0 B9R0.2 BrCCCCCCC(=O)O Amb10071514 [0,0,0,0,0,0|1,0,2]=3 1 B9R0.2 C#CCCCCCC(O)=O Amb22232010 [0,0,0,0,0,0|0,0,4]=4 2 B9R0.2 C#CCCCNCC(O)=O Amb25284826 [0,0,0,0,0,0|1,0,3]=4 3 B9R0.2 C#CCCS\C=C\C(O)=O Amb25045988 [0,0,0,0,0,0|1,0,2]=3 4 B9R0.2 C=CCCCC#CC(O)=O Amb25770578 [0,0,0,0,0,0|0,0,4]=4 5 B9R0.2 C=CCC\C=C\CC(O)=O Amb18643551 [0,0,0,0,0,0|0,0,4]=4 6 B9R0.2 C=NCCCCCC(O)=O Amb25111950 [0,0,0,0,0,0|1,0,3]=4 7 B9R0.2 CC#CCCNCC(O)=O Amb25138292 [0,0,0,0,0,0|1,0,3]=4 8 B9R0.2 CC#CCN\C=C\C(O)=O Amb25354156 [0,0,0,0,0,0|1,0,2]=3 9 B9R0.2 CC(=C)\C=C\CCCC=O Amb18643329 [0,0,0,0,0,0|3,0,1]=4 10 B9R0.2 CC(=O)CCCCCCBr Amb24436166 [0,0,0,0,0,0|2,0,2]=4 11 B9R0.2 CC(=O)CCCCCCF Amb25050277 [0,0,0,0,0,0|2,0,2]=4 12 B9R0.2 CC(=O)CCCCCCN Amb25147578 [0,0,0,0,0,0|2,0,2]=4 13 B9R0.2 CC(=O)CCCCCCO Amb25728037 [0,0,0,0,0,0|2,0,2]=4 14 B9R0.2 CC(=O)CSCCCCO Amb24504843 [0,0,0,0,0,0|3,0,1]=4 15 B9R0.2 CC(=O)NCCCCCBr Amb24477078 [0,0,0,0,0,0|3,0,1]=4 16 B9R0.2 CC(=O)NCCCCCCl Amb25709577 [0,0,0,0,0,0|3,0,1]=4 17 B9R0.2 CC(=O)NCCCCCN Amb18102716 [0,0,0,0,0,0|3,0,1]=4 18 B9R0.2 CC(=O)NOCCCCF Amb24577255 [0,0,0,0,0,0|4,0,0]=4 19 B9R0.2 CC(=O)OCCCCCF Amb25346117 [0,0,0,0,0,0|3,0,1]=4 20 B9R0.2 CC(=O)OCCCCCI Amb25304053 [0,0,0,0,0,0|3,0,1]=4 21 B9R0.2 CC(=O)OCCCCCN Amb25228426 [0,0,0,0,0,0|3,0,1]=4 22 B9R0.2 CC(=O)O\C=C/CCCBr Amb25068275 [0,0,0,0,0,0|3,0,1]=4 23 B9R0.2 CC(=O)O\C=C\CCCBr Amb24567866 [0,0,0,0,0,0|3,0,1]=4 24 B9R0.2 CC(=O)SCCCCCCl Amb24443095 [0,0,0,0,0,0|3,0,1]=4 25 B9R0.2 CC(=O)\C=C\CCCC#C Amb25205680 [0,0,0,0,0,0|1,0,2]=3 26 B9R0.2 CC(=O)\C=C\CCCC#N Amb24612117 [0,0,0,0,0,0|2,0,1]=3 27 B9R0.2 CC(=O)\C=C\CCCC=O Amb24476998 [0,0,0,0,0,0|2,0,1]=3 28 B9R0.2 CC(=O)\C=C\CCCCBr Amb24477141 [0,0,0,0,0,0|2,0,0]=2 29 B9R0.2 CC(=O)\C=C\CCCCO Amb24518640 [0,0,0,0,0,0|2,0,0]=2 30 B9R0.2 CC(=O)\C=C\CCN=[N+]=[N-] Amb24566210 [0,0,0,0,0,0|4,0,0]=4 31 B9R0.2 CC(=O)\C=C\COCC=C Amb25263648 [0,0,0,0,0,0|2,0,2]=4 32 B9R0.2 CC(=O)\C=C\NCCC=C Amb25086633 [0,0,0,0,0,0|2,0,2]=4 33 B9R0.2 CC(C)=C=CCCCCO Amb25332292 [0,0,0,0,0,0|3,0,1]=4 34 B9R0.2 CC(C)=CC=CCCCO Amb24429879 [0,0,0,0,0,0|3,0,1]=4 35 B9R0.2 CC(C)=CCCCCCBr Amb24524614 [0,0,0,0,0,0|3,0,1]=4 36 B9R0.2 CC(C)\C=C\CCCCO Amb25127444 [0,0,0,0,0,0|3,0,1]=4 37 B9R0.2 CC(O)\C=C\CCCC#C Amb25687922 [0,0,0,0,0,0|1,0,3]=4 38 B9R0.2 CC(O)\C=C\CCCC=C Amb25806729 [0,0,0,0,0,0|1,0,3]=4 39 B9R0.2 CC(O)\C=C\CCCC=O Amb24611225 [0,0,0,0,0,0|2,0,2]=4 40 B9R0.2 CC(O)\C=C\CCCCN Amb25346064 [0,0,0,0,0,0|2,0,1]=3 41 B9R0.2 CC=CC=CC=CC(O)=O Amb24561626 [0,0,0,0,0,0|0,0,4]=4 42 B9R0.2 CCC=CCC=CC(C)=O Amb24061730 [0,0,0,0,0,0|1,0,2]=3 43 B9R0.2 CCCC=C\C=C\C(C)=O Amb25274464 [0,0,0,0,0,0|1,0,2]=3 44 B9R0.2 CCCCC#CCC(C)=O Amb24479204 [0,0,0,0,0,0|1,0,3]=4 45 B9R0.2 CCCCC#CCC(N)=O Amb25105357 [0,0,0,0,0,0|1,0,3]=4 46 B9R0.2 CCCCC=C=CC(=O)O Amb17593544 [0,0,0,0,0,0|0,0,2]=2 47 B9R0.2 CCCCC=C=CC(C)=O Amb24061644 [0,0,0,0,0,0|1,0,2]=3 48 B9R0.2 CCCCC=NNC(C)=O Amb25206196 [0,0,0,0,0,0|3,0,1]=4 49 B9R0.2 CCCCCC#CC(C)=O Amb25146663 [0,0,0,0,0,0|1,0,2]=3 50 B9R0.2 CCCCCC#CC(N)=O Amb25363776 [0,0,0,0,0,0|1,0,2]=3 51 B9R0.2 CCCCCC#C[C@H](C)O Amb25762969 [0,0,0,0,0,0|1,0,3]=4 52 B9R0.2 CCCCCCC=C(C)C Amb24539575 [0,0,0,0,0,0|2,0,1]=3 53 B9R0.2 CCCCCCCB(O)O Amb13890611 [0,0,0,0,0,0|1,0,3]=4 54 B9R0.2 CCCCCCCC(=O)S Amb10561702 [0,0,0,0,0,0|0,1,2]=3 55 B9R0.2 CCCCCCCC(O)=O Amb22352272 [0,0,0,0,0,0|0,0,2]=2 56 B9R0.2 CCCCCCCC(O)=O Amb22353407 [0,0,0,0,0,0|0,0,2]=2 57 B9R0.2 CCCCCCCC([O-])=O Amb22045472 [0,0,0,0,0,0|0,0,3]=3 58 B9R0.2 CCCCCCCC([O-])=O Amb22731641 [0,0,0,0,0,0|0,0,3]=3 59 B9R0.2 CCCCCCCC([O-])=O Amb22732291 [0,0,0,0,0,0|0,0,3]=3 60 B9R0.2 CCCCCCCC([O-])=O Amb22732747 [0,0,0,0,0,0|0,0,3]=3 61 B9R0.2 CCCCCCC[13C](O)=O Amb20243497 [0,0,0,0,0,0|0,0,2]=2 62 B9R0.2 CCCCCCC[13C]([O-])=O Amb22366893 [0,0,0,0,0,0|0,0,3]=3 63 B9R0.2 CCCCCCC[C@@H](C)O Amb22362646 [0,0,0,0,0,0|1,0,3]=4 64 B9R0.2 CCCCCCC[C@H](C)O Amb22362633 [0,0,0,0,0,0|1,0,3]=4 65 B9R0.2 CCCCCCC[N+]([O-])=O Amb17672611 [0,0,0,0,0,0|1,0,3]=4 66 B9R0.2 CCCCCCNC(=S)N Amb1152526 [0,0,0,0,0,0|2,1,1]=4 67 B9R0.2 CCCCCCNC(C)=N Amb25288761 [0,0,0,0,0,0|3,0,1]=4 68 B9R0.2 CCCCCCNC(N)=N Amb25292193 [0,0,0,0,0,0|3,0,1]=4 69 B9R0.2 CCCCCCNC(N)=O Amb23569596 [0,0,0,0,0,0|2,0,1]=3 70 B9R0.2 CCCCCCNC(O)=S Amb24375451 [0,0,0,0,0,0|1,1,1]=3 71 B9R0.2 CCCCCCNC(S)=S Amb24702211 [0,0,0,0,0,0|1,2,1]=4 72 B9R0.2 CCCCCCOC(=O)Cl Amb10070637 [0,0,0,0,0,0|2,0,1]=3 73 B9R0.2 CCCCCCOC(N)=O Amb22495526 [0,0,0,0,0,0|2,0,1]=3 74 B9R0.2 CCCCCCOC([S-])=S Amb19849157 [0,0,0,0,0,0|1,2,1]=4 75 B9R0.2 CCCCCCSC(N)=N Amb20676030 [0,0,0,0,0,0|3,0,1]=4 76 B9R0.2 CCCCCCSC(N)=N Amb22487386 [0,0,0,0,0,0|3,0,1]=4 77 B9R0.2 CCCCCCSC(N)=O Amb25765687 [0,0,0,0,0,0|2,0,1]=3 78 B9R0.2 CCCCCC[13CH2]C(O)=O Amb22367410 [0,0,0,0,0,0|0,0,2]=2 79 B9R0.2 CCCCCC[13CH2][13C](O)=O Amb22367490 [0,0,0,0,0,0|0,0,2]=2 80 B9R0.2 CCCCCN=CN(C)C Amb24430694 [0,0,0,0,0,0|4,0,0]=4 81 B9R0.2 CCCCCNCC(=C)C Amb17308711 [0,0,0,0,0,0|3,0,1]=4 82 B9R0.2 CCCCCNCC(=C)Cl Amb18800599 [0,0,0,0,0,0|3,0,1]=4 83 B9R0.2 CCCCCNCC(=O)Cl Amb25248398 [0,0,0,0,0,0|2,0,1]=3 84 B9R0.2 CCCCCNN=C(C)C Amb24732722 [0,0,0,0,0,0|4,0,0]=4 85 B9R0.2 CCCCCOCC(=C)Br Amb25261580 [0,0,0,0,0,0|3,0,1]=4 86 B9R0.2 CCCCCOCC(N)=O Amb25770302 [0,0,0,0,0,0|2,0,1]=3 87 B9R0.2 CCCCCONC(N)=N Amb25147362 [0,0,0,0,0,0|4,0,0]=4 88 B9R0.2 CCCCCSCC(=C)Cl Amb25220149 [0,0,0,0,0,0|3,0,1]=4 89 B9R0.2 CCCCCSCC(C)O Amb24675808 [0,0,0,0,0,0|2,0,2]=4 90 B9R0.2 CCCCCSCC(N)=N Amb24382920 [0,0,0,0,0,0|3,0,1]=4 91 B9R0.2 CCCCCSCC(N)=O Amb24524402 [0,0,0,0,0,0|2,0,1]=3 92 B9R0.2 CCCCCSC[C@@H](C)O Amb24581873 [0,0,0,0,0,0|2,0,2]=4 93 B9R0.2 CCCCCSC[C@H](C)O Amb25796591 [0,0,0,0,0,0|2,0,2]=4 94 B9R0.2 CCCCC\C=C/C(C)=O Amb25783438 [0,0,0,0,0,0|1,0,0]=1 95 B9R0.2 CCCCC\C=C/C(C)C Amb22546691 [0,0,0,0,0,0|2,0,1]=3 96 B9R0.2 CCCCC\C=C\B(O)O Amb10068584 [0,0,0,0,0,0|1,0,1]=2 97 B9R0.2 CCCCC\C=C\C(=O)Cl Amb24754105 [0,0,0,0,0,0|1,0,0]=1 98 B9R0.2 CCCCC\C=C\C(C)=O Amb22052624 [0,0,0,0,0,0|1,0,0]=1 99 B9R0.2 CCCCC\C=C\C(C)C Amb22546757 [0,0,0,0,0,0|2,0,1]=3 100 B9R0.2 CCCCC\C=C\C(N)=N Amb25260868 [0,0,0,0,0,0|2,0,0]=2 101 B9R0.2 CCCCC\C=C\[C@@H](C)O Amb25795409 [0,0,0,0,0,0|1,0,1]=2 102 B9R0.2 CCCCN=CCC(C)=O Amb25276853 [0,0,0,0,0,0|2,0,1]=3 103 B9R0.2 CCCCNCC=C(C)C Amb18643772 [0,0,0,0,0,0|3,0,1]=4 104 B9R0.2 CCCCNOCC(N)=O Amb24561497 [0,0,0,0,0,0|3,0,1]=4 105 B9R0.2 CCCCN\C=C/C(C)=O Amb25348567 [0,0,0,0,0,0|2,0,0]=2 106 B9R0.2 CCCCN\C=C\C(C)=O Amb25147404 [0,0,0,0,0,0|2,0,0]=2 107 B9R0.2 CCCCN\C=C\C(O)=O Amb25703721 [0,0,0,0,0,0|1,0,0]=1 108 B9R0.2 CCCCO\C=C\C(C)=O Amb25146855 [0,0,0,0,0,0|2,0,0]=2 109 B9R0.2 CCCCO\C=C\C(O)=O Amb18644130 [0,0,0,0,0,0|1,0,0]=1 110 B9R0.2 CCCCSCC=C(C)C Amb24464957 [0,0,0,0,0,0|3,0,1]=4 111 B9R0.2 CCCCSCCC(=O)O Amb1032992 [0,0,0,0,0,0|1,0,2]=3 112 B9R0.2 CCCCSCCC(N)=O Amb18798040 [0,0,0,0,0,0|2,0,2]=4 113 B9R0.2 CCCCS\C=C/C(O)=O Amb18645412 [0,0,0,0,0,0|1,0,0]=1 114 B9R0.2 CCCCS\C=C\C(O)=O Amb24380477 [0,0,0,0,0,0|1,0,0]=1 115 B9R0.2 CCCC[13CH2][13CH2][13CH2][13C](O)=O Amb22351826 [0,0,0,0,0,0|0,0,2]=2 116 B9R0.2 CCCC\C=C\CC(=O)N Amb1815461 [0,0,0,0,0,0|1,0,2]=3 117 B9R0.2 CCCC\C=C\C[C@@H](C)O Amb25041963 [0,0,0,0,0,0|1,0,3]=4 118 B9R0.2 CCCC\C=C\NC(C)=O Amb24674131 [0,0,0,0,0,0|2,0,1]=3 119 B9R0.2 CCCC\C=C\OC(C)=O Amb25293926 [0,0,0,0,0,0|2,0,1]=3 120 B9R0.2 CCCNCCCC(=O)O Amb1109953 [0,0,0,0,0,0|1,0,2]=3 121 B9R0.2 CCCNCCCC(N)=O Amb24513695 [0,0,0,0,0,0|2,0,2]=4 122 B9R0.2 CCCNCCOC(C)=O Amb18928593 [0,0,0,0,0,0|3,0,1]=4 123 B9R0.2 CCCOCCOC(C)=O Amb25354004 [0,0,0,0,0,0|3,0,1]=4 124 B9R0.2 CCCON\C=C\C(O)=O Amb24391769 [0,0,0,0,0,0|2,0,0]=2 125 B9R0.2 CCCSCCNC(C)=O Amb24548362 [0,0,0,0,0,0|3,0,1]=4 126 B9R0.2 CCC\C=C\C#CC(O)=O Amb24411024 [0,0,0,0,0,0|0,0,4]=4 127 B9R0.2 CCC\C=C\C=CB(O)O Amb24562024 [0,0,0,0,0,0|1,0,3]=4 128 B9R0.2 CCC\C=C\C=CC(C)=O Amb24722296 [0,0,0,0,0,0|1,0,2]=3 129 B9R0.2 CCC\C=C\C=C\B(O)O Amb24395096 [0,0,0,0,0,0|1,0,3]=4 130 B9R0.2 CCC\C=C\C=C\C(C)=C Amb22641687 [0,0,0,0,0,0|2,0,2]=4 131 B9R0.2 CCC\C=C\C=C\C(C)=O Amb25050290 [0,0,0,0,0,0|1,0,2]=3 132 B9R0.2 CCC\C=C\C=C\C(O)=O Amb25836826 [0,0,0,0,0,0|0,0,2]=2 133 B9R0.2 CCC\C=C\CCC(O)=O Amb25378821 [0,0,0,0,0,0|0,0,4]=4 134 B9R0.2 CCNCCCCC(O)=O Amb24385094 [0,0,0,0,0,0|1,0,2]=3 135 B9R0.2 CCNCCNCC(O)=O Amb24568313 [0,0,0,0,0,0|2,0,1]=3 136 B9R0.2 CCNCCOCC(C)=O Amb18111808 [0,0,0,0,0,0|3,0,1]=4 137 B9R0.2 CCNCCOCC(O)=O Amb18111801 [0,0,0,0,0,0|2,0,1]=3 138 B9R0.2 CCNCC\C=C\C(F)F Amb24392562 [0,0,0,0,0,0|3,0,1]=4 139 B9R0.2 CCOCCCOC(C)=O Amb22733319 [0,0,0,0,0,0|3,0,1]=4 140 B9R0.2 CCOCCSCC(N)=O Amb25837642 [0,0,0,0,0,0|3,0,1]=4 141 B9R0.2 CCSCCCNC(N)=O Amb25791875 [0,0,0,0,0,0|3,0,1]=4 142 B9R0.2 CCSCCNCC(O)=O Amb24652163 [0,0,0,0,0,0|2,0,1]=3 143 B9R0.2 CCSCCOCC(C)=O Amb25693909 [0,0,0,0,0,0|3,0,1]=4 144 B9R0.2 CCSCCOCC(O)=O Amb24716269 [0,0,0,0,0,0|2,0,1]=3 145 B9R0.2 CCSCCSCC(C)=O Amb24522838 [0,0,0,0,0,0|3,0,1]=4 146 B9R0.2 CCSCC\C=C\C(O)=O Amb25200813 [0,0,0,0,0,0|1,0,0]=1 147 B9R0.2 CCSC\C=C/CC(O)=O Amb18645410 [0,0,0,0,0,0|1,0,2]=3 148 B9R0.2 CCSC\C=C\CC(O)=O Amb25322061 [0,0,0,0,0,0|1,0,2]=3 149 B9R0.2 CC\C=C\C=C\CC(O)=O Amb18643575 [0,0,0,0,0,0|0,0,4]=4 150 B9R0.2 CC\C=C\CCCC(O)=O Amb18643886 [0,0,0,0,0,0|0,0,4]=4 151 B9R0.2 CNCCCCCC(C)=O Amb25728176 [0,0,0,0,0,0|2,0,2]=4 152 B9R0.2 CNCCCCCC(O)=O Amb25704769 [0,0,0,0,0,0|1,0,2]=3 153 B9R0.2 CNCCCNCC(O)=O Amb25292252 [0,0,0,0,0,0|2,0,1]=3 154 B9R0.2 CNCCOCCC(O)=O Amb18111840 [0,0,0,0,0,0|2,0,2]=4 155 B9R0.2 CNCC\C=C\C=C(C)C Amb25708903 [0,0,0,0,0,0|3,0,1]=4 156 B9R0.2 COCCCCCC(=O)O Amb10607872 [0,0,0,0,0,0|1,0,2]=3 157 B9R0.2 COCCCCNC(N)=O Amb24478015 [0,0,0,0,0,0|3,0,1]=4 158 B9R0.2 COCCCCOC(C)=O Amb24325176 [0,0,0,0,0,0|3,0,1]=4 159 B9R0.2 COCCCOCC(C)=O Amb25056055 [0,0,0,0,0,0|3,0,1]=4 160 B9R0.2 COCCCOCC(O)=O Amb25304314 [0,0,0,0,0,0|2,0,1]=3 161 B9R0.2 COCCCONC(N)=O Amb24673253 [0,0,0,0,0,0|4,0,0]=4 162 B9R0.2 COCCCSCC(C)=O Amb25289706 [0,0,0,0,0,0|3,0,1]=4 