678920768 [0,2,0,0,0,0|1,0,0]=3 1380 B12R0.1 CCOC(=O)CCCCCCCCl MCULE-8377860069 [0,2,0,0,0,0|1,0,0]=3 1381 B12R0.1 CCOC(=O)CCCCCCCI MCULE-5677306490 [0,2,0,0,0,0|1,0,0]=3 1382 B12R0.1 CCOC(=O)CCCCCCCN MCULE-2162819446 [0,2,0,0,0,0|1,0,0]=3 1383 B12R0.1 CCOC(=O)CCCCCCCN MCULE-4046698936 [0,2,0,0,0,0|1,0,0]=3 1384 B12R0.1 CCOC(=O)CCCCCCCO MCULE-3311157136 [0,2,0,0,0,0|1,0,0]=3 1385 B12R0.1 CCOC(=O)CCNCCCOC MCULE-1490737085 [0,2,0,0,0,0|2,0,0]=4 1386 B12R0.1 CCOCCNCCC(=O)OCC MCULE-8716932397 [0,2,0,0,0,0|2,0,0]=4 1387 B12R0.49 CCCCCCC=C(C)C(=O)OC MCULE-9746455818 [0,2,0,0,0,0|0,0,2]=4 1388 B12R0.49 CCCCCNCC(C)C(=O)OC MCULE-7883564580 [0,2,0,0,0,0|1,0,0]=3 1389 B12R0.49 CCOCCNCC(C)C(=O)OC MCULE-7787221059 [0,2,0,0,0,0|2,0,0]=4 1390 B12R0.49 COCCCNCC(C)C(=O)OC MCULE-4671999012 [0,2,0,0,0,0|2,0,0]=4 1391 B12R0.57 CCCCCCCCC(CC)CO MCULE-4207731459 [0,2,0,0,0,0|1,0,1]=4 1392 B12R0.57 CCCCCCCCC(OC)OC MCULE-1801269369 [0,2,0,0,0,0|0,0,2]=4 1393 B12R0.102 C=CC(=O)OCCC(C)CCCC MCULE-4430853878 [0,2,0,0,0,0|2,0,0]=4 1394 B12R0.102 C=CC(=O)OCCC(C)CCCC MCULE-9499965302 [0,2,0,0,0,0|2,0,0]=4 1395 B12R0.142 CCCCCC(O)CCC(=O)NC MCULE-6293429988 [0,2,0,0,0,0|1,0,0]=3 1396 B12R0.142 CCCCCC(O)CCC(=O)NN MCULE-5752578751 [0,2,0,0,0,0|1,0,0]=3 1397 B12R0.142 CCCCCN(C)CCC(=O)OC MCULE-2291452390 [0,2,0,0,0,0|1,0,0]=3 1398 B12R0.142 CCCOCC(O)CCC(=O)NN MCULE-8615765536 [0,2,0,0,0,0|2,0,0]=4 1399 B12R0.183 COC(=O)CCCCCC(=O)OC MCULE-4367657579 [0,2,0,0,0,0|1,0,1]=4 1400 B12R0.248 C=CC(=O)NCCCCCCCC MCULE-9686941876 [0,2,0,0,0,0|1,0,0]=3 1401 B12R0.248 C=CC(=O)OCCCCCCCC MCULE-8708207271 [0,2,0,0,0,0|1,0,0]=3 1402 B12R0.248 C=CCCCCCCCC(=O)OC MCULE-1843303649 [0,2,0,0,0,0|0,0,1]=3 1403 B12R0.248 CCCCCCCCC/C(=N\O)/N MCULE-5582103663 [0,2,0,0,0,0|1,0,0]=3 1404 B12R0.248 CCCCCCCCCC(=O)CC MCULE-8070056231 [0,2,0,0,0,0|1,0,0]=3 1405 B12R0.248 CCCCCCCCCC(=O)NC MCULE-5903490737 [0,2,0,0,0,0|1,0,0]=3 1406 B12R0.248 CCCCCCCCCC(=O)NN MCULE-5225093755 [0,2,0,0,0,0|1,0,0]=3 1407 B12R0.248 CCCCCCCCCC(=O)NO MCULE-3922115888 [0,2,0,0,0,0|0,0,0]=2 1408 B12R0.248 CCCCCCCCCC(=O)OC MCULE-3080392178 [0,2,0,0,0,0|0,0,0]=2 1409 B12R0.248 CCCCCCCCCC(C)C=O MCULE-7485962352 [0,2,0,0,0,0|1,0,1]=4 1410 B12R0.248 CCCCCCCCCC(O)CC MCULE-8088841540 [0,2,0,0,0,0|1,0,1]=4 1411 B12R0.248 CCCCCCCCCC(O)CO MCULE-3958170897 [0,2,0,0,0,0|0,0,2]=4 1412 B12R0.248 CCCCCCCCCC([NH3+])CO MCULE-4329139225 [0,2,0,0,0,0|1,0,1]=4 1413 B12R0.248 CCCCCCCCCC([NH3+])CO MCULE-6424120612 [0,2,0,0,0,0|1,0,1]=4 1414 B12R0.248 CCCCCCCCNC(=O)CCl MCULE-4427362960 [0,2,0,0,0,0|1,0,0]=3 1415 B12R0.248 CCCCCCCCNC(=S)NN MCULE-7622055380 [0,2,0,0,0,0|1,1,0]=4 1416 B12R0.248 CCCCCCCCOC(=O)CBr MCULE-6221987137 [0,2,0,0,0,0|1,0,0]=3 1417 B12R0.248 CCCCCCCCOC(=O)CC MCULE-3871560069 [0,2,0,0,0,0|1,0,0]=3 1418 B12R0.248 CCCCCCCCOC(=O)CCl MCULE-4822709810 [0,2,0,0,0,0|1,0,0]=3 1419 B12R0.248 CCCCCCCCOC(=O)CN MCULE-1232197423 [0,2,0,0,0,0|1,0,0]=3 1420 B12R0.248 CCCCCCCCOC(=O)CN MCULE-3856902884 [0,2,0,0,0,0|1,0,0]=3 1421 B12R0.248 CCCCCCCCOC(=O)CS MCULE-8976044992 [0,2,0,0,0,0|0,1,0]=3 1422 B12R0.248 CCCCCCCSCC(=O)OC MCULE-8419218207 [0,2,0,0,0,0|0,0,0]=2 1423 B12R0.248 CNCCCCCCCC(=O)OC MCULE-2073535841 [0,2,0,0,0,0|0,0,0]=2 1424 B12R0.248 COC(=O)CCCCCCCC=O MCULE-8962678443 [0,2,0,0,0,0|0,0,1]=3 1425 B12R0.248 COC(=O)CCCCCCCCBr MCULE-8360143365 [0,2,0,0,0,0|0,0,0]=2 1426 B12R0.248 COC(=O)CCCCCCCCO MCULE-5867988584 [0,2,0,0,0,0|0,0,0]=2 1427 B12R0.248 COC(=O)CCCCCCN=N#N MCULE-3237572469 [0,2,0,0,0,0|2,0,0]=4 1428 B12R0.248 COC(=O)CCOCCOCCO MCULE-8679120721 [0,2,0,0,0,0|2,0,0]=4 1429 B12R0.248 OCCCCCCCCC(O)CO MCULE-5399962147 [0,2,0,0,0,0|0,0,2]=4 1430 B12R0.251 C=CCCCCCC[C@@H](N)C(=O)O MCULE-2799345068 [0,2,0,0,0,0|0,0,1]=3 1431 B12R0.251 C=CCCCCCC[C@@H](N)C(=O)O MCULE-9903243220 [0,2,0,0,0,0|0,0,1]=3 1432 B12R0.251 C=CCCCCCC[C@H](N)C(=O)O MCULE-2269405644 [0,2,0,0,0,0|0,0,1]=3 1433 B12R0.251 C=CCCCCCC[C@H](N)C(=O)O MCULE-9502690178 [0,2,0,0,0,0|0,0,1]=3 1434 B12R0.251 CCCCCCCCC(=C(F)F)F MCULE-6308736081 [0,2,0,0,0,0|2,0,0]=4 1435 B12R0.251 CCCCCCCCC(Br)C(=O)O MCULE-2249695757 [0,2,0,0,0,0|0,0,0]=2 1436 B12R0.251 CCCCCCCCC(C)C(=O)O MCULE-5055484783 [0,2,0,0,0,0|0,0,0]=2 1437 B12R0.251 CCCCCCCCC(N)C(=O)O MCULE-5147614071 [0,2,0,0,0,0|0,0,0]=2 1438 B12R0.251 CCCCCCCCC(O)C(=O)O MCULE-8352063977 [0,2,0,0,0,0|0,0,0]=2 1439 B12R0.251 CCCCCCCC[C@@H](C)C(=O)O MCULE-7683022827 [0,2,0,0,0,0|0,0,0]=2 1440 B12R0.251 CCCCCCCC[C@@H](N)C(=O)O MCULE-7339170439 [0,2,0,0,0,0|0,0,0]=2 1441 B12R0.251 CCCCCCCC[C@H](N)C(=O)O MCULE-4486967061 [0,2,0,0,0,0|0,0,0]=2 1442 B12R0.251 CCCCCCCC[C@H](N)C(=O)O MCULE-5097554565 [0,2,0,0,0,0|0,0,0]=2 1443 B12R0.251 CCCCCCCC[C@H](O)C(=O)O MCULE-8055488376 [0,2,0,0,0,0|0,0,0]=2 1444 B12R0.251 CCCCCCCC[C@H](O)C(=O)O MCULE-9794122537 [0,2,0,0,0,0|0,0,0]=2 1445 B12R0.251 CCCCCCCOC(C)C(=O)O MCULE-7189109747 [0,2,0,0,0,0|0,0,0]=2 1446 B12R0.251 [C@@H](N)(CCCCCCCC)C(=O)O MCULE-7027186088 [0,2,0,0,0,0|0,0,0]=2 1447 B12R0.276 CCOC(=O)CCCCC(=O)OC MCULE-2483929710 [0,2,0,0,0,0|1,0,1]=4 1448 B12R0.312 C=CS(=O)(=O)CCCCCCCC MCULE-1033727057 [0,2,0,0,0,0|1,0,1]=4 1449 B12R0.312 CCCCCCCCS(=O)(=O)CCl MCULE-5423643010 [0,2,0,0,0,0|1,0,1]=4 1450 B12R0.312 CCCCCCCCS(=O)(=O)NN MCULE-9926914582 [0,2,0,0,0,0|1,0,1]=4 1451 B12R0.312 CCCCCCCC[Si](C)(C)OC MCULE-8570982657 [0,2,0,0,0,0|1,1,0]=4 1452 B12R0.48 CCCCS(=O)CCC(N)C(=O)O MCULE-3972272860 [0,2,0,0,0,0|1,0,0]=3 1453 B12R0.48 CCCNC(=O)CCC(N)C(=O)O MCULE-6343668590 [0,2,0,0,0,0|1,0,1]=4 1454 B12R0.58 CCCCCCCC(C)(C)C(=O)C MCULE-5474855266 [0,2,0,0,0,0|1,0,0]=3 1455 B12R0.58 CCCCCCCC(C)(C)C(=O)O MCULE-5703679612 [0,2,0,0,0,0|0,0,0]=2 1456 B12R0.123 CCCCCC(=O)NC(C)C(=O)O MCULE-5820006482 [0,2,0,0,0,0|1,0,1]=4 1457 B12R0.123 CCCCOC(=O)CC(N)C(=O)O MCULE-6916489846 [0,2,0,0,0,0|1,0,1]=4 1458 B12R0.186 CCC(=N)NCCC[C@H](N)C(=O)O MCULE-5572284521 [0,2,0,0,0,0|1,0,1]=4 1459 B12R0.186 CCC(=N)NCCC[C@H](N)C(=O)O MCULE-9860243160 [0,2,0,0,0,0|1,0,1]=4 1460 B12R0.201 CCCCCCCC(CC)C(=O)O MCULE-8987975802 [0,2,0,0,0,0|0,0,0]=2 1461 B12R0.201 CCCCCON[C@@H](CO)C(=O)O MCULE-1344242121 [0,2,0,0,0,0|2,0,0]=4 1462 B12R0.201 CCCCCON[C@@H](CO)C(=O)O MCULE-3027069951 [0,2,0,0,0,0|2,0,0]=4 1463 B12R0.201 CCCCCON[C@@H](CO)C(=O)O MCULE-9803738372 [0,2,0,0,0,0|2,0,0]=4 1464 B12R0.201 CCCCCON[C@@H](CO)C(=O)O MCULE-9924499830 [0,2,0,0,0,0|2,0,0]=4 1465 B12R0.255 CCCCCCC(=O)CCC(=O)O MCULE-1506437124 [0,2,0,0,0,0|0,0,0]=2 1466 B12R0.255 CCCCCCC(O)CCC(=O)O MCULE-5591309975 [0,2,0,0,0,0|0,0,0]=2 1467 B12R0.255 CCCCCCC(O)CCC(=O)[O-] MCULE-4395510611 [0,2,0,0,0,0|0,0,1]=3 1468 B12R0.255 CCCCCCS(=O)CCC(=O)[O-] MCULE-1159145242 [0,2,0,0,0,0|0,0,1]=3 1469 B12R0.255 CCCCCCS(=O)CCC(=O)[O-] MCULE-6759587023 [0,2,0,0,0,0|0,0,1]=3 1470 B12R0.255 CCCCCOC(=S)SCC(=O)O MCULE-6182340488 [0,2,0,0,0,0|1,0,1]=4 1471 B12R0.255 CCCCOCC(S)CNC(=O)N MCULE-2533024157 [0,2,0,0,0,0|2,0,0]=4 1472 B12R0.255 COCCCNC(=O)CCC(=O)O MCULE-2235611201 [0,2,0,0,0,0|1,0,1]=4 1473 B12R0.255 O=C(O)CCC(=O)OCCCCO MCULE-6404727181 [0,2,0,0,0,0|1,0,1]=4 1474 B12R0.210 CCS(=O)(=O)CCCCCC(=O)O MCULE-9652550148 [0,2,0,0,0,0|1,0,0]=3 1475 B12R0.277 CCCC(=O)CCCCCC(=O)O MCULE-2592304646 [0,2,0,0,0,0|0,0,0]=2 1476 B12R0.277 CCCC(C)CCCCCC(=O)O MCULE-8094468025 [0,2,0,0,0,0|0,0,0]=2 1477 B12R0.277 CCCC(N)CCCCCC(=O)O MCULE-6921348147 [0,2,0,0,0,0|0,0,0]=2 1478 B12R0.277 CCOC(=O)CCCCCC(=O)C MCULE-9869285908 [0,2,0,0,0,0|1,0,1]=4 1479 B12R0.277 CCOC(=O)CCCCCC(=O)Cl MCULE-5720452434 [0,2,0,0,0,0|1,0,1]=4 1480 B12R0.277 CCOC(=O)CCCCCC(=O)O MCULE-3615439341 [0,2,0,0,0,0|0,0,1]=3 1481 B12R0.233 CCCCCC(=O)CCCC(=O)O MCULE-7183792222 [0,2,0,0,0,0|0,0,0]=2 1482 B12R0.233 CCCCCC(=O)NCCC(=O)O MCULE-7265291580 [0,2,0,0,0,0|0,0,1]=3 1483 B12R0.233 CCCCCC(O)CCCC(=O)O MCULE-2335278488 [0,2,0,0,0,0|0,0,0]=2 1484 B12R0.233 CCCCCC(O)CCCC(=O)[O-] MCULE-7035156488 [0,2,0,0,0,0|0,0,1]=3 1485 B12R0.233 CCCCNC(=O)CCCC(=O)O MCULE-9110065966 [0,2,0,0,0,0|0,0,1]=3 1486 B12R0.233 CCCCNC(=O)COCC(=O)O MCULE-2161293982 [0,2,0,0,0,0|1,0,1]=4 1487 B12R0.233 COCCNC(=O)CCCC(=O)O MCULE-3432547059 [0,2,0,0,0,0|1,0,1]=4 1488 B12R0.254 CCCCC(CC)COCC(=O)O MCULE-3191470354 [0,2,0,0,0,0|1,0,0]=3 1489 B12R0.254 CCCCC(CC)COCC(=O)[O-] MCULE-9011234560 [0,2,0,0,0,0|1,0,1]=4 1490 B12R0.254 CCCCN(CCCC(=O)O)N=O MCULE-9526072372 [0,2,0,0,0,0|1,0,0]=3 1491 B12R0.331 CCCCS(=O)(=O)CCCC(=O)O MCULE-1657286675 [0,2,0,0,0,0|1,0,0]=3 1492 B12R0.95 CCCCC(=O)CCCCC(=O)O MCULE-6207970958 [0,2,0,0,0,0|0,0,0]=2 1493 B12R0.95 O=C(O)CCCCC(=O)OCCO MCULE-1346681356 [0,2,0,0,0,0|1,0,1]=4 1494 B12R0.119 CCCCCCCCCP(=O)(O)O MCULE-4052139199 [0,2,0,0,0,0|1,0,0]=3 1495 B12R0.119 CCCCCCCCCS(=O)(=O)Cl MCULE-8052966186 [0,2,0,0,0,0|1,0,1]=4 1496 B12R0.119 CCCCCCCCCS(=O)(=O)[O-] MCULE-1927567552 [0,2,0,0,0,0|1,0,1]=4 1497 B12R0.119 CCCCCCCCCS(=O)(=O)[O-] MCULE-3281419364 [0,2,0,0,0,0|1,0,1]=4 1498 B12R0.119 CCCCCCCCOP(=O)(C)C MCULE-5071482809 [0,2,0,0,0,0|2,0,0]=4 1499 B12R0.119 CCCCCCCCOP(=O)(Cl)Cl MCULE-2430760129 [0,2,0,0,0,0|2,0,0]=4 1500 B12R0.119 CCCCCCCCOP(=O)(O)O MCULE-5203489281 [0,2,0,0,0,0|1,0,0]=3 1501 B12R0.119 CCCCCCCCOS(=O)(=O)[O-] MCULE-5107186458 [0,2,0,0,0,0|1,0,1]=4 1502 B12R0.119 CCCCCCCCOS(=O)(=O)[O-] MCULE-8859174394 [0,2,0,0,0,0|1,0,1]=4 1503 B12R0.234 C#CCCCCCCCCC(=O)Cl MCULE-2889527190 [0,2,0,0,0,0|1,0,0]=3 1504 B12R0.234 C#CCCCCCCCCC(=O)O MCULE-2483655428 [0,2,0,0,0,0|0,0,0]=2 1505 B12R0.234 C=C(Br)CCCCCCCCCC MCULE-6429692740 [0,2,0,0,0,0|2,0,0]=4 1506 B12R0.234 C=C(C)CCCCCCCCCC MCULE-5430192671 [0,2,0,0,0,0|2,0,0]=4 1507 B12R0.234 C=C(Cl)CCCCCCCCCC MCULE-5277185113 [0,2,0,0,0,0|2,0,0]=4 1508 B12R0.234 C=CCCCCCCCCC(=O)C MCULE-8465504630 [0,2,0,0,0,0|1,0,0]=3 1509 B12R0.234 C=CCCCCCCCCC(=O)Cl MCULE-1643300518 [0,2,0,0,0,0|1,0,0]=3 1510 B12R0.234 C=CCCCCCCCCC(=O)N MCULE-2069893872 [0,2,0,0,0,0|1,0,0]=3 1511 B12R0.234 C=CCCCCCCCCC(=O)O MCULE-7928135942 [0,2,0,0,0,0|0,0,0]=2 1512 B12R0.234 C=CCCCCCCCCC(=O)[O-] MCULE-4921741648 [0,2,0,0,0,0|0,0,1]=3 1513 B12R0.234 C=CCCCCCCCCC(=O)[O-] MCULE-8671525222 [0,2,0,0,0,0|0,0,1]=3 1514 B12R0.234 C=CCCCCCCCCN(=O)=O MCULE-9960791760 [0,2,0,0,0,0|1,0,1]=4 1515 B12R0.234 C=CCCCCCCCOC(=O)C MCULE-7392620730 [0,2,0,0,0,0|1,0,1]=4 1516 B12R0.234 CC#CCCCCCCCC(=O)O MCULE-8975663292 [0,2,0,0,0,0|0,0,0]=2 1517 B12R0.234 CC(=O)NCCCCNCCCN MCULE-7493998252 [0,2,0,0,0,0|2,0,0]=4 1518 B12R0.234 CC(=O)NCCCCNCCCN MCULE-9577502089 [0,2,0,0,0,0|2,0,0]=4 1519 B12R0.234 CC(=O)NCCCNCCCCN MCULE-3303778613 [0,2,0,0,0,0|2,0,0]=4 1520 B12R0.234 CC(=O)NCCCNCCCCN MCULE-8365270729 [0,2,0,0,0,0|2,0,0]=4 1521 B12R0.234 CC(=O)OCCCCCCCCBr MCULE-4728650316 [0,2,0,0,0,0|1,0,0]=3 1522 B12R0.234 CCC=CCCCCCOC(=O)C MCULE-2714811926 [0,2,0,0,0,0|1,0,1]=4 1523 B12R0.234 CCCCCCC/C=C/CC(=O)C MCULE-6992455059 [0,2,0,0,0,0|1,0,0]=3 1524 B12R0.234 CCCCCCCC/C=C/C(=O)O MCULE-6786701242 [0,2,0,0,0,0|0,0,0]=2 1525 B12R0.234 CCCCCCCCC=CC(=O)O MCULE-7750983255 [0,2,0,0,0,0|0,0,0]=2 1526 B12R0.234 CCCCCCCCCCB(O)O MCULE-6277841305 [0,2,0,0,0,0|1,0,1]=4 1527 B12R0.234 CCCCCCCCCCC(=O)C MCULE-3936750617 [0,2,0,0,0,0|1,0,0]=3 1528 B12R0.234 CCCCCCCCCCC(=O)Cl MCULE-1131766423 [0,2,0,0,0,0|1,0,0]=3 1529 B12R0.234 CCCCCCCCCCC(=O)N MCULE-7086521203 [0,2,0,0,0,0|1,0,0]=3 1530 B12R0.234 CCCCCCCCCCC(=O)O MCULE-5110587542 [0,2,0,0,0,0|0,0,0]=2 1531 B12R0.234 CCCCCCCCCCC(C)O MCULE-9407036721 [0,2,0,0,0,0|1,0,1]=4 1532 B12R0.234 CCCCCCCCCCN(=O)=O MCULE-9525688454 [0,2,0,0,0,0|1,0,1]=4 1533 B12R0.234 CCCCCCCCCCS(=O)C MCULE-1607212944 [0,2,0,0,0,0|2,0,0]=4 1534 B12R0.234 CCCCCCCCCOC(=O)C MCULE-7712513310 [0,2,0,0,0,0|1,0,0]=3 1535 B12R0.234 CCCCCCCCCOC(=O)Cl MCULE-4937657236 [0,2,0,0,0,0|1,0,0]=3 1536 B12R0.234 CCCCCCCCCOC(=S)[S-] MCULE-1048722427 [0,2,0,0,0,0|0,2,0]=4 1537 B12R0.234 CCCCCCCCCOC(=S)[S-] MCULE-2082950273 [0,2,0,0,0,0|0,2,0]=4 1538 B12R0.234 CCCCCCCCCSC(=N)N MCULE-2574065227 [0,2,0,0,0,0|2,0,0]=4 1539 B12R0.234 CCCCCCCCCSC(=N)N MCULE-7175152082 [0,2,0,0,0,0|2,0,0]=4 1540 B12R0.234 CCCCCCCCNCC(C)O MCULE-9293787711 [0,2,0,0,0,0|1,0,1]=4 1541 B12R0.234 CCCCCCCCOCC(=O)O MCULE-8710960938 [0,2,0,0,0,0|0,0,0]=2 1542 B12R0.234 CCCCCCCCOCC(C)O MCULE-7262368590 [0,2,0,0,0,0|1,0,1]=4 1543 B12R0.234 CCCCCCCCSCC(=O)N MCULE-3095528852 [0,2,0,0,0,0|1,0,0]=3 1544 B12R0.234 CCCCCCCCSCC(=O)O MCULE-8082253480 [0,2,0,0,0,0|0,0,0]=2 1545 B12R0.234 CCCCCCCC[NH2+]CC(=O)O MCULE-1736831432 [0,2,0,0,0,0|0,0,0]=2 1546 B12R0.234 CCCCCCCC[NH2+]CC(=O)O MCULE-8284012398 [0,2,0,0,0,0|0,0,0]=2 1547 B12R0.234 CCCCCCCNCCC(=O)N MCULE-9973742738 [0,2,0,0,0,0|1,0,0]=3 1548 B12R0.234 CCOCCCCCCCC(=O)O MCULE-4393917993 [0,2,0,0,0,0|0,0,0]=2 1549 B12R0.234 CNCCOCCOCCC(=O)O MCULE-5859151176 [0,2,0,0,0,0|1,0,0]=3 1550 B12R0.234 COCCOCCOCCC(=O)Cl MCULE-4397360863 [0,2,0,0,0,0|2,0,0]=4 1551 B12R0.234 COCCOCCOCCC(=O)O MCULE-3073877899 [0,2,0,0,0,0|1,0,0]=3 1552 B12R0.234 N#CCCCCCCCCC(=O)O MCULE-1219422242 [0,2,0,0,0,0|0,0,0]=2 1553 B12R0.234 N#N=NCCCCCCCC(=O)O MCULE-5693417997 [0,2,0,0,0,0|1,0,0]=3 1554 B12R0.234 NCCCCCCCCCC(=O)O MCULE-1324986945 [0,2,0,0,0,0|0,0,0]=2 1555 B12R0.234 NCCOCCOCCCC(=O)O MCULE-2525701431 [0,2,0,0,0,0|1,0,0]=3 1556 B12R0.234 O=C(O)/C=C/CCCCCCCO MCULE-7936793574 [0,2,0,0,0,0|0,0,1]=3 1557 B12R0.234 O=C(O)C=CCCCCCCCO MCULE-6067845776 [0,2,0,0,0,0|0,0,1]=3 1558 B12R0.234 O=C(O)CCCCCCCCCBr MCULE-5728710095 [0,2,0,0,0,0|0,0,0]=2 1559 B12R0.234 O=C(O)CCCCCCCCCF MCULE-1907577974 [0,2,0,0,0,0|0,0,0]=2 1560 B12R0.234 O=C(O)CCCCCCCCCO MCULE-3771681317 [0,2,0,0,0,0|0,0,0]=2 1561 B12R0.234 O=N(=O)CCCCCCCCCBr MCULE-3636866484 [0,2,0,0,0,0|1,0,1]=4 1562 B12R0.234 O=N(=O)CCCCCCCCCO MCULE-4658294221 [0,2,0,0,0,0|1,0,1]=4 1563 B12R0.268 