163 B9R0.2 COCCCSCC(N)=O Amb25096665 [0,0,0,0,0,0|3,0,1]=4 164 B9R0.2 COCCCSCC(O)=O Amb18798347 [0,0,0,0,0,0|2,0,1]=3 165 B9R0.2 COCCC\C=C\C(C)=O Amb25125817 [0,0,0,0,0,0|2,0,0]=2 166 B9R0.2 COCCN\C=C\C(O)=O Amb24479660 [0,0,0,0,0,0|2,0,0]=2 167 B9R0.2 COCOCC#CC(O)=O Amb25791596 [0,0,0,0,0,0|2,0,2]=4 168 B9R0.2 COC\C=C/C=C/C(O)=O Amb24505179 [0,0,0,0,0,0|1,0,2]=3 169 B9R0.2 CONCCCCC(O)=O Amb25694999 [0,0,0,0,0,0|2,0,2]=4 170 B9R0.2 CSCCCONC(C)=O Amb25702616 [0,0,0,0,0,0|4,0,0]=4 171 B9R0.2 CSCCCONC(N)=O Amb25675874 [0,0,0,0,0,0|4,0,0]=4 172 B9R0.2 CSCCNCCC(O)=O Amb25055507 [0,0,0,0,0,0|2,0,2]=4 173 B9R0.2 CSCCOCCC(O)=O Amb25173504 [0,0,0,0,0,0|2,0,2]=4 174 B9R0.2 CSCCSCCC(O)=O Amb25798868 [0,0,0,0,0,0|2,0,2]=4 175 B9R0.2 CSCCS\C=C\C(O)=O Amb24504431 [0,0,0,0,0,0|2,0,0]=2 176 B9R0.2 CSSCCCCC(O)=O Amb24429106 [0,0,0,0,0,0|2,0,2]=4 177 B9R0.2 CSSCCNCC(O)=O Amb24538756 [0,0,0,0,0,0|3,0,1]=4 178 B9R0.2 C[13CH2]CCCCCC(O)=O Amb22367488 [0,0,0,0,0,0|0,0,2]=2 179 B9R0.2 C[C@@H](O)\C=C\CCCC=C Amb25187326 [0,0,0,0,0,0|1,0,3]=4 180 B9R0.2 C[C@@H](O)\C=C\CCCC=O Amb25116052 [0,0,0,0,0,0|2,0,2]=4 181 B9R0.2 C\C=C\CC=CCC(O)=O Amb25076809 [0,0,0,0,0,0|0,0,4]=4 182 B9R0.2 C\C=C\CCCCC(O)=O Amb18643887 [0,0,0,0,0,0|0,0,4]=4 183 B9R0.2 C\C=C\CC\C=C\C(C)=O Amb24402185 [0,0,0,0,0,0|1,0,2]=3 184 B9R0.2 C\C=C\CC\C=C\C(O)=O Amb25111532 [0,0,0,0,0,0|0,0,2]=2 185 B9R0.2 C\C=C\CN\C=C\C(O)=O Amb24625568 [0,0,0,0,0,0|1,0,2]=3 186 B9R0.2 ClCCCCCC=C(Cl)Cl Amb25836265 [0,0,0,0,0,0|3,0,1]=4 187 B9R0.2 ClCCCCCCC(=O)O Amb17594087 [0,0,0,0,0,0|1,0,2]=3 188 B9R0.2 ClCCCCOC=C(Cl)Cl Amb25090285 [0,0,0,0,0,0|4,0,0]=4 189 B9R0.2 FC(F)=CCCCCCCl Amb25129470 [0,0,0,0,0,0|3,0,1]=4 190 B9R0.2 N#CCCCCCC(O)=O Amb18643705 [0,0,0,0,0,0|1,0,3]=4 191 B9R0.2 N#CCCCSCC(=O)O Amb1109771 [0,0,0,0,0,0|2,0,2]=4 192 B9R0.2 N#CCCC\C=C\B(O)O Amb25176210 [0,0,0,0,0,0|2,0,2]=4 193 B9R0.2 N#CCCC\C=C\C(O)=O Amb25231131 [0,0,0,0,0,0|1,0,1]=2 194 B9R0.2 NC(=O)CNCCCCF Amb25694790 [0,0,0,0,0,0|3,0,1]=4 195 B9R0.2 NC(=O)CNCCCCO Amb25140635 [0,0,0,0,0,0|3,0,1]=4 196 B9R0.2 NC(=O)CSCCCCBr Amb25853094 [0,0,0,0,0,0|3,0,1]=4 197 B9R0.2 NC(=O)OCCCCCBr Amb24479497 [0,0,0,0,0,0|3,0,1]=4 198 B9R0.2 NC(=O)OCCCCCCl Amb25378803 [0,0,0,0,0,0|3,0,1]=4 199 B9R0.2 NCCCCCC=C(Cl)Cl Amb25299275 [0,0,0,0,0,0|3,0,1]=4 200 B9R0.2 NCCCCCCC(=O)O Amb1151254 [0,0,0,0,0,0|1,0,2]=3 201 B9R0.2 NCCCCCCC(=O)O Amb16232099 [0,0,0,0,0,0|1,0,2]=3 202 B9R0.2 NCCCCNCC(N)=O Amb25840017 [0,0,0,0,0,0|3,0,1]=4 203 B9R0.2 NCCCCOCC(N)=O Amb24515943 [0,0,0,0,0,0|3,0,1]=4 204 B9R0.2 NCCCCSCC(=O)C Amb17500952 [0,0,0,0,0,0|3,0,1]=4 205 B9R0.2 NCCCCSCC(=O)N Amb17500917 [0,0,0,0,0,0|3,0,1]=4 206 B9R0.2 NCCCCSCC(=O)O Amb17500919 [0,0,0,0,0,0|2,0,1]=3 207 B9R0.2 NCCCC\C=C\C(O)=O Amb24502157 [0,0,0,0,0,0|1,0,0]=1 208 B9R0.2 NCCCN\C=C\C(O)=O Amb25834729 [0,0,0,0,0,0|2,0,0]=2 209 B9R0.2 NCCCOCCC(O)=O Amb18111494 [0,0,0,0,0,0|2,0,2]=4 210 B9R0.2 NCCCSCCC(O)=O Amb24496605 [0,0,0,0,0,0|2,0,2]=4 211 B9R0.2 NCCNCCNC(O)=O Amb24069145 [0,0,0,0,0,0|3,0,1]=4 212 B9R0.2 NCCNC\C=C\C(O)=O Amb24595620 [0,0,0,0,0,0|2,0,0]=2 213 B9R0.2 NCCOCCCC(O)=O Amb18111467 [0,0,0,0,0,0|2,0,2]=4 214 B9R0.2 NCCSCCCC(=O)O Amb17500468 [0,0,0,0,0,0|2,0,2]=4 215 B9R0.2 NCCSC\C=C\C(O)=O Amb25089810 [0,0,0,0,0,0|2,0,0]=2 216 B9R0.2 NOCCCCCC(=O)O Amb10975958 [0,0,0,0,0,0|2,0,2]=4 217 B9R0.2 O=C(Cl)CCCCCCCl Amb24703296 [0,0,0,0,0,0|2,0,2]=4 218 B9R0.2 O=C(Cl)\C=C\CCCCCl Amb25074569 [0,0,0,0,0,0|2,0,0]=2 219 B9R0.2 OB(O)\C=C\CCCC=O Amb24678117 [0,0,0,0,0,0|2,0,2]=4 220 B9R0.2 OC(=O)CCCCCCF Amb25132501 [0,0,0,0,0,0|1,0,2]=3 221 B9R0.2 OC(=O)CCCCCCS Amb24710334 [0,0,0,0,0,0|1,0,2]=3 222 B9R0.2 OC(=O)CCCNCCF Amb25312142 [0,0,0,0,0,0|2,0,2]=4 223 B9R0.2 OC(=O)CCOCCCBr Amb25207601 [0,0,0,0,0,0|2,0,2]=4 224 B9R0.2 OC(=O)CCOCCCF Amb25794478 [0,0,0,0,0,0|2,0,2]=4 225 B9R0.2 OC(=O)CNCCCCCl Amb24505281 [0,0,0,0,0,0|2,0,1]=3 226 B9R0.2 OC(=O)CNCCCCF Amb24588093 [0,0,0,0,0,0|2,0,1]=3 227 B9R0.2 OC(=O)C\C=C/CCC=O Amb24480684 [0,0,0,0,0,0|1,0,3]=4 228 B9R0.2 OC(=O)C\C=C\CCC=O Amb18643818 [0,0,0,0,0,0|1,0,3]=4 229 B9R0.2 OC(=O)\C=C\CC#CCBr Amb24393543 [0,0,0,0,0,0|1,0,2]=3 230 B9R0.2 OC(=O)\C=C\CCCC=O Amb25253849 [0,0,0,0,0,0|1,0,1]=2 231 B9R0.2 OC(=O)\C=C\CCCCBr Amb18130981 [0,0,0,0,0,0|1,0,0]=1 232 B9R0.2 OC(=O)\C=C\CCCCCl Amb18645743 [0,0,0,0,0,0|1,0,0]=1 233 B9R0.2 OC(=O)\C=C\CNCCF Amb24411628 [0,0,0,0,0,0|2,0,0]=2 234 B9R0.2 OC(=O)\C=C\COCCBr Amb25131553 [0,0,0,0,0,0|2,0,0]=2 235 B9R0.2 OCCCCCNC(=O)C Amb15769972 [0,0,0,0,0,0|3,0,1]=4 236 B9R0.2 OCCCCSCC(O)=O Amb18798269 [0,0,0,0,0,0|2,0,1]=3 237 B9R0.2 OCCCC\C=C\B(O)O Amb24478495 [0,0,0,0,0,0|2,0,1]=3 238 B9R0.2 OCCCC\C=C\C(O)=O Amb18644146 [0,0,0,0,0,0|1,0,0]=1 239 B9R0.2 OCCCOCCC(O)=O Amb24476864 [0,0,0,0,0,0|2,0,2]=4 240 B9R0.2 OCCCSSCC(O)=O Amb25053922 [0,0,0,0,0,0|3,0,1]=4 241 B9R0.2 OCCCS\C=C\C(O)=O Amb25130157 [0,0,0,0,0,0|2,0,0]=2 242 B9R0.2 OCCNC\C=C\C(O)=O Amb24541803 [0,0,0,0,0,0|2,0,0]=2 243 B9R0.2 ONCCCCCC(O)=O Amb25354224 [0,0,0,0,0,0|2,0,2]=4 244 B9R0.2 [13CH3]CCCCCCC(O)=O Amb22367137 [0,0,0,0,0,0|0,0,2]=2 245 B9R0.2 [13CH3][13CH2]CCCCCC(O)=O Amb22367489 [0,0,0,0,0,0|0,0,2]=2 246 B8R0.4 C#CCOC\C=C\C=O Amb24621909 [1,0,0,0,0,0|1,0,2]=4 247 B8R0.4 C=CCCC\C=C/CO Amb22730735 [1,0,0,0,0,0|0,0,3]=4 248 B8R0.4 C=CCCC\C=C\C=O Amb25243082 [1,0,0,0,0,0|0,0,2]=3 249 B8R0.4 C=CCCC\C=C\CO Amb19930201 [1,0,0,0,0,0|0,0,3]=4 250 B8R0.4 C=CCOC\C=C/C=O Amb25373418 [1,0,0,0,0,0|1,0,2]=4 251 B8R0.4 C=CCSC\C=C\C=O Amb24621454 [1,0,0,0,0,0|1,0,2]=4 252 B8R0.4 C=C\C=C\CCCC=O Amb18642211 [1,0,0,0,0,0|2,0,1]=4 253 B8R0.4 C=C\C=C\CCCCBr Amb24693997 [1,0,0,0,0,0|2,0,0]=3 254 B8R0.4 C=C\C=C\CCCCCl Amb25107305 [1,0,0,0,0,0|2,0,0]=3 255 B8R0.4 C=C\C=C\CCCCN Amb18642357 [1,0,0,0,0,0|2,0,0]=3 256 B8R0.4 C=C\C=C\OCCCO Amb25332487 [1,0,0,0,0,0|3,0,0]=4 257 B8R0.4 CC=C=CCCCCN Amb25374847 [1,0,0,0,0,0|2,0,1]=4 258 B8R0.4 CC=C=CCCCCO Amb25334666 [1,0,0,0,0,0|2,0,1]=4 259 B8R0.4 CC=CC=CCCCC Amb22228349 [1,0,0,0,0,0|1,0,1]=3 260 B8R0.4 CC=C\C=C\CCCC Amb24558323 [1,0,0,0,0,0|1,0,1]=3 261 B8R0.4 CCC#CC\C=C\C=O Amb24666803 [1,0,0,0,0,0|0,0,2]=3 262 B8R0.4 CCC#CC\C=C\CO Amb24617242 [1,0,0,0,0,0|0,0,3]=4 263 B8R0.4 CCCC#C\C=C/CO Amb10563780 [1,0,0,0,0,0|0,0,3]=4 264 B8R0.4 CCCC#C\C=C\C=O Amb25108334 [1,0,0,0,0,0|0,0,2]=3 265 B8R0.4 CCCC#C\C=C\CO Amb25358310 [1,0,0,0,0,0|0,0,3]=4 266 B8R0.4 CCCCC#CCC=O Amb25347288 [1,0,0,0,0,0|0,0,3]=4 267 B8R0.4 CCCCC/C=C/CBr Amb17666913 [1,0,0,0,0,0|1,0,1]=3 268 B8R0.4 CCCCCC#CC=C Amb17940382 [1,0,0,0,0,0|1,0,2]=4 269 B8R0.4 CCCCCC/C=N/O Amb17672299 [1,0,0,0,0,0|1,0,1]=3 270 B8R0.4 CCCCCCC=NO Amb25278553 [1,0,0,0,0,0|1,0,1]=3 271 B8R0.4 CCCCCCC[13CH2]O Amb22367456 [1,0,0,0,0,0|0,0,3]=4 272 B8R0.4 CCCCCCOC=C Amb24440550 [1,0,0,0,0,0|2,0,1]=4 273 B8R0.4 CCCCCCON=O Amb17672945 [1,0,0,0,0,0|2,0,1]=4 274 B8R0.4 CCCCCCSN=O Amb24596500 [1,0,0,0,0,0|2,0,1]=4 275 B8R0.4 CCCCCC\C=C\Br Amb24677708 [1,0,0,0,0,0|1,0,1]=3 276 B8R0.4 CCCCCC\C=C\Cl Amb24697939 [1,0,0,0,0,0|1,0,1]=3 277 B8R0.4 CCCCCC\C=C\I Amb24446897 [1,0,0,0,0,0|1,0,1]=3 278 B8R0.4 CCCCCOCC=C Amb22230169 [1,0,0,0,0,0|2,0,1]=4 279 B8R0.4 CCCCCOCCO Amb22264988 [1,0,0,0,0,0|1,0,2]=4 280 B8R0.4 CCCCCSCC=O Amb25113339 [1,0,0,0,0,0|1,0,1]=3 281 B8R0.4 CCCCCSCCO Amb1032987 [1,0,0,0,0,0|1,0,2]=4 282 B8R0.4 CCCCC\C=C/C=O Amb24419726 [1,0,0,0,0,0|0,0,0]=1 283 B8R0.4 CCCCC\C=C/CC Amb22730456 [1,0,0,0,0,0|1,0,1]=3 284 B8R0.4 CCCCC\C=C\C#N Amb18642132 [1,0,0,0,0,0|1,0,1]=3 285 B8R0.4 CCCCC\C=C\C=C Amb22641683 [1,0,0,0,0,0|1,0,0]=2 286 B8R0.4 CCCCC\C=C\CCl Amb24597697 [1,0,0,0,0,0|1,0,1]=3 287 B8R0.4 CCCCC\C=C\CN Amb18642556 [1,0,0,0,0,0|1,0,1]=3 288 B8R0.4 CCCCNCNC=O Amb25728066 [1,0,0,0,0,0|2,0,1]=4 289 B8R0.4 CCCCNC\C=C/Br Amb24677760 [1,0,0,0,0,0|2,0,1]=4 290 B8R0.4 CCCCN\C=C\C#N Amb24477000 [1,0,0,0,0,0|2,0,1]=4 291 B8R0.4 CCCCN\C=C\C=O Amb25175069 [1,0,0,0,0,0|1,0,0]=2 292 B8R0.4 CCCCOC\C=C\Cl Amb24480196 [1,0,0,0,0,0|2,0,1]=4 293 B8R0.4 CCCCO\C=C\C=O Amb24480362 [1,0,0,0,0,0|1,0,0]=2 294 B8R0.4 CCCCSCCC=O Amb24729974 [1,0,0,0,0,0|1,0,2]=4 295 B8R0.4 CCCCSC\C=C\Cl Amb25765695 [1,0,0,0,0,0|2,0,1]=4 296 B8R0.4 CCCC\C=C\C=C/Br Amb24480294 [1,0,0,0,0,0|1,0,1]=3 297 B8R0.4 CCCC\C=C\C=CBr Amb24580369 [1,0,0,0,0,0|1,0,1]=3 298 B8R0.4 CCCC\C=C\C=C\Cl Amb24479953 [1,0,0,0,0,0|1,0,1]=3 299 B8R0.4 CCCC\C=C\CC=O Amb18642464 [1,0,0,0,0,0|0,0,2]=3 300 B8R0.4 CCCC\C=C\N=C=O Amb25694711 [1,0,0,0,0,0|1,0,2]=4 301 B8R0.4 CCCNC\C=C\CCl Amb25337395 [1,0,0,0,0,0|2,0,1]=4 302 B8R0.4 CCCNC\C=C\CN Amb22346358 [1,0,0,0,0,0|2,0,1]=4 303 B8R0.4 CCCOC\C=C\CN Amb24523082 [1,0,0,0,0,0|2,0,1]=4 304 B8R0.4 CCCSC\C=C\CCl Amb25355163 [1,0,0,0,0,0|2,0,1]=4 305 B8R0.4 CCCSC\C=C\CO Amb24397965 [1,0,0,0,0,0|1,0,1]=3 306 B8R0.4 CCCSC\C=C\CS Amb24475880 [1,0,0,0,0,0|1,1,1]=4 307 B8R0.4 CCC\C=C\C=CCO Amb24539762 [1,0,0,0,0,0|0,0,3]=4 308 B8R0.4 CCC\C=C\C=C\C=C Amb22641675 [1,0,0,0,0,0|1,0,2]=4 309 B8R0.4 CCC\C=C\C=C\CO Amb22053869 [1,0,0,0,0,0|0,0,3]=4 310 B8R0.4 CCOC#C\C=C\C=O Amb25195309 [1,0,0,0,0,0|1,0,2]=4 311 B8R0.4 CCOCCCNC=O Amb24528788 [1,0,0,0,0,0|2,0,1]=4 312 B8R0.4 CCOCCOCC=O Amb24052109 [1,0,0,0,0,0|2,0,1]=4 313 B8R0.4 CCO\C=C\C=CC=O Amb24587787 [1,0,0,0,0,0|1,0,2]=4 314 B8R0.4 CCO\C=C\C=C\C=O Amb25054124 [1,0,0,0,0,0|1,0,2]=4 315 B8R0.4 CCSCCCCC=O Amb24690525 [1,0,0,0,0,0|1,0,2]=4 316 B8R0.4 CCSCCSCC=O Amb25733396 [1,0,0,0,0,0|2,0,1]=4 317 B8R0.4 CC\C=C/CCCCBr Amb24480222 [1,0,0,0,0,0|2,0,1]=4 318 B8R0.4 CC\C=C/CCCCC Amb25258581 [1,0,0,0,0,0|1,0,1]=3 319 B8R0.4 CC\C=C/CCCCCl Amb24361654 [1,0,0,0,0,0|2,0,1]=4 320 B8R0.4 CC\C=C/CCCCO Amb22052636 [1,0,0,0,0,0|2,0,1]=4 321 B8R0.4 CC\C=C\CC=CC=O Amb25264841 [1,0,0,0,0,0|0,0,2]=3 322 B8R0.4 CC\C=C\CC=CCO Amb24332902 [1,0,0,0,0,0|0,0,3]=4 323 B8R0.4 CC\C=C\CCCCC Amb22347893 [1,0,0,0,0,0|1,0,1]=3 324 B8R0.4 CC\C=C\CCCCN Amb25274450 [1,0,0,0,0,0|2,0,1]=4 325 B8R0.4 CC\C=C\NC=CC=O Amb25175085 [1,0,0,0,0,0|1,0,2]=4 326 B8R0.4 CC\C=C\N\C=C/C=O Amb18642305 [1,0,0,0,0,0|1,0,2]=4 