C=C(C)CCCCCCOC(=O)C MCULE-3590471537 [0,2,0,0,0,0|1,0,1]=4 1564 B12R0.268 CC(=O)CCCCCC=CC(=O)O MCULE-5335097568 [0,2,0,0,0,0|0,0,2]=4 1565 B12R0.268 CC(=O)CCCCCCCC(=O)O MCULE-5299092348 [0,2,0,0,0,0|0,0,0]=2 1566 B12R0.268 CC(C)CCCCCCCC(=O)O MCULE-5820446421 [0,2,0,0,0,0|0,0,0]=2 1567 B12R0.268 CC(C)SCCCCCCC(=O)O MCULE-2523005761 [0,2,0,0,0,0|0,0,0]=2 1568 B12R0.268 CC(O)CCCCCCCC(=O)O MCULE-2753582455 [0,2,0,0,0,0|0,0,0]=2 1569 B12R0.268 NC(=O)CCCCCCCC(=O)O MCULE-3125592334 [0,2,0,0,0,0|0,0,1]=3 1570 B12R0.268 O=C(Cl)CCCCCCCC(=O)Cl MCULE-9993434552 [0,2,0,0,0,0|1,0,1]=4 1571 B12R0.268 O=C(O)CCCCCCCC(=O)O MCULE-4093240509 [0,2,0,0,0,0|0,0,1]=3 1572 B12R0.268 O=C(O)CCCCCCON(=O)=O MCULE-5045906943 [0,2,0,0,0,0|2,0,0]=4 1573 B12R0.268 O=C(O)CCCCNCCC(=O)O MCULE-2001162043 [0,2,0,0,0,0|1,0,1]=4 1574 B12R0.268 O=C(O)CCCCNCCC(=O)O MCULE-8676764057 [0,2,0,0,0,0|1,0,1]=4 1575 B12R0.268 O=C(O)CCCNCCCC(=O)O MCULE-1624663865 [0,2,0,0,0,0|1,0,1]=4 1576 B12R0.268 O=C(O)CCCOCCCC(=O)O MCULE-5250506996 [0,2,0,0,0,0|1,0,1]=4 1577 B10R1.10 CCCC1CC(=O)CCN1 MCULE-1509807204 [1,0,0,1,0,0|2,0,0]=4 1578 B10R1.10 CCCC1CC(=O)CCN1 MCULE-1669137140 [1,0,0,1,0,0|2,0,0]=4 1579 B10R1.10 CCCC1CC(=O)CCO1 MCULE-7566764510 [1,0,0,1,0,0|2,0,0]=4 1580 B10R1.10 CCCC1CCCC(=O)C1 MCULE-7668769463 [1,0,0,1,0,0|1,0,0]=3 1581 B10R1.10 CCCC1CCCC(=O)O1 MCULE-9181432444 [1,0,0,1,0,0|0,0,0]=2 1582 B10R1.10 CCCC1CCCC(C1)O MCULE-6301598723 [1,0,0,1,0,0|1,0,1]=4 1583 B10R1.10 CCCC1CCNC(=O)C1 MCULE-2999950135 [1,0,0,1,0,0|2,0,0]=4 1584 B10R1.10 CCOC1CCCC(=O)C1 MCULE-1985935662 [1,0,0,1,0,0|2,0,0]=4 1585 B10R1.10 COCC1CCCC(=O)C1 MCULE-5201599537 [1,0,0,1,0,0|2,0,0]=4 1586 B10R1.10 O=C1CCCC(O1)CCBr MCULE-4728327671 [1,0,0,1,0,0|1,0,0]=3 1587 B10R1.16 CCCCC1CCC(=O)O1 MCULE-2172174471 [1,0,0,1,0,0|0,0,0]=2 1588 B10R1.16 CCCCC1CNC(=O)C1 MCULE-7940886893 [1,0,0,1,0,0|2,0,0]=4 1589 B10R1.16 CCCCC1COC(=O)N1 MCULE-7413985675 [1,0,0,1,0,0|2,0,0]=4 1590 B10R1.18 CC(=O)CC1CCCCC1 MCULE-4557008527 [1,0,0,1,0,0|1,0,0]=3 1591 B10R1.18 CC(=O)CC1CCCCN1 MCULE-1827771795 [1,0,0,1,0,0|2,0,0]=4 1592 B10R1.18 CC(=O)CC1CCCCN1 MCULE-9317294757 [1,0,0,1,0,0|2,0,0]=4 1593 B10R1.18 CC(=O)CC1CCCCO1 MCULE-1058487646 [1,0,0,1,0,0|2,0,0]=4 1594 B10R1.18 CC(=O)CC1CCCOC1 MCULE-4781249046 [1,0,0,1,0,0|2,0,0]=4 1595 B10R1.18 CC(=O)CC1CCNCC1 MCULE-3381787603 [1,0,0,1,0,0|2,0,0]=4 1596 B10R1.18 CC(=O)CC1CCNCC1 MCULE-3485224360 [1,0,0,1,0,0|2,0,0]=4 1597 B10R1.18 CC(=O)CC1CCOCC1 MCULE-6845890561 [1,0,0,1,0,0|2,0,0]=4 1598 B10R1.18 CC(=O)CN1CCCCC1 MCULE-2519145455 [1,0,0,1,0,0|2,0,0]=4 1599 B10R1.18 CC(=O)CN1CCCCC1 MCULE-8358959341 [1,0,0,1,0,0|2,0,0]=4 1600 B10R1.18 CC(=O)C[C@H]1CCCCN1 MCULE-2330430389 [1,0,0,1,0,0|2,0,0]=4 1601 B10R1.18 CC(=O)NC1CCCCC1 MCULE-8353778142 [1,0,0,1,0,0|2,0,0]=4 1602 B10R1.18 CC(=O)OC1CCCCC1 MCULE-8221153491 [1,0,0,1,0,0|2,0,0]=4 1603 B10R1.18 C[C@@H](O)CC1CCCCC1 MCULE-4273662766 [1,0,0,1,0,0|1,0,1]=4 1604 B10R1.18 C[C@H](O)CC1CCCCC1 MCULE-7528064890 [1,0,0,1,0,0|1,0,1]=4 1605 B10R1.18 N=C(N)CC1CCCCC1 MCULE-8473334050 [1,0,0,1,0,0|2,0,0]=4 1606 B10R1.18 N=C(N)CC1CCCCC1 MCULE-9393856468 [1,0,0,1,0,0|2,0,0]=4 1607 B10R1.18 NC(=O)CC1CCCCC1 MCULE-4951525688 [1,0,0,1,0,0|1,0,0]=3 1608 B10R1.18 NC(=O)CC1CCCCN1 MCULE-2185479052 [1,0,0,1,0,0|2,0,0]=4 1609 B10R1.18 NC(=O)CC1CCCCN1 MCULE-4538477610 [1,0,0,1,0,0|2,0,0]=4 1610 B10R1.18 NC(=O)CC1CCCNC1 MCULE-9261260462 [1,0,0,1,0,0|2,0,0]=4 1611 B10R1.18 NC(=O)CC1CCCNC1 MCULE-9756580933 [1,0,0,1,0,0|2,0,0]=4 1612 B10R1.18 NC(=O)CC1CCNCC1 MCULE-4391382932 [1,0,0,1,0,0|2,0,0]=4 1613 B10R1.18 NC(=O)CC1CCNCC1 MCULE-4639158092 [1,0,0,1,0,0|2,0,0]=4 1614 B10R1.18 NC(=O)CC1CCOCC1 MCULE-6220113088 [1,0,0,1,0,0|2,0,0]=4 1615 B10R1.18 NC(=O)CN1CCCCC1 MCULE-5267943459 [1,0,0,1,0,0|2,0,0]=4 1616 B10R1.18 NC(=O)NC1CCCCC1 MCULE-8036346010 [1,0,0,1,0,0|2,0,0]=4 1617 B10R1.18 NC(=O)OC1CCCCC1 MCULE-3235010863 [1,0,0,1,0,0|2,0,0]=4 1618 B10R1.18 NC(=S)CC1CCCCC1 MCULE-2529176221 [1,0,0,1,0,0|1,1,0]=4 1619 B10R1.18 O=C(Cl)CC1CCCCC1 MCULE-2220383860 [1,0,0,1,0,0|1,0,0]=3 1620 B10R1.18 O=C(Cl)CC1CCOCC1 MCULE-6068907888 [1,0,0,1,0,0|2,0,0]=4 1621 B10R1.18 O=C(Cl)OC1CCCCC1 MCULE-4011557961 [1,0,0,1,0,0|2,0,0]=4 1622 B10R1.18 O=C(O)C=C1CCCCC1 MCULE-2830279446 [1,0,0,1,0,0|0,0,2]=4 1623 B10R1.18 O=C(O)CC1=CCCCC1 MCULE-9909477927 [1,0,0,1,0,0|0,0,2]=4 1624 B10R1.18 O=C(O)CC1C=CCCC1 MCULE-3207533436 [1,0,0,1,0,0|0,0,2]=4 1625 B10R1.18 O=C(O)CC1CC=CCC1 MCULE-3427584067 [1,0,0,1,0,0|0,0,2]=4 1626 B10R1.18 O=C(O)CC1CCCCC1 MCULE-3370925166 [1,0,0,1,0,0|0,0,0]=2 1627 B10R1.18 O=C(O)CC1CCCCN1 MCULE-7593127940 [1,0,0,1,0,0|1,0,0]=3 1628 B10R1.18 O=C(O)CC1CCCCN1 MCULE-7653711252 [1,0,0,1,0,0|1,0,0]=3 1629 B10R1.18 O=C(O)CC1CCCCO1 MCULE-2711682647 [1,0,0,1,0,0|1,0,0]=3 1630 B10R1.18 O=C(O)CC1CCCNC1 MCULE-3254470591 [1,0,0,1,0,0|1,0,0]=3 1631 B10R1.18 O=C(O)CC1CCCNC1 MCULE-7958803985 [1,0,0,1,0,0|1,0,0]=3 1632 B10R1.18 O=C(O)CC1CCCOC1 MCULE-5877605158 [1,0,0,1,0,0|1,0,0]=3 1633 B10R1.18 O=C(O)CC1CCNCC1 MCULE-1130327966 [1,0,0,1,0,0|1,0,0]=3 1634 B10R1.18 O=C(O)CC1CCNCC1 MCULE-2100213856 [1,0,0,1,0,0|1,0,0]=3 1635 B10R1.18 O=C(O)CC1CCOCC1 MCULE-7878329119 [1,0,0,1,0,0|1,0,0]=3 1636 B10R1.18 O=C(O)CC1CCSCC1 MCULE-3567762107 [1,0,0,1,0,0|1,0,0]=3 1637 B10R1.18 O=C(O)CC1CNCCN1 MCULE-5141588986 [1,0,0,1,0,0|2,0,0]=4 1638 B10R1.18 O=C(O)CC1CNCCO1 MCULE-3058504133 [1,0,0,1,0,0|2,0,0]=4 1639 B10R1.18 O=C(O)CC1CNCCO1 MCULE-3387061328 [1,0,0,1,0,0|2,0,0]=4 1640 B10R1.18 O=C(O)CC1CNCCO1 MCULE-4327756750 [1,0,0,1,0,0|2,0,0]=4 1641 B10R1.18 O=C(O)CC1CNCCO1 MCULE-4883251317 [1,0,0,1,0,0|2,0,0]=4 1642 B10R1.18 O=C(O)CC1COCCN1 MCULE-4486190659 [1,0,0,1,0,0|2,0,0]=4 1643 B10R1.18 O=C(O)CC1COCCN1 MCULE-8010316572 [1,0,0,1,0,0|2,0,0]=4 1644 B10R1.18 O=C(O)CC1COCCO1 MCULE-8632741098 [1,0,0,1,0,0|2,0,0]=4 1645 B10R1.18 O=C(O)CC1CSCCS1 MCULE-4793456872 [1,0,0,1,0,0|2,0,0]=4 1646 B10R1.18 O=C(O)CC1OCCCO1 MCULE-1471723881 [1,0,0,1,0,0|2,0,0]=4 1647 B10R1.18 O=C(O)CN1CCCCC1 MCULE-9137136186 [1,0,0,1,0,0|1,0,0]=3 1648 B10R1.18 O=C(O)CN1CCCCC1 MCULE-9769416161 [1,0,0,1,0,0|1,0,0]=3 1649 B10R1.18 O=C(O)CN1CCNCC1 MCULE-4945447446 [1,0,0,1,0,0|2,0,0]=4 1650 B10R1.18 O=C(O)CN1CCNCC1 MCULE-6990903527 [1,0,0,1,0,0|2,0,0]=4 1651 B10R1.18 O=C(O)CN1CCNCC1 MCULE-8811795576 [1,0,0,1,0,0|2,0,0]=4 1652 B10R1.18 O=C(O)CN1CCOCC1 MCULE-2955270234 [1,0,0,1,0,0|2,0,0]=4 1653 B10R1.18 O=C(O)CN1CCOCC1 MCULE-5710414541 [1,0,0,1,0,0|2,0,0]=4 1654 B10R1.18 O=C(O)CN1CCSCC1 MCULE-9107067895 [1,0,0,1,0,0|2,0,0]=4 1655 B10R1.18 O=C(O)CN1CCSCC1 MCULE-9299535292 [1,0,0,1,0,0|2,0,0]=4 1656 B10R1.18 O=C(O)C[C@@H]1CC=CCC1 MCULE-6316447839 [1,0,0,1,0,0|0,0,2]=4 1657 B10R1.18 O=C(O)C[C@@H]1CCCCN1 MCULE-3905830299 [1,0,0,1,0,0|1,0,0]=3 1658 B10R1.18 O=C(O)C[C@@H]1CCCCN1 MCULE-5277218457 [1,0,0,1,0,0|1,0,0]=3 1659 B10R1.18 O=C(O)C[C@@H]1CCCCN1 MCULE-7510387772 [1,0,0,1,0,0|1,0,0]=3 1660 B10R1.18 O=C(O)C[C@@H]1CCCNC1 MCULE-5325818659 [1,0,0,1,0,0|1,0,0]=3 1661 B10R1.18 O=C(O)C[C@@H]1CCCNC1 MCULE-7001078313 [1,0,0,1,0,0|1,0,0]=3 1662 B10R1.18 O=C(O)C[C@@H]1CCCNC1 MCULE-8120215253 [1,0,0,1,0,0|1,0,0]=3 1663 B10R1.18 O=C(O)C[C@@H]1CCCNC1 MCULE-9602652995 [1,0,0,1,0,0|1,0,0]=3 1664 B10R1.18 O=C(O)C[C@@H]1CNCCO1 MCULE-4498530905 [1,0,0,1,0,0|2,0,0]=4 1665 B10R1.18 O=C(O)C[C@@H]1CNCCO1 MCULE-4549445854 [1,0,0,1,0,0|2,0,0]=4 1666 B10R1.18 O=C(O)C[C@@H]1CNCCO1 MCULE-5055136882 [1,0,0,1,0,0|2,0,0]=4 1667 B10R1.18 O=C(O)C[C@@H]1CNCCO1 MCULE-7244079860 [1,0,0,1,0,0|2,0,0]=4 1668 B10R1.18 O=C(O)C[C@@H]1COCCN1 MCULE-2046760558 [1,0,0,1,0,0|2,0,0]=4 1669 B10R1.18 O=C(O)C[C@@H]1COCCN1 MCULE-4473145834 [1,0,0,1,0,0|2,0,0]=4 1670 B10R1.18 O=C(O)C[C@@H]1COCCN1 MCULE-5100169676 [1,0,0,1,0,0|2,0,0]=4 1671 B10R1.18 O=C(O)C[C@H]1CCCCN1 MCULE-3680996115 [1,0,0,1,0,0|1,0,0]=3 1672 B10R1.18 O=C(O)C[C@H]1CCCCN1 MCULE-4674662417 [1,0,0,1,0,0|1,0,0]=3 1673 B10R1.18 O=C(O)C[C@H]1CCCNC1 MCULE-1302740697 [1,0,0,1,0,0|1,0,0]=3 1674 B10R1.18 O=C(O)C[C@H]1CCCNC1 MCULE-2509529219 [1,0,0,1,0,0|1,0,0]=3 1675 B10R1.18 O=C(O)C[C@H]1CCCNC1 MCULE-3753473259 [1,0,0,1,0,0|1,0,0]=3 1676 B10R1.18 O=C(O)C[C@H]1CCCNC1 MCULE-9619904988 [1,0,0,1,0,0|1,0,0]=3 1677 B10R1.18 O=C(O)C[C@H]1CNCCO1 MCULE-1832902178 [1,0,0,1,0,0|2,0,0]=4 1678 B10R1.18 O=C(O)C[C@H]1CNCCO1 MCULE-5015018730 [1,0,0,1,0,0|2,0,0]=4 1679 B10R1.18 O=C(O)C[C@H]1CNCCO1 MCULE-5838446318 [1,0,0,1,0,0|2,0,0]=4 1680 B10R1.18 O=C(O)C[C@H]1CNCCO1 MCULE-9119322865 [1,0,0,1,0,0|2,0,0]=4 1681 B10R1.18 O=C(O)C[C@H]1COCCN1 MCULE-8571286067 [1,0,0,1,0,0|2,0,0]=4 1682 B10R1.18 O=C(O)C[C@H]1COCCN1 MCULE-9555376320 [1,0,0,1,0,0|2,0,0]=4 1683 B10R1.18 O=C(O)NC1CCCCC1 MCULE-5645794848 [1,0,0,1,0,0|1,0,0]=3 1684 B10R1.18 O=P(O)CN1CCCCC1 MCULE-5899780033 [1,0,0,1,0,0|2,0,0]=4 1685 B10R1.18 OB(O)CC1CCCCC1 MCULE-6141319242 [1,0,0,1,0,0|1,0,1]=4 1686 B10R1.24 CCCCCC1CC(=O)C1 MCULE-5494050284 [1,0,0,1,0,0|1,0,0]=3 1687 B10R1.39 CCC1CCCC1C(=O)O MCULE-2134315765 [1,0,0,1,0,0|0,0,0]=2 1688 B10R1.39 CCC1CCNC1C(=O)O MCULE-1392850907 [1,0,0,1,0,0|1,0,0]=3 1689 B10R1.39 CCC1CCNC1C(=O)O MCULE-2618729884 [1,0,0,1,0,0|1,0,0]=3 1690 B10R1.39 CCC1NCCC1C(=O)O MCULE-6308897662 [1,0,0,1,0,0|1,0,0]=3 1691 B10R1.39 CCC1NCCC1C(=O)O MCULE-6989316364 [1,0,0,1,0,0|1,0,0]=3 1692 B10R1.39 CCC1OCCC1C(=O)O MCULE-3029813377 [1,0,0,1,0,0|1,0,0]=3 1693 B10R1.39 CCN1CCCC1C(=O)O MCULE-9170639085 [1,0,0,1,0,0|1,0,0]=3 1694 B10R1.39 CCN1CCC[C@@H]1C(=O)N MCULE-2931781805 [1,0,0,1,0,0|2,0,0]=4 1695 B10R1.39 CCN1CCC[C@@H]1C(=O)O MCULE-6272401541 [1,0,0,1,0,0|1,0,0]=3 1696 B10R1.39 CCN1CCC[C@H]1C(=O)N MCULE-7196500635 [1,0,0,1,0,0|2,0,0]=4 1697 B10R1.39 CCN1CCC[C@H]1C(=O)N MCULE-8340783541 [1,0,0,1,0,0|2,0,0]=4 1698 B10R1.39 CCN1CCC[C@H]1C(=O)O MCULE-4672768595 [1,0,0,1,0,0|1,0,0]=3 1699 B10R1.39 CCN1CCC[C@H]1C(=O)O MCULE-5066096497 [1,0,0,1,0,0|1,0,0]=3 1700 B10R1.39 CC[C@@H]1CNC[C@@H]1C(=O)O MCULE-8464460557 [1,0,0,1,0,0|1,0,0]=3 1701 B10R1.39 CC[C@H]1CNC[C@H]1C(=O)O MCULE-2742804200 [1,0,0,1,0,0|1,0,0]=3 1702 B10R1.39 COC1CCCC1C(=O)O MCULE-6165424004 [1,0,0,1,0,0|1,0,0]=3 1703 B10R1.39 CSC1CCCC1C(=O)O MCULE-7830513386 [1,0,0,1,0,0|1,0,0]=3 1704 B10R1.39 NCC1CCCC1C(=O)O MCULE-5775773821 [1,0,0,1,0,0|1,0,0]=3 1705 B10R1.39 NCC1CCCC1C(=O)O MCULE-6872336527 [1,0,0,1,0,0|1,0,0]=3 1706 B10R1.39 NCC1OCCC1C(=O)O MCULE-2668866861 [1,0,0,1,0,0|2,0,0]=4 1707 B10R1.39 NCC1OCCC1C(=O)O MCULE-9067491644 [1,0,0,1,0,0|2,0,0]=4 1708 B10R1.39 O=C(O)C1CNCC1CO MCULE-4689035983 [1,0,0,1,0,0|2,0,0]=4 1709 B10R1.61 CC(=O)C1CCCCC1C MCULE-9283684652 [1,0,0,1,0,0|1,0,0]=3 1710 B10R1.61 CC(=O)C1CCCCC1F MCULE-4625331195 [1,0,0,1,0,0|2,0,0]=4 1711 B10R1.61 CC(=O)C1CCCCC1N MCULE-2419182932 [1,0,0,1,0,0|2,0,0]=4 1712 B10R1.61 CC(=O)C1CCCCC1N MCULE-6311029678 [1,0,0,1,0,0|2,0,0]=4 1713 B10R1.61 CC(=O)C1NCCCC1C MCULE-2230049407 [1,0,0,1,0,0|2,0,0]=4 1714 B10R1.61 CC(=O)C1NCCCC1C MCULE-8677498528 [1,0,0,1,0,0|2,0,0]=4 1715 B10R1.61 CC1=C(CCCC1)C(=O)O MCULE-2899177590 [1,0,0,1,0,0|0,0,2]=4 1716 B10R1.61 CC1CC=CCC1C(=O)O MCULE-9141456284 [1,0,0,1,0,0|0,0,2]=4 1717 B10R1.61 CC1CCCC=C1C(=O)O MCULE-2002913109 [1,0,0,1,0,0|0,0,2]=4 1718 B10R1.61 CC1CCCCC1C(=O)Cl MCULE-7597713129 [1,0,0,1,0,0|1,0,0]=3 1719 B10R1.61 CC1CCCCC1C(=O)O MCULE-3305682191 [1,0,0,1,0,0|0,0,0]=2 1720 B10R1.61 CC1CCCCN1C(=O)Cl MCULE-6389946008 [1,0,0,1,0,0|2,0,0]=4 1721 B10R1.61 CC1CCCNC1C(=O)N MCULE-8821146640 [1,0,0,1,0,0|2,0,0]=4 1722 B10R1.61 CC1CCNCC1C(=O)O MCULE-8748624987 [1,0,0,1,0,0|1,0,0]=3 1723 B10R1.61 CC1CCNCC1C(=O)O MCULE-9934986088 [1,0,0,1,0,0|1,0,0]=3 1724 B10R1.61 CC1CNCCC1C(=O)O MCULE-4662714630 [1,0,0,1,0,0|1,0,0]=3 1725 B10R1.61 CC1CNCCC1C(=O)O MCULE-7019458300 [1,0,0,1,0,0|1,0,0]=3 1726 B10R1.61 CC1COCCC1C(=O)O MCULE-3541844170 [1,0,0,1,0,0|1,0,0]=3 1727 B10R1.61 CC1NCCCC1C(=O)O MCULE-1657397096 [1,0,0,1,0,0|1,0,0]=3 1728 B10R1.61 CC1NCCCC1C(=O)O MCULE-3297923255 [1,0,0,1,0,0|1,0,0]=3 1729 B10R1.61 CC1OCCCC1C(=O)O MCULE-1412449239 [1,0,0,1,0,0|1,0,0]=3 1730 B10R1.61 CC1OCCNC1C(=O)O MCULE-7650728786 [1,0,0,1,0,0|2,0,0]=4 1731 B10R1.61 CC1OCCNC1C(=O)O MCULE-7980002158 [1,0,0,1,0,0|2,0,0]=4 1732 B10R1.61 CN1CCCCC1C(=O)O MCULE-3456275150 [1,0,0,1,0,0|1,0,0]=3 1733 B10R1.61 CN1CCCCC1C(=O)O MCULE-6372652181 [1,0,0,1,0,0|1,0,0]=3 1734 B10R1.61 CN1CCCCC1C(=O)O MCULE-7834522939 [1,0,0,1,0,0|1,0,0]=3 1735 B10R1.61 CN1CCCC[C@@H]1C(=O)O MCULE-2245294368 [1,0,0,1,0,0|1,0,0]=3 1736 B10R1.61 CN1CCCC[C@@H]1C(=O)O MCULE-2258119449 [1,0,0,1,0,0|1,0,0]=3 1737 B10R1.61 CN1CCCC[C@@H]1C(=O)O MCULE-4757725445 [1,0,0,1,0,0|1,0,0]=3 1738 B10R1.61 CN1CCCC[C@@H]1C(=O)O MCULE-9648696079 [1,0,0,1,0,0|1,0,0]=3 1739 B10R1.61 CN1CCCC[C@H]1C(=O)O MCULE-5396822712 [1,0,0,1,0,0|1,0,0]=3 1740 B10R1.61 CN1CCCC[C@H]1C(=O)O MCULE-5529863786 [1,0,0,1,0,0|1,0,0]=3 1741 B10R1.61 CN1CCNCC1C(=O)O MCULE-1461373192 [1,0,0,1,0,0|2,0,0]=4 1742 B10R1.61 CN1CCNCC1C(=O)O MCULE-2314108697 [1,0,0,1,0,0|2,0,0]=4 1743 B10R1.61 CN1CCNCC1C(=O)O MCULE-6876364616 [1,0,0,1,0,0|2,0,0]=4 1744 B10R1.61 CN1CCNC[C@@H]1C(=O)O MCULE-6844980804 [1,0,0,1,0,0|2,0,0]=4 1745 B10R1.61 CN1CCNC[C@@H]1C(=O)O MCULE-9108769184 [1,0,0,1,0,0|2,0,0]=4 1746 B10R1.61 CN1CCNC[C@H]1C(=O)O MCULE-5706230528 [1,0,0,1,0,0|2,0,0]=4 1747 B10R1.61 CN1CCNC[C@H]1C(=O)O MCULE-6493932779 [1,0,0,1,0,0|2,0,0]=4 1748 B10R1.61 CN1CCOCC1C(=O)O MCULE-3133710690 [1,0,0,1,0,0|2,0,0]=4 1749 B10R1.61 CN1CCOCC1C(=O)O MCULE-3290676693 [1,0,0,1,0,0|2,0,0]=4 1750 B10R1.61 CN1CCOC[C@@H]1C(=O)O MCULE-1062473078 [1,0,0,1,0,0|2,0,0]=4 1751 B10R1.61 CN1CCOC[C@@H]1C(=O)O MCULE-1353468073 [1,0,0,1,0,0|2,0,0]=4 1752 B10R1.61 CN1CCOC[C@@H]1C(=O)O MCULE-2754171059 [1,0,0,1,0,0|2,0,0]=4 1753 B10R1.61 CN1CCOC[C@@H]1C(=O)O MCULE-8165717473 [1,0,0,1,0,0|2,0,0]=4 1754 B10R1.61 CN1CCOC[C@H]1C(=O)O MCULE-4042448961 [1,0,0,1,0,0|2,0,0]=4 1755 B10R1.61 CN1CCOC[C@H]1C(=O)O MCULE-4563667791 [1,0,0,1,0,0|2,0,0]=4 1756 B10R1.61 CN1CCOC[C@H]1C(=O)O MCULE-6824999437 [1,0,0,1,0,0|2,0,0]=4 1757 B10R1.61 CN1CCOC[C@H]1C(=O)O MCULE-9114074540 [1,0,0,1,0,0|2,0,0]=4 1758 B10R1.61 C[C@@H]1CCCN[C@@H]1C(=O)N MCULE-1327276849 [1,0,0,1,0,0|2,0,0]=4 1759 B10R1.61 C[C@@H]1CCCN[C@@H]1C(=O)N MCULE-3578282795 [1,0,0,1,0,0|2,0,0]=4 1760 B10R1.61 C[C@@H]1NCCC[C@@H]1C(=O)O MCULE-5453839569 [1,0,0,1,0,0|1,0,0]=3 1761 B10R1.61 C[C@@H]1NCCC[C@@H]1C(=O)O MCULE-8712948607 [1,0,0,1,0,0|1,0,0]=3 1762 B10R1.61 C[C@@H]1NCCC[C@H]1C(=O)O MCULE-4097586923 [1,0,0,1,0,0|1,0,0]=3 1763 B10R1.61 C[C@@H]1OCCN[C@@H]1C(=O)O MCULE-5754974970 [1,0,0,1,0,0|2,0,0]=4 1764 B10R1.61 C[C@@H]1OCCN[C@@H]1C(=O)O MCULE-9389286375 [1,0,0,1,0,0|2,0,0]=4 1765 B10R1.61 C[C@H]1NCCC[C@@H]1C(=O)O MCULE-1705027594 [1,0,0,1,0,0|1,0,0]=3 1766 B10R1.61 C[C@H]1NCCC[C@H]1C(=O)O MCULE-8221283836 [1,0,0,1,0,0|1,0,0]=3 1767 B10R1.61 C[C@H]1NCCC[C@H]1C(=O)O MCULE-8542699735 [1,0,0,1,0,0|1,0,0]=3 1768 B10R1.61 C[C@H]1OCCC[C@H]1C(=O)O MCULE-9860065784 [1,0,0,1,0,0|1,0,0]=3 1769 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-1879170734 [1,0,0,1,0,0|2,0,0]=4 1770 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-4061314927 [1,0,0,1,0,0|2,0,0]=4 1771 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-4489336660 [1,0,0,1,0,0|2,0,0]=4 1772 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-4667134552 [1,0,0,1,0,0|2,0,0]=4 1773 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-5449945964 [1,0,0,1,0,0|2,0,0]=4 1774 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-7387257453 [1,0,0,1,0,0|2,0,0]=4 1775 B10R1.61 NC(=O)C1CCCCC1N MCULE-2662216069 [1,0,0,1,0,0|2,0,0]=4 1776 B10R1.61 NC(=O)C1CCCCC1N MCULE-7467804033 [1,0,0,1,0,0|2,0,0]=4 1777 B10R1.61 NC(=O)[C@@H]1CCCC[C@@H]1N MCULE-2263565157 [1,0,0,1,0,0|2,0,0]=4 1778 B10R1.61 NC(=O)[C@@H]1CCCC[C@@H]1N MCULE-4928808183 [1,0,0,1,0,0|2,0,0]=4 1779 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N MCULE-3135295628 [1,0,0,1,0,0|2,0,0]=4 1780 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N MCULE-6221057684 [1,0,0,1,0,0|2,0,0]=4 1781 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N MCULE-8654148060 [1,0,0,1,0,0|2,0,0]=4 1782 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N MCULE-9581516213 [1,0,0,1,0,0|2,0,0]=4 1783 B10R1.61 NC1CCCCC1C(=O)O MCULE-4736252154 [1,0,0,1,0,0|1,0,0]=3 1784 B10R1.61 NC1CCCCC1C(=O)O MCULE-6203238767 [1,0,0,1,0,0|1,0,0]=3 1785 B10R1.61 NC1COCCC1C(=O)O MCULE-3475622537 [1,0,0,1,0,0|2,0,0]=4 1786 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O MCULE-1790728170 [1,0,0,1,0,0|1,0,0]=3 1787 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O MCULE-3150171920 [1,0,0,1,0,0|1,0,0]=3 1788 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O MCULE-4600025587 [1,0,0,1,0,0|1,0,0]=3 1789 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O MCULE-9708582870 [1,0,0,1,0,0|1,0,0]=3 1790 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O MCULE-3088249896 [1,0,0,1,0,0|1,0,0]=3 1791 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O MCULE-4663931442 [1,0,0,1,0,0|1,0,0]=3 1792 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O MCULE-6017464144 [1,0,0,1,0,0|1,0,0]=3 1793 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O MCULE-9507759371 [1,0,0,1,0,0|1,0,0]=3 1794 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O MCULE-2040720562 [1,0,0,1,0,0|1,0,0]=3 1795 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O MCULE-5411687824 [1,0,0,1,0,0|1,0,0]=3 1796 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O MCULE-6353451287 [1,0,0,1,0,0|1,0,0]=3 1797 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O MCULE-9744443114 [1,0,0,1,0,0|1,0,0]=3 1798 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O MCULE-1070315128 [1,0,0,1,0,0|1,0,0]=3 1799 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O MCULE-2665445473 [1,0,0,1,0,0|1,0,0]=3 1800 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O MCULE-5776301031 [1,0,0,1,0,0|1,0,0]=3 1801 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O MCULE-7183400727 [1,0,0,1,0,0|1,0,0]=3 1802 B10R1.61 N[C@H]1COCC[C@H]1C(=O)O MCULE-4608934385 [1,0,0,1,0,0|2,0,0]=4 1803 B10R1.61 N[C@H]1COCC[C@H]1C(=O)O MCULE-7590284479 [1,0,0,1,0,0|2,0,0]=4 1804 B10R1.61 O=C(O)C1CCCCC1=O MCULE-1684765148 [1,0,0,1,0,0|1,0,1]=4 1805 B10R1.61 O=C(O)C1CCCCC1F MCULE-9495362772 [1,0,0,1,0,0|1,0,0]=3 1806 B10R1.61 O=C(O)C1CCCCC1O MCULE-4502285714 [1,0,0,1,0,0|1,0,0]=3 1807 B10R1.61 O=C(O)C1CCCCN1O MCULE-1338694603 [1,0,0,1,0,0|2,0,0]=4 1808 B10R1.61 O=C(O)C1CCNCC1F MCULE-5749357486 [1,0,0,1,0,0|2,0,0]=4 1809 B10R1.61 O=C(O)C1CCNCC1F MCULE-7431262807 [1,0,0,1,0,0|2,0,0]=4 1810 B10R1.61 O=C(O)C1NCCCC1O MCULE-2981139992 [1,0,0,1,0,0|2,0,0]=4 1811 B10R1.61 O=C(O)[C@@H]1NCCC[C@H]1O MCULE-2224593354 [1,0,0,1,0,0|2,0,0]=4 1812 B10R1.61 O=C(O)[C@@H]1NCCC[C@H]1O MCULE-3743184576 [1,0,0,1,0,0|2,0,0]=4 1813 B10R1.61 O=C(O)[C@H]1NCCC[C@@H]1O MCULE-2137327596 [1,0,0,1,0,0|2,0,0]=4 1814 B10R1.61 O=C(O)[C@H]1NCCC[C@@H]1O MCULE-3028221093 [1,0,0,1,0,0|2,0,0]=4 1815 B10R1.61 O=C(O)[C@H]1NCCC[C@@H]1O MCULE-3468221525 [1,0,0,1,0,0|2,0,0]=4 1816 B10R1.61 O=C(O)[C@H]1NCCC[C@@H]1O MCULE-5449397815 [1,0,0,1,0,0|2,0,0]=4 1817 B10R1.61 O=C(O)[C@H]1NCCC[C@H]1O MCULE-2786788134 [1,0,0,1,0,0|2,0,0]=4 1818 B10R1.61 O=C(O)[C@H]1NCCC[C@H]1O MCULE-3262303247 [1,0,0,1,0,0|2,0,0]=4 1819 B10R1.61 O=C(O)[C@H]1NCCC[C@H]1O MCULE-4026886814 [1,0,0,1,0,0|2,0,0]=4 1820 B10R1.61 O=C(O)[C@H]1NCCC[C@H]1O MCULE-4165843552 [1,0,0,1,0,0|2,0,0]=4 1821 B10R1.64 CC(=O)CN1CCCC1C MCULE-5489343795 [1,0,0,1,0,0|2,0,0]=4 1822 B10R1.64 CC1CCCC1CC(=O)O MCULE-1034129697 [1,0,0,1,0,0|0,0,0]=2 1823 B10R1.64 CC1CCCN1CC(=O)O MCULE-5477147476 [1,0,0,1,0,0|1,0,0]=3 1824 B10R1.64 CC1CCCN1CC(=O)O MCULE-7787437864 [1,0,0,1,0,0|1,0,0]=3 1825 B10R1.64 CC1OCCC1CC(=O)O MCULE-3630286814 [1,0,0,1,0,0|1,0,0]=3 1826 B10R1.64 CN1CCCC1CC(=O)O MCULE-1900515698 [1,0,0,1,0,0|1,0,0]=3 1827 B10R1.64 CN1CCCC1CC(=O)O MCULE-4392051296 [1,0,0,1,0,0|1,0,0]=3 1828 B10R1.64 CN1CCC[C@H]1CC(=O)O MCULE-2926738632 [1,0,0,1,0,0|1,0,0]=3 1829 B10R1.64 NC1CCCC1CC(=O)O MCULE-7275948763 [1,0,0,1,0,0|1,0,0]=3 1830 B10R1.64 NC1CCCC1CC(=O)O MCULE-7852876693 [1,0,0,1,0,0|1,0,0]=3 1831 B10R1.64 O=C(O)CC1CCCC1=O MCULE-9371811615 [1,0,0,1,0,0|1,0,1]=4 1832 B10R1.66 CC(=O)CCC1CCCC1 MCULE-9602514524 [1,0,0,1,0,0|1,0,0]=3 1833 B10R1.66 NC(=O)CCC1CCCC1 MCULE-6308384459 [1,0,0,1,0,0|1,0,0]=3 1834 B10R1.66 NC(=O)CCN1CCCC1 MCULE-1109710642 [1,0,0,1,0,0|2,0,0]=4 1835 B10R1.66 NC(=O)CNC1CCCC1 MCULE-5401113380 [1,0,0,1,0,0|2,0,0]=4 1836 B10R1.66 NC(=O)CNC1CCCC1 MCULE-8595660552 [1,0,0,1,0,0|2,0,0]=4 1837 B10R1.66 NC(=O)COC1CCCC1 MCULE-6280655419 [1,0,0,1,0,0|2,0,0]=4 1838 B10R1.66 O=C(Cl)CCC1CCCC1 MCULE-6098498258 [1,0,0,1,0,0|1,0,0]=3 1839 B10R1.66 O=C(O)/C=C/C1CCCC1 MCULE-5196632480 [1,0,0,1,0,0|0,0,2]=4 1840 B10R1.66 O=C(O)C=CC1CCCC1 MCULE-4492328269 [1,0,0,1,0,0|0,0,2]=4 1841 B10R1.66 O=C(O)CCC1CCCC1 MCULE-4583118303 [1,0,0,1,0,0|0,0,0]=2 1842 B10R1.66 O=C(O)CCC1CCCN1 MCULE-2613608732 [1,0,0,1,0,0|1,0,0]=3 1843 B10R1.66 O=C(O)CCC1CCCN1 MCULE-8814917549 [1,0,0,1,0,0|1,0,0]=3 1844 B10R1.66 O=C(O)CCC1CCCO1 MCULE-4111498968 [1,0,0,1,0,0|1,0,0]=3 1845 B10R1.66 O=C(O)CCC1CCNC1 MCULE-8082069026 [1,0,0,1,0,0|1,0,0]=3 1846 B10R1.66 O=C(O)CCC1CCNC1 MCULE-8359539011 [1,0,0,1,0,0|1,0,0]=3 1847 B10R1.66 O=C(O)CCC1CCOC1 MCULE-9339795680 [1,0,0,1,0,0|1,0,0]=3 1848 B10R1.66 O=C(O)CCC1OCCO1 MCULE-1077920259 [1,0,0,1,0,0|2,0,0]=4 1849 B10R1.66 O=C(O)CCN1CCCC1 MCULE-4735526690 [1,0,0,1,0,0|1,0,0]=3 1850 B10R1.66 O=C(O)CCN1CCCC1 MCULE-6724732496 [1,0,0,1,0,0|1,0,0]=3 1851 B10R1.66 O=C(O)CCN1CCCO1 MCULE-4658280001 [1,0,0,1,0,0|2,0,0]=4 1852 B10R1.66 O=C(O)CCN1CCCO1 MCULE-5549624995 [1,0,0,1,0,0|2,0,0]=4 1853 B10R1.66 O=C(O)CC[C@@H]1CCCN1 MCULE-9918992229 [1,0,0,1,0,0|1,0,0]=3 1854 B10R1.66 O=C(O)CC[C@@H]1CCCO1 MCULE-8942407071 [1,0,0,1,0,0|1,0,0]=3 1855 B10R1.66 O=C(O)CC[C@H]1CCCO1 MCULE-8877470669 [1,0,0,1,0,0|1,0,0]=3 1856 B10R1.66 O=C(O)CNC1CCCC1 MCULE-2656159228 [1,0,0,1,0,0|1,0,0]=3 1857 B10R1.66 O=C(O)CNC1CCCC1 MCULE-9561013929 [1,0,0,1,0,0|1,0,0]=3 1858 B10R1.66 O=C(O)COC1CCCC1 MCULE-2079008170 [1,0,0,1,0,0|1,0,0]=3 1859 B10R1.66 O=C(O)COC1CCOC1 MCULE-9235017197 [1,0,0,1,0,0|2,0,0]=4 1860 B10R1.66 O=C(O)CSC1CCCC1 MCULE-7601914378 [1,0,0,1,0,0|1,0,0]=3 1861 B10R1.77 O=C1CCCCCC(=O)O1 MCULE-4901663442 [1,0,0,1,0,0|1,0,1]=4 1862 B10R1.78 O=C1CCCCCCCC1 MCULE-1205201333 [1,0,0,1,0,0|1,0,0]=3 1863 B10R1.78 O=C1CCCCCCCN1 MCULE-2754830482 [1,0,0,1,0,0|1,0,0]=3 1864 B10R1.78 O=C1CCCCCCCO1 MCULE-8839309567 [1,0,0,1,0,0|0,0,0]=2 1865 B10R1.86 C1(CCN1CCC)C(=O)O MCULE-6068820697 [1,0,0,1,0,0|1,0,0]=3 1866 B10R1.86 C1(CCN1CCF)C(=O)O MCULE-2135962737 [1,0,0,1,0,0|2,0,0]=4 1867 B10R1.86 CCCN1CCC1C(=O)O MCULE-3134623791 [1,0,0,1,0,0|1,0,0]=3 1868 B10R1.86 CCCN1CC[C@H]1C(=O)O MCULE-3091851598 [1,0,0,1,0,0|1,0,0]=3 1869 B10R1.86 CCCN1CC[C@H]1C(=O)O MCULE-5611349990 [1,0,0,1,0,0|1,0,0]=3 1870 B10R1.86 O=C(O)[C@@H]1CCN1CCF MCULE-3445864469 [1,0,0,1,0,0|2,0,0]=4 1871 B10R1.86 [C@H]1(CCN1CCF)C(=O)O MCULE-3345473633 [1,0,0,1,0,0|2,0,0]=4 1872 B10R1.126 O=C(O)CCCCC1CC1 MCULE-2606424315 [1,0,0,1,0,0|0,0,0]=2 1873 B10R1.126 O=C(O)CCNCC1CC1 MCULE-5098818326 [1,0,0,1,0,0|1,0,0]=3 1874 B10R1.126 O=C(O)CCOCC1CC1 MCULE-4509324999 [1,0,0,1,0,0|1,0,0]=3 1875 B10R1.126 O=C(O)CCSCC1CC1 MCULE-6245691771 [1,0,0,1,0,0|1,0,0]=3 1876 B10R1.127 O=C(O)CCCC1CCC1 MCULE-4719788416 [1,0,0,1,0,0|0,0,0]=2 1877 B10R1.127 O=C(O)CCOC1COC1 MCULE-4318139300 [1,0,0,1,0,0|2,0,0]=4 1878 B10R1.127 O=C(O)COCC1CCC1 MCULE-7673852901 [1,0,0,1,0,0|1,0,0]=3 1879 B10R1.144 CCCCC1CC1C(=O)O MCULE-5737299312 [1,0,0,1,0,0|0,0,0]=2 1880 B10R1.162 NCC1CCCCC(=O)N1 MCULE-4887883772 [1,0,0,1,0,0|2,0,0]=4 1881 B10R1.162 O=C1CCCCC(N1)CO MCULE-9454883286 [1,0,0,1,0,0|2,0,0]=4 1882 B10R1.348 CC(=O)C1CCCCCC1 MCULE-9324503120 [1,0,0,1,0,0|1,0,0]=3 1883 B10R1.348 CC(=O)N1CCCCCC1 MCULE-4232660324 [1,0,0,1,0,0|2,0,0]=4 1884 B10R1.348 CC(O)C1CCCCCC1 MCULE-6112396200 [1,0,0,1,0,0|1,0,1]=4 1885 B10R1.348 C[C@@H](O)C1CCCCCC1 MCULE-7903519728 [1,0,0,1,0,0|1,0,1]=4 1886 B10R1.348 C[C@H](O)C1CCCCCC1 MCULE-5041888426 [1,0,0,1,0,0|1,0,1]=4 1887 B10R1.348 N=C(N)C1CCCCCC1 MCULE-2361950713 [1,0,0,1,0,0|2,0,0]=4 1888 B10R1.348 N=C(N)C1CCCCCC1 MCULE-8756683037 [1,0,0,1,0,0|2,0,0]=4 1889 B10R1.348 NC(=O)C1CCCCCC1 MCULE-2005648941 [1,0,0,1,0,0|1,0,0]=3 1890 B10R1.348 NC(=O)C1CCCCNC1 MCULE-6748059498 [1,0,0,1,0,0|2,0,0]=4 1891 B10R1.348 NC(=O)C1CCCCNC1 MCULE-8697140088 [1,0,0,1,0,0|2,0,0]=4 1892 B10R1.348 NC(=O)N1CCCCCC1 MCULE-6181473782 [1,0,0,1,0,0|2,0,0]=4 1893 B10R1.348 O=C(Cl)C1CCCCCC1 MCULE-4659434885 [1,0,0,1,0,0|1,0,0]=3 1894 B10R1.348 O=C(Cl)N1CCCCCC1 MCULE-3861437886 [1,0,0,1,0,0|2,0,0]=4 1895 B10R1.348 O=C(O)C1=CCCCCC1 MCULE-5438079704 [1,0,0,1,0,0|0,0,2]=4 1896 B10R1.348 O=C(O)C1CCC=CCC1 MCULE-6767000432 [1,0,0,1,0,0|0,0,2]=4 1897 B10R1.348 O=C(O)C1CCCCCC1 MCULE-7903672891 [1,0,0,1,0,0|0,0,0]=2 1898 B10R1.348 O=C(O)C1CCCCCN1 MCULE-2741684183 [1,0,0,1,0,0|1,0,0]=3 1899 B10R1.348 O=C(O)C1CCCCCN1 MCULE-7374703751 [1,0,0,1,0,0|1,0,0]=3 1900 B10R1.348 O=C(O)C1CCCCNC1 MCULE-3392190626 [1,0,0,1,0,0|1,0,0]=3 1901 B10R1.348 O=C(O)C1CCCCNC1 MCULE-7795043703 [1,0,0,1,0,0|1,0,0]=3 1902 B10R1.348 O=C(O)C1CCCNCC1 MCULE-7690110773 [1,0,0,1,0,0|1,0,0]=3 1903 B10R1.348 O=C(O)C1CCCNCC1 MCULE-9766781803 [1,0,0,1,0,0|1,0,0]=3 1904 B10R1.348 O=C(O)C1CCCOCC1 MCULE-9318516869 [1,0,0,1,0,0|1,0,0]=3 1905 B10R1.348 O=C(O)C1CNCCCN1 MCULE-3558230210 [1,0,0,1,0,0|2,0,0]=4 1906 B10R1.348 O=C(O)C1CNCCCN1 MCULE-6835715048 [1,0,0,1,0,0|2,0,0]=4 1907 B10R1.348 O=C(O)C1CNCCCO1 MCULE-2282415374 [1,0,0,1,0,0|2,0,0]=4 1908 B10R1.348 O=C(O)C1CNCCCO1 MCULE-3064687044 [1,0,0,1,0,0|2,0,0]=4 1909 B10R1.348 O=C(O)C1COCCOC1 MCULE-7686530449 [1,0,0,1,0,0|2,0,0]=4 1910 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-2016813857 [1,0,0,1,0,0|1,0,0]=3 1911 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-2504826586 [1,0,0,1,0,0|1,0,0]=3 1912 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-4939523441 [1,0,0,1,0,0|1,0,0]=3 1913 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-8497154031 [1,0,0,1,0,0|1,0,0]=3 1914 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-1709248067 [1,0,0,1,0,0|1,0,0]=3 1915 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-4607599990 [1,0,0,1,0,0|1,0,0]=3 1916 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-4947785395 [1,0,0,1,0,0|1,0,0]=3 1917 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-8502245212 [1,0,0,1,0,0|1,0,0]=3 1918 B10R1.348 O=C(O)[C@H]1CCCNCC1 MCULE-2658567129 [1,0,0,1,0,0|1,0,0]=3 1919 B10R1.4 C#CCC1CCCCC1=O MCULE-5207298577 [1,0,0,1,0,0|0,0,2]=4 1920 B10R1.4 C=CCC1CCCCC1=O MCULE-5192402567 [1,0,0,1,0,0|0,0,2]=4 1921 B10R1.4 C=CCC1CCCCC1N MCULE-4315709833 [1,0,0,1,0,0|2,0,0]=4 1922 B10R1.4 C=CCC1CCCCC1O MCULE-3098883814 [1,0,0,1,0,0|2,0,0]=4 1923 B10R1.4 CC1CCCCC1CCN MCULE-3335129206 [1,0,0,1,0,0|1,0,1]=4 1924 B10R1.4 CC1CCCCN1CCO MCULE-3413721569 [1,0,0,1,0,0|1,0,1]=4 1925 B10R1.4 CC1CCCNC1CCO MCULE-6750887095 [1,0,0,1,0,0|1,0,1]=4 1926 B10R1.4 CCCC1=CCCCC1=O MCULE-9765434554 [1,0,0,1,0,0|0,0,2]=4 1927 B10R1.4 CCCC1CCCCC1=O MCULE-3320705054 [1,0,0,1,0,0|0,0,0]=2 1928 B10R1.4 CCCC1CCCCC1N MCULE-5022700480 [1,0,0,1,0,0|1,0,1]=4 1929 B10R1.4 CCCC1CCCCC1O MCULE-7446006713 [1,0,0,1,0,0|0,0,1]=3 1930 B10R1.4 