327 B8R0.4 COCCCCNC=O Amb24713995 [1,0,0,0,0,0|2,0,1]=4 328 B8R0.4 COCCC\C=C\CCl Amb24746059 [1,0,0,0,0,0|2,0,1]=4 329 B8R0.4 COCOC\C=C\CO Amb24671466 [1,0,0,0,0,0|2,0,1]=4 330 B8R0.4 CO\C=C\CCCCBr Amb24661955 [1,0,0,0,0,0|3,0,0]=4 331 B8R0.4 CO\C=C\CCCCCl Amb25145953 [1,0,0,0,0,0|3,0,0]=4 332 B8R0.4 CSCCCSCC=O Amb25755822 [1,0,0,0,0,0|2,0,1]=4 333 B8R0.4 CS\C=C\CCCCO Amb25070629 [1,0,0,0,0,0|3,0,0]=4 334 B8R0.4 C\C=C/CCCCCC Amb22730637 [1,0,0,0,0,0|1,0,1]=3 335 B8R0.4 C\C=C\C=CCCCBr Amb24697800 [1,0,0,0,0,0|2,0,1]=4 336 B8R0.4 C\C=C\C=CCCCN Amb25261065 [1,0,0,0,0,0|2,0,1]=4 337 B8R0.4 C\C=C\C=C\CCCC Amb24477896 [1,0,0,0,0,0|1,0,1]=3 338 B8R0.4 C\C=C\C=C\CCCO Amb17593323 [1,0,0,0,0,0|2,0,1]=4 339 B8R0.4 C\C=C\C=C\CNCC Amb24714676 [1,0,0,0,0,0|2,0,1]=4 340 B8R0.4 C\C=C\CCCCCBr Amb24519144 [1,0,0,0,0,0|2,0,1]=4 341 B8R0.4 C\C=C\CCCCCC Amb19930200 [1,0,0,0,0,0|1,0,1]=3 342 B8R0.4 C\C=C\CCCCCO Amb25247777 [1,0,0,0,0,0|2,0,1]=4 343 B8R0.4 C\C=C\CCNCCC Amb25375567 [1,0,0,0,0,0|2,0,1]=4 344 B8R0.4 C\C=C\CC\C=C\C=O Amb18642215 [1,0,0,0,0,0|0,0,2]=3 345 B8R0.4 C\C=C\CNCCCC Amb18642548 [1,0,0,0,0,0|2,0,1]=4 346 B8R0.4 ClCCCC\C=C/C#N Amb10605327 [1,0,0,0,0,0|2,0,1]=4 347 B8R0.4 N#CC=CCCCCCl Amb24063222 [1,0,0,0,0,0|2,0,1]=4 348 B8R0.4 N#CCCC\C=C\CO Amb25271968 [1,0,0,0,0,0|1,0,2]=4 349 B8R0.4 NCCCCCOC=O Amb24585868 [1,0,0,0,0,0|2,0,1]=4 350 B8R0.4 NCCCC\C=C\CO Amb24117507 [1,0,0,0,0,0|1,0,1]=3 351 B8R0.4 NC\C=C/CCCCN Amb25328456 [1,0,0,0,0,0|2,0,1]=4 352 B8R0.4 NC\C=C\CCCCN Amb24699111 [1,0,0,0,0,0|2,0,1]=4 353 B8R0.4 O=CC#CCCCCCl Amb24649354 [1,0,0,0,0,0|1,0,2]=4 354 B8R0.4 O=CCCCCCCBr Amb22755463 [1,0,0,0,0,0|1,0,2]=4 355 B8R0.4 O=CCCCCCCF Amb24682783 [1,0,0,0,0,0|1,0,2]=4 356 B8R0.4 O=CCCC\C=C\C=O Amb24641347 [1,0,0,0,0,0|1,0,1]=3 357 B8R0.4 O=COCCCCCCl Amb24750052 [1,0,0,0,0,0|2,0,1]=4 358 B8R0.4 O=C\C=C\CCC=C=O Amb25804049 [1,0,0,0,0,0|1,0,2]=4 359 B8R0.4 OCCCCC=C=CBr Amb24650522 [1,0,0,0,0,0|2,0,1]=4 360 B8R0.4 OCCCCCC=NO Amb25343910 [1,0,0,0,0,0|2,0,1]=4 361 B8R0.4 OCCCCCCC=O Amb24711951 [1,0,0,0,0,0|1,0,2]=4 362 B8R0.4 OCCCCCNC=O Amb24752050 [1,0,0,0,0,0|2,0,1]=4 363 B8R0.4 OC\C=C/CC#CCC Amb17593279 [1,0,0,0,0,0|0,0,3]=4 364 B8R0.4 OC\C=C/CCCC=O Amb24496297 [1,0,0,0,0,0|1,0,2]=4 365 B8R0.4 OC\C=C\CSCCO Amb25739839 [1,0,0,0,0,0|2,0,1]=4 366 B8R0.7 BrCCCCCC(=O)O Amb2081955 [1,0,0,0,0,0|1,0,1]=3 367 B8R0.7 C#CCC\C=C\C(O)=O Amb24622206 [1,0,0,0,0,0|0,0,2]=3 368 B8R0.7 C#CCN\C=C\C(O)=O Amb24524223 [1,0,0,0,0,0|1,0,2]=4 369 B8R0.7 C=CCC\C=C\C(O)=O Amb25756053 [1,0,0,0,0,0|0,0,2]=3 370 B8R0.7 C=CCO\C=C\C(O)=O Amb24471908 [1,0,0,0,0,0|1,0,2]=4 371 B8R0.7 CC(=C)\C=C\CCCBr Amb25264506 [1,0,0,0,0,0|3,0,0]=4 372 B8R0.7 CC(=C)\C=C\CCCO Amb25266398 [1,0,0,0,0,0|3,0,0]=4 373 B8R0.7 CC(=O)CCCCCF Amb25373197 [1,0,0,0,0,0|2,0,1]=4 374 B8R0.7 CC(=O)CCCCCN Amb22641918 [1,0,0,0,0,0|2,0,1]=4 375 B8R0.7 CC(=O)CCCCCN Amb24113384 [1,0,0,0,0,0|2,0,1]=4 376 B8R0.7 CC(=O)NCCCCN Amb21520291 [1,0,0,0,0,0|3,0,0]=4 377 B8R0.7 CC(=O)OCCCCF Amb24393797 [1,0,0,0,0,0|3,0,0]=4 378 B8R0.7 CC(=O)OCCCCN Amb24657282 [1,0,0,0,0,0|3,0,0]=4 379 B8R0.7 CC(=O)OCCCCO Amb25714960 [1,0,0,0,0,0|3,0,0]=4 380 B8R0.7 CC(=O)OCCCCS Amb24431588 [1,0,0,0,0,0|3,0,0]=4 381 B8R0.7 CC(=O)SCCCCBr Amb22641871 [1,0,0,0,0,0|3,0,0]=4 382 B8R0.7 CC(=O)SCCCCN Amb24117263 [1,0,0,0,0,0|3,0,0]=4 383 B8R0.7 CC(=O)SCCCCO Amb25049205 [1,0,0,0,0,0|3,0,0]=4 384 B8R0.7 CC(=O)\C=C/CCC=C Amb25267525 [1,0,0,0,0,0|1,0,2]=4 385 B8R0.7 CC(=O)\C=C/CCC=O Amb24557160 [1,0,0,0,0,0|2,0,1]=4 386 B8R0.7 CC(=O)\C=C/NCCCl Amb24477726 [1,0,0,0,0,0|3,0,0]=4 387 B8R0.7 CC(=O)\C=C\CCC#N Amb18642111 [1,0,0,0,0,0|2,0,1]=4 388 B8R0.7 CC(=O)\C=C\CCC=O Amb18642401 [1,0,0,0,0,0|2,0,1]=4 389 B8R0.7 CC(=O)\C=C\CCCBr Amb24480224 [1,0,0,0,0,0|2,0,0]=3 390 B8R0.7 CC(=O)\C=C\NCCO Amb25146021 [1,0,0,0,0,0|3,0,0]=4 391 B8R0.7 CC(=O)\C=C\OCCO Amb25318892 [1,0,0,0,0,0|3,0,0]=4 392 B8R0.7 CC(=O)\C=C\SCCO Amb25116065 [1,0,0,0,0,0|3,0,0]=4 393 B8R0.7 CC(Br)=CCCCCO Amb24592453 [1,0,0,0,0,0|3,0,0]=4 394 B8R0.7 CC(O)\C=C\CCCO Amb24481909 [1,0,0,0,0,0|2,0,1]=4 395 B8R0.7 CCC#C\C=C/C(N)=O Amb25848367 [1,0,0,0,0,0|1,0,2]=4 396 B8R0.7 CCCC#CCC(=O)O Amb17593307 [1,0,0,0,0,0|0,0,3]=4 397 B8R0.7 CCCC/C=C/C(O)=O Amb17778752 [1,0,0,0,0,0|0,0,0]=1 398 B8R0.7 CCCC/C=C/C([O-])=O Amb17778116 [1,0,0,0,0,0|0,0,1]=2 399 B8R0.7 CCCC=C=CC(C)=O Amb24061645 [1,0,0,0,0,0|1,0,2]=4 400 B8R0.7 CCCC=C=CC(N)=O Amb25307861 [1,0,0,0,0,0|1,0,2]=4 401 B8R0.7 CCCC=C=CC(O)=O Amb24407382 [1,0,0,0,0,0|0,0,2]=3 402 B8R0.7 CCCCC#CC(=O)C Amb17593278 [1,0,0,0,0,0|1,0,2]=4 403 B8R0.7 CCCCCC=C(C)C Amb22730264 [1,0,0,0,0,0|2,0,0]=3 404 B8R0.7 CCCCCC=C(F)F Amb10840486 [1,0,0,0,0,0|2,0,0]=3 405 B8R0.7 CCCCCCC(N)O Amb25368398 [1,0,0,0,0,0|1,0,2]=4 406 B8R0.7 CCCCCCC([O-])=O Amb22729026 [1,0,0,0,0,0|0,0,2]=3 407 B8R0.7 CCCCCCS(O)=O Amb25213753 [1,0,0,0,0,0|1,0,1]=3 408 B8R0.7 CCCCCC[N+](=O)[O-] Amb17618424 [1,0,0,0,0,0|1,0,2]=4 409 B8R0.7 CCCCCNC(=O)Cl Amb25087634 [1,0,0,0,0,0|2,0,0]=3 410 B8R0.7 CCCCCNC(C)=O Amb17797593 [1,0,0,0,0,0|2,0,0]=3 411 B8R0.7 CCCCCNC(C)=S Amb24364558 [1,0,0,0,0,0|2,1,0]=4 412 B8R0.7 CCCCCNC(N)=N Amb19416708 [1,0,0,0,0,0|3,0,0]=4 413 B8R0.7 CCCCCNC(S)=S Amb25032265 [1,0,0,0,0,0|1,2,0]=4 414 B8R0.7 CCCCCOB(O)O Amb24716868 [1,0,0,0,0,0|2,0,1]=4 415 B8R0.7 CCCCCOC(=O)Cl Amb10844803 [1,0,0,0,0,0|2,0,0]=3 416 B8R0.7 CCCCCOC(C)=O Amb22351262 [1,0,0,0,0,0|2,0,0]=3 417 B8R0.7 CCCCCOC([S-])=S Amb22334083 [1,0,0,0,0,0|1,2,0]=4 418 B8R0.7 CCCCCOS(O)=O Amb22730504 [1,0,0,0,0,0|2,0,0]=3 419 B8R0.7 CCCCCO[N+]([O-])=O Amb22729008 [1,0,0,0,0,0|2,0,1]=4 420 B8R0.7 CCCCCSC(N)=N Amb20675976 [1,0,0,0,0,0|3,0,0]=4 421 B8R0.7 CCCCCSC(N)=N Amb23590643 [1,0,0,0,0,0|3,0,0]=4 422 B8R0.7 CCCCNCC(=O)N Amb1126543 [1,0,0,0,0,0|2,0,1]=4 423 B8R0.7 CCCCOCC(=O)Cl Amb25806749 [1,0,0,0,0,0|2,0,1]=4 424 B8R0.7 CCCCONC(C)=O Amb25057412 [1,0,0,0,0,0|3,0,0]=4 425 B8R0.7 CCCCSCC(=O)O Amb1138789 [1,0,0,0,0,0|1,0,1]=3 426 B8R0.7 CCCCSNC(N)=O Amb24744550 [1,0,0,0,0,0|3,0,0]=4 427 B8R0.7 CCCC[Hg]OC(C)=O Amb22360223 [1,0,0,0,0,0|3,0,0]=4 428 B8R0.7 CCCC\C=C/B(O)O Amb25727222 [1,0,0,0,0,0|1,0,1]=3 429 B8R0.7 CCCC\C=C/C(N)=O Amb25839420 [1,0,0,0,0,0|1,0,0]=2 430 B8R0.7 CCCC\C=C\B(O)O Amb10068585 [1,0,0,0,0,0|1,0,1]=3 431 B8R0.7 CCCC\C=C\C(C)=C Amb24559388 [1,0,0,0,0,0|2,0,0]=3 432 B8R0.7 CCCC\C=C\C(C)=O Amb22043236 [1,0,0,0,0,0|1,0,0]=2 433 B8R0.7 CCCC\C=C\C(C)C Amb24614606 [1,0,0,0,0,0|2,0,1]=4 434 B8R0.7 CCCC\C=C\C(C)O Amb22052697 [1,0,0,0,0,0|1,0,1]=3 435 B8R0.7 CCCC\C=C\C(N)=O Amb24616435 [1,0,0,0,0,0|1,0,0]=2 436 B8R0.7 CCCNCC=C(C)C Amb24477771 [1,0,0,0,0,0|3,0,0]=4 437 B8R0.7 CCCNCCC(=O)O Amb2372065 [1,0,0,0,0,0|1,0,1]=3 438 B8R0.7 CCCNCCC(C)=O Amb24700442 [1,0,0,0,0,0|2,0,1]=4 439 B8R0.7 CCCNCCC(N)=O Amb19960057 [1,0,0,0,0,0|2,0,1]=4 440 B8R0.7 CCCNCCC(O)=O Amb18633174 [1,0,0,0,0,0|1,0,1]=3 441 B8R0.7 CCCNCSC(C)=O Amb25190302 [1,0,0,0,0,0|3,0,0]=4 442 B8R0.7 CCCNN=CC(C)=O Amb24739997 [1,0,0,0,0,0|3,0,0]=4 443 B8R0.7 CCCN\C=C/C(C)=O Amb25749455 [1,0,0,0,0,0|2,0,0]=3 444 B8R0.7 CCCN\C=C\C(C)=O Amb25254846 [1,0,0,0,0,0|2,0,0]=3 445 B8R0.7 CCCN\N=C\C(C)=O Amb24633726 [1,0,0,0,0,0|3,0,0]=4 446 B8R0.7 CCCOCNC(N)=O Amb24349738 [1,0,0,0,0,0|3,0,0]=4 447 B8R0.7 CCCON=CC(N)=O Amb25324154 [1,0,0,0,0,0|3,0,0]=4 448 B8R0.7 CCCO\C=C\C(C)=O Amb24647800 [1,0,0,0,0,0|2,0,0]=3 449 B8R0.7 CCCO\C=C\C(O)=O Amb18642782 [1,0,0,0,0,0|1,0,0]=2 450 B8R0.7 CCCSCCC(N)=O Amb24333543 [1,0,0,0,0,0|2,0,1]=4 451 B8R0.7 CCCSCNC(C)=O Amb24681262 [1,0,0,0,0,0|3,0,0]=4 452 B8R0.7 CCCSSCC(O)=O Amb25209982 [1,0,0,0,0,0|2,0,1]=4 453 B8R0.7 CCCS\C=C/C(O)=O Amb18644291 [1,0,0,0,0,0|1,0,0]=2 454 B8R0.7 CCCS\C=C/C([O-])=O Amb19816096 [1,0,0,0,0,0|1,0,1]=3 455 B8R0.7 CCCS\C=C\C(O)=O Amb25051625 [1,0,0,0,0,0|1,0,0]=2 456 B8R0.7 CCC\C=C\CC(C)=O Amb24736384 [1,0,0,0,0,0|1,0,2]=4 457 B8R0.7 CCC\C=C\CC(N)=O Amb25328428 [1,0,0,0,0,0|1,0,2]=4 458 B8R0.7 CCC\C=C\CC(O)=O Amb18642602 [1,0,0,0,0,0|0,0,2]=3 459 B8R0.7 CCC\C=C\NC(C)=O Amb25785327 [1,0,0,0,0,0|2,0,1]=4 460 B8R0.7 CCNCCC=C(C)C Amb18312577 [1,0,0,0,0,0|3,0,0]=4 461 B8R0.7 CCNCCCC(C)=O Amb24093735 [1,0,0,0,0,0|2,0,1]=4 462 B8R0.7 CCNCCCC(N)=O Amb24709859 [1,0,0,0,0,0|2,0,1]=4 463 B8R0.7 CCNCCNC(N)=O Amb18312910 [1,0,0,0,0,0|3,0,0]=4 464 B8R0.7 CCNCCOC(C)=O Amb25313154 [1,0,0,0,0,0|3,0,0]=4 465 B8R0.7 CCNCCOC(N)=O Amb24402750 [1,0,0,0,0,0|3,0,0]=4 466 B8R0.7 CCOCC#CC(O)=O Amb24409938 [1,0,0,0,0,0|1,0,2]=4 467 B8R0.7 CCOCCCC(N)=O Amb25841206 [1,0,0,0,0,0|2,0,1]=4 468 B8R0.7 CCOCCNC(C)=O Amb24389255 [1,0,0,0,0,0|3,0,0]=4 469 B8R0.7 CCOCCOC(=O)Cl Amb22228804 [1,0,0,0,0,0|3,0,0]=4 470 B8R0.7 CCOCOCC(O)=O Amb25682215 [1,0,0,0,0,0|2,0,1]=4 471 B8R0.7 CCOCSCC(O)=O Amb25147004 [1,0,0,0,0,0|2,0,1]=4 472 B8R0.7 CCOC\C=C\C(C)=O Amb25347398 [1,0,0,0,0,0|2,0,0]=3 473 B8R0.7 CCOC\C=C\C(O)=O Amb19020649 [1,0,0,0,0,0|1,0,0]=2 474 B8R0.7 CCSCCOC(=O)Cl Amb24382779 [1,0,0,0,0,0|3,0,0]=4 475 B8R0.7 CCSCCOC(C)=O Amb24459072 [1,0,0,0,0,0|3,0,0]=4 476 B8R0.7 CCSC\C=C\C(C)O Amb24688230 [1,0,0,0,0,0|2,0,1]=4 477 B8R0.7 CCSC\C=C\C(O)=O Amb19020657 [1,0,0,0,0,0|1,0,0]=2 478 B8R0.7 CC\C=C/CCC(O)=O Amb25831265 [1,0,0,0,0,0|0,0,3]=4 479 B8R0.7 CC\C=C\C=CC(C)=O Amb25258167 [1,0,0,0,0,0|1,0,2]=4 480 B8R0.7 CC\C=C\C=CC(O)=O Amb24552622 [1,0,0,0,0,0|0,0,2]=3 481 B8R0.7 CC\C=C\C=C\C(C)=O Amb24667251 [1,0,0,0,0,0|1,0,2]=4 482 B8R0.7 CC\C=C\C=C\C(O)=O Amb18642407 [1,0,0,0,0,0|0,0,2]=3 483 B8R0.7 CC\C=C\CCC(O)=O Amb18642608 [1,0,0,0,0,0|0,0,3]=4 484 B8R0.7 CNCCCCC(=O)O Amb10605773 [1,0,0,0,0,0|1,0,1]=3 485 B8R0.7 CNCCCCC(C)=O Amb18642717 [1,0,0,0,0,0|2,0,1]=4 486 B8R0.7 CNCCCCC(O)=O Amb24340485 [1,0,0,0,0,0|1,0,1]=3 487 B8R0.7 CNCCCNC(C)=O Amb19346187 [1,0,0,0,0,0|3,0,0]=4 488 B8R0.7 CNCCCSC(C)=O Amb25197778 [1,0,0,0,0,0|3,0,0]=4 489 B8R0.7 CNCCNCC(O)=O Amb25211792 [1,0,0,0,0,0|2,0,1]=4 490 B8R0.7 CNCCOCC(O)=O Amb18630741 [1,0,0,0,0,0|2,0,1]=4 491 B8R0.7 COCCCNC(=O)N Amb1105274 [1,0,0,0,0,0|3,0,0]=4 492 B8R0.7 COCCCOC(C)=O