CCCC1CCCCN1C MCULE-6814041819 [1,0,0,1,0,0|2,0,0]=4 1931 B10R1.4 CCCC1NCCNC1=O MCULE-9907026950 [1,0,0,1,0,0|2,0,0]=4 1932 B10R1.4 CCCN1CCNCC1=O MCULE-6335276136 [1,0,0,1,0,0|2,0,0]=4 1933 B10R1.4 CCCN1CCNCC1=O MCULE-9352928130 [1,0,0,1,0,0|2,0,0]=4 1934 B10R1.4 CCC[C@H]1OCCC[C@@H]1O MCULE-6368727966 [1,0,0,1,0,0|1,0,1]=4 1935 B10R1.4 CCNC1CCCCC1O MCULE-2443480945 [1,0,0,1,0,0|1,0,1]=4 1936 B10R1.4 CCN[C@@H]1CCCC[C@H]1O MCULE-3866695986 [1,0,0,1,0,0|1,0,1]=4 1937 B10R1.4 CCN[C@@H]1CCCC[C@H]1O MCULE-9998369380 [1,0,0,1,0,0|1,0,1]=4 1938 B10R1.4 CCOC1CCCCC1=O MCULE-9251299042 [1,0,0,1,0,0|1,0,0]=3 1939 B10R1.4 CCOC1CCCCC1O MCULE-1477945543 [1,0,0,1,0,0|1,0,1]=4 1940 B10R1.4 CN1CCCCC1CCO MCULE-4857811656 [1,0,0,1,0,0|1,0,1]=4 1941 B10R1.4 CNCC1CCCCC1O MCULE-3103334855 [1,0,0,1,0,0|1,0,1]=4 1942 B10R1.4 N#CCC1CCCCC1=O MCULE-8137543980 [1,0,0,1,0,0|1,0,1]=4 1943 B10R1.4 NCCN1CCCCC1=O MCULE-1427901317 [1,0,0,1,0,0|2,0,0]=4 1944 B10R1.4 NCCN1CCCCC1=O MCULE-6448945987 [1,0,0,1,0,0|2,0,0]=4 1945 B10R1.4 NCCN1CCCCC1=O MCULE-9599542364 [1,0,0,1,0,0|2,0,0]=4 1946 B10R1.4 O=C1CCCCN1CCO MCULE-2557885455 [1,0,0,1,0,0|2,0,0]=4 1947 B10R1.4 O=C1NCCCC1CCO MCULE-7839494483 [1,0,0,1,0,0|2,0,0]=4 1948 B10R1.5 CCCC1CCCC1CN MCULE-4555488401 [1,0,0,1,0,0|1,0,1]=4 1949 B10R1.5 CCCC1CCCC1CN MCULE-7754450722 [1,0,0,1,0,0|1,0,1]=4 1950 B10R1.5 COCC1CCCN1C=O MCULE-7280935888 [1,0,0,1,0,0|2,0,0]=4 1951 B10R1.5 COC[C@@H]1CCCN1C=O MCULE-1646250924 [1,0,0,1,0,0|2,0,0]=4 1952 B10R1.5 COC[C@@H]1CCCN1C=O MCULE-4654959513 [1,0,0,1,0,0|2,0,0]=4 1953 B10R1.5 COC[C@H]1CCCN1C=O MCULE-1806468932 [1,0,0,1,0,0|2,0,0]=4 1954 B10R1.5 COC[C@H]1CCCN1C=O MCULE-3639368907 [1,0,0,1,0,0|2,0,0]=4 1955 B10R1.7 CC1CCCCCCC1=O MCULE-5002473983 [1,0,0,1,0,0|0,0,0]=2 1956 B10R1.7 NC1CCCCCCC1O MCULE-9142911119 [1,0,0,1,0,0|1,0,1]=4 1957 B10R1.7 N[C@@H]1CCCCCC[C@@H]1O MCULE-1728493798 [1,0,0,1,0,0|1,0,1]=4 1958 B10R1.7 N[C@@H]1CCCCCC[C@H]1O MCULE-8702565765 [1,0,0,1,0,0|1,0,1]=4 1959 B10R1.7 N[C@H]1CCCCCC[C@@H]1O MCULE-4894585058 [1,0,0,1,0,0|1,0,1]=4 1960 B10R1.7 N[C@H]1CCCCCC[C@H]1O MCULE-3214389652 [1,0,0,1,0,0|1,0,1]=4 1961 B10R1.7 O=C1NCCCCCC1I MCULE-6621175147 [1,0,0,1,0,0|2,0,0]=4 1962 B10R1.7 OC1CCCCCCC1O MCULE-4573160076 [1,0,0,1,0,0|1,0,1]=4 1963 B10R1.7 O[C@H]1CCCCCC[C@H]1O MCULE-3578348851 [1,0,0,1,0,0|1,0,1]=4 1964 B10R1.17 BrCCCC1CCCCC1 MCULE-3138331756 [1,0,0,1,0,0|1,0,1]=4 1965 B10R1.17 C#CCCC1CCCCC1 MCULE-2956732689 [1,0,0,1,0,0|1,0,1]=4 1966 B10R1.17 C=CCNC1CCCCC1 MCULE-2585284590 [1,0,0,1,0,0|2,0,0]=4 1967 B10R1.17 CCCCC1CCCCC1 MCULE-2568850283 [1,0,0,1,0,0|1,0,1]=4 1968 B10R1.17 CCCCC1CCCCN1 MCULE-1100697619 [1,0,0,1,0,0|1,0,1]=4 1969 B10R1.17 CCCCC1CCCCN1 MCULE-8604986429 [1,0,0,1,0,0|1,0,1]=4 1970 B10R1.17 CCCCC1CCCNC1 MCULE-2755229629 [1,0,0,1,0,0|2,0,0]=4 1971 B10R1.17 CCCCC1CCCNC1 MCULE-8332785679 [1,0,0,1,0,0|2,0,0]=4 1972 B10R1.17 CCCOC1CCCCO1 MCULE-5501679825 [1,0,0,1,0,0|1,0,1]=4 1973 B10R1.17 CCNCC1CCCCO1 MCULE-2963268801 [1,0,0,1,0,0|1,0,1]=4 1974 B10R1.17 CCNCC1CCCCO1 MCULE-3483111447 [1,0,0,1,0,0|1,0,1]=4 1975 B10R1.17 CNCCC1CCCCC1 MCULE-9916111513 [1,0,0,1,0,0|2,0,0]=4 1976 B10R1.17 CNCCC1CCCCO1 MCULE-4536076135 [1,0,0,1,0,0|1,0,1]=4 1977 B10R1.17 CNCCC1CCCCO1 MCULE-9123549746 [1,0,0,1,0,0|1,0,1]=4 1978 B10R1.17 ClCCCC1CCCCC1 MCULE-9703542324 [1,0,0,1,0,0|1,0,1]=4 1979 B10R1.17 ICCCC1CCCCC1 MCULE-3721842593 [1,0,0,1,0,0|1,0,1]=4 1980 B10R1.17 N#CCCC1CCCCC1 MCULE-1308152967 [1,0,0,1,0,0|1,0,1]=4 1981 B10R1.17 NCCCC1CCCCC1 MCULE-6337829624 [1,0,0,1,0,0|1,0,1]=4 1982 B10R1.17 NCCCC1CCCCC1 MCULE-8205690727 [1,0,0,1,0,0|1,0,1]=4 1983 B10R1.17 NCCCC1CCCCO1 MCULE-8380034501 [1,0,0,1,0,0|1,0,1]=4 1984 B10R1.17 NNCCC1CCCCC1 MCULE-1394503563 [1,0,0,1,0,0|2,0,0]=4 1985 B10R1.17 NNCCC1CCCCC1 MCULE-2159579511 [1,0,0,1,0,0|2,0,0]=4 1986 B10R1.17 NOCCC1CCCCC1 MCULE-8421298103 [1,0,0,1,0,0|2,0,0]=4 1987 B10R1.17 NOCCC1CCCCC1 MCULE-8505614906 [1,0,0,1,0,0|2,0,0]=4 1988 B10R1.17 O=C=NCC1CCCCC1 MCULE-8641797577 [1,0,0,1,0,0|1,0,1]=4 1989 B10R1.17 O=CC=CC1CCCCC1 MCULE-6888009707 [1,0,0,1,0,0|0,0,2]=4 1990 B10R1.17 O=CCCC1CCCCC1 MCULE-7542460978 [1,0,0,1,0,0|0,0,0]=2 1991 B10R1.17 O=CCCC1CCOCC1 MCULE-9926976903 [1,0,0,1,0,0|1,0,0]=3 1992 B10R1.17 O=CCCN1CCCCC1 MCULE-1060522965 [1,0,0,1,0,0|1,0,0]=3 1993 B10R1.17 O=CCCN1CCOCC1 MCULE-6110490684 [1,0,0,1,0,0|2,0,0]=4 1994 B10R1.17 O=CCOC1CCCCC1 MCULE-6729274923 [1,0,0,1,0,0|1,0,0]=3 1995 B10R1.17 O=CCOC1CCCCO1 MCULE-5185852140 [1,0,0,1,0,0|2,0,0]=4 1996 B10R1.17 O=CCOC1CCOCC1 MCULE-9271510143 [1,0,0,1,0,0|2,0,0]=4 1997 B10R1.17 OCCCC1CCCCC1 MCULE-6307495993 [1,0,0,1,0,0|0,0,1]=3 1998 B10R1.17 OCCCC1CCCCN1 MCULE-4753823032 [1,0,0,1,0,0|1,0,1]=4 1999 B10R1.17 OCCCC1CCCCN1 MCULE-7684357711 [1,0,0,1,0,0|1,0,1]=4 2000 B10R1.17 OCCCC1CCCCO1 MCULE-8974781617 [1,0,0,1,0,0|1,0,1]=4 2001 B10R1.17 OCCCC1CCCNC1 MCULE-5587440064 [1,0,0,1,0,0|1,0,1]=4 2002 B10R1.17 OCCCC1CCNCC1 MCULE-8103308194 [1,0,0,1,0,0|1,0,1]=4 2003 B10R1.17 OCCCC1CCNCC1 MCULE-9288109884 [1,0,0,1,0,0|1,0,1]=4 2004 B10R1.17 OCCCC1CCOCC1 MCULE-4181244746 [1,0,0,1,0,0|1,0,1]=4 2005 B10R1.17 OCCCN1CCCCC1 MCULE-8412207622 [1,0,0,1,0,0|1,0,1]=4 2006 B10R1.17 OCCNC1CCCCC1 MCULE-7503084631 [1,0,0,1,0,0|1,0,1]=4 2007 B10R1.17 OCCOC1CCCCC1 MCULE-9282353409 [1,0,0,1,0,0|1,0,1]=4 2008 B10R1.19 CCC1CCCCCC1=O MCULE-8032779658 [1,0,0,1,0,0|0,0,0]=2 2009 B10R1.19 CCC1NCCCNC1=O MCULE-3991998861 [1,0,0,1,0,0|2,0,0]=4 2010 B10R1.19 CCN1CCCNCC1=O MCULE-3571024405 [1,0,0,1,0,0|2,0,0]=4 2011 B10R1.19 CCN1CCCNCC1=O MCULE-4254439389 [1,0,0,1,0,0|2,0,0]=4 2012 B10R1.19 CCN1CCNCCC1=O MCULE-7164789319 [1,0,0,1,0,0|2,0,0]=4 2013 B10R1.19 CCN1CCNCCC1=O MCULE-9020529314 [1,0,0,1,0,0|2,0,0]=4 2014 B10R1.19 CC[C@@H]1NCCCNC1=O MCULE-5830249410 [1,0,0,1,0,0|2,0,0]=4 2015 B10R1.19 CC[C@H]1NCCCNC1=O MCULE-4266677415 [1,0,0,1,0,0|2,0,0]=4 2016 B10R1.19 N#CC1CCCCCC1=O MCULE-1907886746 [1,0,0,1,0,0|1,0,1]=4 2017 B10R1.19 NC1CCCCCC1CO MCULE-2803910179 [1,0,0,1,0,0|1,0,1]=4 2018 B10R1.19 NCC1CCCCNC1=O MCULE-1946763373 [1,0,0,1,0,0|2,0,0]=4 2019 B10R1.19 NCC1CCCCNC1=O MCULE-4514221590 [1,0,0,1,0,0|2,0,0]=4 2020 B10R1.19 O=C1CCCCCN1CO MCULE-8622356666 [1,0,0,1,0,0|2,0,0]=4 2021 B10R1.19 O=C1NCCCCC1CBr MCULE-4441145418 [1,0,0,1,0,0|2,0,0]=4 2022 B10R1.19 O=C1NCCCCC1CO MCULE-8501668247 [1,0,0,1,0,0|2,0,0]=4 2023 B10R1.19 O=CC1CCCCCC1Cl MCULE-2719076051 [1,0,0,1,0,0|1,0,0]=3 2024 B10R1.20 CCC1CCCCC1C=O MCULE-1484578990 [1,0,0,1,0,0|0,0,0]=2 2025 B10R1.20 CCC1CCCCC1CN MCULE-1374247015 [1,0,0,1,0,0|1,0,1]=4 2026 B10R1.20 CCC1CCCCC1CN MCULE-2869403995 [1,0,0,1,0,0|1,0,1]=4 2027 B10R1.20 CCC1CCCCC1NC MCULE-5620204313 [1,0,0,1,0,0|2,0,0]=4 2028 B10R1.20 CCN1CCCCC1CO MCULE-9707891464 [1,0,0,1,0,0|1,0,1]=4 2029 B10R1.20 COC1CCCCC1CO MCULE-2988894861 [1,0,0,1,0,0|1,0,1]=4 2030 B10R1.20 COC1CCCCN1C=O MCULE-6015330788 [1,0,0,1,0,0|2,0,0]=4 2031 B10R1.20 OCC1CCCCC1CO MCULE-8066977999 [1,0,0,1,0,0|1,0,1]=4 2032 B10R1.20 OC[C@@H]1CCCC[C@H]1CO MCULE-2394544180 [1,0,0,1,0,0|1,0,1]=4 2033 B10R1.20 OC[C@@H]1CCCC[C@H]1CO MCULE-2693534916 [1,0,0,1,0,0|1,0,1]=4 2034 B10R1.20 OC[C@H]1CCCC[C@@H]1CO MCULE-3855557555 [1,0,0,1,0,0|1,0,1]=4 2035 B10R1.20 OC[C@H]1CCCC[C@@H]1CO MCULE-5406023810 [1,0,0,1,0,0|1,0,1]=4 2036 B10R1.20 OC[C@H]1CCCC[C@@H]1CO MCULE-9792878219 [1,0,0,1,0,0|1,0,1]=4 2037 B10R1.20 OC[C@H]1CCCC[C@H]1CO MCULE-3342954422 [1,0,0,1,0,0|1,0,1]=4 2038 B10R1.21 C=CCCNC1CCCC1 MCULE-9451351907 [1,0,0,1,0,0|2,0,0]=4 2039 B10R1.21 CCCCCC1CCCC1 MCULE-2927062716 [1,0,0,1,0,0|1,0,1]=4 2040 B10R1.21 CCCCCC1OCCO1 MCULE-1814222548 [1,0,0,1,0,0|1,0,1]=4 2041 B10R1.21 CCCNCC1CCCO1 MCULE-4700464282 [1,0,0,1,0,0|1,0,1]=4 2042 B10R1.21 CNCCCC1CCCC1 MCULE-4994722322 [1,0,0,1,0,0|2,0,0]=4 2043 B10R1.21 CNCCCC1CCCC1 MCULE-8583851497 [1,0,0,1,0,0|2,0,0]=4 2044 B10R1.21 CNCCCC1CCCO1 MCULE-6662766860 [1,0,0,1,0,0|1,0,1]=4 2045 B10R1.21 NCCCCC1CCCC1 MCULE-2916392587 [1,0,0,1,0,0|1,0,1]=4 2046 B10R1.21 NCCCCC1CCCO1 MCULE-5459645657 [1,0,0,1,0,0|1,0,1]=4 2047 B10R1.21 NCCCCC1CCCO1 MCULE-7012525648 [1,0,0,1,0,0|1,0,1]=4 2048 B10R1.21 O=CCCCC1OCCO1 MCULE-3822312994 [1,0,0,1,0,0|2,0,0]=4 2049 B10R1.21 O=CCCOC1CCCC1 MCULE-7685598743 [1,0,0,1,0,0|1,0,0]=3 2050 B10R1.21 O=CCOCC1CCCC1 MCULE-2137455007 [1,0,0,1,0,0|1,0,0]=3 2051 B10R1.21 OCCCCC1CCCC1 MCULE-2531889942 [1,0,0,1,0,0|0,0,1]=3 2052 B10R1.21 OCCCCC1CCCO1 MCULE-4507968926 [1,0,0,1,0,0|1,0,1]=4 2053 B10R1.21 OCCCCN1CCCC1 MCULE-1882081510 [1,0,0,1,0,0|1,0,1]=4 2054 B10R1.21 OCCCNC1CCCC1 MCULE-8914483355 [1,0,0,1,0,0|1,0,1]=4 2055 B10R1.21 OCCCOC1CCCC1 MCULE-7184062888 [1,0,0,1,0,0|1,0,1]=4 2056 B10R1.21 OCCOCC1CCCC1 MCULE-2133060843 [1,0,0,1,0,0|1,0,1]=4 2057 B10R1.29 CC1CCCC1NCCO MCULE-3863073293 [1,0,0,1,0,0|1,0,1]=4 2058 B10R1.29 CCCCC1=CCCC1=O MCULE-3298793962 [1,0,0,1,0,0|0,0,2]=4 2059 B10R1.29 CCCCC1CCCC1=O MCULE-7853231747 [1,0,0,1,0,0|0,0,0]=2 2060 B10R1.29 CCCCC1CCCC1N MCULE-4431843178 [1,0,0,1,0,0|1,0,1]=4 2061 B10R1.29 CCCCN1CCCC1=O MCULE-4214883053 [1,0,0,1,0,0|1,0,0]=3 2062 B10R1.29 CCOCC1CCCC1=O MCULE-9114631954 [1,0,0,1,0,0|1,0,0]=3 2063 B10R1.29 CN1CCCC1CCCO MCULE-9622016302 [1,0,0,1,0,0|1,0,1]=4 2064 B10R1.29 CNCCN1CCCC1=O MCULE-4360482877 [1,0,0,1,0,0|2,0,0]=4 2065 B10R1.29 CNCCN1CCCC1=O MCULE-6909271074 [1,0,0,1,0,0|2,0,0]=4 2066 B10R1.29 COCCC1CCCC1=O MCULE-3820027368 [1,0,0,1,0,0|1,0,0]=3 2067 B10R1.29 COCCC1CCNC1=O MCULE-3116351154 [1,0,0,1,0,0|2,0,0]=4 2068 B10R1.29 COCOC1CCCC1=O MCULE-4014159200 [1,0,0,1,0,0|2,0,0]=4 2069 B10R1.29 N#CCCC1CCCC1=O MCULE-5481171300 [1,0,0,1,0,0|1,0,1]=4 2070 B10R1.29 NCCCC1CCCC1O MCULE-3919877654 [1,0,0,1,0,0|1,0,1]=4 2071 B10R1.29 NCCCC1CCOC1=O MCULE-4266690176 [1,0,0,1,0,0|2,0,0]=4 2072 B10R1.29 NCCCC1CCOC1=O MCULE-9834041839 [1,0,0,1,0,0|2,0,0]=4 2073 B10R1.29 NCCCN1CCCC1=O MCULE-7525290934 [1,0,0,1,0,0|2,0,0]=4 2074 B10R1.29 O=C1CCCC1CCCF MCULE-9345325426 [1,0,0,1,0,0|1,0,0]=3 2075 B10R1.29 O=C1CCCN1CCCCl MCULE-6294076675 [1,0,0,1,0,0|2,0,0]=4 2076 B10R1.29 O=C1CCCN1CCCO MCULE-5493768478 [1,0,0,1,0,0|2,0,0]=4 2077 B10R1.57 OCCCNCC1CCC1 MCULE-8121544435 [1,0,0,1,0,0|1,0,1]=4 2078 B10R1.85 BrCCC1CCCCCC1 MCULE-9479740717 [1,0,0,1,0,0|1,0,1]=4 2079 B10R1.85 C=CCC1CCCCCC1 MCULE-7344516120 [1,0,0,1,0,0|1,0,0]=3 2080 B10R1.85 CCCC1OCCCCO1 MCULE-5285924074 [1,0,0,1,0,0|1,0,1]=4 2081 B10R1.85 CNCC1CCCCCC1 MCULE-9325217457 [1,0,0,1,0,0|2,0,0]=4 2082 B10R1.85 NCCC1CCCCCC1 MCULE-1371543041 [1,0,0,1,0,0|1,0,1]=4 2083 B10R1.85 NCCC1CCCCCC1 MCULE-3740795020 [1,0,0,1,0,0|1,0,1]=4 2084 B10R1.85 O=C=NC1CCCCCC1 MCULE-1717120909 [1,0,0,1,0,0|1,0,1]=4 2085 B10R1.85 O=CCC1CCCCCC1 MCULE-6382907203 [1,0,0,1,0,0|0,0,0]=2 2086 B10R1.85 OCCC1CCCCCC1 MCULE-9936994835 [1,0,0,1,0,0|0,0,1]=3 2087 B10R1.85 OCCC1CCCCCN1 MCULE-7960769906 [1,0,0,1,0,0|1,0,1]=4 2088 B10R1.85 OCCC1CCCCCN1 MCULE-8951609776 [1,0,0,1,0,0|1,0,1]=4 2089 B10R1.85 OCCC1CCCNCC1 MCULE-1518082087 [1,0,0,1,0,0|1,0,1]=4 2090 B10R1.85 OCCN1CCCCCC1 MCULE-5823768484 [1,0,0,1,0,0|1,0,1]=4 2091 B10R1.161 C=CC1CCCCCCC1 MCULE-4062427042 [1,0,0,1,0,0|1,0,0]=3 2092 B10R1.161 CNC1CCCCCCC1 MCULE-2172886818 [1,0,0,1,0,0|2,0,0]=4 2093 B10R1.161 CNC1CCCCCCC1 MCULE-2549730402 [1,0,0,1,0,0|2,0,0]=4 2094 B10R1.161 N#CC1CCCCCCC1 MCULE-8673985853 [1,0,0,1,0,0|1,0,1]=4 2095 B10R1.161 NCC1CCCCCCC1 MCULE-9635361503 [1,0,0,1,0,0|1,0,1]=4 2096 B10R1.161 O=CC1=CCCCCCC1 MCULE-3035020921 [1,0,0,1,0,0|0,0,2]=4 2097 B10R1.161 O=CC1=CCCCCCC1 MCULE-5359478815 [1,0,0,1,0,0|0,0,2]=4 2098 B10R1.161 O=CC1CCCCCCC1 MCULE-6277104874 [1,0,0,1,0,0|0,0,0]=2 2099 B10R1.161 O=NN1CCCCCCC1 MCULE-4918563903 [1,0,0,1,0,0|2,0,0]=4 2100 B10R1.161 OCC1CCCCCCC1 MCULE-1512335429 [1,0,0,1,0,0|0,0,1]=3 2101 B10R1.161 ON=C1CCCCCCC1 MCULE-1582039185 [1,0,0,1,0,0|1,0,1]=4 2102 B10R1.185 C1CCCCNCCCC1 MCULE-8151021132 [1,0,0,1,0,0|1,0,1]=4 2103 B12R1.7 CCCC#CCC1CCC(=O)O1 MCULE-9827566704 [0,1,0,1,0,0|0,0,1]=3 2104 B12R1.7 CCCCCCC1CCC(=O)O1 MCULE-8274362783 [0,1,0,1,0,0|0,0,0]=2 2105 B12R1.7 CCCCCCC1OCC(O1)C MCULE-3434939793 [0,1,0,1,0,0|1,0,1]=4 2106 B12R1.7 CCCCOCC1CNC(=O)O1 MCULE-6966705652 [0,1,0,1,0,0|1,0,0]=3 2107 B12R1.107 CC(=CC(=O)O)C1CCCCC1 MCULE-1521149204 [0,1,0,1,0,0|0,0,2]=4 2108 B12R1.107 CC(=O)CC(=O)C1CCCCC1 MCULE-5013219868 [0,1,0,1,0,0|1,0,1]=4 2109 B12R1.107 CC(CC(=O)O)C1CCCCC1 MCULE-5146752612 [0,1,0,1,0,0|0,0,0]=2 2110 B12R1.107 CC(CC(=O)O)C1CCNCC1 MCULE-4155328285 [0,1,0,1,0,0|1,0,0]=3 2111 B12R1.107 CC(CC(=O)O)C1COCCO1 MCULE-9669755956 [0,1,0,1,0,0|2,0,0]=4 2112 B12R1.107 CC(CC(=O)O)N1CCCCC1 MCULE-5546995806 [0,1,0,1,0,0|1,0,0]=3 2113 B12R1.107 CC(CC(=O)O)N1CCCCC1 MCULE-8811572713 [0,1,0,1,0,0|1,0,0]=3 2114 B12R1.107 CC(CC(=O)O)N1CCOCC1 MCULE-7868090057 [0,1,0,1,0,0|2,0,0]=4 2115 B12R1.107 CC(CC(=O)O)N1CCOCC1 MCULE-9159267461 [0,1,0,1,0,0|2,0,0]=4 2116 B12R1.107 CN(CC(=O)O)C1CCCCC1 MCULE-8538488249 [0,1,0,1,0,0|1,0,0]=3 2117 B12R1.107 CN(CC(=O)O)C1CCCCC1 MCULE-8582183581 [0,1,0,1,0,0|1,0,0]=3 2118 B12R1.107 CN(CC(=O)O)C1CCNCC1 MCULE-5744482363 [0,1,0,1,0,0|2,0,0]=4 2119 B12R1.107 CN(CC(=O)O)C1CCNCC1 MCULE-5812424158 [0,1,0,1,0,0|2,0,0]=4 2120 B12R1.107 NC(CC(=O)O)C1CC=CCC1 MCULE-4298708464 [0,1,0,1,0,0|0,0,2]=4 2121 B12R1.107 NC(CC(=O)O)C1CCCCC1 MCULE-3734527997 [0,1,0,1,0,0|0,0,0]=2 2122 B12R1.107 NC(CC(=O)O)C1CCCCC1 MCULE-8095164306 [0,1,0,1,0,0|0,0,0]=2 2123 B12R1.107 NC(CC(=O)O)C1CCCOC1 MCULE-6067693399 [0,1,0,1,0,0|1,0,0]=3 2124 B12R1.107 NC(CC(=O)O)C1CCCOC1 MCULE-9538415271 [0,1,0,1,0,0|1,0,0]=3 2125 B12R1.107 NC(CC(=O)O)C1CCOCC1 MCULE-3602136384 [0,1,0,1,0,0|1,0,0]=3 2126 B12R1.107 NC(CC(=O)O)C1CCOCC1 MCULE-4838977044 [0,1,0,1,0,0|1,0,0]=3 2127 B12R1.107 N[C@@H](CC(=O)O)C1CCCCC1 MCULE-1722747072 [0,1,0,1,0,0|0,0,0]=2 2128 B12R1.107 N[C@@H](CC(=O)O)C1CCCCC1 MCULE-4345050528 [0,1,0,1,0,0|0,0,0]=2 2129 B12R1.107 N[C@@H](CC(=O)O)C1CCCCC1 MCULE-6774023632 [0,1,0,1,0,0|0,0,0]=2 2130 B12R1.107 N[C@H](CC(=O)O)C1CCCCC1 MCULE-5426257730 [0,1,0,1,0,0|0,0,0]=2 2131 B12R1.107 N[C@H](CC(=O)O)C1CCCCC1 MCULE-6223565506 [0,1,0,1,0,0|0,0,0]=2 2132 B12R1.107 N[C@H](CC(=O)O)C1CCCCC1 MCULE-8271946680 [0,1,0,1,0,0|0,0,0]=2 2133 B12R1.107 N[C@H](CC(=O)O)C1CCCCC1 MCULE-9947760299 [0,1,0,1,0,0|0,0,0]=2 2134 B12R1.141 O=C1CCCCCCCC(=O)O1 MCULE-2456565439 [0,1,0,1,0,0|0,0,1]=3 2135 B12R1.182 CCCN1CCC(C1)CC(=O)O MCULE-1543292991 [0,1,0,1,0,0|1,0,0]=3 2136 B12R1.182 COCC1CCN(C1)CC(=O)O MCULE-2102825620 [0,1,0,1,0,0|2,0,0]=4 2137 B12R1.212 CC1CCC=CCCC1C(=O)O MCULE-6485603876 [0,1,0,1,0,0|0,0,1]=3 2138 B12R1.212 NC1C=CCCCCC1C(=O)O MCULE-5863246150 [0,1,0,1,0,0|0,0,2]=4 2139 B12R1.212 NC1C=CCCCCC1C(=O)O MCULE-8663847830 [0,1,0,1,0,0|0,0,2]=4 2140 B12R1.212 NC1CCC=CCCC1C(=O)O MCULE-1180368495 [0,1,0,1,0,0|0,0,2]=4 2141 B12R1.212 NC1CCC=CCCC1C(=O)O MCULE-3657089764 [0,1,0,1,0,0|0,0,2]=4 2142 B12R1.212 NC1CCCCCCC1C(=O)O MCULE-2303513219 [0,1,0,1,0,0|0,0,0]=2 2143 B12R1.212 NC1CCCCCCC1C(=O)O MCULE-5336927273 [0,1,0,1,0,0|0,0,0]=2 2144 B12R1.212 N[C@@H]1CCC=CCC[C@@H]1C(=O)O MCULE-7804346033 [0,1,0,1,0,0|0,0,2]=4 2145 B12R1.212 N[C@H]1CCC=CCC[C@H]1C(=O)O MCULE-1347595708 [0,1,0,1,0,0|0,0,2]=4 2146 B12R1.212 N[C@H]1CCC=CCC[C@H]1C(=O)O MCULE-5235638295 [0,1,0,1,0,0|0,0,2]=4 2147 B12R1.212 O=C(O)C1CCCCCCC1=O MCULE-5304671902 [0,1,0,1,0,0|0,0,1]=3 2148 B12R1.260 CC(=O)CC(C)SC1CCCC1 MCULE-4159500347 [0,1,0,1,0,0|2,0,0]=4 2149 B12R1.438 CCC1CC(CCO1)CC(=O)O MCULE-1533632681 [0,1,0,1,0,0|1,0,0]=3 2150 B12R1.438 CCN1CCCC(C1)CC(=O)O MCULE-7610748383 [0,1,0,1,0,0|1,0,0]=3 2151 B12R1.438 COC1CCCC(C1)CC(=O)O MCULE-9301642131 [0,1,0,1,0,0|1,0,0]=3 2152 B12R1.438 COC1CCCN(C1)CC(=O)O MCULE-8425591467 [0,1,0,1,0,0|2,0,0]=4 2153 B12R1.438 N#CC1CCCC(C1)CC(=O)O MCULE-8692118131 [0,1,0,1,0,0|1,0,1]=4 2154 B12R1.438 O=C(O)CN1CCCC(C1)CBr MCULE-6873714063 [0,1,0,1,0,0|2,0,0]=4 2155 B12R1.438 O=C(O)CN1CCCC(C1)CCl MCULE-7630589107 [0,1,0,1,0,0|2,0,0]=4 2156 B12R1.438 O=C(O)CN1CCCC(C1)CI MCULE-5847096454 [0,1,0,1,0,0|2,0,0]=4 2157 B12R1.438 O=C(O)CN1CCCC(C1)CO MCULE-9181009444 [0,1,0,1,0,0|2,0,0]=4 2158 B12R1.874 O=C(O)CC1CCCCC(=O)N1 MCULE-9763824152 [0,1,0,1,0,0|1,0,1]=4 2159 B12R1.874 O=C(O)CC1CCCNC(=O)C1 MCULE-2622321919 [0,1,0,1,0,0|1,0,1]=4 2160 B12R1.1392 C=C(C)CC1CCCCCCC1 MCULE-8129802280 [0,1,0,1,0,0|2,0,0]=4 2161 B12R1.1392 CC(=O)OC1CCCCCCC1 MCULE-6350829843 [0,1,0,1,0,0|1,0,0]=3 2162 B12R1.1392 NC(=O)NC1CCCCCCC1 MCULE-8088379075 [0,1,0,1,0,0|1,0,0]=3 2163 B12R1.1392 O=C(O)CN1CCCCCCC1 MCULE-5706680135 [0,1,0,1,0,0|0,0,0]=2 2164 B12R1.1829 NC1(CCCCCC1)CC(=O)O MCULE-6494985992 [0,1,0,1,0,0|0,0,0]=2 2165 B12R1.1829 NC1(CCCCCC1)CC(=O)O MCULE-6930845885 [0,1,0,1,0,0|0,0,0]=2 2166 B12R1.1829 O=C(O)CC1(CCCCCC1)O MCULE-4067052677 [0,1,0,1,0,0|0,0,0]=2 2167 B12R1.105 CN1CCC(C1)CNCC(=O)O MCULE-8437681719 [0,1,0,1,0,0|2,0,0]=4 2168 B12R1.105 CN1CCC(C1)COCC(=O)O MCULE-4604350152 [0,1,0,1,0,0|2,0,0]=4 2169 B12R1.226 CC1CCCC(C1)OCC(=O)O MCULE-3536391684 [0,1,0,1,0,0|1,0,0]=3 2170 B12R1.226 CC1CCCN(C1)CCC(=O)O MCULE-1932078578 [0,1,0,1,0,0|1,0,0]=3 2171 B12R1.226 CC1CCCN(C1)CCC(=O)O MCULE-5507374908 [0,1,0,1,0,0|1,0,0]=3 2172 B12R1.226 CN1CCCC(C1)CCC(=O)O MCULE-3500988064 [0,1,0,1,0,0|1,0,0]=3 2173 B12R1.226 CN1CCCC(C1)CCC(=O)O MCULE-8728115483 [0,1,0,1,0,0|1,0,0]=3 2174 B12R1.226 CN1CCCC(C1)NCC(=O)O MCULE-6721661189 [0,1,0,1,0,0|2,0,0]=4 2175 B12R1.226 CN1CCCC(C1)OCC(=O)O MCULE-6639864622 [0,1,0,1,0,0|2,0,0]=4 2176 B12R1.226 CN1CCC[C@@H](C1)NCC(=O)O MCULE-3675830850 [0,1,0,1,0,0|2,0,0]=4 2177 B12R1.226 CN1CCC[C@@H](C1)OCC(=O)O MCULE-2069209067 [0,1,0,1,0,0|2,0,0]=4 2178 B12R1.226 CN1CCC[C@H](C1)NCC(=O)O MCULE-9295632716 [0,1,0,1,0,0|2,0,0]=4 2179 B12R1.226 CN1CCC[C@H](C1)OCC(=O)O MCULE-1022208079 [0,1,0,1,0,0|2,0,0]=4 2180 B12R1.226 NC1CCCC(C1)CCC(=O)O MCULE-1427868111 [0,1,0,1,0,0|0,0,0]=2 2181 B12R1.226 O=C(O)CCC1CCCC(=O)N1 MCULE-3373923105 [0,1,0,1,0,0|1,0,1]=4 2182 B12R1.261 CC(=O)N1CCCCC1C(=O)O MCULE-9909402121 [0,1,0,1,0,0|1,0,1]=4 2183 B12R1.261 CC(C)N1CCCCC1C(=O)O MCULE-1732607027 [0,1,0,1,0,0|1,0,0]=3 2184 B12R1.261 CC(C)N1CCCCC1C(=O)O MCULE-7684924530 [0,1,0,1,0,0|1,0,0]=3 2185 B12R1.261 CC(C)N1CCCC[C@H]1C(=O)O MCULE-7336169680 [0,1,0,1,0,0|1,0,0]=3 2186 B12R1.261 CC(C)N1CCCC[C@H]1C(=O)O MCULE-8875686576 [0,1,0,1,0,0|1,0,0]=3 2187 B12R1.261 CC(C)N1CCNCC1C(=O)O MCULE-7688172132 [0,1,0,1,0,0|2,0,0]=4 2188 B12R1.261 NC(=O)C1CCCCC1C(=O)O MCULE-3798252597 [0,1,0,1,0,0|1,0,1]=4 2189 B12R1.261 NC(=O)[C@@H]1CCCC[C@@H]1C(=O)O MCULE-7178475126 [0,1,0,1,0,0|1,0,1]=4 2190 B12R1.261 NC(=O)[C@@H]1CCCC[C@@H]1C(=O)O MCULE-8672445916 [0,1,0,1,0,0|1,0,1]=4 2191 B12R1.261 NC(=O)[C@@H]1CCCC[C@H]1C(=O)O MCULE-2394611865 [0,1,0,1,0,0|1,0,1]=4 2192 B12R1.261 NC(=O)[C@@H]1CCCC[C@H]1C(=O)O MCULE-4597512342 [0,1,0,1,0,0|1,0,1]=4 2193 B12R1.261 NC(=O)[C@H]1CCCC[C@@H]1C(=O)O MCULE-3656636765 [0,1,0,1,0,0|1,0,1]=4 2194 B12R1.261 NC(=O)[C@H]1CCCC[C@@H]1C(=O)O MCULE-3887795119 [0,1,0,1,0,0|1,0,1]=4 2195 B12R1.261 NC(=O)[C@H]1CCCC[C@H]1C(=O)O MCULE-4029989910 [0,1,0,1,0,0|1,0,1]=4 2196 B12R1.261 NC(=O)[C@H]1CCCC[C@H]1C(=O)O MCULE-6704294440 [0,1,0,1,0,0|1,0,1]=4 2197 B12R1.261 O=C(O)C1CCCCC1C(=O)O MCULE-3185409075 [0,1,0,1,0,0|1,0,1]=4 2198 B12R1.261 O=C(O)[C@@H]1CCCC[C@H]1C(=O)O MCULE-4895515726 [0,1,0,1,0,0|1,0,1]=4 2199 B12R1.261 O=C(O)[C@@H]1CCCC[C@H]1C(=O)O MCULE-4906980900 [0,1,0,1,0,0|1,0,1]=4 2200 B12R1.261 O=C(O)[C@@H]1CCCC[C@H]1C(=O)O MCULE-7747323415 [0,1,0,1,0,0|1,0,1]=4 2201 B12R1.261 O=C(O)[C@H]1CCCC[C@@H]1C(=O)O MCULE-1184405040 [0,1,0,1,0,0|1,0,1]=4 2202 B12R1.261 O=C(O)[C@H]1CCCC[C@@H]1C(=O)O MCULE-3346909877 [0,1,0,1,0,0|1,0,1]=4 2203 B12R1.261 O=C(O)[C@H]1CCCC[C@H]1C(=O)O MCULE-9506589203 [0,1,0,1,0,0|1,0,1]=4 2204 B12R1.391 CC1(CCCCC1CC(=O)O)C MCULE-6771932074 [0,1,0,1,0,0|0,0,0]=2 2205 B12R1.391 CC1(CNCCC1CC(=O)O)C MCULE-6484507552 [0,1,0,1,0,0|1,0,0]=3 2206 B12R1.391 CC1(CNCCC1CC(=O)O)C MCULE-8006312451 [0,1,0,1,0,0|1,0,0]=3 2207 B12R1.391 O=C(O)CC1CCNCC1(F)F MCULE-2904991236 [0,1,0,1,0,0|2,0,0]=4 2208 B12R1.391 O=C(O)CC1CCNCC1(F)F MCULE-7469979335 [0,1,0,1,0,0|2,0,0]=4 2209 B12R1.392 CC(C)CN1CCCC1C(=O)O MCULE-4228889336 [0,1,0,1,0,0|1,0,0]=3 2210 B12R1.392 CC(C)CN1CCC[C@H]1C(=O)O MCULE-2363163465 [0,1,0,1,0,0|1,0,0]=3 2211 B12R1.392 CC(C)CN1CCC[C@H]1C(=O)O MCULE-2594145267 [0,1,0,1,0,0|1,0,0]=3 2212 B12R1.392 CC(O)CN1CCC[C@H]1C(=O)O MCULE-1519984794 [0,1,0,1,0,0|1,0,0]=3 2213 B12R1.392 O=C(O)C1CCCN1CC(F)F MCULE-7517429490 [0,1,0,1,0,0|2,0,0]=4 2214 B12R1.1011 O=C1CCCCCC(C1)C(=O)O MCULE-3072060660 [0,1,0,1,0,0|0,0,1]=3 2215 B12R1.1 CCCCCC1CC=C(CC1)Br MCULE-9220672225 [0,1,0,1,0,0|2,0,0]=4 2216 B12R1.1 CCCCCC1CCC(=O)CC1 MCULE-1865638063 [0,1,0,1,0,0|1,0,0]=3 2217 B12R1.1 CCCCCC1CCC(CC1)O MCULE-3435416328 [0,1,0,1,0,0|1,0,1]=4 2218 B12R1.1 CCCCC[C@H]1CC[C@@H](CC1)O MCULE-2942273227 [0,1,0,1,0,0|1,0,1]=4 2219 B12R1.27 C=CC(=O)NCC1CCCCC1 MCULE-7329688046 [0,1,0,1,0,0|2,0,0]=4 2220 B12R1.27 CNC(=O)CCC1CCCCC1 MCULE-4673526571 [0,1,0,1,0,0|1,0,0]=3 2221 B12R1.27 CNC(=O)CCC1CCCCN1 MCULE-1058691471 [0,1,0,1,0,0|2,0,0]=4 2222 B12R1.27 CNC(=O)CCC1CCCCN1 MCULE-6199763890 [0,1,0,1,0,0|2,0,0]=4 2223 B12R1.27 CNC(=O)CCC1CCCNC1 MCULE-4365216369 [0,1,0,1,0,0|2,0,0]=4 2224 B12R1.27 CNC(=O)CCC1CCCNC1 MCULE-4665588497 [0,1,0,1,0,0|2,0,0]=4 2225 B12R1.27 CNC(=O)CCC1CCNCC1 MCULE-5487007846 [0,1,0,1,0,0|2,0,0]=4 2226 B12R1.27 COC(=O)CCC1CCCCC1 MCULE-4982130149 [0,1,0,1,0,0|0,0,0]=2 2227 B12R1.27 COC(=O)CCC1CCCCN1 MCULE-5430155727 [0,1,0,1,0,0|1,0,0]=3 2228 B12R1.27 COC(=O)CCC1CCCCN1 MCULE-8425873185 [0,1,0,1,0,0|1,0,0]=3 2229 B12R1.27 COC(=O)CCC1CCCNC1 MCULE-3207892462 [0,1,0,1,0,0|1,0,0]=3 2230 B12R1.27 COC(=O)CCC1CCCNC1 MCULE-4998474197 [0,1,0,1,0,0|1,0,0]=3 2231 B12R1.27 COC(=O)CCC1CCNCC1 MCULE-4070291371 [0,1,0,1,0,0|1,0,0]=3 2232 B12R1.27 COC(=O)CCC1CCNCC1 MCULE-9899833979 [0,1,0,1,0,0|1,0,0]=3 2233 B12R1.27 COC(=O)CCC1CNCCN1 MCULE-3646955067 [0,1,0,1,0,0|2,0,0]=4 2234 B12R1.27 COC(=O)CCC1CNCCN1 MCULE-7815242180 [0,1,0,1,0,0|2,0,0]=4 2235 B12R1.27 COC(=O)CCC1COCCN1 MCULE-2668736062 [0,1,0,1,0,0|2,0,0]=4 2236 B12R1.27 COC(=O)CCC1COCCN1 MCULE-3833814360 [0,1,0,1,0,0|2,0,0]=4 2237 B12R1.27 COC(=O)CCN1CCCCC1 MCULE-8363403616 [0,1,0,1,0,0|1,0,0]=3 2238 B12R1.27 COC(=O)CCN1CCCCC1 MCULE-9158799668 [0,1,0,1,0,0|1,0,0]=3 2239 B12R1.27 COC(=O)CCN1CCNCC1 MCULE-7011490046 [0,1,0,1,0,0|2,0,0]=4 2240 B12R1.27 COC(=O)CCN1CCNCC1 MCULE-9475157340 [0,1,0,1,0,0|2,0,0]=4 2241 B12R1.27 COC(=O)CCN1CCOCC1 MCULE-1223322617 [0,1,0,1,0,0|2,0,0]=4 2242 B12R1.27 COC(=O)CCN1CCSCC1 MCULE-4456368053 [0,1,0,1,0,0|2,0,0]=4 2243 B12R1.27 COC(=O)CNC1CCCCC1 MCULE-3628546494 [0,1,0,1,0,0|1,0,0]=3 2244 B12R1.27 COC(=O)CNC1CCCCC1 MCULE-8461156941 [0,1,0,1,0,0|1,0,0]=3 2245 B12R1.27 COC(=O)CNC1CCOCC1 MCULE-2414362668 [0,1,0,1,0,0|2,0,0]=4 2246 B12R1.27 COC(=O)CNC1CCOCC1 MCULE-9240609938 [0,1,0,1,0,0|2,0,0]=4 2247 B12R1.27 COC(=O)COC1CCCCC1 MCULE-2770584925 [0,1,0,1,0,0|1,0,0]=3 2248 B12R1.27 COC(=O)COC1CCCCO1 MCULE-9132561989 [0,1,0,1,0,0|2,0,0]=4 2249 B12R1.27 COC(=O)COC1CCNCC1 MCULE-1515730437 [0,1,0,1,0,0|2,0,0]=4 2250 B12R1.27 COC(=O)COC1CCNCC1 MCULE-4644132320 [0,1,0,1,0,0|2,0,0]=4 2251 B12R1.27 COC(=O)CSC1CCCCC1 MCULE-3029014522 [0,1,0,1,0,0|1,0,0]=3 2252 B12R1.27 N/C(=N/O)/CCN1CCCCC1 MCULE-6992526811 [0,1,0,1,0,0|2,0,0]=4 2253 B12R1.27 N/C(=N\O)/CCN1CCCCC1 MCULE-8593066538 [0,1,0,1,0,0|2,0,0]=4 2254 B12R1.27 NNC(=O)CCC1CCCCC1 MCULE-5265552441 [0,1,0,1,0,0|1,0,0]=3 2255 B12R1.27 NNC(=O)CCC1CCCOC1 MCULE-8516252594 [0,1,0,1,0,0|2,0,0]=4 2256 B12R1.27 NNC(=O)CCN1CCCCC1 MCULE-1695375615 [0,1,0,1,0,0|2,0,0]=4 2257 B12R1.27 NNC(=O)CNC1CCCCC1 MCULE-1213092866 [0,1,0,1,0,0|2,0,0]=4 2258 B12R1.27 O=C(CBr)CCC1CCCCO1 MCULE-5556789952 [0,1,0,1,0,0|2,0,0]=4 2259 B12R1.27 O=C(CBr)NCC1CCCCC1 MCULE-2764680318 [0,1,0,1,0,0|2,0,0]=4 2260 B12R1.27 O=C(CCC1CCCCC1)NO MCULE-7475709240 [0,1,0,1,0,0|0,0,0]=2 2261 B12R1.27 O=C(CCl)NCC1CCCCC1 MCULE-9819057027 [0,1,0,1,0,0|2,0,0]=4 2262 B12R1.27 O=C(CO)NCC1CCCCC1 MCULE-7174776825 [0,1,0,1,0,0|1,0,0]=3 2263 B12R1.77 CCC1CCCCN1C(=O)CCl MCULE-4069585041 [0,1,0,1,0,0|2,0,0]=4 2264 B12R1.77 CCC1CCCCN1C(=O)CN MCULE-1194274038 [0,1,0,1,0,0|2,0,0]=4 2265 B12R1.77 CCC1CCCCN1C(=O)CN MCULE-9480609009 [0,1,0,1,0,0|2,0,0]=4 2266 B12R1.77 CCN1CCOCC1C(=O)OC MCULE-6939340199 [0,1,0,1,0,0|2,0,0]=4 2267 B12R1.77 COC(=O)C1CCCCC1CCl MCULE-1382388531 [0,1,0,1,0,0|1,0,0]=3 2268 B12R1.77 COC(=O)C1CCCCC1CN MCULE-6303964876 [0,1,0,1,0,0|1,0,0]=3 2269 B12R1.77 COC(=O)C1CCCCC1CN MCULE-9790305648 [0,1,0,1,0,0|1,0,0]=3 2270 B12R1.77 COC(=O)C1CCCCC1CO MCULE-9026826219 [0,1,0,1,0,0|1,0,0]=3 2271 B12R1.77 COC(=O)[C@@H]1CCCC[C@H]1CO MCULE-9762653277 [0,1,0,1,0,0|1,0,0]=3 2272 B12R1.77 COC(=O)[C@H]1CCCC[C@@H]1CO MCULE-9302510534 [0,1,0,1,0,0|1,0,0]=3 2273 B12R1.215 O=C1CCNCCCCCCN1 MCULE-1263100451 [0,1,0,1,0,0|1,0,0]=3 2274 B12R1.215 O=C1CCNCCCOCCN1 MCULE-2789680382 [0,1,0,1,0,0|2,0,0]=4 2275 B12R1.365 COC(=O)C1CCCCCC1=O MCULE-3603977230 [0,1,0,1,0,0|1,0,1]=4 2276 B12R1.365 COC(=O)C1CCCCCC1N MCULE-2985536871 [0,1,0,1,0,0|1,0,0]=3 2277 B12R1.365 COC(=O)C1CCCCCC1N MCULE-7391362167 [0,1,0,1,0,0|1,0,0]=3 2278 B12R1.365 COC(=O)C1CNCCCN1C MCULE-8944326904 [0,1,0,1,0,0|2,0,0]=4 2279 B12R1.365 COC(=O)C1CNCCCN1C MCULE-9025092370 [0,1,0,1,0,0|2,0,0]=4 2280 B12R1.371 CC1CCCCC1CC(=O)NN MCULE-2112501539 [0,1,0,1,0,0|1,0,0]=3 2281 B12R1.371 CC1CCCCC1NC(=O)CCl MCULE-8520758651 [0,1,0,1,0,0|2,0,0]=4 2282 B12R1.371 CC1CCCCN1CC(=O)NN MCULE-5982584996 [0,1,0,1,0,0|2,0,0]=4 2283 B12R1.371 COC(=O)CC1CCCCC1=O MCULE-2536809252 [0,1,0,1,0,0|1,0,1]=4 2284 B12R1.371 COC(=O)CC1CCCNC1C MCULE-5727809126 [0,1,0,1,0,0|1,0,0]=3 2285 B12R1.371 COC(=O)CC1CNCCC1C MCULE-4797744674 [0,1,0,1,0,0|1,0,0]=3 2286 B12R1.371 COC(=O)CC1CNCCC1C MCULE-6244671024 [0,1,0,1,0,0|1,0,0]=3 2287 B12R1.371 COC(=O)N[C@@H]1CNCC[C@@H]1C MCULE-3868741323 [0,1,0,1,0,0|2,0,0]=4 2288 B12R1.371 COC(=O)N[C@@H]1CNCC[C@@H]1C MCULE-4196602758 [0,1,0,1,0,0|2,0,0]=4 2289 B12R1.396 COC(=O)CCC[C@@H]1O[C@H]1CO MCULE-9567091665 [0,1,0,1,0,0|2,0,0]=4 2290 B12R1.477 COC(=O)CCNC1CCCC1 MCULE-8194716372 [0,1,0,1,0,0|1,0,0]=3 2291 B12R1.477 COC(=O)CCOC1CCNC1 MCULE-7299406956 [0,1,0,1,0,0|2,0,0]=4 2292 B12R1.477 COC(=O)CCOC1CCNC1 MCULE-8084056923 [0,1,0,1,0,0|2,0,0]=4 2293 B12R1.477 N/C(=N\O)/CCCN1CCCC1 MCULE-5877211703 [0,1,0,1,0,0|2,0,0]=4 2294 B12R1.1659 C=CC(=O)N1CCCCCCC1 MCULE-4957524755 [0,1,0,1,0,0|2,0,0]=4 2295 B12R1.1659 COC(=O)C1CCCCCCC1 MCULE-8407585180 [0,1,0,1,0,0|0,0,0]=2 2296 B12R1.1659 O=C(CCl)N1CCCCCCC1 MCULE-9778356861 [0,1,0,1,0,0|2,0,0]=4 2297 B12R1.1748 COC(=O)C=C1CCCCCC1 MCULE-2954267118 [0,1,0,1,0,0|0,0,2]=4 2298 B12R1.1748 COC(=O)CC1CCCCCC1 MCULE-5471448909 [0,1,0,1,0,0|0,0,0]=2 2299 B12R1.1748 COC(=O)CC1CCCNCC1 MCULE-8246652599 [0,1,0,1,0,0|1,0,0]=3 2300 B12R1.1748 COC(=O)CC1CCCNCC1 MCULE-8769597228 [0,1,0,1,0,0|1,0,0]=3 2301 B12R1.1748 COC(=O)CN1CCCNCC1 MCULE-2302704687 [0,1,0,1,0,0|2,0,0]=4 2302 B12R1.1748 COC(=O)CN1CCCNCC1 MCULE-2502781833 [0,1,0,1,0,0|2,0,0]=4 2303 B12R1.1748 N/C(=N\O)/CN1CCCCCC1 MCULE-9532779232 [0,1,0,1,0,0|2,0,0]=4 2304 B12R1.1748 NNC(=O)CN1CCCCCC1 MCULE-4753957009 [0,1,0,1,0,0|2,0,0]=4 2305 B12R1.1748 O=C(CCl)NC1CCCCCC1 MCULE-9132892908 [0,1,0,1,0,0|2,0,0]=4 2306 B12R1.43 C=C(CN1CCCCC1)C(=O)O MCULE-4086003668 [0,1,0,1,0,0|1,0,1]=4 2307 B12R1.43 CC(=O)C(C)CN1CCCCC1 MCULE-2176063333 [0,1,0,1,0,0|2,0,0]=4 2308 B12R1.43 