Amb22732978 [1,0,0,0,0,0|3,0,0]=4 493 B8R0.7 COCCNCC(O)=O Amb19514667 [1,0,0,0,0,0|2,0,1]=4 494 B8R0.7 COCC\C=C\C(O)=O Amb24532833 [1,0,0,0,0,0|1,0,0]=2 495 B8R0.7 CONCCCC(O)=O Amb24647348 [1,0,0,0,0,0|2,0,1]=4 496 B8R0.7 CO\C=C\C=C/C(O)=O Amb25856553 [1,0,0,0,0,0|1,0,2]=4 497 B8R0.7 CSCCCCC(=O)O Amb17503764 [1,0,0,0,0,0|1,0,1]=3 498 B8R0.7 CSCCCNC(C)=O Amb24546713 [1,0,0,0,0,0|3,0,0]=4 499 B8R0.7 CSCCCNC(N)=O Amb25265571 [1,0,0,0,0,0|3,0,0]=4 500 B8R0.7 CSCCCOC(=O)Cl Amb25810712 [1,0,0,0,0,0|3,0,0]=4 501 B8R0.7 CSCCNCC(O)=O Amb24401934 [1,0,0,0,0,0|2,0,1]=4 502 B8R0.7 CSC\C=C/CC(O)=O Amb18644292 [1,0,0,0,0,0|1,0,2]=4 503 B8R0.7 CSSCCCC(O)=O Amb25269470 [1,0,0,0,0,0|2,0,1]=4 504 B8R0.7 C[C@H](O)\C=C\CCCO Amb25842182 [1,0,0,0,0,0|2,0,1]=4 505 B8R0.7 C\C=C/CCCC(O)=O Amb25314407 [1,0,0,0,0,0|0,0,3]=4 506 B8R0.7 C\C=C\CCCC(O)=O Amb18642615 [1,0,0,0,0,0|0,0,3]=4 507 B8R0.7 C\C=C\C\C=C\C(O)=O Amb24688696 [1,0,0,0,0,0|0,0,2]=3 508 B8R0.7 ClCCCCC=C(Cl)Cl Amb25707298 [1,0,0,0,0,0|3,0,0]=4 509 B8R0.7 ClCCCCCC(=O)Cl Amb10844967 [1,0,0,0,0,0|2,0,1]=4 510 B8R0.7 ClCCC\C=C\B(O)O Amb2455805 [1,0,0,0,0,0|2,0,1]=4 511 B8R0.7 N#CCCCCC(=O)O Amb17593332 [1,0,0,0,0,0|1,0,2]=4 512 B8R0.7 N#CCC\C=C\C(O)=O Amb24425060 [1,0,0,0,0,0|1,0,1]=3 513 B8R0.7 NC(=O)CCCCCO Amb22524369 [1,0,0,0,0,0|2,0,1]=4 514 B8R0.7 NC(=O)NCCCCO Amb25146104 [1,0,0,0,0,0|3,0,0]=4 515 B8R0.7 NCCCCC=C(Cl)Cl Amb25786790 [1,0,0,0,0,0|3,0,0]=4 516 B8R0.7 NCCCCC=C(F)F Amb25063284 [1,0,0,0,0,0|3,0,0]=4 517 B8R0.7 NCCCCCC(=O)Cl Amb17142873 [1,0,0,0,0,0|2,0,1]=4 518 B8R0.7 NCCCCCC(=O)O Amb17607928 [1,0,0,0,0,0|1,0,1]=3 519 B8R0.7 NCCCCCC(=O)O Amb1905625 [1,0,0,0,0,0|1,0,1]=3 520 B8R0.7 NCCCCNC(=O)C Amb17053700 [1,0,0,0,0,0|3,0,0]=4 521 B8R0.7 NCCCCNC(=O)S Amb25328775 [1,0,0,0,0,0|2,1,0]=4 522 B8R0.7 NCCCCNC(N)=O Amb19026975 [1,0,0,0,0,0|3,0,0]=4 523 B8R0.7 NCCCCNC(N)=O Amb19374296 [1,0,0,0,0,0|3,0,0]=4 524 B8R0.7 NCCCCOC(=O)Cl Amb25320806 [1,0,0,0,0,0|3,0,0]=4 525 B8R0.7 NCCCNCC(O)=O Amb22733138 [1,0,0,0,0,0|2,0,1]=4 526 B8R0.7 NCCCNCC(O)=O Amb25848815 [1,0,0,0,0,0|2,0,1]=4 527 B8R0.7 NCCCOCC(O)=O Amb18111435 [1,0,0,0,0,0|2,0,1]=4 528 B8R0.7 NCCCSCC(=O)O Amb17500676 [1,0,0,0,0,0|2,0,1]=4 529 B8R0.7 NCCC\C=C\C(O)=O Amb22054306 [1,0,0,0,0,0|1,0,0]=2 530 B8R0.7 NCCC\C=C\C(O)=O Amb25221789 [1,0,0,0,0,0|1,0,0]=2 531 B8R0.7 NCCNCCC(O)=O Amb20668304 [1,0,0,0,0,0|2,0,1]=4 532 B8R0.7 NCCNCCC(O)=O Amb22058790 [1,0,0,0,0,0|2,0,1]=4 533 B8R0.7 NCCOCCC(O)=O Amb18630461 [1,0,0,0,0,0|2,0,1]=4 534 B8R0.7 NCCSCCC(O)=O Amb21988844 [1,0,0,0,0,0|2,0,1]=4 535 B8R0.7 NCCS\C=C\C(O)=O Amb18644341 [1,0,0,0,0,0|2,0,0]=3 536 B8R0.7 NC\C=C\C=CC(O)=O Amb24682694 [1,0,0,0,0,0|1,0,2]=4 537 B8R0.7 NC\C=C\C=C\C(O)=O Amb25146005 [1,0,0,0,0,0|1,0,2]=4 538 B8R0.7 NOCCCCC(=O)O Amb10975955 [1,0,0,0,0,0|2,0,1]=4 539 B8R0.7 O=C(Cl)\C=C\CCCBr Amb24707452 [1,0,0,0,0,0|2,0,0]=3 540 B8R0.7 O=C(F)OCCCCCl Amb24416872 [1,0,0,0,0,0|3,0,0]=4 541 B8R0.7 OC(=O)C#CCCCCl Amb24347497 [1,0,0,0,0,0|1,0,2]=4 542 B8R0.7 OC(=O)CCCCC=O Amb18642763 [1,0,0,0,0,0|1,0,2]=4 543 B8R0.7 OC(=O)CCCCCCl Amb18796646 [1,0,0,0,0,0|1,0,1]=3 544 B8R0.7 OC(=O)CCCCCI Amb22736492 [1,0,0,0,0,0|1,0,1]=3 545 B8R0.7 OC(=O)CCCCCS Amb18644374 [1,0,0,0,0,0|1,0,1]=3 546 B8R0.7 OC(=O)CCOCCBr Amb24057757 [1,0,0,0,0,0|2,0,1]=4 547 B8R0.7 OC(=O)CCSCCCl Amb24097450 [1,0,0,0,0,0|2,0,1]=4 548 B8R0.7 OC(=O)CCSCCS Amb18126456 [1,0,0,0,0,0|2,0,1]=4 549 B8R0.7 OC(=O)CNCCCBr Amb25765814 [1,0,0,0,0,0|2,0,1]=4 550 B8R0.7 OC(=O)CNCCCS Amb25268354 [1,0,0,0,0,0|2,0,1]=4 551 B8R0.7 OC(=O)COCCCBr Amb24594816 [1,0,0,0,0,0|2,0,1]=4 552 B8R0.7 OC(=O)COCCCF Amb24481828 [1,0,0,0,0,0|2,0,1]=4 553 B8R0.7 OC(=O)CSCCCBr Amb25771711 [1,0,0,0,0,0|2,0,1]=4 554 B8R0.7 OC(=O)CSCCCCl Amb18126548 [1,0,0,0,0,0|2,0,1]=4 555 B8R0.7 OC(=O)CSCCCF Amb25676986 [1,0,0,0,0,0|2,0,1]=4 556 B8R0.7 OC(=O)\C=C\C=CCBr Amb25746310 [1,0,0,0,0,0|1,0,2]=4 557 B8R0.7 OC(=O)\C=C\CCCBr Amb24446659 [1,0,0,0,0,0|1,0,0]=2 558 B8R0.7 OC(=O)\C=C\CCCCl Amb18644386 [1,0,0,0,0,0|1,0,0]=2 559 B8R0.7 OC(=O)\C=C\NCCF Amb25850814 [1,0,0,0,0,0|2,0,0]=3 560 B8R0.7 OCCCCNC(=O)C Amb17102977 [1,0,0,0,0,0|3,0,0]=4 561 B8R0.7 OCCC\C=C\B(O)O Amb24588560 [1,0,0,0,0,0|2,0,1]=4 562 B8R0.7 OCCC\C=C\C(O)=O Amb18642790 [1,0,0,0,0,0|1,0,0]=2 563 B8R0.7 OCCNCCC(=O)O Amb1110010 [1,0,0,0,0,0|2,0,1]=4 564 B8R0.7 OC\C=C\C=C\C(O)=O Amb18642572 [1,0,0,0,0,0|1,0,2]=4 565 B8R0.7 OP(=O)OCCCCBr Amb25322865 [1,0,0,0,0,0|3,0,0]=4 566 B8R0.7 [O-]C(=O)CCCCCO Amb22491268 [1,0,0,0,0,0|1,0,2]=4 567 B10R0.3 CCCC(C)C=C=CC(O)=O Amb25385234 [0,1,0,0,0,0|0,0,2]=3 568 B10R0.3 CCCC(C)CCCC(O)=O Amb20669051 [0,1,0,0,0,0|0,0,2]=3 569 B10R0.3 CCCC(C)CCOC(C)=O Amb24087389 [0,1,0,0,0,0|2,0,1]=4 570 B10R0.3 CCCC(C)N\C=C\C(O)=O Amb25381556 [0,1,0,0,0,0|1,0,0]=2 571 B10R0.3 CCCC(CCOC(=O)C)S Amb10071332 [0,1,0,0,0,0|2,0,1]=4 572 B10R0.3 CCCC(O)CC#CC(O)=O Amb25681661 [0,1,0,0,0,0|0,0,2]=3 573 B10R0.3 CCNC(=O)N\C=C\C(O)=O Amb22960482 [0,1,0,0,0,0|2,0,1]=4 574 B10R0.3 CCOC(=O)N\C=C\C(O)=O Amb24602365 [0,1,0,0,0,0|2,0,1]=4 575 B10R0.3 CCSC(C)CC=CC(C)=O Amb24063197 [0,1,0,0,0,0|2,0,0]=3 576 B10R0.3 COCC(C)N\C=C\C(O)=O Amb25381543 [0,1,0,0,0,0|2,0,0]=3 577 B10R0.4 C#CCCCCC#CC(O)=O Amb24487919 [0,1,0,0,0,0|0,0,3]=4 578 B10R0.4 C#CCC\C=C\C=C\C(O)=O Amb25382139 [0,1,0,0,0,0|0,0,3]=4 579 B10R0.4 C=CCCCCC#CC(O)=O Amb25384882 [0,1,0,0,0,0|0,0,3]=4 580 B10R0.4 CC#CCNC\C=C\C(O)=O Amb25381520 [0,1,0,0,0,0|0,0,2]=3 581 B10R0.4 CC(=O)C=C=CCCCC#C Amb24766919 [0,1,0,0,0,0|1,0,2]=4 582 B10R0.4 CC(=O)NCCCCCCO Amb24113372 [0,1,0,0,0,0|2,0,1]=4 583 B10R0.4 CC(=O)N\C=C\CCCCO Amb25385775 [0,1,0,0,0,0|2,0,0]=3 584 B10R0.4 CC(=O)OCCCCCCBr Amb24063174 [0,1,0,0,0,0|2,0,1]=4 585 B10R0.4 CCCCC#C\C=C/C(N)=O Amb24726172 [0,1,0,0,0,0|1,0,1]=3 586 B10R0.4 CCCCC#C\C=C\C(C)=O Amb25712227 [0,1,0,0,0,0|1,0,1]=3 587 B10R0.4 CCCCC#C\C=C\[C@H](C)O Amb25722252 [0,1,0,0,0,0|1,0,2]=4 588 B10R0.4 CCCCCC#CCC(O)=O Amb25384153 [0,1,0,0,0,0|0,0,2]=3 589 B10R0.4 CCCCCCCCC([O-])=O Amb22729912 [0,1,0,0,0,0|0,0,3]=4 590 B10R0.4 CCCCCCCC[Sn](O)=O Amb22729697 [0,1,0,0,0,0|1,0,2]=4 591 B10R0.4 CCCCCCCNC(N)=O Amb17939018 [0,1,0,0,0,0|1,0,2]=4 592 B10R0.4 CCCCCCCOC(=O)Cl Amb19886548 [0,1,0,0,0,0|1,0,2]=4 593 B10R0.4 CCCCCC\C=C\B(O)O Amb2456043 [0,1,0,0,0,0|1,0,1]=3 594 B10R0.4 CCCCCC\C=C\C(C)=C Amb22546604 [0,1,0,0,0,0|2,0,0]=3 595 B10R0.4 CCCCCC\C=C\C(C)=O Amb22052629 [0,1,0,0,0,0|1,0,0]=2 596 B10R0.4 CCCCCC\C=C\C(C)O Amb22641689 [0,1,0,0,0,0|1,0,1]=3 597 B10R0.4 CCCCC\C=C/NC(C)=O Amb24766540 [0,1,0,0,0,0|1,0,0]=2 598 B10R0.4 CCCCC\C=C\C=C(C)C Amb22546758 [0,1,0,0,0,0|2,0,0]=3 599 B10R0.4 CCCCC\C=C\CC(=O)O Amb17593915 [0,1,0,0,0,0|0,0,0]=1 600 B10R0.4 CCCC\C=C/C#CC(C)=O Amb25271006 [0,1,0,0,0,0|1,0,2]=4 601 B10R0.4 CCCC\C=C\COC(C)=O Amb22730256 [0,1,0,0,0,0|1,0,2]=4 602 B10R0.4 CCCNCCCOC(C)=O Amb18924647 [0,1,0,0,0,0|2,0,1]=4 603 B10R0.4 CCOCCCC#CC(O)=O Amb25384938 [0,1,0,0,0,0|0,0,2]=3 604 B10R0.4 CCOCCCCCC(O)=O Amb22234334 [0,1,0,0,0,0|0,0,2]=3 605 B10R0.4 CNCCOCCCC(O)=O Amb18106300 [0,1,0,0,0,0|1,0,2]=4 606 B10R0.4 COCC#C\C=C\CC(O)=O Amb24390292 [0,1,0,0,0,0|1,0,2]=4 607 B10R0.4 COCCCOCCC(O)=O Amb18180046 [0,1,0,0,0,0|1,0,2]=4 608 B10R0.4 C\C=C\CC\C=C/NC(C)=O Amb25231260 [0,1,0,0,0,0|1,0,2]=4 609 B10R0.4 C\C=C\CC\C=C\NC(C)=O Amb25260428 [0,1,0,0,0,0|1,0,2]=4 610 B10R0.4 NCCCCCCCC(=O)O Amb1994908 [0,1,0,0,0,0|0,0,2]=3 611 B10R0.4 NCCCCCCCC(O)=O Amb19929586 [0,1,0,0,0,0|0,0,2]=3 612 B10R0.4 NCCCCCCNC(O)=O Amb22494605 [0,1,0,0,0,0|1,0,1]=3 613 B10R0.4 NCCCOCCCC(O)=O Amb18111568 [0,1,0,0,0,0|1,0,2]=4 614 B10R0.4 NCCCSCCCC(=O)O Amb17500719 [0,1,0,0,0,0|1,0,2]=4 615 B10R0.4 NCCOCCOCC(=O)O Amb10602483 [0,1,0,0,0,0|2,0,1]=4 616 B10R0.4 NCCOCCOCC(=O)O Amb16232535 [0,1,0,0,0,0|2,0,1]=4 617 B10R0.4 OC(=O)C#CCCCCCCl Amb25386237 [0,1,0,0,0,0|0,0,2]=3 618 B10R0.4 OC(=O)CCCCCCCS Amb22353760 [0,1,0,0,0,0|0,0,2]=3 619 B10R0.4 OCCCSCCCC(=O)O Amb17502860 [0,1,0,0,0,0|1,0,2]=4 620 B10R0.4 OCCOCCOCC(O)=O Amb24057830 [0,1,0,0,0,0|2,0,1]=4 621 B10R0.4 [O-]C(=O)CCCCCCCBr Amb22015198 [0,1,0,0,0,0|0,0,3]=4 622 B10R0.6 CC(=O)NC(=N)CCCOC Amb25382809 [0,1,0,0,0,0|3,0,0]=4 623 B10R0.6 CC(=O)NC(=O)CCCCBr Amb25383772 [0,1,0,0,0,0|3,0,0]=4 624 B10R0.6 CC(=O)NC(=O)CCCCC Amb25383542 [0,1,0,0,0,0|2,0,0]=3 625 B10R0.6 CC(=O)NC(=S)OCCCC Amb25384459 [0,1,0,0,0,0|3,0,0]=4 626 B10R0.6 CC(=O)\C=C(/O)\C=C\CCC Amb24766878 [0,1,0,0,0,0|1,0,2]=4 627 B10R0.6 CC(=O)\C=C(/O)\CCC#CC Amb25778979 [0,1,0,0,0,0|1,0,2]=4 628 B10R0.6 CC(C)=CC(=O)NCCCC Amb24765113 [0,1,0,0,0,0|3,0,0]=4 629 B10R0.6 CC(CCCC#C)=CC(O)=O Amb25384983 [0,1,0,0,0,0|0,0,2]=3 630 B10R0.6 CC(CNCC#C)=CC(O)=O Amb25381553 [0,1,0,0,0,0|1,0,2]=4 631 B10R0.6 CC(O)=CC(=O)CCCC#C Amb24765434 [0,1,0,0,0,0|1,0,2]=4 632 B10R0.6 CCCC#CC(=C)CC(O)=O Amb24740674 [0,1,0,0,0,0|0,0,3]=4 633 B10R0.6 CCCCCC(=O)CC(=O)C Amb10807435 [0,1,0,0,0,0|1,0,1]=3 634 B10R0.6 CCCCCC(=O)NC(N)=N Amb25386165 [0,1,0,0,0,0|3,0,0]=4 635 B10R0.6 CCCCCC(=O)NC(N)=O Amb24755476 [0,1,0,0,0,0|2,0,0]=3 636 B10R0.6 CCCCCC(C)CC(O)=O Amb19375410 [0,1,0,0,0,0|0,0,2]=3 637 B10R0.6 CCCCCC(C)NC(C)=O Amb17798194 [0,1,0,0,0,0|2,0,1]=4 638 B10R0.6 CCCCCC(N)CC(O)=O Amb21857987 [0,1,0,0,0,0|0,0,2]=3 639 B10R0.6 CCCCCC(O)CC(O)=O Amb18797787 [0,1,0,0,0,0|0,0,2]=3 640 B10R0.6 CCCCNC(C)=CC(C)=O Amb25386412 [0,1,0,0,0,0|2,0,0]=3 641 B10R0.6 CCCCN\C(\C)=C/C(C)=O Amb25386154 [0,1,0,0,0,0|2,0,0]=3 642 B10R0.6 CCCCOC(=O)CC(=O)C Amb2412117 [0,1,0,0,0,0|2,0,1]=4 643 B10R0.6 C\C(=C/C(C)=O)\NCCOC Amb24765309 [0,1,0,0,0,0|3,0,0]=4 644 B10R0.6 C\C(=C\C(C)=O)\NCCCO Amb24766506 [0,1,0,0,0,0|3,0,0]=4 645 B10R0.6 C\C(\CC\C=C\C)=C/C(O)=O Amb18644659 [0,1,0,0,0,0|0,0,2]=3 646 B10R0.6 C\C(\O)=C\C(=O)CCCC#C Amb24766615 [0,1,0,0,0,0|1,0,2]=4 647 B10R0.6 NCCCC[C@@H](N)CC(O)=O Amb22746256 [0,1,0,0,0,0|1,0,2]=4 648 B10R0.6 NCCCC[C@H](N)CC(O)=O Amb22369388 [0,1,0,0,0,0|1,0,2]=4 649 B10R0.6 [2H]\C(\CCCCC)=C/C(C)C Amb22546752 [0,1,0,0,0,0|2,0,1]=4 650 B10R0.22 CCCCCC=CC(F)(F)F Amb24055957 [0,1,0,0,0,0|2,0,1]=4 651 B10R0.22 CCCCCCCS(O)(=O)=O Amb22266617 [0,1,0,0,0,0|1,0,2]=4 652 B10R0.22 CCCCC\C=C\C(C)(C)C Amb22546599 [0,1,0,0,0,0|2,0,1]=4 653 B10R0.55 CCC(C)CCCCC(O)=O Amb24271145 [0,1,0,0,0,0|0,0,2]=3 654 B10R0.55 CCC(CCCCC(=O)C)C Amb17619474 [0,1,0,0,0,0|1,0,2]=4 655 B10R0.55 CC[C@H](C)\C=C\C=C\C(O)=O Amb25386304 [0,1,0,0,0,0|0,0,2]=3 656 B10R0.55 CNC(=O)CN\C=C\C(O)=O Amb25715609 [0,1,0,0,0,0|2,0,1]=4 657 B10R0.55 CNC(=O)CS\C=C\C(O)=O Amb25382402 [0,1,0,0,0,0|2,0,1]=4 658 B10R0.55 CNC(=O)NC\C=C\C(O)=O Amb25209406 [0,1,0,0,0,0|2,0,1]=4 659 B10R0.55 COC(=O)CN\C=C\C(O)=O Amb25381551 [0,1,0,0,0,0|2,0,1]=4 660 B10R0.55 COC(C)CN\C=C\C(O)=O Amb25381523 [0,1,0,0,0,0|2,0,0]=3 661 B10R0.55 COC(C)\C=C\C=CC(O)=O Amb24762987 [0,1,0,0,0,0|1,0,2]=4 662 B10R0.55 CSC(C)CN\C=C\C(O)=O Amb25381529 [0,1,0,0,0,0|2,0,0]=3 663 B10R0.55 C\C(\CC\C=C\C(O)=O)=C\Cl Amb25384840 [0,1,0,0,0,0|1,0,2]=4 664 B10R0.55 OC(=O)CCCCC(F)CBr Amb22547639 [0,1,0,0,0,0|1,0,2]=4 665 B10R0.55 OCC(O)CN\C=C\C(O)=O Amb25381516 [0,1,0,0,0,0|2,0,0]=3 666 B10R0.74 BrCCCCCCC(=O)OC Amb10604007 [0,1,0,0,0,0|1,0,2]=4 667 B10R0.74 CCCCCC#CC(=O)C=C Amb17593739 [0,1,0,0,0,0|1,0,2]=4 668 B10R0.74 CCCCCC#CC(=O)CF Amb25383110 [0,1,0,0,0,0|1,0,2]=4 669 B10R0.74 CCCCCC#CC(=O)NN Amb24391165 [0,1,0,0,0,0|1,0,2]=4 670 B10R0.74 CCCCCC=CC(=O)OC Amb24066773 [0,1,0,0,0,0|0,0,0]=1 671 B10R0.74 CCCCCCCC(=O)C#C Amb10562240 [0,1,0,0,0,0|1,0,2]=4 672 B10R0.74 CCCCCCCC(=O)C=C Amb10562277 [0,1,0,0,0,0|1,0,2]=4 673 B10R0.74 CCCCCCCC(=O)N[O-] Amb22346792 [0,1,0,0,0,0|0,0,3]=4 674 B10R0.74 CCCCCCCC(=O)N[O-] Amb22731855 [0,1,0,0,0,0|0,0,3]=4 675 B10R0.74 CCCCCCCC(=O)SC Amb22366709 [0,1,0,0,0,0|0,1,2]=4 676 B10R0.74 CCCCCCNC(=O)CBr Amb17331633 [0,1,0,0,0,0|2,0,1]=4 677 B10R0.74 CCCCCCNC(=O)OC Amb17859513 [0,1,0,0,0,0|1,0,1]=3 678 B10R0.74 CCCCCCOC(=O)C=O Amb17614962 [0,1,0,0,0,0|1,0,2]=4 679 B10R0.74 CCCCCCOC(=O)CC Amb22168098 [0,1,0,0,0,0|2,0,1]=4 680 B10R0.74 CCCCCC\C=C(\I)/CC Amb22641682 [0,1,0,0,0,0|2,0,1]=4 681 B10R0.74 CCCCCOCC(=O)NN Amb19960391 [0,1,0,0,0,0|2,0,1]=4 682 B10R0.74 CCCCC\C=C/C(C)C=C Amb22546637 [0,1,0,0,0,0|2,0,1]=4 683 B10R0.74 CCCC\C=C\NC(=O)CCl Amb25384877 [0,1,0,0,0,0|2,0,1]=4 684 B10R0.74 CNC(=O)NCCCCCC Amb22347740 [0,1,0,0,0,0|2,0,1]=4 685 B10R0.74 COC(=O)C#CCCCCO Amb24750368 [0,1,0,0,0,0|1,0,2]=4 686 B10R0.74 OCCCCCCC(=O)OC Amb13887312 [0,1,0,0,0,0|1,0,2]=4 687 B10R0.75 BrCCCCCC(=O)C(=O)O Amb10072070 [0,1,0,0,0,0|1,0,1]=3 688 B10R0.75 CC(=C)C(=O)OCCCCC Amb17933948 [0,1,0,0,0,0|3,0,0]=4 689 B10R0.75 CC(=CCCCC#C)C(C)=O Amb24766517 [0,1,0,0,0,0|1,0,2]=4 690 B10R0.75 CC(=CCNCC#C)C(O)=O Amb25381552 [0,1,0,0,0,0|1,0,2]=4 691 B10R0.75 CC(C(=O)O)SCCCCN Amb17500920 [0,1,0,0,0,0|2,0,1]=4 692 B10R0.75 CCCCC#CC(C)C(O)=O Amb24484963 [0,1,0,0,0,0|0,0,3]=4 693 B10R0.75 CCCCC#CC(O)C(O)=O Amb24538170 [0,1,0,0,0,0|0,0,3]=4 694 B10R0.75 CCCCCCC(=O)C(O)=O Amb22228909 [0,1,0,0,0,0|0,0,1]=2 695 B10R0.75 CCCCCCC(Br)C(=O)Br Amb24061160 [0,1,0,0,0,0|1,0,2]=4 696 B10R0.75 CCCCCCC(C(=O)O)C Amb10843971 [0,1,0,0,0,0|0,0,2]=3 697 B10R0.75 CCCCCCC(F)=C(F)F Amb19883953 [0,1,0,0,0,0|2,0,1]=4 698 B10R0.75 CCCCCC[C@H](C(=O)O)N Amb16183913 [0,1,0,0,0,0|0,0,2]=3 699 B10R0.75 CCCCCOC(=O)C(C)O Amb22230235 [0,1,0,0,0,0|2,0,1]=4 700 B10R0.75 CCCCN\C=C(\C)/C(C)=O Amb25385047 [0,1,0,0,0,0|2,0,0]=3 701 B10R0.75 C\C(=C/C=C/CCC)\C(O)=O Amb25384965 [0,1,0,0,0,0|0,0,2]=3 702 B10R0.75 C\C(=C\CCC#CC)\C(O)=O Amb25295507 [0,1,0,0,0,0|0,0,2]=3 703 B10R0.75 N#CCCCNC(=O)C(O)=O Amb25382629 [0,1,0,0,0,0|2,0,1]=4 704 B10R0.75 NCCCCNC(=O)C(O)=O Amb24068933 [0,1,0,0,0,0|2,0,0]=3 705 B10R0.78 CC(CCC#C)\C=C\C(C)=O Amb24766518 [0,1,0,0,0,0|1,0,2]=4 706 B10R0.78 CCCCC(O)C#CC(O)=O Amb24650964 [0,1,0,0,0,0|0,0,2]=3 707 B10R0.78 CCCCC(O)CCC(O)=O Amb17689111 [0,1,0,0,0,0|0,0,2]=3 708 B10R0.78 CCCCS(=O)CCC(=O)O Amb10669585 [0,1,0,0,0,0|1,0,2]=4 709 B10R0.78 CCCNC(=O)\C=C/C(=O)O Amb1235088 [0,1,0,0,0,0|1,0,1]=3 710 B10R0.78 CCC\C=C(/F)\C=CC(O)=O Amb25385176 [0,1,0,0,0,0|0,0,2]=3 711 B10R0.78 CCONC(=O)\C=C\C(O)=O Amb24763047 [0,1,0,0,0,0|2,0,1]=4 712 B10R0.78 CN(CCC#N)\C=C\C(O)=O Amb24755176 [0,1,0,0,0,0|2,0,1]=4 713 B10R0.78 NCCNC(=O)\C=C\C(O)=O Amb19006241 [0,1,0,0,0,0|2,0,1]=4 714 B10R0.78 OC(=O)\C=C\C(=O)NCCF Amb25381863 [0,1,0,0,0,0|2,0,1]=4 715 B10R0.78 OC(=O)\C=C\C(=O)NCCO Amb25382193 [0,1,0,0,0,0|2,0,1]=4 716 B10R0.78 OCCNC(=O)\C=C/C(=O)O Amb17131337 [0,1,0,0,0,0|2,0,1]=4 717 B10R0.97 CC(=C)CCN\C=C\C(O)=O Amb24767269 [0,1,0,0,0,0|1,0,1]=3 718 B10R0.97 CC(=C)CON\C=C\C(O)=O Amb24764355 [0,1,0,0,0,0|2,0,1]=4 719 B10R0.97 CC(C)=CCC\C=C\C(C)=O Amb24765274 [0,1,0,0,0,0|1,0,2]=4 720 B10R0.97 CC(C)=CCC\C=C\C(O)=O Amb18125771 [0,1,0,0,0,0|0,0,2]=3 721 B10R0.97 CC(C)=CCO\C=C\C(O)=O Amb18644791 [0,1,0,0,0,0|1,0,2]=4 722 B10R0.97 CC(C)CCCC#CC(O)=O Amb24711246 [0,1,0,0,0,0|0,0,2]=3 723 B10R0.97 CC(C)CCN\C=C\C(O)=O Amb25381532 [0,1,0,0,0,0|1,0,0]=2 724 B10R0.97 CC(C)C\C=C\C=CC(O)=O Amb25379757 [0,1,0,0,0,0|0,0,2]=3 725 B10R0.97 CC(C)O\C=C\C=C/C(O)=O Amb25385224 [0,1,0,0,0,0|1,0,2]=4 726 B10R0.97 CC(CCCCCC(=O)O)C Amb16232096 [0,1,0,0,0,0|0,0,2]=3 727 B10R0.97 CC(CCNCCC(=O)O)C Amb1110986 [0,1,0,0,0,0|1,0,2]=4 728 B10R0.97 CC(O)CCCCCC(O)=O Amb24117232 [0,1,0,0,0,0|0,0,2]=3 729 B10R0.97 CN(C)CCCOCC(O)=O Amb24069053 [0,1,0,0,0,0|2,0,1]=4 730 B10R0.97 CN(C)CCN\C=C\C(O)=O Amb25381533 [0,1,0,0,0,0|2,0,0]=3 731 B10R0.97 NC(=O)CCN\C=C\C(O)=O Amb25381541 [0,1,0,0,0,0|2,0,1]=4 732 B10R1.10 C=CCC1CC=CC(=O)C1 Amb25086253 [0,0,0,1,0,0|1,0,2]=4 733 B10R1.10 CC1C=CCC(CCC)N1 Amb24651511 [0,0,0,1,0,0|2,0,1]=4 734 B10R1.10 CCCC1=CC(=O)C=CO1 Amb25262571 [0,0,0,1,0,0|2,0,1]=4 735 B10R1.10 CCCC1C=CCC(=O)N1 Amb25799491 [0,0,0,1,0,0|1,0,2]=4 736 B10R1.10 CCCC1CC(=O)C=CO1 Amb25297506 [0,0,0,1,0,0|2,0,0]=3 737 B10R1.10 CCCC1CC(=O)CCC1 Amb22754799 [0,0,0,1,0,0|1,0,2]=4 738 B10R1.10 CCCC1CC=CC(=O)C1 Amb25723335 [0,0,0,1,0,0|1,0,0]=2 739 B10R1.10 CCCC1CC=CC(=O)O1 Amb24099235 [0,0,0,1,0,0|0,0,0]=1 740 B10R1.10 CCCC1CCCC(=O)O1 Amb10807378 [0,0,0,1,0,0|0,0,2]=3 741 B10R1.10 CCC[C@@H]1CC=CC(=O)N1 Amb24374720 [0,0,0,1,0,0|1,0,0]=2 742 B10R1.10 CCC[C@H]1CC(=O)C=CO1 Amb25086215 [0,0,0,1,0,0|2,0,0]=3 743 B10R1.10 CCC[C@H]1CC(=O)CCC1 Amb25145507 [0,0,0,1,0,0|1,0,2]=4 744 B10R1.10 CCC[n+]1cc(O)ccc1 Amb25134204 [0,0,0,1,0,0|2,0,1]=4 745 B10R1.10 CCCc1cc(O)ccn1 Amb10599775 [0,0,0,1,0,0|2,0,1]=4 746 B10R1.10 CCCc1cccc(n1)O Amb10600153 [0,0,0,1,0,0|1,0,2]=4 747 B10R1.10 CCCc1nccc(n1)O Amb10599370 [0,0,0,1,0,0|2,0,1]=4 748 B10R1.10 CNCC1CC=CC(=O)C1 Amb24746680 [0,0,0,1,0,0|2,0,0]=3 749 B10R1.10 C[C@H]1C=CC[C@@H](CCC)N1 Amb24618177 [0,0,0,1,0,0|2,0,1]=4 750 B10R1.10 C\C=C\C1CC=CC(=O)N1 Amb24478289 [0,0,0,1,0,0|1,0,2]=4 751 B10R1.10 C\C=C\[C@@H]1CC=CC(=O)N1 Amb25858274 [0,0,0,1,0,0|1,0,2]=4 752 B10R1.10 OCCC1CC=CC(=O)O1 Amb24405460 [0,0,0,1,0,0|1,0,0]=2 753 B10R1.10 OCCC1CCCC(=O)O1 Amb25317310 [0,0,0,1,0,0|1,0,2]=4 754 B10R1.10 OCC[C@@H]1CC=CC(=O)O1 Amb25787204 [0,0,0,1,0,0|1,0,0]=2 755 B10R1.10 OCC[C@H]1CC=CC(=O)C1 Amb25263656 [0,0,0,1,0,0|2,0,0]=3 756 B10R1.10 OCC[C@H]1CC=CC(=O)O1 Amb25204964 [0,0,0,1,0,0|1,0,0]=2 757 B10R1.16 Brc1ccc(CCCBr)o1 Amb25234702 [0,0,0,1,0,0|2,0,1]=4 758 B10R1.16 C=CCCC1CC(=O)C=C1 Amb24721642 [0,0,0,1,0,0|1,0,2]=4 759 B10R1.16 CCCCC1=CCC(=O)O1 Amb25213288 [0,0,0,1,0,0|0,0,2]=3 760 B10R1.16 CCCCC1=CNC(=O)N1 Amb25112032 [0,0,0,1,0,0|2,0,1]=4 761 B10R1.16 CCCCC1=CNC(=O)O1 Amb25224041 [0,0,0,1,0,0|1,0,1]=3 762 B10R1.16 CCCCC1=NCC(=O)O1 Amb25253303 [0,0,0,1,0,0|1,0,2]=4 763 B10R1.16 CCCCC1=NNC(=O)O1 Amb25318131 [0,0,0,1,0,0|2,0,1]=4 764 B10R1.16 CCCCC1CC(=O)C=C1 Amb25714388 [0,0,0,1,0,0|1,0,0]=2 765 B10R1.16 CCCCC1CC(=O)CC1 Amb25778036 [0,0,0,1,0,0|1,0,2]=4 766 B10R1.16 CCCCC1CC(O)C=C1 Amb25852931 [0,0,0,1,0,0|1,0,1]=3 767 B10R1.16 CCCCC1CCC(=O)N1 Amb17940085 [0,0,0,1,0,0|1,0,2]=4 768 B10R1.16 CCCCC1CNC(=O)S1 Amb25695530 [0,0,0,1,0,0|1,1,1]=4 769 B10R1.16 CCCCC1COC(=O)C1 Amb25212009 [0,0,0,1,0,0|2,0,1]=4 770 B10R1.16 CCCCC1COC(=O)N1 Amb24482077 [0,0,0,1,0,0|2,0,1]=4 771 B10R1.16 CCCC[C@@H]1CC(=O)CC1 Amb24614759 [0,0,0,1,0,0|1,0,2]=4 772 B10R1.16 CCCC[C@@H]1COC(=O)N1 Amb22225366 [0,0,0,1,0,0|2,0,1]=4 773 B10R1.16 CCCC[C@@H]1C[C@@H](O)C=C1 Amb25285616 [0,0,0,1,0,0|1,0,1]=3 774 B10R1.16 CCCC[C@H]1CC(=O)CC1 Amb24380749 [0,0,0,1,0,0|1,0,2]=4 775 B10R1.16 CCCC[C@H]1CNC(=O)C1 Amb24384050 [0,0,0,1,0,0|2,0,1]=4 776 B10R1.16 CCCC[C@H]1COC(=O)N1 Amb22226709 [0,0,0,1,0,0|2,0,1]=4 777 B10R1.16 CCCC[C@H]1C[C@H](O)C=C1 Amb24598813 [0,0,0,1,0,0|1,0,1]=3 778 B10R1.16 CCCC[n]1cc(O)c[n]1 Amb24696313 [0,0,0,1,0,0|3,0,0]=4 779 B10R1.16 CCCCc1ccc(I)o1 Amb25127159 [0,0,0,1,0,0|1,0,1]=3 780 B10R1.16 CCCCc1ccc(s1)C Amb10807431 [0,0,0,1,0,0|1,1,1]=4 781 B10R1.16 CCCCc1nc(c[nH]1)O Amb17610365 [0,0,0,1,0,0|2,0,1]=4 782 B10R1.16 CCCOC1C=CC(=O)N1 Amb24699802 [0,0,0,1,0,0|2,0,0]=3 783 B10R1.16 CCCSc1ccc(s1)O Amb17201955 [0,0,0,1,0,0|1,1,1]=4 784 B10R1.16 CCNCc1ccc(Cl)o1 Amb18288966 [0,0,0,1,0,0|2,0,1]=4 785 B10R1.16 CCNCc1ccc(N)o1 Amb18625539 [0,0,0,1,0,0|2,0,1]=4 786 B10R1.16 CCOCc1ccc(Br)o1 Amb24466863 [0,0,0,1,0,0|2,0,1]=4 787 B10R1.16 COCOC1CC(=O)C=C1 Amb24706817 [0,0,0,1,0,0|3,0,0]=4 788 B10R1.16 Cc1ccc(CCCC)[nH]1 Amb25278176 [0,0,0,1,0,0|2,0,1]=4 789 B10R1.16 Cc1ccc(CCNC)o1 Amb25130668 [0,0,0,1,0,0|2,0,1]=4 790 B10R1.16 Cc1ccc(CNCC)o1 Amb21959933 [0,0,0,1,0,0|2,0,1]=4 791 B10R1.16 Cc1ccc(COCC)o1 Amb24579114 [0,0,0,1,0,0|2,0,1]=4 792 B10R1.16 Cc1ccc(o1)CCCCl Amb17477784 [0,0,0,1,0,0|2,0,1]=4 793 B10R1.16 Cc1ccc(o1)CCCN Amb17477776 [0,0,0,1,0,0|2,0,1]=4 794 B10R1.16 Cc1ccc(o1)CCCO Amb17477780 [0,0,0,1,0,0|2,0,1]=4 795 B10R1.16 Cc1ccc(o1)SCCC Amb24616069 [0,0,0,1,0,0|2,0,1]=4 796 B10R1.16 N#CCCC1C=CC(=O)O1 Amb25072829 [0,0,0,1,0,0|1,0,1]=3 797 B10R1.16 NCCCC1COC(=O)O1 Amb25124005 [0,0,0,1,0,0|2,0,1]=4 798 B10R1.16 NCCCc1ccc(Cl)o1 Amb24744527 [0,0,0,1,0,0|2,0,1]=4 799 B10R1.16 NCCCc1ccc(I)o1 Amb25706348 [0,0,0,1,0,0|2,0,1]=4 800 B10R1.16 O=C1C=CC(CCCCl)O1 Amb24502164 [0,0,0,1,0,0|1,0,0]=2 801 B10R1.16 O=C1CCC(CCCCl)O1 