CC(CC1CCCCC1)C(=O)O MCULE-5593770209 [0,1,0,1,0,0|0,0,0]=2 2309 B12R1.43 CC(CC1CCCCN1)C(=O)O MCULE-2755004024 [0,1,0,1,0,0|1,0,0]=3 2310 B12R1.43 CC(CC1CCCCN1)C(=O)O MCULE-7476245238 [0,1,0,1,0,0|1,0,0]=3 2311 B12R1.43 CC(CC1CCCNC1)C(=O)O MCULE-3014272377 [0,1,0,1,0,0|1,0,0]=3 2312 B12R1.43 CC(CC1CCCNC1)C(=O)O MCULE-5164954255 [0,1,0,1,0,0|1,0,0]=3 2313 B12R1.43 CC(CC1CCNCC1)C(=O)O MCULE-1413560351 [0,1,0,1,0,0|1,0,0]=3 2314 B12R1.43 CC(CC1CCNCC1)C(=O)O MCULE-4131542201 [0,1,0,1,0,0|1,0,0]=3 2315 B12R1.43 CC(CC1CCOCC1)C(=O)O MCULE-8701973693 [0,1,0,1,0,0|1,0,0]=3 2316 B12R1.43 CC(CN1CCCCC1)C(=O)O MCULE-1034953096 [0,1,0,1,0,0|1,0,0]=3 2317 B12R1.43 CC(CN1CCCCC1)C(=O)O MCULE-2445155741 [0,1,0,1,0,0|1,0,0]=3 2318 B12R1.43 CC(CN1CCOCC1)C(=O)O MCULE-5931804753 [0,1,0,1,0,0|2,0,0]=4 2319 B12R1.43 CC(C[NH+]1CCOCC1)C(=O)O MCULE-4377838448 [0,1,0,1,0,0|2,0,0]=4 2320 B12R1.43 CC(NC1CCCCC1)C(=O)O MCULE-2337671318 [0,1,0,1,0,0|1,0,0]=3 2321 B12R1.43 CC(OC1CCCCC1)C(=O)O MCULE-3390289519 [0,1,0,1,0,0|1,0,0]=3 2322 B12R1.43 C[C@H](CC1CCCCC1)C(=O)O MCULE-1498161955 [0,1,0,1,0,0|0,0,0]=2 2323 B12R1.43 C[C@H](NC1CCCCC1)C(=O)O MCULE-7949492561 [0,1,0,1,0,0|1,0,0]=3 2324 B12R1.43 C[C@H](NC1CCCCC1)C(=O)O MCULE-8747258792 [0,1,0,1,0,0|1,0,0]=3 2325 B12R1.43 NC(=O)[C@@H](N)CC1CCCCC1 MCULE-2925655826 [0,1,0,1,0,0|1,0,0]=3 2326 B12R1.43 NC(=O)[C@@H](N)CC1CCCCC1 MCULE-7996338421 [0,1,0,1,0,0|1,0,0]=3 2327 B12R1.43 NC(=O)[C@@H](N)CC1CCCCC1 MCULE-8243136061 [0,1,0,1,0,0|1,0,0]=3 2328 B12R1.43 NC(=O)[C@@H](N)CC1CCCCC1 MCULE-8981874598 [0,1,0,1,0,0|1,0,0]=3 2329 B12R1.43 NC(CC1CCCCC1)C(=O)O MCULE-4231962732 [0,1,0,1,0,0|0,0,0]=2 2330 B12R1.43 NC(CC1CCCCC1)C(=O)O MCULE-5441238803 [0,1,0,1,0,0|0,0,0]=2 2331 B12R1.43 NC(CC1CCCCC1)C(=O)O MCULE-5559107138 [0,1,0,1,0,0|0,0,0]=2 2332 B12R1.43 NC(CC1CCCCC1)C(=O)O MCULE-9351196605 [0,1,0,1,0,0|0,0,0]=2 2333 B12R1.43 NC(CC1CCOCC1)C(=O)O MCULE-3782499699 [0,1,0,1,0,0|1,0,0]=3 2334 B12R1.43 NC(CC1CCOCC1)C(=O)O MCULE-8813787947 [0,1,0,1,0,0|1,0,0]=3 2335 B12R1.43 NC(CN1CCNCC1)C(=O)O MCULE-6112445045 [0,1,0,1,0,0|2,0,0]=4 2336 B12R1.43 NC(CN1CCNCC1)C(=O)O MCULE-9896812285 [0,1,0,1,0,0|2,0,0]=4 2337 B12R1.43 NC(CN1CCOCC1)C(=O)O MCULE-2006139914 [0,1,0,1,0,0|2,0,0]=4 2338 B12R1.43 NC(CN1CCOCC1)C(=O)O MCULE-9043079943 [0,1,0,1,0,0|2,0,0]=4 2339 B12R1.43 N[C@@H](CC1CCCCC1)C(=O)O MCULE-1782298917 [0,1,0,1,0,0|0,0,0]=2 2340 B12R1.43 N[C@@H](CC1CCCCC1)C(=O)O MCULE-1829182577 [0,1,0,1,0,0|0,0,0]=2 2341 B12R1.43 N[C@@H](CC1CCCCC1)C(=O)O MCULE-2645618623 [0,1,0,1,0,0|0,0,0]=2 2342 B12R1.43 N[C@@H](CC1CCCCC1)C(=O)O MCULE-8551085565 [0,1,0,1,0,0|0,0,0]=2 2343 B12R1.43 N[C@@H](CC1CCOCC1)C(=O)O MCULE-1647906724 [0,1,0,1,0,0|1,0,0]=3 2344 B12R1.43 N[C@@H](CC1CCOCC1)C(=O)O MCULE-3558141373 [0,1,0,1,0,0|1,0,0]=3 2345 B12R1.43 N[C@@H](CC1CCOCC1)C(=O)O MCULE-9537249167 [0,1,0,1,0,0|1,0,0]=3 2346 B12R1.43 N[C@@H](CC1CCOCC1)C(=O)O MCULE-9665106160 [0,1,0,1,0,0|1,0,0]=3 2347 B12R1.43 N[C@@H](CN1CCNCC1)C(=O)O MCULE-1402393212 [0,1,0,1,0,0|2,0,0]=4 2348 B12R1.43 N[C@@H](CN1CCNCC1)C(=O)O MCULE-5238707864 [0,1,0,1,0,0|2,0,0]=4 2349 B12R1.43 N[C@@H](CN1CCNCC1)C(=O)O MCULE-7943048524 [0,1,0,1,0,0|2,0,0]=4 2350 B12R1.43 N[C@@H](CN1CCNCC1)C(=O)O MCULE-9411844365 [0,1,0,1,0,0|2,0,0]=4 2351 B12R1.43 N[C@@H](CN1CCOCC1)C(=O)O MCULE-5887663442 [0,1,0,1,0,0|2,0,0]=4 2352 B12R1.43 N[C@H](CC1CCCCC1)C(=O)O MCULE-3421636940 [0,1,0,1,0,0|0,0,0]=2 2353 B12R1.43 N[C@H](CC1CCCCC1)C(=O)O MCULE-4892184412 [0,1,0,1,0,0|0,0,0]=2 2354 B12R1.43 N[C@H](CC1CCCCC1)C(=O)O MCULE-5098090144 [0,1,0,1,0,0|0,0,0]=2 2355 B12R1.43 N[C@H](CC1CCCCC1)C(=O)O MCULE-8153309063 [0,1,0,1,0,0|0,0,0]=2 2356 B12R1.43 N[C@H](CC1CCOCC1)C(=O)O MCULE-1997730867 [0,1,0,1,0,0|1,0,0]=3 2357 B12R1.43 N[C@H](CC1CCOCC1)C(=O)O MCULE-2898762909 [0,1,0,1,0,0|1,0,0]=3 2358 B12R1.43 N[C@H](CC1CCOCC1)C(=O)O MCULE-4075867386 [0,1,0,1,0,0|1,0,0]=3 2359 B12R1.43 N[C@H](CC1CCOCC1)C(=O)O MCULE-6776158188 [0,1,0,1,0,0|1,0,0]=3 2360 B12R1.43 N[C@H](CN1CCOCC1)C(=O)O MCULE-4790134437 [0,1,0,1,0,0|2,0,0]=4 2361 B12R1.43 O=C(O)C(=CC1CCCCC1)F MCULE-2588722385 [0,1,0,1,0,0|0,0,2]=4 2362 B12R1.43 O=C(O)C(=O)CC1CCCCC1 MCULE-2990391321 [0,1,0,1,0,0|0,0,1]=3 2363 B12R1.43 O=C(O)C(=O)NC1CCCCC1 MCULE-9213832688 [0,1,0,1,0,0|1,0,1]=4 2364 B12R1.43 O=C(O)C(F)CC1CCCCC1 MCULE-7464253405 [0,1,0,1,0,0|0,0,0]=2 2365 B12R1.43 O=C(O)C(O)CC1CCCCC1 MCULE-9641279057 [0,1,0,1,0,0|0,0,0]=2 2366 B12R1.43 O=C(O)C(O)CC1CCOCC1 MCULE-6691815074 [0,1,0,1,0,0|1,0,0]=3 2367 B12R1.43 O=C(O)[C@@H](O)CC1CCCCC1 MCULE-2560030099 [0,1,0,1,0,0|0,0,0]=2 2368 B12R1.43 O=C(O)[C@H](O)CC1CCCCC1 MCULE-1111579897 [0,1,0,1,0,0|0,0,0]=2 2369 B12R1.43 O=C(O)[C@H](O)CC1CCCCC1 MCULE-1257034455 [0,1,0,1,0,0|0,0,0]=2 2370 B12R1.80 CCC1CCCN1C(=O)C(=O)O MCULE-4865236632 [0,1,0,1,0,0|1,0,1]=4 2371 B12R1.124 CC1CCCCN1C(=O)C(=O)O MCULE-5991116368 [0,1,0,1,0,0|1,0,1]=4 2372 B12R1.124 CC1CCCCN1C(C)C(=O)O MCULE-2732233941 [0,1,0,1,0,0|1,0,0]=3 2373 B12R1.264 CC(OCC1CCCO1)C(=O)O MCULE-1083050078 [0,1,0,1,0,0|2,0,0]=4 2374 B12R1.264 CC(SCC1CCCO1)C(=O)O MCULE-8873052414 [0,1,0,1,0,0|2,0,0]=4 2375 B12R1.264 NC(CCC1OCCO1)C(=O)O MCULE-3069534908 [0,1,0,1,0,0|2,0,0]=4 2376 B12R1.264 NC(CCN1CCCC1)C(=O)O MCULE-2409569180 [0,1,0,1,0,0|1,0,0]=3 2377 B12R1.279 CCCC1CC(CCO1)C(=O)O MCULE-6136659670 [0,1,0,1,0,0|1,0,0]=3 2378 B12R1.279 CCCN1CCCC(C1)C(=O)N MCULE-4508068601 [0,1,0,1,0,0|2,0,0]=4 2379 B12R1.279 CCCN1CCCC(C1)C(=O)O MCULE-7817334936 [0,1,0,1,0,0|1,0,0]=3 2380 B12R1.279 CCCN1CCCC(C1)C(=O)O MCULE-9739658494 [0,1,0,1,0,0|1,0,0]=3 2381 B12R1.279 O=C(O)C1CCCN(C1)CCO MCULE-3946447960 [0,1,0,1,0,0|2,0,0]=4 2382 B12R1.337 CCCCC1NC(CS1)C(=O)O MCULE-3670233740 [0,1,0,1,0,0|1,0,0]=3 2383 B12R1.337 COCCN1CCC(C1)C(=O)O MCULE-5583519936 [0,1,0,1,0,0|2,0,0]=4 2384 B12R1.337 CSCCC1NC(CS1)C(=O)O MCULE-3846304676 [0,1,0,1,0,0|2,0,0]=4 2385 B12R1.626 COC1CCCCC(C1)C(=O)O MCULE-7462960246 [0,1,0,1,0,0|1,0,0]=3 2386 B12R1.1385 NC1(CCCCCCC1)C(=O)O MCULE-6266027658 [0,1,0,1,0,0|0,0,0]=2 2387 B12R1.1416 COCCOC1CC(C1)C(=O)O MCULE-7014590630 [0,1,0,1,0,0|2,0,0]=4 2388 B12R1.2197 C(N)(C(=O)O)C1CCCCCC1 MCULE-6964253676 [0,1,0,1,0,0|0,0,0]=2 2389 B12R1.2197 CC(C(=O)O)N1CCCCCC1 MCULE-2902696136 [0,1,0,1,0,0|1,0,0]=3 2390 B12R1.2197 CC(C(=O)O)N1CCCCCC1 MCULE-9930977486 [0,1,0,1,0,0|1,0,0]=3 2391 B12R1.2197 NC(C(=O)O)C1CCCCCC1 MCULE-6624049364 [0,1,0,1,0,0|0,0,0]=2 2392 B12R1.2197 NC(C(=O)O)C1CCCCCC1 MCULE-8004618459 [0,1,0,1,0,0|0,0,0]=2 2393 B12R1.2197 N[C@@H](C(=O)O)C1CCCCCC1 MCULE-1678135453 [0,1,0,1,0,0|0,0,0]=2 2394 B12R1.2197 N[C@@H](C(=O)O)C1CCCCCC1 MCULE-4899000866 [0,1,0,1,0,0|0,0,0]=2 2395 B12R1.2197 N[C@H](C(=O)O)C1CCCCCC1 MCULE-4407848265 [0,1,0,1,0,0|0,0,0]=2 2396 B12R1.2197 N[C@H](C(=O)O)C1CCCCCC1 MCULE-5410436039 [0,1,0,1,0,0|0,0,0]=2 2397 B12R1.2197 O=C(O)C(=O)N1CCCCCC1 MCULE-4049951771 [0,1,0,1,0,0|1,0,1]=4 2398 B12R1.2197 O=C(O)C(O)C1CCCCCC1 MCULE-8206008473 [0,1,0,1,0,0|0,0,0]=2 2399 B12R1.54 CC(CCC(=O)O)N1CCCC1 MCULE-1274131595 [0,1,0,1,0,0|1,0,0]=3 2400 B12R1.54 CC(CCC(=O)O)N1CCCC1 MCULE-6098106748 [0,1,0,1,0,0|1,0,0]=3 2401 B12R1.54 O=C(O)CCC(=O)C1CCCC1 MCULE-4029687060 [0,1,0,1,0,0|0,0,1]=3 2402 B12R1.54 O=C(O)CCC(=O)N1CCCC1 MCULE-5028290066 [0,1,0,1,0,0|1,0,1]=4 2403 B12R1.54 O=C(O)CNC(=O)C1CCCC1 MCULE-5901743102 [0,1,0,1,0,0|1,0,1]=4 2404 B12R1.59 CCC1CCC(C1)CCC(=O)O MCULE-7730890965 [0,1,0,1,0,0|0,0,0]=2 2405 B12R1.59 CCC1CCC(C1)CCC(=O)[O-] MCULE-2720912899 [0,1,0,1,0,0|0,0,1]=3 2406 B12R1.210 O=C(O)CN1CCCCCC1=O MCULE-8200254471 [0,1,0,1,0,0|1,0,1]=4 2407 B12R1.552 O=C(O)CCC(=O)NCC1CC1 MCULE-3412392311 [0,1,0,1,0,0|1,0,1]=4 2408 B12R1.1009 CC1CCCC(N1CC(=O)O)C MCULE-5134002534 [0,1,0,1,0,0|1,0,0]=3 2409 B12R1.1009 CC1CCCC(N1CC(=O)O)C MCULE-6785666353 [0,1,0,1,0,0|1,0,0]=3 2410 B12R1.1009 C[C@H]1CCC[C@H](N1CC(=O)O)C MCULE-4897379084 [0,1,0,1,0,0|1,0,0]=3 2411 B12R1.1343 CC(=O)CCC1CCCCCC1 MCULE-1678869086 [0,1,0,1,0,0|1,0,0]=3 2412 B12R1.1343 O=C(O)CCC1CCCCCC1 MCULE-3221739644 [0,1,0,1,0,0|0,0,0]=2 2413 B12R1.1343 O=C(O)CCN1CCCCCC1 MCULE-6902441701 [0,1,0,1,0,0|0,0,0]=2 2414 B12R1.1343 O=C(O)CCN1CCCCCC1 MCULE-8652213601 [0,1,0,1,0,0|0,0,0]=2 2415 B12R1.1343 O=C(O)CCN1CSCCSC1 MCULE-9661159221 [0,1,0,1,0,0|2,0,0]=4 2416 B12R1.1343 O=C(O)CNC1=NCCCCC1 MCULE-2991973710 [0,1,0,1,0,0|1,0,1]=4 2417 B12R1.1343 O=C(O)CNC1CCCCCC1 MCULE-3407473628 [0,1,0,1,0,0|0,0,0]=2 2418 B12R1.1343 O=C(O)COC1CCCCCC1 MCULE-7705697205 [0,1,0,1,0,0|0,0,0]=2 2419 B12R1.3110 CC(=O)NCC1(CCCCC1)N MCULE-6978852027 [0,1,0,1,0,0|2,0,0]=4 2420 B12R1.3110 CC(=O)NCC1(CCCCC1)N MCULE-7572327873 [0,1,0,1,0,0|2,0,0]=4 2421 B12R1.3110 CC1(CCCCC1)CCC(=O)O MCULE-4030655928 [0,1,0,1,0,0|0,0,0]=2 2422 B12R1.3110 CC1(CCOCC1)OCC(=O)O MCULE-9546718249 [0,1,0,1,0,0|2,0,0]=4 2423 B12R1.3110 NC1(CCCCC1)CCC(=O)O MCULE-7944829065 [0,1,0,1,0,0|0,0,0]=2 2424 B12R1.3110 NC1(CCCCC1)CCC(=O)O MCULE-8909515747 [0,1,0,1,0,0|0,0,0]=2 2425 B12R1.3110 O=C(O)C#CC1(CCCCC1)O MCULE-9539141010 [0,1,0,1,0,0|0,0,2]=4 2426 B12R1.21 CC(=O)SC[C@H]1CC[C@@H](CC1)N MCULE-6711585956 [0,1,0,1,0,0|2,0,0]=4 2427 B12R1.21 CC(=O)SC[C@H]1CC[C@@H](CC1)N MCULE-9356026775 [0,1,0,1,0,0|2,0,0]=4 2428 B12R1.21 CC1CCC(CC1)OCC(=O)O MCULE-3906347654 [0,1,0,1,0,0|1,0,0]=3 2429 B12R1.21 CC1CCN(CC1)CCC(=O)N MCULE-9374395485 [0,1,0,1,0,0|2,0,0]=4 2430 B12R1.21 CC1CCN(CC1)CCC(=O)O MCULE-2878454112 [0,1,0,1,0,0|1,0,0]=3 2431 B12R1.21 CC1CC[NH+](CC1)CCC(=O)O MCULE-8844394642 [0,1,0,1,0,0|1,0,0]=3 2432 B12R1.21 CN1CCC(CC1)CCC(=O)O MCULE-2352268379 [0,1,0,1,0,0|1,0,0]=3 2433 B12R1.21 CN1CCC(CC1)CCC(=O)O MCULE-5230181915 [0,1,0,1,0,0|1,0,0]=3 2434 B12R1.21 CN1CCC(CC1)NCC(=O)O MCULE-1028235136 [0,1,0,1,0,0|2,0,0]=4 2435 B12R1.21 CN1CCC(CC1)NCC(=O)O MCULE-1844187145 [0,1,0,1,0,0|2,0,0]=4 2436 B12R1.21 CN1CCC(CC1)NCC(=O)O MCULE-2824894839 [0,1,0,1,0,0|2,0,0]=4 2437 B12R1.21 CN1CCC(CC1)OCC(=O)O MCULE-2494292636 [0,1,0,1,0,0|2,0,0]=4 2438 B12R1.21 CN1CCC(CC1)OCC(=O)O MCULE-2925460339 [0,1,0,1,0,0|2,0,0]=4 2439 B12R1.21 CN1CCN(CC1)CCC(=O)O MCULE-1064558305 [0,1,0,1,0,0|2,0,0]=4 2440 B12R1.21 CN1CCN(CC1)CCC(=O)O MCULE-8851231968 [0,1,0,1,0,0|2,0,0]=4 2441 B12R1.21 C[C@H]1CC[C@@H](CC1)CCC(=O)O MCULE-7082492863 [0,1,0,1,0,0|0,0,0]=2 2442 B12R1.21 C[NH+]1CC[NH+](CC1)CCC(=O)O MCULE-4626055005 [0,1,0,1,0,0|2,0,0]=4 2443 B12R1.21 NC(=O)CNC1CCC(CC1)N MCULE-8943771451 [0,1,0,1,0,0|2,0,0]=4 2444 B12R1.21 NC1CCC(CC1)CCC(=O)O MCULE-3578215541 [0,1,0,1,0,0|0,0,0]=2 2445 B12R1.21 NC1CCC(CC1)NCC(=O)O MCULE-5319227851 [0,1,0,1,0,0|1,0,0]=3 2446 B12R1.21 O=C(O)CCC1CCC(=O)CC1 MCULE-5805639266 [0,1,0,1,0,0|0,0,1]=3 2447 B12R1.21 O=C(O)CCC1CCC(=O)NC1 MCULE-4463958596 [0,1,0,1,0,0|1,0,1]=4 2448 B12R1.21 O=C(O)CCN1CCC(=O)CC1 MCULE-3345805432 [0,1,0,1,0,0|1,0,1]=4 2449 B12R1.21 O=C(O)CCN1CCC(CC1)O MCULE-9235280130 [0,1,0,1,0,0|1,0,0]=3 2450 B12R1.21 O=C(O)CCN1CCC(CC1)O MCULE-9990533659 [0,1,0,1,0,0|1,0,0]=3 2451 B12R1.21 O=C(O)CCN1CCS(=O)CC1 MCULE-2459585373 [0,1,0,1,0,0|2,0,0]=4 2452 B12R1.21 O=C(O)CNC1CCC(=O)CC1 MCULE-8506813160 [0,1,0,1,0,0|1,0,1]=4 2453 B12R1.21 O=C(O)CNC1CCC(CC1)Br MCULE-6782284499 [0,1,0,1,0,0|1,0,0]=3 2454 B12R1.21 O=C(O)CNC1CCC(CC1)Cl MCULE-6608935546 [0,1,0,1,0,0|1,0,0]=3 2455 B12R1.21 O=C(O)CNC1CCC(CC1)I MCULE-2374737750 [0,1,0,1,0,0|1,0,0]=3 2456 B12R1.21 O=C(O)CNC1CCC(CC1)O MCULE-5139328392 [0,1,0,1,0,0|1,0,0]=3 2457 B12R1.368 CCC(=O)N1CCCC1C(=O)O MCULE-9954111494 [0,1,0,1,0,0|1,0,1]=4 2458 B12R1.368 CCC(=O)N1CCC[C@H]1C(=O)O MCULE-1913297626 [0,1,0,1,0,0|1,0,1]=4 2459 B12R1.368 CCC(=O)N1CCC[C@H]1C(=O)O MCULE-2045476528 [0,1,0,1,0,0|1,0,1]=4 2460 B12R1.368 COC(=O)C1CCCC1C(=O)O MCULE-9581431032 [0,1,0,1,0,0|1,0,1]=4 2461 B12R1.368 COC(=O)[C@@H]1CCC[C@H]1C(=O)O MCULE-3708284379 [0,1,0,1,0,0|1,0,1]=4 2462 B12R1.368 COC(=O)[C@@H]1CCC[C@H]1C(=O)O MCULE-7207251404 [0,1,0,1,0,0|1,0,1]=4 2463 B12R1.368 COC(=O)[C@H]1CCC[C@@H]1C(=O)O MCULE-2395296422 [0,1,0,1,0,0|1,0,1]=4 2464 B12R1.368 COC(=O)[C@H]1CCC[C@H]1C(=O)O MCULE-1837515410 [0,1,0,1,0,0|1,0,1]=4 2465 B12R1.368 COC(=O)[C@H]1CCC[C@H]1C(=O)O MCULE-4611068546 [0,1,0,1,0,0|1,0,1]=4 2466 B12R1.368 COC(=O)[C@H]1CCC[C@H]1C(=O)O MCULE-7157008551 [0,1,0,1,0,0|1,0,1]=4 2467 B12R1.125 CC1CCCCC1OCC(=O)O MCULE-2149192016 [0,1,0,1,0,0|0,0,0]=2 2468 B12R1.125 CC1CCCCN1CCC(=N)N MCULE-2398652845 [0,1,0,1,0,0|2,0,0]=4 2469 B12R1.125 CC1CCCCN1CCC(=N)N MCULE-7004020111 [0,1,0,1,0,0|2,0,0]=4 2470 B12R1.125 CC1CCCCN1CCC(=O)O MCULE-2264327508 [0,1,0,1,0,0|0,0,0]=2 2471 B12R1.125 CC1CCCCN1CCC(=O)O MCULE-6515087928 [0,1,0,1,0,0|0,0,0]=2 2472 B12R1.125 CC1CNCCC1CCC(=O)O MCULE-8609285846 [0,1,0,1,0,0|0,0,0]=2 2473 B12R1.125 CN1CCCCC1CCC(=O)O MCULE-7324723252 [0,1,0,1,0,0|0,0,0]=2 2474 B12R1.125 CN1CCCCC1CCC(=O)O MCULE-8814910063 [0,1,0,1,0,0|0,0,0]=2 2475 B12R1.125 NC1CCCCC1CCC(=O)O MCULE-6538296828 [0,1,0,1,0,0|0,0,0]=2 2476 B12R1.125 NC1CCCCC1CCC(=O)O MCULE-9802411985 [0,1,0,1,0,0|0,0,0]=2 2477 B12R1.125 O=C(O)CCC1CCCCC1=O MCULE-4224119563 [0,1,0,1,0,0|0,0,1]=3 2478 B12R1.125 O=C(O)CCN1CCCCC1=O MCULE-6569100258 [0,1,0,1,0,0|1,0,1]=4 2479 B12R1.125 O=C(O)CSC1CCCCC1O MCULE-9209996677 [0,1,0,1,0,0|1,0,0]=3 2480 B12R1.127 CN1CCN(C(C1)CC(=O)O)C MCULE-2335316854 [0,1,0,1,0,0|2,0,0]=4 2481 B12R1.127 CN1CCN(C(C1)CC(=O)O)C MCULE-4623068601 [0,1,0,1,0,0|2,0,0]=4 2482 B12R1.252 C=C(C)CCCC1CCCCC1 MCULE-7799078786 [0,1,0,1,0,0|2,0,0]=4 2483 B12R1.252 CC(=O)CCC=C1CCCCC1 MCULE-1076445196 [0,1,0,1,0,0|1,0,1]=4 2484 B12R1.252 CC(=O)CCCC1CCCCC1 MCULE-5187598883 [0,1,0,1,0,0|1,0,0]=3 2485 B12R1.252 CC(=O)NCCC1CCCCN1 MCULE-5840104711 [0,1,0,1,0,0|2,0,0]=4 2486 B12R1.252 CC(=O)NCCC1CCCCN1 MCULE-7320206184 [0,1,0,1,0,0|2,0,0]=4 2487 B12R1.252 CC(=O)NCCC1CCCCN1 MCULE-9295576951 [0,1,0,1,0,0|2,0,0]=4 2488 B12R1.252 CC(=O)NCCC1CCCNC1 MCULE-2925470482 [0,1,0,1,0,0|2,0,0]=4 2489 B12R1.252 CC(=O)NCCC1CCCNC1 MCULE-7399408933 [0,1,0,1,0,0|2,0,0]=4 2490 B12R1.252 CC(=O)NCCC1CCNCC1 MCULE-7669887235 [0,1,0,1,0,0|2,0,0]=4 2491 B12R1.252 CC(=O)NCCC1CCNCC1 MCULE-9410705557 [0,1,0,1,0,0|2,0,0]=4 2492 B12R1.252 CC(=O)OCCC1CCCCN1 MCULE-1026387511 [0,1,0,1,0,0|2,0,0]=4 2493 B12R1.252 CC(=O)OCCC1CCCCN1 MCULE-3751642892 [0,1,0,1,0,0|2,0,0]=4 2494 B12R1.252 CC(=O)OCCC1CCCNC1 MCULE-1775660875 [0,1,0,1,0,0|2,0,0]=4 2495 B12R1.252 CC(=O)OCCC1CCCNC1 MCULE-7081319541 [0,1,0,1,0,0|2,0,0]=4 2496 B12R1.252 CC(=O)OCCC1CCNCC1 MCULE-3691332043 [0,1,0,1,0,0|2,0,0]=4 2497 B12R1.252 CC(=O)OCCC1CCNCC1 MCULE-8239323848 [0,1,0,1,0,0|2,0,0]=4 2498 B12R1.252 CC(=O)SCCC1CCCCC1 MCULE-8635148363 [0,1,0,1,0,0|1,0,0]=3 2499 B12R1.252 CC(=O)SCCN1CCCCC1 MCULE-2541705969 [0,1,0,1,0,0|2,0,0]=4 2500 B12R1.252 CC(=O)SCCN1CCCCC1 MCULE-8698410675 [0,1,0,1,0,0|2,0,0]=4 2501 B12R1.252 CC(O)CNCC1CCCCC1 MCULE-6837813049 [0,1,0,1,0,0|1,0,1]=4 2502 B12R1.252 CC(O)CNCC1CCCCC1 MCULE-6859220464 [0,1,0,1,0,0|1,0,1]=4 2503 B12R1.252 NC(=O)CCCC1CCNCC1 MCULE-8068328020 [0,1,0,1,0,0|1,0,0]=3 2504 B12R1.252 NC(=O)CCNC1CCCCC1 MCULE-6961669869 [0,1,0,1,0,0|1,0,0]=3 2505 B12R1.252 NC(=O)CNCC1CCOCC1 MCULE-8061631380 [0,1,0,1,0,0|2,0,0]=4 2506 B12R1.252 O=C(Cl)CCCC1CCCCC1 MCULE-6685434994 [0,1,0,1,0,0|1,0,0]=3 2507 B12R1.252 O=C(O)/C=C/CN1CCCCC1 MCULE-2574027587 [0,1,0,1,0,0|0,0,2]=4 2508 B12R1.252 O=C(O)/C=C/CN1CCCCC1 MCULE-7976173160 [0,1,0,1,0,0|0,0,2]=4 2509 B12R1.252 O=C(O)C=CCN1CCCCC1 MCULE-2313554291 [0,1,0,1,0,0|0,0,2]=4 2510 B12R1.252 O=C(O)C=CCN1CCCCC1 MCULE-5619896364 [0,1,0,1,0,0|0,0,2]=4 2511 B12R1.252 O=C(O)CCCC1CCCCC1 MCULE-8249292238 [0,1,0,1,0,0|0,0,0]=2 2512 B12R1.252 O=C(O)CCCC1CCCCN1 MCULE-6744436702 [0,1,0,1,0,0|0,0,0]=2 2513 B12R1.252 O=C(O)CCCC1CCCCN1 MCULE-6927833795 [0,1,0,1,0,0|0,0,0]=2 2514 B12R1.252 O=C(O)CCCC1CCNCC1 MCULE-1999021566 [0,1,0,1,0,0|0,0,0]=2 2515 B12R1.252 O=C(O)CCCC1CCNCC1 MCULE-5061937452 [0,1,0,1,0,0|0,0,0]=2 2516 B12R1.252 O=C(O)CCCC1CCOCC1 MCULE-3067113283 [0,1,0,1,0,0|0,0,0]=2 2517 B12R1.252 O=C(O)CCCN1CCCCC1 MCULE-2691750895 [0,1,0,1,0,0|0,0,0]=2 2518 B12R1.252 O=C(O)CCCN1CCCCC1 MCULE-7693123644 [0,1,0,1,0,0|0,0,0]=2 2519 B12R1.252 O=C(O)CCCN1CCOCC1 MCULE-3808061194 [0,1,0,1,0,0|1,0,0]=3 2520 B12R1.252 O=C(O)CCCN1CCOCC1 MCULE-6111321827 [0,1,0,1,0,0|1,0,0]=3 2521 B12R1.252 O=C(O)CCNC1=NCCCC1 MCULE-7368604852 [0,1,0,1,0,0|1,0,1]=4 2522 B12R1.252 O=C(O)CCNC1CCCCC1 MCULE-9246786190 [0,1,0,1,0,0|0,0,0]=2 2523 B12R1.252 O=C(O)CCOC1CCCCO1 MCULE-1716928477 [0,1,0,1,0,0|1,0,0]=3 2524 B12R1.252 O=C(O)CCOC1CCOCC1 MCULE-9390535734 [0,1,0,1,0,0|1,0,0]=3 2525 B12R1.252 O=C(O)CNCC1CCCCC1 MCULE-8613545922 [0,1,0,1,0,0|0,0,0]=2 2526 B12R1.252 O=C(O)CNCC1CCCCC1 MCULE-8778334854 [0,1,0,1,0,0|0,0,0]=2 2527 B12R1.252 O=C(O)COCC1CCCCO1 MCULE-4058015104 [0,1,0,1,0,0|1,0,0]=3 2528 B12R1.252 O=C(O)CSCC1CCCCO1 MCULE-4195821334 [0,1,0,1,0,0|1,0,0]=3 2529 B12R1.252 O=C([O-])CCCC1CCCCC1 MCULE-8598802518 [0,1,0,1,0,0|0,0,1]=3 2530 B12R1.252 OB(O)CCCC1CCCCC1 MCULE-4093256475 [0,1,0,1,0,0|1,0,1]=4 2531 B12R1.1238 CC1CC1C(=O)NCCC(=O)O MCULE-4926198449 [0,1,0,1,0,0|1,0,1]=4 2532 B12R1.1357 O=C(O)CCCC(=O)C1CCC1 MCULE-4094454547 [0,1,0,1,0,0|0,0,1]=3 2533 B12R1.1357 O=C(O)CCNC(=O)C1CCC1 MCULE-2845215122 [0,1,0,1,0,0|1,0,1]=4 2534 B12R1.1359 O=C(O)CCCC(=O)NC1CC1 MCULE-8313432744 [0,1,0,1,0,0|1,0,1]=4 2535 B12R1.2019 CCCNC(=O)C1CC1C(=O)O MCULE-4249132839 [0,1,0,1,0,0|1,0,1]=4 2536 B12R1.28 CC/C=C\CC1CCCC(=O)O1 MCULE-3393454158 [0,1,0,1,0,0|0,0,1]=3 2537 B12R1.28 CCC=CCC1CCCC(=O)O1 MCULE-9639028527 [0,1,0,1,0,0|0,0,1]=3 2538 B12R1.28 CCCCCC1CC=CC(=O)O1 MCULE-9666662342 [0,1,0,1,0,0|0,0,1]=3 2539 B12R1.28 CCCCCC1CCCC(=O)O1 MCULE-2527242599 [0,1,0,1,0,0|0,0,0]=2 2540 B12R1.28 CCCCC[C@@H]1CC=CC(=O)O1 MCULE-1286702458 [0,1,0,1,0,0|0,0,1]=3 2541 B12R1.28 CCCCC[C@H]1CC=CC(=O)O1 MCULE-7838361683 [0,1,0,1,0,0|0,0,1]=3 2542 B12R1.28 CCCCOC1=CC(=O)CCC1 MCULE-4416106131 [0,1,0,1,0,0|1,0,1]=4 2543 B12R1.28 N#CCCCC1CCCC(=O)C1 MCULE-4819873207 [0,1,0,1,0,0|1,0,1]=4 2544 B12R1.75 CCC1CCCCN1CC(=O)O MCULE-1466936975 [0,1,0,1,0,0|0,0,0]=2 2545 B12R1.75 CCC1CCCCN1CC(=O)O MCULE-4786692834 [0,1,0,1,0,0|0,0,0]=2 2546 B12R1.75 CNC1CCCCC1NC(=O)C MCULE-2047298936 [0,1,0,1,0,0|2,0,0]=4 2547 B12R1.75 COC1COCCC1CC(=O)O MCULE-1148352268 [0,1,0,1,0,0|1,0,0]=3 2548 B12R1.75 O=C(O)CN1CCCCC1CBr MCULE-4745302069 [0,1,0,1,0,0|1,0,0]=3 2549 B12R1.75 O=C(O)CN1CCCCC1CCl MCULE-1771575283 [0,1,0,1,0,0|1,0,0]=3 2550 B12R1.75 O=C(O)CN1CCCCC1CI MCULE-1312726912 [0,1,0,1,0,0|1,0,0]=3 2551 B12R1.75 O=C(O)CN1CCCCC1CO MCULE-9904924658 [0,1,0,1,0,0|1,0,0]=3 2552 B12R1.81 COC1CCCC1NCC(=O)N MCULE-9154365181 [0,1,0,1,0,0|2,0,0]=4 2553 B12R1.81 COC1CCCC1NCC(=O)O MCULE-2262288610 [0,1,0,1,0,0|1,0,0]=3 2554 B12R1.130 CN1CCCC1CNCC(=O)O MCULE-3274185883 [0,1,0,1,0,0|1,0,0]=3 2555 B12R1.130 CN1CCCC1COCC(=O)O MCULE-2248139834 [0,1,0,1,0,0|1,0,0]=3 2556 B12R1.130 CN1CCCC1COCC(=O)O MCULE-6246100493 [0,1,0,1,0,0|1,0,0]=3 2557 B12R1.130 CN1CCC[C@H]1CNCC(=O)O MCULE-5802596984 [0,1,0,1,0,0|1,0,0]=3 2558 B12R1.130 CN1CCC[C@H]1COCC(=O)O MCULE-6137867536 [0,1,0,1,0,0|1,0,0]=3 2559 B12R1.130 O=C(O)CCCN1CCCC1=O MCULE-4412423494 [0,1,0,1,0,0|1,0,1]=4 2560 B12R1.130 O=C(O)CCSC1CCCC1=O MCULE-9295693664 [0,1,0,1,0,0|1,0,1]=4 2561 B12R1.170 NCCC1CCCCCC(=O)N1 MCULE-7372073941 [0,1,0,1,0,0|1,0,0]=3 2562 B12R1.170 NCCC1CCCCCC(=O)N1 MCULE-9427535286 [0,1,0,1,0,0|1,0,0]=3 2563 B12R1.255 NC(=O)CCCCC1CCSS1 MCULE-3905195412 [0,1,0,1,0,0|2,0,0]=4 2564 B12R1.255 NC(=O)CCNCC1CCCO1 MCULE-9163751662 [0,1,0,1,0,0|2,0,0]=4 2565 B12R1.255 O=C(O)CCCCC1CCSS1 MCULE-1034910084 [0,1,0,1,0,0|1,0,0]=3 2566 B12R1.255 O=C(O)CCCCC1CSSC1 MCULE-2400272112 [0,1,0,1,0,0|1,0,0]=3 2567 B12R1.255 O=C(O)CCCCC1OCCO1 MCULE-2471174890 [0,1,0,1,0,0|1,0,0]=3 2568 B12R1.255 O=C(O)CCCCN1CCCC1 MCULE-4626905282 [0,1,0,1,0,0|0,0,0]=2 2569 B12R1.255 O=C(O)CCCCN1CCCC1 MCULE-9805744856 [0,1,0,1,0,0|0,0,0]=2 2570 B12R1.255 O=C(O)CCCC[C@@H]1CCSS1 MCULE-3939318333 [0,1,0,1,0,0|1,0,0]=3 2571 B12R1.255 O=C(O)CCCC[C@@H]1CCSS1 MCULE-5119858094 [0,1,0,1,0,0|1,0,0]=3 2572 B12R1.255 O=C(O)CCCC[C@H]1CCSS1 MCULE-3745351545 [0,1,0,1,0,0|1,0,0]=3 2573 B12R1.255 O=C(O)CCCC[C@H]1CCSS1 MCULE-4196115946 [0,1,0,1,0,0|1,0,0]=3 2574 B12R1.255 O=C(O)CCOCC1CCCO1 MCULE-6575689085 [0,1,0,1,0,0|1,0,0]=3 2575 B12R1.255 O=C(O)CSCCN1CCCC1 MCULE-8161223615 [0,1,0,1,0,0|1,0,0]=3 2576 B12R1.255 O=C(O)CSCCN1CCCC1 MCULE-9395650023 [0,1,0,1,0,0|1,0,0]=3 2577 B12R1.255 O=C([O-])CCCCC1CCSS1 MCULE-7092697398 [0,1,0,1,0,0|1,0,1]=4 2578 B12R1.283 C#CCN1CCCCC1C(=O)O MCULE-1189881562 [0,1,0,1,0,0|0,0,2]=4 2579 B12R1.283 CCCN1CCCCC1C(=O)O MCULE-1283308328 [0,1,0,1,0,0|0,0,0]=2 2580 B12R1.283 CCCN1CCCCC1C(=O)O MCULE-5666620583 [0,1,0,1,0,0|0,0,0]=2 2581 B12R1.283 CCCN1CCNCC1C(=O)O MCULE-8138651228 [0,1,0,1,0,0|1,0,0]=3 2582 B12R1.283 CNCC1CCCCN1C(=O)C MCULE-9756626362 [0,1,0,1,0,0|2,0,0]=4 2583 B12R1.289 COCC1CCCN1CC(=O)O MCULE-8271632316 [0,1,0,1,0,0|1,0,0]=3 2584 B12R1.375 CCCCCCCCC[C@@H]1CO1 MCULE-1904651720 [0,1,0,1,0,0|1,0,1]=4 2585 B12R1.375 CCCCCCCOC[C@H]1CO1 MCULE-6928162982 [0,1,0,1,0,0|1,0,1]=4 2586 B12R1.386 CCNCC1CCCN1C(=O)C MCULE-8894860154 [0,1,0,1,0,0|2,0,0]=4 2587 B12R1.386 CCNC[C@@H]1CCCN1C(=O)C MCULE-7509434787 [0,1,0,1,0,0|2,0,0]=4 2588 B12R1.386 COCCN1CSCC1C(=O)O MCULE-2549882838 [0,1,0,1,0,0|2,0,0]=4 2589 B12R1.386 N#CCCN1CCCC1C(=O)O MCULE-6379867176 [0,1,0,1,0,0|1,0,1]=4 2590 B12R1.386 N#CCCN1CCC[C@H]1C(=O)O MCULE-7540836002 [0,1,0,1,0,0|1,0,1]=4 2591 B12R1.405 CCN1CCCCCC1C(=O)O MCULE-2326419949 [0,1,0,1,0,0|0,0,0]=2 2592 B12R1.890 NS(=O)(=O)CCCC1CCCC1 MCULE-5066271688 [0,1,0,1,0,0|1,0,1]=4 2593 B12R1.890 O=S(=O)(Cl)CCCC1CCCC1 MCULE-2318188109 [0,1,0,1,0,0|1,0,1]=4 2594 B12R1.891 NS(=O)(=O)CCC1CCCCC1 MCULE-2360578309 [0,1,0,1,0,0|1,0,1]=4 2595 B12R1.891 O=S(=O)(Cl)CCC1CCCCC1 MCULE-1325872536 [0,1,0,1,0,0|1,0,1]=4 2596 B12R1.891 O=S(=O)(O)CCC1CCNCC1 MCULE-5986223279 [0,1,0,1,0,0|2,0,0]=4 2597 B12R1.2240 O=P(O)(O)CN1CCCCCC1 MCULE-8678712147 [0,1,0,1,0,0|2,0,0]=4 2598 B12R1.2240 O=S(=O)(Cl)CC1CCCCCC1 MCULE-3804366348 [0,1,0,1,0,0|1,0,1]=4 2599 B12R1.233 CC1CN(CCN1CC(=O)O)C MCULE-6193081491 [0,1,0,1,0,0|2,0,0]=4 2600 B12R1.1007 O=C1CCCCC(=O)OCCO1 MCULE-2873980195 [0,1,0,1,0,0|1,0,1]=4 2601 B12R1.1356 O=C(O)CCCCC(=O)C1CC1 MCULE-3621765531 [0,1,0,1,0,0|0,0,1]=3 2602 B12R1.1356 O=C(O)CCCNC(=O)C1CC1 MCULE-4578404941 [0,1,0,1,0,0|1,0,1]=4 2603 B12R2.24 O=C1C=C2CCCCC2CC1 MCULE-1925425954 [0,0,0,2,0,0|1,0,1]=4 2604 B12R2.24 O=C1CCC2=C(O1)CCCC2 MCULE-3616070284 [0,0,0,2,0,0|0,0,2]=4 2605 B12R2.24 O=C1CCC2CCCCC2C1 MCULE-5132415908 [0,0,0,2,0,0|1,0,0]=3 2606 B12R2.24 O=C1CCC2CCCCC2O1 MCULE-8264574980 [0,0,0,2,0,0|0,0,0]=2 2607 B12R2.24 O=C1CCC2CCCNC2C1 MCULE-6331379359 [0,0,0,2,0,0|2,0,0]=4 2608 B12R2.24 O=C1CCC2CNCCC2N1 MCULE-1605613797 [0,0,0,2,0,0|2,0,0]=4 2609 B12R2.24 O=C1CCC2CNCCC2N1 MCULE-4751402400 [0,0,0,2,0,0|2,0,0]=4 2610 B12R2.24 O=C1CCC2COCCC2C1 MCULE-2996737699 [0,0,0,2,0,0|2,0,0]=4 2611 B12R2.24 O=C1CCN2CCCCC2C1 MCULE-8834975179 [0,0,0,2,0,0|2,0,0]=4 2612 B12R2.24 O=C1CN2CCCCC2CN1 MCULE-4553224664 [0,0,0,2,0,0|2,0,0]=4 2613 B12R2.24 O=C1CNC2CCCCC2N1 MCULE-4636303193 [0,0,0,2,0,0|2,0,0]=4 2614 B12R2.24 O=C1CNC2CCCCC2O1 MCULE-1674440433 [0,0,0,2,0,0|1,0,0]=3 2615 B12R2.24 O=C1COC2CCCCC2N1 MCULE-3544591104 [0,0,0,2,0,0|2,0,0]=4 2616 B12R2.24 O=C1CSC2CCCCC2O1 MCULE-2850415472 [0,0,0,2,0,0|1,0,0]=3 2617 B12R2.24 OC1CCC2CCCCC2C1 MCULE-5725182462 [0,0,0,2,0,0|1,0,1]=4 2618 B12R2.24 O[C@H]1CC[C@H]2CCCC[C@@H]2C1 MCULE-4891406192 [0,0,0,2,0,0|1,0,1]=4 2619 B12R2.24 [C@@H]12CCCCC1CC[C@H](C2)O MCULE-6819576815 [0,0,0,2,0,0|1,0,1]=4 2620 B12R2.24 [C@@H]12CCCC[C@H]1NC(=O)CN2 MCULE-2920414481 [0,0,0,2,0,0|2,0,0]=4 2621 B12R2.24 [C@@H]12CNCC[C@H]1COC(=O)N2 MCULE-4787024813 [0,0,0,2,0,0|2,0,0]=4 2622 B12R2.24 [C@H]12CCCC[C@H]1NC(=O)CN2 MCULE-7195121221 [0,0,0,2,0,0|2,0,0]=4 2623 B12R2.1081 C12CCCC(=O)C1CCCN2 MCULE-7871473963 [0,0,0,2,0,0|2,0,0]=4 2624 B12R2.1081 C12CCCCC1C(=O)CCN2 MCULE-5542279033 [0,0,0,2,0,0|2,0,0]=4 2625 B12R2.1081 O=C1CCCC2C1CCCC2 MCULE-8480896518 [0,0,0,2,0,0|1,0,0]=3 2626 B12R2.1081 O=C1CCCC2N1CCNC2 MCULE-5025496575 [0,0,0,2,0,0|2,0,0]=4 2627 B12R2.1081 O=C1CCCC2N1CCNC2 MCULE-5496789049 [0,0,0,2,0,0|2,0,0]=4 2628 B12R2.1081 O=C1CCCN2C1CCCC2 MCULE-3277635107 [0,0,0,2,0,0|2,0,0]=4 2629 B12R2.1081 O=C1CCC[C@@H]2[C@@H]1CCCC2 MCULE-5964799305 [0,0,0,2,0,0|1,0,0]=3 2630 B12R2.1081 O=C1CCNC2C1CCCC2 MCULE-6781228133 [0,0,0,2,0,0|2,0,0]=4 2631 B12R2.1081 O=C1CCNC2N1CCCC2 MCULE-7383053948 [0,0,0,2,0,0|2,0,0]=4 2632 B12R2.1081 O=C1CNCC2N1CCCC2 MCULE-5438706854 [0,0,0,2,0,0|2,0,0]=4 2633 B12R2.1081 O=C1CNCC2N1CCCC2 MCULE-9023773742 [0,0,0,2,0,0|2,0,0]=4 2634 B12R2.1081 O=C1NCCC2C1CCNC2 MCULE-4722262759 [0,0,0,2,0,0|2,0,0]=4 2635 B12R2.1081 O=C1NCCC2C1CCNC2 MCULE-5602366246 [0,0,0,2,0,0|2,0,0]=4 2636 B12R2.1081 O=C1NCCC2C1CCNC2 MCULE-8721795873 [0,0,0,2,0,0|2,0,0]=4 2637 B12R2.1081 O=C1NCCC2C1NCCC2 MCULE-2965834050 [0,0,0,2,0,0|2,0,0]=4 2638 B12R2.1081 O=C1NCCN2C1CCCC2 MCULE-4674978248 [0,0,0,2,0,0|2,0,0]=4 2639 B12R2.1081 OC1CCCC2C1CCCC2 MCULE-2885059856 [0,0,0,2,0,0|1,0,1]=4 2640 B12R2.1081 O[C@H]1CCCC2C1CCCC2 MCULE-2747777640 [0,0,0,2,0,0|1,0,1]=4 2641 B12R2.1081 [C@@H]12CCCC(=O)N1CCNC2 MCULE-4764122446 [0,0,0,2,0,0|2,0,0]=4 2642 B12R2.1081 [C@@H]12CCCC(=O)N1CCNC2 MCULE-8407336784 [0,0,0,2,0,0|2,0,0]=4 2643 B12R2.1081 [C@@H]12CCCCC1[C@H](CCC2)O MCULE-7662556694 [0,0,0,2,0,0|1,0,1]=4 2644 B12R2.1081 [C@@H]12CCCCN1C(=O)CNC2 MCULE-3371879382 [0,0,0,2,0,0|2,0,0]=4 2645 B12R2.1081 [C@@H]12CCCCN1C(=O)CNC2 MCULE-6889335982 [0,0,0,2,0,0|2,0,0]=4 2646 B12R2.1081 [C@@H]12CCCC[C@@H]1C(CCC2)O MCULE-4935151944 [0,0,0,2,0,0|1,0,1]=4 2647 B12R2.1081 [C@@H]12CCCC[C@H]1C(=O)CCN2 MCULE-3781193879 [0,0,0,2,0,0|2,0,0]=4 2648 B12R2.1081 [C@@H]12CCCC[C@H]1C(=O)CCN2 MCULE-5151768324 [0,0,0,2,0,0|2,0,0]=4 2649 B12R2.1081 [C@H]12CCCC(=O)N1CCNC2 MCULE-4814093132 [0,0,0,2,0,0|2,0,0]=4 2650 B12R2.1081 [C@H]12CCCC(=O)N1CCNC2 MCULE-9247976237 [0,0,0,2,0,0|2,0,0]=4 2651 B12R2.1081 [C@H]12CCCCN1C(=O)CNC2 MCULE-6245598698 [0,0,0,2,0,0|2,0,0]=4 2652 B12R2.1081 [C@H]12CCCC[C@H]1C(CCC2)O MCULE-3874298930 [0,0,0,2,0,0|1,0,1]=4 2653 B12R2.1286 O=C1CCCC(C1)OC2CC2 MCULE-2766083065 [0,0,0,2,0,0|2,0,0]=4 2654 B12R2.5121 O=C1CCCC2(C1)CCCC2 MCULE-8186406213 [0,0,0,2,0,0|1,0,0]=3 2655 B12R2.5121 O=C1CCNC2(C1)CCCC2 MCULE-1531257981 [0,0,0,2,0,0|2,0,0]=4 2656 B12R2.5121 O=C1CCNC2(C1)CCCC2 MCULE-9150029003 [0,0,0,2,0,0|2,0,0]=4 2657 B12R2.5121 O=C1CCOC2(C1)CCCC2 MCULE-1401559407 [0,0,0,2,0,0|2,0,0]=4 2658 B12R2.5121 O=C1CNCC2(N1)CCCC2 MCULE-5451846226 [0,0,0,2,0,0|2,0,0]=4 2659 B12R2.5121 O=C1CNCC2(N1)CCCC2 MCULE-5562956614 [0,0,0,2,0,0|2,0,0]=4 2660 B12R2.6 O=C1CC(CN1)C2CCCC2 MCULE-7577399562 [0,0,0,2,0,0|2,0,0]=4 2661 B12R2.6 O=C1CCC(C1)C2CCCC2 MCULE-9636017250 [0,0,0,2,0,0|1,0,0]=3 2662 B12R2.375 COC1OCC2C1CC(=O)O2 MCULE-5720946300 [0,0,0,2,0,0|2,0,0]=4 2663 B12R2.375 CO[C@H]1OC[C@H]2[C@@H]1CC(=O)O2 MCULE-4081479521 [0,0,0,2,0,0|2,0,0]=4 2664 B12R2.375 CO[C@H]1OC[C@H]2[C@@H]1CC(=O)O2 MCULE-9782089683 [0,0,0,2,0,0|2,0,0]=4 2665 B12R2.375 [C@H]12CC(=O)O[C@H]1COC2OC MCULE-2750034634 [0,0,0,2,0,0|2,0,0]=4 2666 B12R2.375 [C@H]12CC(=O)O[C@H]1CO[C@@H]2OC MCULE-1306471249 [0,0,0,2,0,0|2,0,0]=4 2667 B12R2.1041 O=C1CC2CCCCCC2C1 MCULE-3866880179 [0,0,0,2,0,0|1,0,0]=3 2668 B12R2.2314 CC1CCCC12CNC(=O)C2 MCULE-4725765806 [0,0,0,2,0,0|2,0,0]=4 2669 B12R2.2918 O=C1CC2(CCCCC2)CN1 