Amb25709565 [0,0,0,1,0,0|1,0,2]=4 802 B10R1.16 OCCCC1C=CC(=O)O1 Amb25027983 [0,0,0,1,0,0|1,0,0]=2 803 B10R1.16 OCCC[C@@H]1CCC(=O)O1 Amb24352318 [0,0,0,1,0,0|1,0,2]=4 804 B10R1.16 OCCCc1ccc(Br)o1 Amb25800149 [0,0,0,1,0,0|2,0,1]=4 805 B10R1.16 OC\C=C\C1C=CC(=O)O1 Amb24475086 [0,0,0,1,0,0|1,0,2]=4 806 B10R1.18 C=C(Cl)C=C1CCCCC1 Amb25697580 [0,0,0,1,0,0|2,0,0]=3 807 B10R1.18 CC(=O)C=C1NCCCN1 Amb24551071 [0,0,0,1,0,0|3,0,0]=4 808 B10R1.18 CC(=O)C=C1SCCCS1 Amb25146584 [0,0,0,1,0,0|3,0,0]=4 809 B10R1.18 CC(=O)C[NH+]1CCCCC1 Amb16224768 [0,0,0,1,0,0|2,0,1]=4 810 B10R1.18 CC(=O)N=C1CCCCN1 Amb24479034 [0,0,0,1,0,0|3,0,0]=4 811 B10R1.18 CC(=O)NC1CCCCC1 Amb2237063 [0,0,0,1,0,0|2,0,1]=4 812 B10R1.18 CC(=O)NN1CCCCC1 Amb2125333 [0,0,0,1,0,0|3,0,0]=4 813 B10R1.18 CC(=O)ON1CCCCC1 Amb24634649 [0,0,0,1,0,0|3,0,0]=4 814 B10R1.18 CC(=O)\C=C/1\CCCCN1 Amb24591348 [0,0,0,1,0,0|2,0,0]=3 815 B10R1.18 CC(=O)\C=C/1\CCCOC1 Amb24479503 [0,0,0,1,0,0|2,0,0]=3 816 B10R1.18 CC(=O)\C=C/1\CCCSC1 Amb25106062 [0,0,0,1,0,0|2,0,0]=3 817 B10R1.18 CC(C)=CC=1CCCCN1 Amb24523147 [0,0,0,1,0,0|3,0,0]=4 818 B10R1.18 CC(I)=CC1CCCCC1 Amb25274381 [0,0,0,1,0,0|2,0,1]=4 819 B10R1.18 CC(O)C=C1CCOCC1 Amb24479535 [0,0,0,1,0,0|2,0,1]=4 820 B10R1.18 CC(O)C=C1CCSCC1 Amb24479533 [0,0,0,1,0,0|2,0,1]=4 821 B10R1.18 CC(O)\C=C\1/COCCC1 Amb24440244 [0,0,0,1,0,0|2,0,1]=4 822 B10R1.18 C[C@@H](O)C=C1CCCCC1 Amb25317545 [0,0,0,1,0,0|1,0,1]=3 823 B10R1.18 C\C(\Br)=C\C1CCCCC1 Amb25770669 [0,0,0,1,0,0|2,0,1]=4 824 B10R1.18 ClC(=O)CN1CCCCC1 Amb17142898 [0,0,0,1,0,0|2,0,1]=4 825 B10R1.18 ClC(Br)=CC1CCCCC1 Amb25242596 [0,0,0,1,0,0|2,0,1]=4 826 B10R1.18 ClC(I)=CC1CCCCC1 Amb24693371 [0,0,0,1,0,0|2,0,1]=4 827 B10R1.18 Cl\C(\Br)=C\C1CCCCC1 Amb25294600 [0,0,0,1,0,0|2,0,1]=4 828 B10R1.18 Cl\C(\I)=C\C1CCCCC1 Amb24428160 [0,0,0,1,0,0|2,0,1]=4 829 B10R1.18 NC(=O)C=C1CCCCC1 Amb24725376 [0,0,0,1,0,0|1,0,0]=2 830 B10R1.18 NC(=O)C=C1SCCCS1 Amb25732971 [0,0,0,1,0,0|3,0,0]=4 831 B10R1.18 NC(=O)CC1CCCCC1 Amb22491829 [0,0,0,1,0,0|1,0,2]=4 832 B10R1.18 NC(=O)CN1CCCCC1 Amb17142861 [0,0,0,1,0,0|2,0,1]=4 833 B10R1.18 NC(=O)N=C1CCCCC1 Amb25757393 [0,0,0,1,0,0|2,0,0]=3 834 B10R1.18 NC(=O)NC1CCCCC1 Amb1151266 [0,0,0,1,0,0|2,0,1]=4 835 B10R1.18 NC(=O)NN1CCCCC1 Amb24505015 [0,0,0,1,0,0|3,0,0]=4 836 B10R1.18 NC(=O)OC=1CCCCC1 Amb25104683 [0,0,0,1,0,0|2,0,1]=4 837 B10R1.18 NC(=O)PC1CCCCC1 Amb24468800 [0,0,0,1,0,0|2,0,1]=4 838 B10R1.18 NC(=O)\C=C/1\COCCN1 Amb25376698 [0,0,0,1,0,0|3,0,0]=4 839 B10R1.18 O=C(F)OC1CCCCC1 Amb25286982 [0,0,0,1,0,0|2,0,1]=4 840 B10R1.18 OB(O)C=C1CCCCC1 Amb24379854 [0,0,0,1,0,0|1,0,1]=3 841 B10R1.18 OC(=O)C=C1CCCCC1 Amb2429191 [0,0,0,1,0,0|0,0,0]=1 842 B10R1.18 OC(=O)C=C1CCNCC1 Amb18560139 [0,0,0,1,0,0|1,0,0]=2 843 B10R1.18 OC(=O)C=C1CCNCC1 Amb22755985 [0,0,0,1,0,0|1,0,0]=2 844 B10R1.18 OC(=O)C=C1NCCCN1 Amb18202633 [0,0,0,1,0,0|2,0,0]=3 845 B10R1.18 OC(=O)CC1CCCCN1 Amb10576328 [0,0,0,1,0,0|1,0,2]=4 846 B10R1.18 OC(=O)CC1CCCCN1 Amb1083025 [0,0,0,1,0,0|1,0,2]=4 847 B10R1.18 OC(=O)CC1CCCCN1 Amb22587703 [0,0,0,1,0,0|1,0,2]=4 848 B10R1.18 OC(=O)CC1CCCCO1 Amb1091980 [0,0,0,1,0,0|1,0,2]=4 849 B10R1.18 OC(=O)CC1CCCNC1 Amb13952813 [0,0,0,1,0,0|1,0,2]=4 850 B10R1.18 OC(=O)CC1CCSCC1 Amb18283322 [0,0,0,1,0,0|1,0,2]=4 851 B10R1.18 OC(=O)CC1CSCCC1 Amb18199274 [0,0,0,1,0,0|1,0,2]=4 852 B10R1.18 OC(=O)CC=1COCCC1 Amb24661667 [0,0,0,1,0,0|1,0,2]=4 853 B10R1.18 OC(=O)CN1CCCCC1 Amb1098973 [0,0,0,1,0,0|1,0,1]=3 854 B10R1.18 OC(=O)CN1CCCCC1 Amb2236243 [0,0,0,1,0,0|1,0,1]=3 855 B10R1.18 OC(=O)CN1CCNCC1 Amb22728245 [0,0,0,1,0,0|2,0,1]=4 856 B10R1.18 OC(=O)CN1CCOCC1 Amb1099394 [0,0,0,1,0,0|2,0,1]=4 857 B10R1.18 OC(=O)CN1CCOCC1 Amb17659437 [0,0,0,1,0,0|2,0,1]=4 858 B10R1.18 OC(=O)CN1CCSCC1 Amb10072976 [0,0,0,1,0,0|2,0,1]=4 859 B10R1.18 OC(=O)C[C@@H]1CCCCN1 Amb13885774 [0,0,0,1,0,0|1,0,2]=4 860 B10R1.18 OC(=O)C[C@@H]1CCCCO1 Amb24361310 [0,0,0,1,0,0|1,0,2]=4 861 B10R1.18 OC(=O)C[C@@H]1CNCCC1 Amb23401360 [0,0,0,1,0,0|1,0,2]=4 862 B10R1.18 OC(=O)C[C@H]1CCCCN1 Amb13885779 [0,0,0,1,0,0|1,0,2]=4 863 B10R1.18 OC(=O)C[NH+]1CCCCC1 Amb19914127 [0,0,0,1,0,0|1,0,1]=3 864 B10R1.18 OC(=O)NC1CCCCC1 Amb22039352 [0,0,0,1,0,0|1,0,1]=3 865 B10R1.18 OC(=O)\C=C/1\CCC=CC1 Amb24551051 [0,0,0,1,0,0|0,0,2]=3 866 B10R1.18 OC(=O)\C=C/1\CCCC=C1 Amb24502168 [0,0,0,1,0,0|0,0,2]=3 867 B10R1.18 OC(=O)\C=C/1\CCCSC1 Amb18948509 [0,0,0,1,0,0|1,0,0]=2 868 B10R1.18 OC(=O)\C=C/1\CNCCN1 Amb24700000 [0,0,0,1,0,0|2,0,0]=3 869 B10R1.18 OC(=O)\C=C/1\COCCN1 Amb18831600 [0,0,0,1,0,0|2,0,0]=3 870 B10R1.18 OC(=O)\C=C/1\CSCCN1 Amb18199861 [0,0,0,1,0,0|2,0,0]=3 871 B10R1.18 OC(=O)\C=C\1/CCC=CC1 Amb24670048 [0,0,0,1,0,0|0,0,2]=3 872 B10R1.18 OC(=S)NC1CCCCC1 Amb24477047 [0,0,0,1,0,0|1,1,1]=4 873 B10R1.18 OP(=O)CN1CCCCC1 Amb2233005 [0,0,0,1,0,0|2,0,1]=4 874 B10R1.18 [O-][N+](=O)C=C1CCOCC1 Amb25350664 [0,0,0,1,0,0|2,0,1]=4 875 B10R1.18 [O-][N+](=O)\C=C\1/CCCCN1 Amb19769995 [0,0,0,1,0,0|2,0,1]=4 876 B10R1.24 CCCCCC1CC(=O)N1 Amb25147264 [0,0,0,1,0,0|1,0,2]=4 877 B10R1.24 COCOCC=1CC(=O)C1 Amb25723336 [0,0,0,1,0,0|3,0,0]=4 878 B10R1.39 CC(=O)C1=CCOC1CC Amb24422439 [0,0,0,1,0,0|2,0,0]=3 879 B10R1.39 CC(=O)C=1CCCC1CC Amb24524647 [0,0,0,1,0,0|1,0,2]=4 880 B10R1.39 CCC1CCCC1C(C)=O Amb24744201 [0,0,0,1,0,0|1,0,2]=4 881 B10R1.39 CCC1CCCC1C(N)=O Amb25113439 [0,0,0,1,0,0|1,0,2]=4 882 B10R1.39 CCC1CCCC1C(O)=O Amb18643940 [0,0,0,1,0,0|0,0,2]=3 883 B10R1.39 CCC1CCCN1C(N)=O Amb25047741 [0,0,0,1,0,0|2,0,1]=4 884 B10R1.39 CCC1CCNC1C(O)=O Amb18644001 [0,0,0,1,0,0|1,0,1]=3 885 B10R1.39 CCC1CNCC1C(O)=O Amb18831583 [0,0,0,1,0,0|1,0,2]=4 886 B10R1.39 CCC1NCCC1C(O)=O Amb18118150 [0,0,0,1,0,0|1,0,2]=4 887 B10R1.39 CCN1CCC[C@@H]1C(O)=O Amb22587552 [0,0,0,1,0,0|1,0,2]=4 888 B10R1.39 CCN1CCC[C@@H]1C(O)=O Amb23385271 [0,0,0,1,0,0|1,0,2]=4 889 B10R1.39 CCN1CCC[C@H]1C(O)=O Amb19516987 [0,0,0,1,0,0|1,0,2]=4 890 B10R1.39 CCN1CCC[C@H]1C(O)=O Amb25751957 [0,0,0,1,0,0|1,0,2]=4 891 B10R1.39 CC[C@@H]1CCC[C@@H]1C(N)=O Amb24714537 [0,0,0,1,0,0|1,0,2]=4 892 B10R1.39 CC[C@@H]1CCC[C@@H]1C(O)=O Amb25328907 [0,0,0,1,0,0|0,0,2]=3 893 B10R1.39 CC[C@@H]1CCC[C@H]1C(C)=O Amb25264397 [0,0,0,1,0,0|1,0,2]=4 894 B10R1.39 CC[C@@H]1CCN[C@H]1C(N)=O Amb25110208 [0,0,0,1,0,0|2,0,1]=4 895 B10R1.39 CC[C@@H]1NCC[C@H]1C(O)=O Amb18202480 [0,0,0,1,0,0|1,0,2]=4 896 B10R1.39 CC[C@H]1OCC[C@H]1C(O)=O Amb24622843 [0,0,0,1,0,0|1,0,2]=4 897 B10R1.39 CC[n]1c[n]cc1C(O)=O Amb21954331 [0,0,0,1,0,0|2,0,1]=4 898 B10R1.39 CCc1[nH]ccc1C(O)=O Amb18832116 [0,0,0,1,0,0|1,0,2]=4 899 B10R1.39 CCc1[n][s]cc1C(O)=O Amb23440942 [0,0,0,1,0,0|2,0,1]=4 900 B10R1.39 CCc1[n]occ1C(O)=O Amb18202782 [0,0,0,1,0,0|2,0,1]=4 901 B10R1.39 CCc1c[nH]cc1C(O)=O Amb25316138 [0,0,0,1,0,0|1,0,2]=4 902 B10R1.39 CCc1c[s]cc1C(O)=O Amb18830769 [0,0,0,1,0,0|1,0,2]=4 903 B10R1.39 CCc1n[nH]cc1C(=O)O Amb15701274 [0,0,0,1,0,0|2,0,1]=4 904 B10R1.39 CCc1occc1C(O)=O Amb18643495 [0,0,0,1,0,0|1,0,2]=4 905 B10R1.39 CCn1nccc1C(=O)O Amb1099167 [0,0,0,1,0,0|2,0,1]=4 906 B10R1.39 CN[C@H]1CCC[C@H]1C(O)=O Amb24626122 [0,0,0,1,0,0|1,0,2]=4 907 B10R1.39 COC1CCCC1C(O)=O Amb18967397 [0,0,0,1,0,0|1,0,2]=4 908 B10R1.39 COC1CCNC1C(O)=O Amb18644194 [0,0,0,1,0,0|2,0,1]=4 909 B10R1.39 COC1CSC=C1C(N)=O Amb25337941 [0,0,0,1,0,0|3,0,0]=4 910 B10R1.39 COC=1CCCC1C(O)=O Amb25072733 [0,0,0,1,0,0|1,0,2]=4 911 B10R1.39 CO[C@@H]1CCN[C@@H]1C(O)=O Amb24120447 [0,0,0,1,0,0|2,0,1]=4 912 B10R1.39 CO[C@@H]1CCN[C@H]1C(O)=O Amb24621898 [0,0,0,1,0,0|2,0,1]=4 913 B10R1.39 CSC1CCCC1C(O)=O Amb18288540 [0,0,0,1,0,0|1,0,2]=4 914 B10R1.39 CSC1CCN[C@@H]1C(O)=O Amb24482453 [0,0,0,1,0,0|2,0,1]=4 915 B10R1.39 CSC=1CCCC1C(O)=O Amb18645091 [0,0,0,1,0,0|1,0,2]=4 916 B10R1.39 NCC1CCCC1C(O)=O Amb25283657 [0,0,0,1,0,0|1,0,2]=4 917 B10R1.39 OC(=O)C1CCCC1CBr Amb18130990 [0,0,0,1,0,0|1,0,2]=4 918 B10R1.39 OC(=O)C1CCCC1CF Amb20668095 [0,0,0,1,0,0|1,0,2]=4 919 B10R1.39 OC(=O)C=1CCCC1CO Amb18643827 [0,0,0,1,0,0|1,0,2]=4 920 B10R1.39 OCC1CCCC1C(O)=O Amb25731866 [0,0,0,1,0,0|1,0,2]=4 921 B10R1.39 OC[C@H]1CCC[C@H]1C(O)=O Amb25174802 [0,0,0,1,0,0|1,0,2]=4 922 B10R1.56 CCCC\C=C/C1=CC1=O Amb25115005 [0,0,0,1,0,0|1,0,1]=3 923 B10R1.56 CCCC\C=C\C1=CC1=O Amb25146317 [0,0,0,1,0,0|1,0,1]=3 924 B10R1.56 OCCCCCC1=CC1=O Amb24481265 [0,0,0,1,0,0|2,0,1]=4 925 B10R1.61 CC(=C)C1=CCCCC1O Amb24576450 [0,0,0,1,0,0|3,0,0]=4 926 B10R1.61 CC(=O)C1=CCCCC1C Amb24480506 [0,0,0,1,0,0|1,0,0]=2 927 B10R1.61 CC1CCC=CC1C(N)=O Amb25695953 [0,0,0,1,0,0|1,0,2]=4 928 B10R1.61 CC1CCC=CC1C(O)=O Amb25703177 [0,0,0,1,0,0|0,0,2]=3 929 B10R1.61 CC1CCCC=C1C(=O)Cl Amb25059849 [0,0,0,1,0,0|1,0,0]=2 930 B10R1.61 CC1CCCC=C1C(O)=O Amb22407010 [0,0,0,1,0,0|0,0,0]=1 931 B10R1.61 CC1CCCCC1C(=O)O Amb1923858 [0,0,0,1,0,0|0,0,2]=3 932 B10R1.61 CC1CCCCN1C(=O)Cl Amb17563085 [0,0,0,1,0,0|2,0,1]=4 933 B10R1.61 CC1CCCCN1C(=O)N Amb1126952 [0,0,0,1,0,0|2,0,1]=4 934 B10R1.61 CC1CCCNC1C(N)=O Amb18279452 [0,0,0,1,0,0|2,0,1]=4 935 B10R1.61 CC1CCCNC1C(O)=O Amb18644006 [0,0,0,1,0,0|1,0,1]=3 936 B10R1.61 CC1CCNCC1C(O)=O Amb18124644 [0,0,0,1,0,0|1,0,2]=4 937 B10R1.61 CC1CCOCC1C(O)=O Amb22229855 [0,0,0,1,0,0|1,0,2]=4 938 B10R1.61 CC1NCCCC1C(O)=O Amb18124643 [0,0,0,1,0,0|1,0,2]=4 939 B10R1.61 CC1NCCCC1C(O)=O Amb22754608 [0,0,0,1,0,0|1,0,2]=4 940 B10R1.61 CC1OC=CC=C1C(O)=O Amb24065741 [0,0,0,1,0,0|1,0,2]=4 941 B10R1.61 CC1OCCNC1C(O)=O Amb18061972 [0,0,0,1,0,0|2,0,1]=4 942 B10R1.61 CC1OCCSC1C(O)=O Amb25238954 [0,0,0,1,0,0|2,0,1]=4 943 B10R1.61 CC1SCCSC1C(O)=O Amb24563145 [0,0,0,1,0,0|2,0,1]=4 944 B10R1.61 CC=1CCCCC1C(C)=O Amb25288428 [0,0,0,1,0,0|1,0,2]=4 945 B10R1.61 CC=1CCCCC1C(N)=O Amb24427374 [0,0,0,1,0,0|1,0,2]=4 946 B10R1.61 CC=1CCCCC1C(O)=O Amb18643592 [0,0,0,1,0,0|0,0,2]=3 947 B10R1.61 CC=1SCCSC1C(O)=O Amb18647984 [0,0,0,1,0,0|2,0,1]=4 948 B10R1.61 CN1CCC=CC1C(O)=O Amb25209324 [0,0,0,1,0,0|1,0,2]=4 949 B10R1.61 CN1CCCC=C1C(O)=O Amb23585359 [0,0,0,1,0,0|1,0,0]=2 950 B10R1.61 CN1CCCCC1C(=O)O Amb1102591 [0,0,0,1,0,0|1,0,2]=4 951 B10R1.61 CN1CCCC[C@@H]1C(O)=O Amb22744921 [0,0,0,1,0,0|1,0,2]=4 952 B10R1.61 C[C@@H]1CCC=C[C@@H]1C(O)=O Amb24514913 [0,0,0,1,0,0|0,0,2]=3 953 B10R1.61 C[C@@H]1CCCCN1C(=O)Cl Amb25349193 [0,0,0,1,0,0|2,0,1]=4 954 B10R1.61 C[C@@H]1CCCC[C@@H]1C(=O)O Amb10843964 [0,0,0,1,0,0|0,0,2]=3 955 B10R1.61 C[C@@H]1CCCC[C@@H]1C(N)=O Amb24746618 [0,0,0,1,0,0|1,0,2]=4 956 B10R1.61 C[C@@H]1CCCC[C@H]1C(=O)O Amb10843965 [0,0,0,1,0,0|0,0,2]=3 957 B10R1.61 C[C@@H]1CCCN[C@@H]1C(=O)O Amb13886260 [0,0,0,1,0,0|1,0,1]=3 958 B10R1.61 C[C@@H]1CCCN[C@@H]1C(N)=O Amb24392330 [0,0,0,1,0,0|2,0,1]=4 959 B10R1.61 C[C@@H]1CNCC[C@@H]1C(O)=O Amb24550511 [0,0,0,1,0,0|1,0,2]=4 960 B10R1.61 C[C@@H]1COCC[C@H]1C(O)=O Amb24560936 [0,0,0,1,0,0|1,0,2]=4 961 B10R1.61 C[C@@H]1NCCC[C@H]1C(O)=O Amb18202482 [0,0,0,1,0,0|1,0,2]=4 962 B10R1.61 C[C@@H]1OCCN[C@H]1C(O)=O Amb22746793 [0,0,0,1,0,0|2,0,1]=4 963 B10R1.61 C[C@@H]1OCCN[C@H]1C(O)=O Amb22755786 [0,0,0,1,0,0|2,0,1]=4 964 B10R1.61 C[C@H]1CCCCN1C(=O)Cl Amb25044989 [0,0,0,1,0,0|2,0,1]=4 965 B10R1.61 C[C@H]1CCCCN1C(C)=O Amb25851555 [0,0,0,1,0,0|2,0,1]=4 966 B10R1.61 C[C@H]1CCCC[C@@H]1C(=O)O Amb10843960 [0,0,0,1,0,0|0,0,2]=3 967 B10R1.61 C[C@H]1CCCC[C@@H]1C(N)=O Amb24746221 [0,0,0,1,0,0|1,0,2]=4 968 B10R1.61 C[C@H]1CCCC[C@H]1C(=O)O Amb10843953 [0,0,0,1,0,0|0,0,2]=3 969 B10R1.61 C[C@H]1CCNC[C@@H]1C(O)=O Amb25228414 [0,0,0,1,0,0|1,0,2]=4 970 B10R1.61 C[C@H]1CNCC[C@H]1C(O)=O Amb25176254 [0,0,0,1,0,0|1,0,2]=4 971 B10R1.61 C[C@H]1NCCC[C@@H]1C(O)=O Amb24667782 [0,0,0,1,0,0|1,0,2]=4 972 B10R1.61 C[NH+]1CCCCC1C(=O)O Amb10573256 [0,0,0,1,0,0|1,0,2]=4 973 B10R1.61 ClC1=C(CCCC1)C(=O)O Amb1157859 [0,0,0,1,0,0|1,0,2]=4 974 B10R1.61 N=C1CCCC=C1C(O)=O Amb25777703 [0,0,0,1,0,0|1,0,1]=3 975 B10R1.61 NC1CCCCC1C(O)=O Amb20626164 [0,0,0,1,0,0|1,0,2]=4 976 B10R1.61 NC1CCCOC1C(O)=O Amb18202149 [0,0,0,1,0,0|2,0,1]=4 977 B10R1.61 NC=1CCCCC1C(O)=O Amb22228577 [0,0,0,1,0,0|1,0,2]=4 978 B10R1.61 N[C@@H]1CCCC[C@@H]1C(O)=O Amb19148605 [0,0,0,1,0,0|1,0,2]=4 979 B10R1.61 N[C@@H]1CCCC[C@@H]1C(O)=O Amb22224856 [0,0,0,1,0,0|1,0,2]=4 980 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O Amb1993721 [0,0,0,1,0,0|1,0,2]=4 981 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O Amb1993765 [0,0,0,1,0,0|1,0,2]=4 982 B10R1.61 N[C@H]1CCCC[C@@H]1C(O)=O Amb22224868 [0,0,0,1,0,0|1,0,2]=4 983 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O Amb1993720 [0,0,0,1,0,0|1,0,2]=4 984 B10R1.61 O=C1CCCC=C1C(=O)C Amb17593495 [0,0,0,1,0,0|2,0,1]=4 985 B10R1.61 OC(=O)C1=C(C)OCCO1 Amb10607351 [0,0,0,1,0,0|2,0,1]=4 986 B10R1.61 OC(=O)C1=CCCC[C@H]1O Amb25848408 [0,0,0,1,0,0|1,0,0]=2 987 B10R1.61 OC(=O)C1C=CCCC1Cl Amb25798840 [0,0,0,1,0,0|1,0,2]=4 988 B10R1.61 OC(=O)C1CCCCC1Cl Amb18126348 [0,0,0,1,0,0|1,0,2]=4 989 B10R1.61 OC(=O)C1CCCCC1S Amb18280240 [0,0,0,1,0,0|1,0,2]=4 990 B10R1.61 OC(=O)C=1CCCCC1Br Amb18130945 [0,0,0,1,0,0|1,0,2]=4 991 B10R1.61 OC(=O)[C@H]1CCCC[C@H]1Br Amb24546671 [0,0,0,1,0,0|1,0,2]=4 992 B10R1.61 OC(=O)[C@H]1CCCC[C@H]1Cl Amb24728090 [0,0,0,1,0,0|1,0,2]=4 993 B10R1.61 OC(=O)[C@H]1NCCO[C@@H]1C Amb10608849 [0,0,0,1,0,0|2,0,1]=4 994 B10R1.61 OC1CCC=CC1C(O)=O Amb18643842 [0,0,0,1,0,0|1,0,2]=4 995 B10R1.61 OC1CCCNC1C(O)=O Amb18124725 [0,0,0,1,0,0|2,0,1]=4 996 B10R1.61 O[C@@H]1CCC=C[C@@H]1C(O)=O Amb25174804 [0,0,0,1,0,0|1,0,2]=4 997 B10R1.61 O[C@@H]1CCCC[C@H]1C(=O)O Amb16204296 [0,0,0,1,0,0|1,0,2]=4 998 B10R1.61 O[C@H]1CCCC[C@@H]1C(O)=O Amb25260394 [0,0,0,1,0,0|1,0,2]=4 999 B10R1.61 O[C@H]1CCCN[C@@H]1C(O)=O Amb25340376 [0,0,0,1,0,0|2,0,1]=4 1000 B10R1.61 O[C@H]1CCCN[C@H]1C(O)=O Amb25214386 [0,0,0,1,0,0|2,0,1]=4 1001 B10R1.64 CC(=O)C=C1CCCC1C Amb24371486 [0,0,0,1,0,0|1,0,0]=2 1002 B10R1.64 CC(=O)C=C1CCOC1C Amb24718767 [0,0,0,1,0,0|2,0,0]=3 1003 B10R1.64 CC(=O)C=C1CCSC1C Amb24481027 [0,0,0,1,0,0|2,0,0]=3 1004 B10R1.64 CC(=O)C=C1CSCC1C Amb25233245 [0,0,0,1,0,0|2,0,0]=3 1005 B10R1.64 CC(=O)C=C1NCCN1C Amb25289721 [0,0,0,1,0,0|3,0,0]=4 1006 B10R1.64 CC(=O)\C=C/1\CCCN1C Amb24480510 [0,0,0,1,0,0|2,0,0]=3 1007 B10R1.64 CC(=O)\C=C/1\NCCN1C Amb25281061 [0,0,0,1,0,0|3,0,0]=4 1008 B10R1.64 CC(=O)\C=C\1/CCCN1C Amb25146900 [0,0,0,1,0,0|2,0,0]=3 1009 B10R1.64 CC/1=CCC\C1=C\C(C)=O Amb24646692 [0,0,0,1,0,0|1,0,2]=4 1010 B10R1.64 CC/1SCC\C1=C\C(C)O Amb24481028 [0,0,0,1,0,0|2,0,1]=4 1011 B10R1.64 CC1CCCC1=CC(O)=O Amb20622694 [0,0,0,1,0,0|0,0,0]=1 1012 B10R1.64 CC1CCCC1CC(C)=O Amb24480371 [0,0,0,1,0,0|1,0,2]=4 1013 B10R1.64 CC1CCCC1NC(C)=O Amb24700997 [0,0,0,1,0,0|2,0,1]=4 1014 B10R1.64 CC1CCCC1NC(N)=O Amb25292071 [0,0,0,1,0,0|2,0,1]=4 1015 B10R1.64 CC1CCCC1OC(C)=O Amb23448381 [0,0,0,1,0,0|2,0,1]=4 1016 B10R1.64 CC1CCCN1CC(C)=O Amb22292307 [0,0,0,1,0,0|2,0,1]=4 1017 B10R1.64 CC1CCCN1CC(O)=O Amb18954282 [0,0,0,1,0,0|1,0,1]=3 1018 B10R1.64 CC1CCCN1NC(N)=O Amb24428163 [0,0,0,1,0,0|3,0,0]=4 1019 B10R1.64 CC1NCCC1CC(O)=O Amb25137202 [0,0,0,1,0,0|1,0,2]=4 1020 B10R1.64 CC1OCCC1=CC(N)=O Amb24482853 [0,0,0,1,0,0|2,0,0]=3 1021 B10R1.64 CC1OCCC1=CC(O)=O Amb25793839 [0,0,0,1,0,0|1,0,0]=2 1022 B10R1.64 CC1OCCC1CC(O)=O Amb24707124 [0,0,0,1,0,0|1,0,2]=4 1023 B10R1.64 CC1SCCC1=CC(O)=O Amb24481025 [0,0,0,1,0,0|1,0,0]=2 1024 B10R1.64 CC1SCCC1CC(O)=O Amb18199391 [0,0,0,1,0,0|1,0,2]=4 1025 B10R1.64 CC=1CCCC1CC(O)=O Amb24410379 [0,0,0,1,0,0|0,0,2]=3 1026 B10R1.64 CN/1CCC\C1=C/N(=O)=O Amb21955353 [0,0,0,1,0,0|2,0,1]=4 1027 B10R1.64 CN/1CCN\C1=C/C(O)=O Amb25739063 [0,0,0,1,0,0|2,0,0]=3 1028 B10R1.64 CN/1CCN\C1=C\C(O)=O Amb18202603 [0,0,0,1,0,0|2,0,0]=3 1029 B10R1.64 CN1CCCC1=C[N+]([O-])=O Amb24066839 [0,0,0,1,0,0|2,0,1]=4 1030 B10R1.64 CN1CCCC1CC(O)=O Amb22586774 [0,0,0,1,0,0|1,0,2]=4 1031 B10R1.64 CN1CCN=C1CC(O)=O Amb24541314 [0,0,0,1,0,0|2,0,1]=4 1032 B10R1.64 CN1CCNC1=CC(N)=O Amb24577597 [0,0,0,1,0,0|3,0,0]=4 1033 B10R1.64 C[C@@H]1CCC[C@@H]1CC(N)=O Amb24561371 [0,0,0,1,0,0|1,0,2]=4 1034 B10R1.64 C[C@@H]1NCC[C@H]1CC(O)=O Amb18202479 [0,0,0,1,0,0|1,0,2]=4 1035 B10R1.64 C[C@H]1CCC[C@@H]1CC(O)=O Amb24587811 [0,0,0,1,0,0|0,0,2]=3 1036 B10R1.64 NC=1CCCC1CC(O)=O Amb24745546 [0,0,0,1,0,0|1,0,2]=4 1037 B10R1.64 N[C@H]1CCC[C@H]1CC(O)=O Amb24715924 [0,0,0,1,0,0|1,0,2]=4 1038 B10R1.64 OC(=O)CC1CCCC1F Amb24733558 [0,0,0,1,0,0|1,0,2]=4 1039 B10R1.64 OC(=O)CN1CCC[C@@H]1O Amb10067047 [0,0,0,1,0,0|2,0,1]=4 1040 B10R1.64 OC(=O)CN1CCC[C@H]1O Amb10067046 [0,0,0,1,0,0|2,0,1]=4 1041 B10R1.64 OC(=O)\C=C/1\CCCC1=O Amb24640823 [0,0,0,1,0,0|1,0,1]=3 1042 B10R1.64 OC(=O)\C=C/1\CCCC1Br Amb24640268 [0,0,0,1,0,0|1,0,0]=2 1043 B10R1.64 OC(=O)\C=C\1/CCCC1=O Amb21858630 [0,0,0,1,0,0|1,0,1]=3 1044 B10R1.64 OC1CCCC1CC(O)=O Amb18202404 [0,0,0,1,0,0|1,0,2]=4 1045 B10R1.66 CC(=O)C#CC1CCCC1 Amb24383777 [0,0,0,1,0,0|1,0,2]=4 1046 B10R1.66 CC(=O)CC=C1CCCC1 Amb25282727 [0,0,0,1,0,0|1,0,2]=4 1047 B10R1.66 CC(=O)CCC1CCCC1 Amb19374837 [0,0,0,1,0,0|1,0,2]=4 1048 B10R1.66 CC(=O)CNC1CCCC1 Amb25291662 [0,0,0,1,0,0|2,0,1]=4 1049 B10R1.66 CC(=O)NCC1CCCC1 Amb25094109 [0,0,0,1,0,0|2,0,1]=4 1050 B10R1.66 CC(=O)NOC1CCCC1 Amb25172461 [0,0,0,1,0,0|3,0,0]=4 1051 B10R1.66 CC(=O)SCC1CCCC1 Amb25169354 [0,0,0,1,0,0|2,0,1]=4 1052 B10R1.66 CC(=O)\C=C/C1CCCC1 Amb24759830 [0,0,0,1,0,0|1,0,0]=2 1053 B10R1.66 CC(=O)\C=C\C1CCCC1 Amb24538035 [0,0,0,1,0,0|1,0,0]=2 1054 B10R1.66 CC(=O)\C=C\C1COCC1 Amb22264587 [0,0,0,1,0,0|2,0,0]=3 1055 B10R1.66 CC(=O)\C=C\C=1CCCC1 Amb25209541 [0,0,0,1,0,0|1,0,2]=4 1056 B10R1.66 CC(N)\C=C\C1CCCC1 Amb24751489 [0,0,0,1,0,0|2,0,1]=4 1057 B10R1.66 CC(O)\C=C\C1CCCO1 Amb25241240 [0,0,0,1,0,0|2,0,1]=4 1058 B10R1.66 CC(O)\C=C\C1COCC1 Amb24479527 [0,0,0,1,0,0|2,0,1]=4 1059 B10R1.66 CN(C)\C=C\C1CCCC1 Amb25101861 [0,0,0,1,0,0|3,0,0]=4 1060 B10R1.66 NC(=O)CNC1CCCC1 Amb1121300 [0,0,0,1,0,0|2,0,1]=4 1061 B10R1.66 NC(=O)CNC1CCCC1 Amb19373254 [0,0,0,1,0,0|2,0,1]=4 1062 B10R1.66 NC(=O)COC1CCCC1 Amb22523400 [0,0,0,1,0,0|2,0,1]=4 1063 B10R1.66 NC(=O)CSC1CCCC1 Amb24476933 [0,0,0,1,0,0|2,0,1]=4 1064 B10R1.66 NC(=O)N=CC1CCCO1 Amb25366812 [0,0,0,1,0,0|3,0,0]=4 1065 B10R1.66 NC(=O)NOC1CCCC1 Amb24479363 [0,0,0,1,0,0|3,0,0]=4 1066 B10R1.66 NC(=O)\C=C\C1CCCN1 Amb25760390 [0,0,0,1,0,0|2,0,0]=3 1067 B10R1.66 NC(=O)\C=C\C=1CCCN1 Amb25099615 [0,0,0,1,0,0|2,0,1]=4 1068 B10R1.66 NC(=S)\C=C\N1CCCC1 Amb17477828 [0,0,0,1,0,0|2,1,0]=4 1069 B10R1.66 OB(\C=C\C1CCCC1)O Amb17611482 [0,0,0,1,0,0|1,0,1]=3 1070 B10R1.66 OC(=O)CCC1CCCO1 Amb1093967 [0,0,0,1,0,0|1,0,2]=4 1071 B10R1.66 OC(=O)CCC1CCCS1 Amb18645411 [0,0,0,1,0,0|1,0,2]=4 1072 B10R1.66 OC(=O)CCC1CNCC1 Amb20668417 [0,0,0,1,0,0|1,0,2]=4 1073 B10R1.66 OC(=O)CCC1CNCC1 Amb22059448 [0,0,0,1,0,0|1,0,2]=4 1074 B10R1.66 OC(=O)CCC1COCC1 Amb18296305 [0,0,0,1,0,0|1,0,2]=4 1075 B10R1.66 OC(=O)CCC1CSCC1 Amb18199268 [0,0,0,1,0,0|1,0,2]=4 1076 B10R1.66 OC(=O)CCN1CCCC1 Amb15740874 [0,0,0,1,0,0|1,0,2]=4 1077 B10R1.66 OC(=O)CC[C@@H]1CCCN1 Amb22745695 [0,0,0,1,0,0|1,0,2]=4 1078 B10R1.66 OC(=O)CC[C@@H]1CCCO1 Amb25340449 [0,0,0,1,0,0|1,0,2]=4 1079 B10R1.66 OC(=O)CNC1CCCC1 Amb1109994 [0,0,0,1,0,0|1,0,1]=3 1080 B10R1.66 OC(=O)CNC1CNCC1 Amb25826582 [0,0,0,1,0,0|2,0,1]=4 1081 B10R1.66 OC(=O)CNC1COCC1 Amb24476834 [0,0,0,1,0,0|2,0,1]=4 1082 B10R1.66 OC(=O)COC1COCC1 Amb20623899 [0,0,0,1,0,0|2,0,1]=4 1083 B10R1.66 OC(=O)CSC1CNCC1 Amb25252988 [0,0,0,1,0,0|2,0,1]=4 1084 B10R1.66 OC(=O)CSC1COCC1 Amb23590292 [0,0,0,1,0,0|2,0,1]=4 1085 B10R1.66 OC(=O)\C=C/C1CCC=C1 Amb24426899 [0,0,0,1,0,0|0,0,2]=3 1086 B10R1.66 OC(=O)\C=C/C1SCCS1 Amb24482273 [0,0,0,1,0,0|2,0,0]=3 1087 B10R1.66 OC(=O)\C=C\C1C=CCO1 Amb25709572 [0,0,0,1,0,0|1,0,2]=4 1088 B10R1.66 OC(=O)\C=C\C1CCC=C1 Amb24560933 [0,0,0,1,0,0|0,0,2]=3 1089 B10R1.66 OC(=O)\C=C\C1CCCC1 Amb18285121 [0,0,0,1,0,0|0,0,0]=1 1090 B10R1.66 OC(=O)\C=C\C1CCCO1 Amb25330231 [0,0,0,1,0,0|1,0,0]=2 1091 B10R1.66 OC(=O)\C=C\C1CN=CN1 Amb24568897 [0,0,0,1,0,0|2,0,1]=4 1092 B10R1.66 OC(=O)\C=C\C1COCC1 Amb18285142 [0,0,0,1,0,0|1,0,0]=2 1093 B10R1.66 OC(=O)\C=C\C1SCCS1 Amb24634450 [0,0,0,1,0,0|2,0,0]=3 1094 B10R1.66 OC(=O)\C=C\C=1CCCC1 Amb18643237 [0,0,0,1,0,0|0,0,2]=3 1095 B10R1.66 [O-][N+](=O)\C=C\C1COCC1 Amb25365836 [0,0,0,1,0,0|2,0,1]=4 1096 B10R1.66 [O-][N+](=O)\C=C\C1CSCC1 Amb25796356 [0,0,0,1,0,0|2,0,1]=4 1097 B10R1.73 