MCULE-6823485026 [0,0,0,2,0,0|2,0,0]=4 2670 B12R2.2918 O=C1CCC2(C1)CCCCC2 MCULE-9066804202 [0,0,0,2,0,0|1,0,0]=3 2671 B12R2.2918 O=C1CCC2(N1)CCCCC2 MCULE-5736156500 [0,0,0,2,0,0|1,0,0]=3 2672 B12R2.2918 O=C1CCC2(N1)CCNCC2 MCULE-2123389887 [0,0,0,2,0,0|2,0,0]=4 2673 B12R2.2918 O=C1CCC2(N1)CCNCC2 MCULE-2948871796 [0,0,0,2,0,0|2,0,0]=4 2674 B12R2.2918 O=C1CCC2(N1)CCNCC2 MCULE-7554250705 [0,0,0,2,0,0|2,0,0]=4 2675 B12R2.2918 O=C1CCC2(O1)CCCCC2 MCULE-2524698119 [0,0,0,2,0,0|0,0,0]=2 2676 B12R2.2918 O=C1CCC2(O1)CCCNC2 MCULE-2577773053 [0,0,0,2,0,0|1,0,0]=3 2677 B12R2.2918 O=C1CCC2(O1)CCCNC2 MCULE-9482796143 [0,0,0,2,0,0|1,0,0]=3 2678 B12R2.2918 O=C1CCC2(O1)CCNCC2 MCULE-5449830396 [0,0,0,2,0,0|1,0,0]=3 2679 B12R2.2918 O=C1CCC2(O1)CCNCC2 MCULE-7439815792 [0,0,0,2,0,0|1,0,0]=3 2680 B12R2.2918 O=C1CNC2(N1)CCCCC2 MCULE-1343250676 [0,0,0,2,0,0|2,0,0]=4 2681 B12R2.2918 O=C1COC2(O1)CCCCC2 MCULE-2313287382 [0,0,0,2,0,0|1,0,0]=3 2682 B12R2.2918 O=C1CSC2(N1)CCCCC2 MCULE-8806088221 [0,0,0,2,0,0|2,0,0]=4 2683 B12R2.2918 O=C1NCC2(O1)CCCCC2 MCULE-5479893010 [0,0,0,2,0,0|1,0,0]=3 2684 B12R2.2918 O=C1NCC2(O1)CCCNC2 MCULE-3807410263 [0,0,0,2,0,0|2,0,0]=4 2685 B12R2.2918 O=C1NCC2(O1)CCCNC2 MCULE-6113783854 [0,0,0,2,0,0|2,0,0]=4 2686 B12R2.2918 O=C1NCC2(O1)CCNCC2 MCULE-1720445749 [0,0,0,2,0,0|2,0,0]=4 2687 B12R2.2918 O=C1NCC2(O1)CCNCC2 MCULE-2982199364 [0,0,0,2,0,0|2,0,0]=4 2688 B12R2.2918 O=C1NCC2(O1)CCNCC2 MCULE-6335475631 [0,0,0,2,0,0|2,0,0]=4 2689 B12R2.2918 O=C1OCC2(O1)CCNCC2 MCULE-2077507217 [0,0,0,2,0,0|2,0,0]=4 2690 B12R2.2918 O=C1OCC2(O1)CCNCC2 MCULE-9643606091 [0,0,0,2,0,0|2,0,0]=4 2691 B12R2.1365 O=C(O)C1C2CCC1CNC2 MCULE-5603355129 [0,0,0,2,0,0|1,0,0]=3 2692 B12R2.1365 O=C(O)C1C2CCC1CNC2 MCULE-9881336877 [0,0,0,2,0,0|1,0,0]=3 2693 B12R2.1387 O=C(O)C1CCC2CCC1N2 MCULE-6972583157 [0,0,0,2,0,0|1,0,0]=3 2694 B12R2.1387 O=C(O)C1CCC2CCC1N2 MCULE-8809233159 [0,0,0,2,0,0|1,0,0]=3 2695 B12R2.1387 O=C(O)[C@@H]1CC[C@@H]2CC[C@H]1N2 MCULE-4717048391 [0,0,0,2,0,0|1,0,0]=3 2696 B12R2.1387 O=C(O)[C@@H]1CC[C@@H]2CC[C@H]1N2 MCULE-8460500552 [0,0,0,2,0,0|1,0,0]=3 2697 B12R2.1387 O=C(O)[C@H]1CC[C@@H]2CC[C@H]1N2 MCULE-2846060692 [0,0,0,2,0,0|1,0,0]=3 2698 B12R2.1387 O=C(O)[C@H]1CC[C@@H]2CC[C@H]1N2 MCULE-6707755571 [0,0,0,2,0,0|1,0,0]=3 2699 B12R2.1387 O=C(O)[C@H]1CC[C@@H]2CC[C@H]1N2 MCULE-8181948728 [0,0,0,2,0,0|1,0,0]=3 2700 B12R2.1392 CC(=O)C1CC2CCC1CC2 MCULE-5557212745 [0,0,0,2,0,0|1,0,0]=3 2701 B12R2.1392 CC(O)C1CC2CCC1CC2 MCULE-5936452265 [0,0,0,2,0,0|1,0,1]=4 2702 B12R2.1392 NC(=O)C1CC2CCC1CC2 MCULE-5952869838 [0,0,0,2,0,0|1,0,0]=3 2703 B12R2.1392 O=C(O)C1CC2C=CC1CC2 MCULE-5624348400 [0,0,0,2,0,0|0,0,2]=4 2704 B12R2.1392 O=C(O)C1CC2CCC1CC2 MCULE-2962671213 [0,0,0,2,0,0|0,0,0]=2 2705 B12R2.1392 O=C(O)C1CC2CCC1CC2 MCULE-3818372379 [0,0,0,2,0,0|0,0,0]=2 2706 B12R2.1392 O=C(O)C1CC2CCC1NC2 MCULE-1236415863 [0,0,0,2,0,0|1,0,0]=3 2707 B12R2.1392 O=C(O)C1CC2CCC1NC2 MCULE-6859105489 [0,0,0,2,0,0|1,0,0]=3 2708 B12R2.1392 O=C(O)C1CC2CCN1CC2 MCULE-2932848984 [0,0,0,2,0,0|1,0,0]=3 2709 B12R2.1392 O=C(O)C1CC2CCN1CC2 MCULE-7612344271 [0,0,0,2,0,0|1,0,0]=3 2710 B12R2.1392 O=C(O)C1CC2CCN1CC2 MCULE-9044388786 [0,0,0,2,0,0|1,0,0]=3 2711 B12R2.1392 O=C(O)C1CC2CCN1CC2 MCULE-9459659957 [0,0,0,2,0,0|1,0,0]=3 2712 B12R2.1392 O=C(O)C1CN2CCC1CC2 MCULE-4064016827 [0,0,0,2,0,0|1,0,0]=3 2713 B12R2.1392 O=C(O)C1CN2CCC1CC2 MCULE-6075389298 [0,0,0,2,0,0|1,0,0]=3 2714 B12R2.1392 O=C(O)C1CN2CCN1CC2 MCULE-5187988179 [0,0,0,2,0,0|2,0,0]=4 2715 B12R2.1392 O=C(O)C1CN2CCN1CC2 MCULE-5971881327 [0,0,0,2,0,0|2,0,0]=4 2716 B12R2.1392 O=C(O)C1NC2CCC1CC2 MCULE-3569236190 [0,0,0,2,0,0|1,0,0]=3 2717 B12R2.1392 O=C(O)C1NC2CCC1CC2 MCULE-9158864070 [0,0,0,2,0,0|1,0,0]=3 2718 B12R2.1392 O=C(O)[C@@H]1CC2CCC1CC2 MCULE-1144961730 [0,0,0,2,0,0|0,0,0]=2 2719 B12R2.1392 O=C(O)[C@@H]1CC2CCN1CC2 MCULE-5324528450 [0,0,0,2,0,0|1,0,0]=3 2720 B12R2.1392 O=C(O)[C@@H]1CC2CCN1CC2 MCULE-7182963110 [0,0,0,2,0,0|1,0,0]=3 2721 B12R2.1392 O=C(O)[C@@H]1C[C@@H]2C=C[C@H]1CC2 MCULE-3959902732 [0,0,0,2,0,0|0,0,2]=4 2722 B12R2.1392 O=C(O)[C@@H]1NC2CCC1CC2 MCULE-6195686243 [0,0,0,2,0,0|1,0,0]=3 2723 B12R2.1392 O=C(O)[C@@H]1NC2CCC1CC2 MCULE-6946147326 [0,0,0,2,0,0|1,0,0]=3 2724 B12R2.1392 O=C(O)[C@H]1CC2CCC1CC2 MCULE-5079027279 [0,0,0,2,0,0|0,0,0]=2 2725 B12R2.1392 O=C(O)[C@H]1CC2CCC1CC2 MCULE-9891734674 [0,0,0,2,0,0|0,0,0]=2 2726 B12R2.1392 O=C(O)[C@H]1CC2CCN1CC2 MCULE-6239448607 [0,0,0,2,0,0|1,0,0]=3 2727 B12R2.1392 O=C(O)[C@H]1NC2CCC1CC2 MCULE-1617197931 [0,0,0,2,0,0|1,0,0]=3 2728 B12R2.1392 O=C(O)[C@H]1NC2CCC1CC2 MCULE-1926890670 [0,0,0,2,0,0|1,0,0]=3 2729 B12R2.1392 O=C(O)[C@H]1NC2CCC1CC2 MCULE-2445923207 [0,0,0,2,0,0|1,0,0]=3 2730 B12R2.1392 O=C(O)[C@H]1NC2CCC1CC2 MCULE-4433008686 [0,0,0,2,0,0|1,0,0]=3 2731 B12R2.1392 [C@@H]1(CC2CCN1CC2)C(=O)O MCULE-4249934614 [0,0,0,2,0,0|1,0,0]=3 2732 B12R2.1392 [C@@H]1(CC2CCN1CC2)C(=O)O MCULE-9578754994 [0,0,0,2,0,0|1,0,0]=3 2733 B12R2.1392 [C@@H]1(CC2CCN1CC2)C(=O)O MCULE-9963300684 [0,0,0,2,0,0|1,0,0]=3 2734 B12R2.2028 O=C1OC(=O)C2C1CCCC2 MCULE-6093566981 [0,0,0,2,0,0|1,0,1]=4 2735 B12R2.2028 O=C1OC(=O)[C@@H]2[C@@H]1CCCC2 MCULE-7070863542 [0,0,0,2,0,0|1,0,1]=4 2736 B12R2.2028 O=C1OC(=O)[C@H]2[C@H]1CCCC2 MCULE-2602740265 [0,0,0,2,0,0|1,0,1]=4 2737 B12R2.2028 [C@@H]12CCCC[C@H]1C(=O)OC2=O MCULE-1146911541 [0,0,0,2,0,0|1,0,1]=4 2738 B12R2.2028 [C@H]12CCCC[C@@H]1C(=O)OC2=O MCULE-9798190812 [0,0,0,2,0,0|1,0,1]=4 2739 B12R2.2028 [C@H]12CCCC[C@H]1C(=O)OC2=O MCULE-5802669356 [0,0,0,2,0,0|1,0,1]=4 2740 B12R2.114 O=C1CCCC2CNCC2N1 MCULE-8908023981 [0,0,0,2,0,0|2,0,0]=4 2741 B12R2.114 O=C1CCC[C@@H]2CNC[C@@H]2N1 MCULE-9416220594 [0,0,0,2,0,0|2,0,0]=4 2742 B12R2.114 [C@H]12CCCC(=O)N[C@H]1CCN2 MCULE-1453873523 [0,0,0,2,0,0|2,0,0]=4 2743 B12R2.114 [C@H]12CCCC(=O)N[C@H]1CCN2 MCULE-8235994215 [0,0,0,2,0,0|2,0,0]=4 2744 B12R2.298 O=C(O)CC1CNCC12CC2 MCULE-1847225281 [0,0,0,2,0,0|1,0,0]=3 2745 B12R2.298 O=C(O)C[C@H]1CNCC12CC2 MCULE-4153448760 [0,0,0,2,0,0|1,0,0]=3 2746 B12R2.1362 NC(=O)C1NCC2C1CCC2 MCULE-7584764383 [0,0,0,2,0,0|2,0,0]=4 2747 B12R2.1362 O=C(O)C1NCC2C1CCC2 MCULE-4710761879 [0,0,0,2,0,0|1,0,0]=3 2748 B12R2.1362 O=C(O)C1NCC2C1CCC2 MCULE-7053299455 [0,0,0,2,0,0|1,0,0]=3 2749 B12R2.1362 O=C(O)[C@H]1CC[C@H]2[C@@H]1CCC2 MCULE-1396695643 [0,0,0,2,0,0|0,0,0]=2 2750 B12R2.1362 O=C(O)[C@H]1NC[C@H]2[C@@H]1CCC2 MCULE-2924365982 [0,0,0,2,0,0|1,0,0]=3 2751 B12R2.1362 O=C(O)[C@H]1NC[C@H]2[C@@H]1CCC2 MCULE-2955497749 [0,0,0,2,0,0|1,0,0]=3 2752 B12R2.1362 O=C(O)[C@H]1NC[C@H]2[C@@H]1CCC2 MCULE-9036371182 [0,0,0,2,0,0|1,0,0]=3 2753 B12R2.1362 [C@H]12CCC[C@H]1CN[C@@H]2C(=O)O MCULE-1175490848 [0,0,0,2,0,0|1,0,0]=3 2754 B12R2.1362 [C@H]12CCC[C@H]1CN[C@@H]2C(=O)O MCULE-2449998335 [0,0,0,2,0,0|1,0,0]=3 2755 B12R2.1362 [C@H]12CCC[C@H]1CN[C@@H]2C(=O)O MCULE-7623385536 [0,0,0,2,0,0|1,0,0]=3 2756 B12R2.1367 O=C(O)CN1C2CCC1CC2 MCULE-1481808214 [0,0,0,2,0,0|1,0,0]=3 2757 B12R2.1661 CC(=O)CC1CC2CCC1C2 MCULE-5651089589 [0,0,0,2,0,0|1,0,0]=3 2758 B12R2.1661 CC(=O)NC1CC2CCC1C2 MCULE-3488558898 [0,0,0,2,0,0|2,0,0]=4 2759 B12R2.1661 NC(=O)CC1CC2CCC1C2 MCULE-6688461882 [0,0,0,2,0,0|1,0,0]=3 2760 B12R2.1661 O=C(O)CC1CC2C=CC1C2 MCULE-3022902616 [0,0,0,2,0,0|0,0,2]=4 2761 B12R2.1661 O=C(O)CC1CC2CCC1C2 MCULE-5339221610 [0,0,0,2,0,0|0,0,0]=2 2762 B12R2.1661 O=C(O)CC1CC2CCC1O2 MCULE-4541461263 [0,0,0,2,0,0|1,0,0]=3 2763 B12R2.1661 O=C(O)CN1CC2CCC1C2 MCULE-2270425781 [0,0,0,2,0,0|1,0,0]=3 2764 B12R2.1661 O=C(O)CN1CC2CCC1C2 MCULE-6766378440 [0,0,0,2,0,0|1,0,0]=3 2765 B12R2.1661 O=C(O)C[C@@H]1C[C@@H]2C=C[C@H]1C2 MCULE-2911613762 [0,0,0,2,0,0|0,0,2]=4 2766 B12R2.1661 [C@@H]12C=C[C@@H](C1)[C@@H](C2)CC(=O)O MCULE-1861105570 [0,0,0,2,0,0|0,0,2]=4 2767 B12R2.1661 [C@@H]12CC[C@@H](C1)C(C2)CC(=O)O MCULE-3421570833 [0,0,0,2,0,0|0,0,0]=2 2768 B12R2.1661 [C@@H]12CC[C@@H](C1)C(C2)CC(=O)O MCULE-7337271479 [0,0,0,2,0,0|0,0,0]=2 2769 B12R2.1661 [C@H]12CC[C@H](C1)CN2CC(=O)O MCULE-7434841215 [0,0,0,2,0,0|1,0,0]=3 2770 B12R2.2257 CCN1C2CCC1CC(=O)C2 MCULE-4621433430 [0,0,0,2,0,0|2,0,0]=4 2771 B12R2.22 O=C1CC(C1)C2CCCCC2 MCULE-8479383540 [0,0,0,2,0,0|1,0,0]=3 2772 B12R2.22 O=C1CC(C1)C2CCOCC2 MCULE-5710758476 [0,0,0,2,0,0|2,0,0]=4 2773 B12R2.1058 O=C1CC2(N1)CCCCCC2 MCULE-1515445669 [0,0,0,2,0,0|1,0,0]=3 2774 B12R2.1067 O=C1NC2C1CCCCCC2 MCULE-1390214368 [0,0,0,2,0,0|1,0,0]=3 2775 B12R2.19 CC12CCCCC1CC(=O)C2 MCULE-4049336240 [0,0,0,2,0,0|1,0,0]=3 2776 B12R2.1154 CN1C2CCCC1CC(=O)C2 MCULE-4596962992 [0,0,0,2,0,0|2,0,0]=4 2777 B12R2.1154 CN1C2CCCC1CC(=O)C2 MCULE-5416654087 [0,0,0,2,0,0|2,0,0]=4 2778 B12R2.1154 [C@@H]12CCC[C@@H](N1C)CC(=O)C2 MCULE-7313573839 [0,0,0,2,0,0|2,0,0]=4 2779 B12R2.3190 O=C(O)[C@@H]1C[C@@H]2[C@H]1CNCC2 MCULE-4276510642 [0,0,0,2,0,0|1,0,0]=3 2780 B12R2.3190 O=C(O)[C@@H]1C[C@@H]2[C@H]1CNCC2 MCULE-6673298372 [0,0,0,2,0,0|1,0,0]=3 2781 B12R2.3190 O=C(O)[C@@H]1C[C@@H]2[C@H]1CNCC2 MCULE-9393277411 [0,0,0,2,0,0|1,0,0]=3 2782 B12R2.3190 O=C(O)[C@@H]1C[C@@H]2[C@H]1CNCC2 MCULE-9559569552 [0,0,0,2,0,0|1,0,0]=3 2783 B12R2.84 CC12CCCN1CCC(=O)C2 MCULE-2879875156 [0,0,0,2,0,0|2,0,0]=4 2784 B12R2.252 C1(CC2CCCC2N1)C(=O)O MCULE-7096971572 [0,0,0,2,0,0|1,0,0]=3 2785 B12R2.252 O=C(Cl)N1C[C@H]2CCC[C@H]2C1 MCULE-3514230352 [0,0,0,2,0,0|2,0,0]=4 2786 B12R2.252 O=C(O)C1CC2CCCC2N1 MCULE-3763733073 [0,0,0,2,0,0|1,0,0]=3 2787 B12R2.252 O=C(O)C1CC2CNCC2C1 MCULE-3791454791 [0,0,0,2,0,0|1,0,0]=3 2788 B12R2.252 O=C(O)C1CC2CNCC2C1 MCULE-5628413984 [0,0,0,2,0,0|1,0,0]=3 2789 B12R2.252 O=C(O)[C@@H]1C[C@@H]2CCC[C@@H]2N1 MCULE-4781251814 [0,0,0,2,0,0|1,0,0]=3 2790 B12R2.252 O=C(O)[C@@H]1C[C@@H]2CCC[C@@H]2N1 MCULE-6047601364 [0,0,0,2,0,0|1,0,0]=3 2791 B12R2.252 [C@H]1(C[C@@H]2CCC[C@@H]2N1)C(=O)O MCULE-2636067119 [0,0,0,2,0,0|1,0,0]=3 2792 B12R2.252 [C@H]1(C[C@@H]2CCC[C@@H]2N1)C(=O)O MCULE-5744849873 [0,0,0,2,0,0|1,0,0]=3 2793 B12R2.252 [C@H]12CCC[C@H]1NC(C2)C(=O)O MCULE-4955002104 [0,0,0,2,0,0|1,0,0]=3 2794 B12R2.252 [C@H]12CCC[C@H]1NC(C2)C(=O)O MCULE-7093611012 [0,0,0,2,0,0|1,0,0]=3 2795 B12R2.252 [C@H]12CCC[C@H]1N[C@@H](C2)C(=O)O MCULE-6923891117 [0,0,0,2,0,0|1,0,0]=3 2796 B12R2.252 [C@H]12CCC[C@H]1N[C@H](C2)C(=O)O MCULE-9231382973 [0,0,0,2,0,0|1,0,0]=3 2797 B12R2.1017 O=C(O)C1CC2OC1CC2O MCULE-9068973855 [0,0,0,2,0,0|2,0,0]=4 2798 B12R2.1017 O=C(O)[C@@H]1C[C@H]2O[C@@H]1C[C@@H]2O MCULE-1774929494 [0,0,0,2,0,0|2,0,0]=4 2799 B12R2.1017 O=C(O)[C@@H]1C[C@H]2O[C@@H]1C[C@@H]2O MCULE-7917451180 [0,0,0,2,0,0|2,0,0]=4 2800 B12R2.1017 [C@H]12C[C@H]([C@H](O1)C[C@@H]2O)C(=O)O MCULE-2987502116 [0,0,0,2,0,0|2,0,0]=4 2801 B12R2.250 NC(=O)C1OC12CCCCC2 MCULE-9044385023 [0,0,0,2,0,0|2,0,0]=4 2802 B12R2.250 O=C(O)C1CC12CCCCC2 MCULE-2503310018 [0,0,0,2,0,0|0,0,0]=2 2803 B12R2.250 O=C(O)C1CC12CCCNC2 MCULE-1681266618 [0,0,0,2,0,0|1,0,0]=3 2804 B12R2.250 O=C(O)C1CC12CCCNC2 MCULE-3549112122 [0,0,0,2,0,0|1,0,0]=3 2805 B12R2.250 O=C(O)C1CC12CCCOC2 MCULE-7358515114 [0,0,0,2,0,0|1,0,0]=3 2806 B12R2.250 O=C(O)C1CC12CCNCC2 MCULE-3702584189 [0,0,0,2,0,0|1,0,0]=3 2807 B12R2.250 O=C(O)C1CC12CCNCC2 MCULE-8315679139 [0,0,0,2,0,0|1,0,0]=3 2808 B12R2.250 O=C(O)C1CC12CCOCC2 MCULE-1128195301 [0,0,0,2,0,0|1,0,0]=3 2809 B12R2.250 O=C(O)C1CC12CCOCC2 MCULE-4318104876 [0,0,0,2,0,0|1,0,0]=3 2810 B12R2.250 O=C(O)C1CC12CCSCC2 MCULE-1978392203 [0,0,0,2,0,0|1,0,0]=3 2811 B12R2.250 O=C(O)C1OC12CCCCC2 MCULE-8536739574 [0,0,0,2,0,0|1,0,0]=3 2812 B12R2.250 O=C(O)[C@@H]1CC12CCOCC2 MCULE-3036385474 [0,0,0,2,0,0|1,0,0]=3 2813 B12R2.250 O=C(O)[C@@H]1CC12CCOCC2 MCULE-9402406943 [0,0,0,2,0,0|1,0,0]=3 2814 B12R2.250 O=C(O)[C@H]1CC12CCOCC2 MCULE-4473969470 [0,0,0,2,0,0|1,0,0]=3 2815 B12R2.250 O=C(O)[C@H]1CC12CCOCC2 MCULE-5930090560 [0,0,0,2,0,0|1,0,0]=3 2816 B12R2.229 O=C1CCNCC2N1CCC2 MCULE-5354866844 [0,0,0,2,0,0|2,0,0]=4 2817 B12R2.229 O=C1CCNC[C@H]2N1CCC2 MCULE-3430808630 [0,0,0,2,0,0|2,0,0]=4 2818 B12R2.229 O=C1NCCCC2C1CNC2 MCULE-6681743352 [0,0,0,2,0,0|2,0,0]=4 2819 B12R2.229 O=C1NCCCC2C1CNC2 MCULE-8669557280 [0,0,0,2,0,0|2,0,0]=4 2820 B12R2.1655 O=C(O)CC1CCC2CC2C1 MCULE-6785284610 [0,0,0,2,0,0|0,0,0]=2 2821 B12R2.1019 [C@H]12CCC[C@H](CNC1)C(=O)N2 MCULE-4526920635 [0,0,0,2,0,0|2,0,0]=4 2822 B12R2.1019 [C@H]12CCC[C@H](CNC1)C(=O)N2 MCULE-6171952464 [0,0,0,2,0,0|2,0,0]=4 2823 B12R2.1123 CC1CC2CC2CC1C(=O)O MCULE-3032434503 [0,0,0,2,0,0|0,0,0]=2 2824 B12R2.254 O=C(O)C1NCC12CCCC2 MCULE-6704016871 [0,0,0,2,0,0|1,0,0]=3 2825 B12R2.254 O=C(O)C1NCC12CCCC2 MCULE-8755908913 [0,0,0,2,0,0|1,0,0]=3 2826 B12R2.1354 O=C(O)C1CC1C2CCCC2 MCULE-3947048694 [0,0,0,2,0,0|0,0,0]=2 2827 B12R2.1410 O=C(O)C1CNCC12CCC2 MCULE-1324368905 [0,0,0,2,0,0|1,0,0]=3 2828 B12R2.1410 O=C(O)C1CNCC12CCC2 MCULE-1600694277 [0,0,0,2,0,0|1,0,0]=3 2829 B12R2.1356 O=C(O)[C@H]1NCC[C@@H]1C2CC2 MCULE-5344790771 [0,0,0,2,0,0|1,0,0]=3 2830 B12R2.1356 O=C(O)[C@H]1NCC[C@@H]1C2CC2 MCULE-6712244548 [0,0,0,2,0,0|1,0,0]=3 2831 B12R2.3066 CC(=O)C12CCCN1CCC2 MCULE-2728827193 [0,0,0,2,0,0|2,0,0]=4 2832 B12R2.3066 O=C(O)C12CCCC1CNC2 MCULE-5852776318 [0,0,0,2,0,0|1,0,0]=3 2833 B12R2.3066 O=C(O)C12CCCC1CNC2 MCULE-6709184550 [0,0,0,2,0,0|1,0,0]=3 2834 B12R2.3066 O=C(O)C12CCCN1CCC2 MCULE-7282574305 [0,0,0,2,0,0|1,0,0]=3 2835 B12R2.3066 O=C(O)C12CCCN1CCC2 MCULE-8263210655 [0,0,0,2,0,0|1,0,0]=3 2836 B12R2.3066 O=C(O)C12CNCC1COC2 MCULE-3715909946 [0,0,0,2,0,0|2,0,0]=4 2837 B12R2.3066 O=C(O)C12CNCC1COC2 MCULE-6913702092 [0,0,0,2,0,0|2,0,0]=4 2838 B12R2.3066 O=C(O)[C@]12CCC[C@@H]1OCC2 MCULE-7464803802 [0,0,0,2,0,0|1,0,0]=3 2839 B12R2.3066 O=C(O)[C@]12CCC[C@H]1CNC2 MCULE-1797980809 [0,0,0,2,0,0|1,0,0]=3 2840 B12R2.3066 [C@@H]12CCC[C@@]1(CNC2)C(=O)O MCULE-1745522148 [0,0,0,2,0,0|1,0,0]=3 2841 B12R2.1385 O=C(O)C1CCC2CC2CC1 MCULE-2590977388 [0,0,0,2,0,0|0,0,0]=2