CC1CC1NCCC(O)=O Amb19025693 [0,0,0,1,0,0|1,0,2]=4 1098 B10R1.73 CC1CC1N\C=C\C(O)=O Amb24479654 [0,0,0,1,0,0|1,0,0]=2 1099 B10R1.77 CC1CC(=O)CCCCC1 Amb24631575 [0,0,0,1,0,0|1,0,2]=4 1100 B10R1.77 CC1CC(=O)NCCCC1 Amb24743149 [0,0,0,1,0,0|2,0,1]=4 1101 B10R1.77 CC=1CCCC=CC(=O)C1 Amb25052096 [0,0,0,1,0,0|1,0,1]=3 1102 B10R1.77 C[C@H]1CC(=O)C=CCCC1 Amb25735262 [0,0,0,1,0,0|1,0,0]=2 1103 B10R1.77 C[C@H]1CC(=O)NCCCC1 Amb24478975 [0,0,0,1,0,0|2,0,1]=4 1104 B10R1.78 BrC1CCCCCCC=C1 Amb24638769 [0,0,0,1,0,0|2,0,1]=4 1105 B10R1.78 C=C1C=CCCCCC=C1 Amb22364880 [0,0,0,1,0,0|2,0,1]=4 1106 B10R1.78 ClC1CCCCCCC=C1 Amb25032477 [0,0,0,1,0,0|2,0,1]=4 1107 B10R1.78 O=C1C=CCCCCC=C1 Amb25146490 [0,0,0,1,0,0|1,0,1]=3 1108 B10R1.78 O=C1C=CCCCCCN1 Amb25309795 [0,0,0,1,0,0|1,0,0]=2 1109 B10R1.78 O=C1CC=CCCCCC1 Amb24571778 [0,0,0,1,0,0|1,0,2]=4 1110 B10R1.78 O=C1CCCCC=CC=C1 Amb22342438 [0,0,0,1,0,0|1,0,2]=4 1111 B10R1.78 O=C1CCCCCC=CN1 Amb25073138 [0,0,0,1,0,0|2,0,1]=4 1112 B10R1.78 O=C1CCCCCCC=C1 Amb22363956 [0,0,0,1,0,0|1,0,0]=2 1113 B10R1.78 O=C1CCCCCCCC1 Amb16185450 [0,0,0,1,0,0|1,0,2]=4 1114 B10R1.78 O=C1CCCCCNC=C1 Amb25324286 [0,0,0,1,0,0|2,0,0]=3 1115 B10R1.78 O=C1CCOCCCC=C1 Amb25759600 [0,0,0,1,0,0|2,0,0]=3 1116 B10R1.78 O=C1NCCCCCCN1 Amb25147498 [0,0,0,1,0,0|2,0,1]=4 1117 B10R1.78 O[C@@H]1CCCCCCC=C1 Amb24404809 [0,0,0,1,0,0|1,0,1]=3 1118 B10R1.86 CCCC1CCC1C(O)=O Amb24670782 [0,0,0,1,0,0|0,0,2]=3 1119 B10R1.86 CCCN1CCC1C(O)=O Amb22011891 [0,0,0,1,0,0|1,0,2]=4 1120 B10R1.86 CCNC1CCC1C(O)=O Amb24509156 [0,0,0,1,0,0|1,0,2]=4 1121 B10R1.86 CCSC1CCC1C(O)=O Amb24634751 [0,0,0,1,0,0|1,0,2]=4 1122 B10R1.86 COCC1CCC1C(O)=O Amb24713218 [0,0,0,1,0,0|1,0,2]=4 1123 B10R1.86 COCC=1CCC1C(O)=O Amb25331314 [0,0,0,1,0,0|1,0,2]=4 1124 B10R1.97 CCCC1CC1CC(O)=O Amb24679540 [0,0,0,1,0,0|0,0,2]=3 1125 B10R1.97 CCCC1CC1NC(C)=O Amb25738755 [0,0,0,1,0,0|2,0,1]=4 1126 B10R1.97 CCC[C@@H]1C[C@H]1NC(N)=O Amb25728396 [0,0,0,1,0,0|2,0,1]=4 1127 B10R1.126 CC(=O)\C=C\C=C\C1CC1 Amb24584304 [0,0,0,1,0,0|1,0,2]=4 1128 B10R1.126 CC(=O)\C=C\CCC1CO1 Amb24478390 [0,0,0,1,0,0|2,0,0]=3 1129 B10R1.126 NC(=O)CNCCC1CC1 Amb25055035 [0,0,0,1,0,0|2,0,1]=4 1130 B10R1.126 NC(=O)COCCC1CC1 Amb25740700 [0,0,0,1,0,0|2,0,1]=4 1131 B10R1.126 NC(=O)NOCCC1CC1 Amb25795201 [0,0,0,1,0,0|3,0,0]=4 1132 B10R1.126 OC(=O)C#CCCC1CC1 Amb25196569 [0,0,0,1,0,0|0,0,2]=3 1133 B10R1.126 OC(=O)CCCCC1CC1 Amb24480443 [0,0,0,1,0,0|0,0,2]=3 1134 B10R1.126 OC(=O)CCCCC1CO1 Amb25324298 [0,0,0,1,0,0|1,0,2]=4 1135 B10R1.126 OC(=O)CCCSC1CC1 Amb24504854 [0,0,0,1,0,0|1,0,2]=4 1136 B10R1.126 OC(=O)CSCCC1CC1 Amb25711705 [0,0,0,1,0,0|1,0,1]=3 1137 B10R1.126 OC(=O)\C=C\CNC1CC1 Amb24479658 [0,0,0,1,0,0|1,0,0]=2 1138 B10R1.126 OC(=O)\C=C\NCC1CC1 Amb24525473 [0,0,0,1,0,0|1,0,0]=2 1139 B10R1.127 CC(=O)C=NNC1CCC1 Amb24741094 [0,0,0,1,0,0|3,0,0]=4 1140 B10R1.127 CC(=O)NCCC1CCC1 Amb25775412 [0,0,0,1,0,0|2,0,1]=4 1141 B10R1.127 CC(=O)\C=N\NC1CCC1 Amb25128851 [0,0,0,1,0,0|3,0,0]=4 1142 B10R1.127 NC(=O)NOCC1CCC1 Amb24414527 [0,0,0,1,0,0|3,0,0]=4 1143 B10R1.127 O=C(Cl)OCCC1CCC1 Amb24360082 [0,0,0,1,0,0|2,0,1]=4 1144 B10R1.127 OC(=O)CCCN1CCC1 Amb24454983 [0,0,0,1,0,0|1,0,2]=4 1145 B10R1.127 OC(=O)CCNC1CCC1 Amb24478078 [0,0,0,1,0,0|1,0,2]=4 1146 B10R1.127 OC(=O)CCOC1CCC1 Amb25732733 [0,0,0,1,0,0|1,0,2]=4 1147 B10R1.127 OC(=O)COCC1CCC1 Amb24417123 [0,0,0,1,0,0|1,0,1]=3 1148 B10R1.127 OC(=O)\C=C\C=C1CCC1 Amb25075830 [0,0,0,1,0,0|0,0,2]=3 1149 B10R1.127 OC(=O)\C=C\NC1CCC1 Amb25102160 [0,0,0,1,0,0|1,0,0]=2 1150 B10R1.127 OC(=O)\C=C\NC1COC1 Amb24724103 [0,0,0,1,0,0|2,0,0]=3 1151 B10R1.127 OC(=O)\C=C\SC1COC1 Amb25788000 [0,0,0,1,0,0|2,0,0]=3 1152 B10R1.144 CC(=O)C1C=C1CCCC Amb25773405 [0,0,0,1,0,0|1,0,2]=4 1153 B10R1.144 CCCCC1=CC1C(=O)Cl Amb24738588 [0,0,0,1,0,0|1,0,2]=4 1154 B10R1.144 CCCCC1=CC1C(O)=O Amb24568035 [0,0,0,1,0,0|0,0,2]=3 1155 B10R1.144 CCCCC1CC1C(=O)C Amb17593552 [0,0,0,1,0,0|1,0,2]=4 1156 B10R1.144 CCCCC1CC1C(=O)O Amb10608641 [0,0,0,1,0,0|0,0,2]=3 1157 B10R1.144 CCCC[C@@H]1O[C@H]1C(O)=O Amb24585157 [0,0,0,1,0,0|1,0,1]=3 1158 B10R1.144 CCCC[C@H]1O[C@@H]1C(O)=O Amb24562255 [0,0,0,1,0,0|1,0,1]=3 1159 B10R1.156 C=C[C@@H]1C[C@H]1\C=C\C(O)=O Amb25360138 [0,0,0,1,0,0|0,0,2]=3 1160 B10R1.156 CCC1OC1\C=C\C(C)=O Amb25086668 [0,0,0,1,0,0|2,0,0]=3 1161 B10R1.162 CCC1CCCCC(=O)O1 Amb25174027 [0,0,0,1,0,0|0,0,2]=3 1162 B10R1.162 CNC1CC(=O)C=CCC1 Amb25378248 [0,0,0,1,0,0|2,0,0]=3 1163 B10R1.162 COC1CC(=O)C=CCC1 Amb25723277 [0,0,0,1,0,0|2,0,0]=3 1164 B10R1.162 O=C1CCCC[C@@H](CBr)O1 Amb25351492 [0,0,0,1,0,0|1,0,2]=4 1165 B10R1.162 OC[C@@H]1CCCCC(=O)O1 Amb24481208 [0,0,0,1,0,0|1,0,2]=4 1166 B10R1.177 CCCCCCC=C1CC1 Amb24711776 [0,0,0,1,0,0|2,0,1]=4 1167 B10R1.177 CCCCC\C=C\C1CO1 Amb24587809 [0,0,0,1,0,0|1,0,1]=3 1168 B10R1.348 CC(=O)C1=CCCCCO1 Amb25744240 [0,0,0,1,0,0|2,0,0]=3 1169 B10R1.348 CC(=O)C1CCCCC=C1 Amb25125700 [0,0,0,1,0,0|1,0,2]=4 1170 B10R1.348 CC(=O)C1CCCCCC1 Amb24407172 [0,0,0,1,0,0|1,0,2]=4 1171 B10R1.348 CC(=O)C1CCCCCN1 Amb25169359 [0,0,0,1,0,0|2,0,1]=4 1172 B10R1.348 CC(=O)C=1CCCCCC1 Amb24477994 [0,0,0,1,0,0|1,0,0]=2 1173 B10R1.348 CC(=O)C=1COCOCC1 Amb25807538 [0,0,0,1,0,0|3,0,0]=4 1174 B10R1.348 CC(=O)N1CCCCCO1 Amb25285347 [0,0,0,1,0,0|3,0,0]=4 1175 B10R1.348 CC(C)=C1CCCCCC1 Amb25048552 [0,0,0,1,0,0|2,0,1]=4 1176 B10R1.348 CC(C)C=1CCCCCC1 Amb25146390 [0,0,0,1,0,0|2,0,1]=4 1177 B10R1.348 CC(N)C=1CCCCCC1 Amb18278571 [0,0,0,1,0,0|2,0,1]=4 1178 B10R1.348 CC(O)C=1CCCCCC1 Amb24477995 [0,0,0,1,0,0|1,0,1]=3 1179 B10R1.348 C[C@@H](O)C=1CCCCCC1 Amb25764963 [0,0,0,1,0,0|1,0,1]=3 1180 B10R1.348 C[C@H](N)C=1CCCCCC1 Amb24634899 [0,0,0,1,0,0|2,0,1]=4 1181 B10R1.348 C[C@H](O)C=1CCCCCC1 Amb25759702 [0,0,0,1,0,0|1,0,1]=3 1182 B10R1.348 ClC(=O)N1CCCCCC1 Amb17563067 [0,0,0,1,0,0|2,0,1]=4 1183 B10R1.348 NC(=O)C1CCCCCC1 Amb24182051 [0,0,0,1,0,0|1,0,2]=4 1184 B10R1.348 NC(=O)C1CCCCCN1 Amb23596651 [0,0,0,1,0,0|2,0,1]=4 1185 B10R1.348 NC(=O)N1CCCCCC1 Amb1107239 [0,0,0,1,0,0|2,0,1]=4 1186 B10R1.348 O=C(Cl)C1CCCCCC1 Amb18797932 [0,0,0,1,0,0|1,0,2]=4 1187 B10R1.348 OB(C1=CCCCCC1)O Amb10068963 [0,0,0,1,0,0|1,0,1]=3 1188 B10R1.348 OC(=O)C1CCCCC=C1 Amb25230619 [0,0,0,1,0,0|0,0,2]=3 1189 B10R1.348 OC(=O)C1CCCNCC1 Amb18831588 [0,0,0,1,0,0|1,0,2]=4 1190 B10R1.348 OC(=O)C1CCCOCC1 Amb18831505 [0,0,0,1,0,0|1,0,2]=4 1191 B10R1.348 OC(=O)C1CCCSCC1 Amb18199262 [0,0,0,1,0,0|1,0,2]=4 1192 B10R1.348 OC(=O)C1CNCCCO1 Amb17739810 [0,0,0,1,0,0|2,0,1]=4 1193 B10R1.348 OC(=O)C1CNCCCO1 Amb22523333 [0,0,0,1,0,0|2,0,1]=4 1194 B10R1.348 OC(=O)C1CNCCCS1 Amb25350672 [0,0,0,1,0,0|2,0,1]=4 1195 B10R1.348 OC(=O)C1CSCCCN1 Amb24374437 [0,0,0,1,0,0|2,0,1]=4 1196 B10R1.348 OC(=O)C=1CCCC=CC1 Amb25067886 [0,0,0,1,0,0|0,0,2]=3 1197 B10R1.348 OC(=O)C=1CCCCCN1 Amb24671301 [0,0,0,1,0,0|1,0,0]=2 1198 B10R1.348 OC(=O)[C@@H]1CCCCC[NH2+]1 Amb10576587 [0,0,0,1,0,0|1,0,1]=3 1199 B10R1.348 OC(=O)[C@H]1CCCNCC1 Amb24479341 [0,0,0,1,0,0|1,0,2]=4 1200 B10R1.348 OC(=O)[C@H]1COCCCN1 Amb24730670 [0,0,0,1,0,0|2,0,1]=4 1201 B10R1.348 OC(=S)N1CCCCCC1 Amb25073270 [0,0,0,1,0,0|1,1,1]=4 1202 B7R0.1 BrCCCCCC=C Amb16234121 [2,0,0,0,0,0|1,0,1]=4 1203 B7R0.1 C#CCC\C=C\C=O Amb25828508 [2,0,0,0,0,0|0,0,2]=4 1204 B7R0.1 C=CCCCCCI Amb24483139 [2,0,0,0,0,0|1,0,1]=4 1205 B7R0.1 C=CCCCCCN Amb18641754 [2,0,0,0,0,0|1,0,1]=4 1206 B7R0.1 C=COCCCCBr Amb25237502 [2,0,0,0,0,0|2,0,0]=4 1207 B7R0.1 C=C\C=C/CCCCl Amb25141623 [2,0,0,0,0,0|1,0,1]=4 1208 B7R0.1 C=C\C=C\CCCBr Amb25053905 [2,0,0,0,0,0|1,0,1]=4 1209 B7R0.1 C=C\C=C\CCCN Amb18641670 [2,0,0,0,0,0|1,0,1]=4 1210 B7R0.1 CCC#C\C=C\C=O Amb24567897 [2,0,0,0,0,0|0,0,2]=4 1211 B7R0.1 CCCCC#CC=C Amb17673844 [2,0,0,0,0,0|0,0,2]=4 1212 B7R0.1 CCCCC#CC=O Amb17593134 [2,0,0,0,0,0|0,0,2]=4 1213 B7R0.1 CCCCC=C=CBr Amb24650210 [2,0,0,0,0,0|1,0,1]=4 1214 B7R0.1 CCCCCCC=N Amb24634610 [2,0,0,0,0,0|1,0,1]=4 1215 B7R0.1 CCCCCCNO Amb24591654 [2,0,0,0,0,0|1,0,1]=4 1216 B7R0.1 CCCCCC[14CH2]O Amb22350258 [2,0,0,0,0,0|0,0,2]=4 1217 B7R0.1 CCCCCNC=O Amb22360637 [2,0,0,0,0,0|1,0,0]=3 1218 B7R0.1 CCCCCON=O Amb17939401 [2,0,0,0,0,0|2,0,0]=4 1219 B7R0.1 CCCCCSCO Amb24703606 [2,0,0,0,0,0|1,0,1]=4 1220 B7R0.1 CCCCC\C=C\I Amb22641605 [2,0,0,0,0,0|1,0,0]=3 1221 B7R0.1 CCCCO/C=C/Cl Amb17689420 [2,0,0,0,0,0|2,0,0]=4 1222 B7R0.1 CCCC\C=C/C=O Amb25278292 [2,0,0,0,0,0|0,0,0]=2 1223 B7R0.1 CCCC\C=C\C#N Amb18641342 [2,0,0,0,0,0|1,0,1]=4 1224 B7R0.1 CCCC\C=C\C=C Amb22729011 [2,0,0,0,0,0|0,0,1]=3 1225 B7R0.1 CCCC\C=C\CBr Amb24507687 [2,0,0,0,0,0|1,0,1]=4 1226 B7R0.1 CCCC\C=C\CCl Amb24483085 [2,0,0,0,0,0|1,0,1]=4 1227 B7R0.1 CCCC\C=C\CN Amb25175053 [2,0,0,0,0,0|1,0,1]=4 1228 B7R0.1 CCCC\C=C\OC Amb25810618 [2,0,0,0,0,0|2,0,0]=4 1229 B7R0.1 CCCNC\C=C\Cl Amb25340126 [2,0,0,0,0,0|2,0,0]=4 1230 B7R0.1 CCCOCCC=C Amb25733577 [2,0,0,0,0,0|1,0,1]=4 1231 B7R0.1 CCCOC\C=C\Br Amb25075093 [2,0,0,0,0,0|2,0,0]=4 1232 B7R0.1 CCCO\C=C\C=O Amb25300597 [2,0,0,0,0,0|1,0,0]=3 1233 B7R0.1 CCCSC\C=C\Cl Amb25690181 [2,0,0,0,0,0|2,0,0]=4 1234 B7R0.1 CCCS\C=C\CO Amb25092280 [2,0,0,0,0,0|1,0,1]=4 1235 B7R0.1 CCC\C=C/CC=O Amb24481514 [2,0,0,0,0,0|0,0,2]=4 1236 B7R0.1 CCC\C=C\C=CBr Amb24615080 [2,0,0,0,0,0|1,0,1]=4 1237 B7R0.1 CCC\C=C\C=C\Br Amb25701400 [2,0,0,0,0,0|1,0,1]=4 1238 B7R0.1 CCC\C=C\C=C\Cl Amb25765579 [2,0,0,0,0,0|1,0,1]=4 1239 B7R0.1 CCC\C=C\CC=O Amb24356718 [2,0,0,0,0,0|0,0,2]=4 1240 B7R0.1 CCNCCC=C=C Amb25327429 [2,0,0,0,0,0|1,0,1]=4 1241 B7R0.1 CCNCCCC=O Amb24481334 [2,0,0,0,0,0|1,0,1]=4 1242 B7R0.1 CCNC\C=C\CO Amb24605921 [2,0,0,0,0,0|1,0,1]=4 1243 B7R0.1 CCOCCNC=O Amb24713535 [2,0,0,0,0,0|2,0,0]=4 1244 B7R0.1 CCOCCOC=C Amb17674189 [2,0,0,0,0,0|2,0,0]=4 1245 B7R0.1 CCOC\C=C\C=O Amb24743396 [2,0,0,0,0,0|1,0,0]=3 1246 B7R0.1 CCOC\C=C\CO Amb25221278 [2,0,0,0,0,0|1,0,1]=4 1247 B7R0.1 CCSCCOC=C Amb25720739 [2,0,0,0,0,0|2,0,0]=4 1248 B7R0.1 CCSC\C=C\CO Amb24734797 [2,0,0,0,0,0|1,0,1]=4 1249 B7R0.1 CC\C=C/C=C/C=O Amb25040049 [2,0,0,0,0,0|0,0,2]=4 1250 B7R0.1 CC\C=C/C=C\C=O Amb24666726 [2,0,0,0,0,0|0,0,2]=4 1251 B7R0.1 CC\C=C\CCCC Amb19930202 [2,0,0,0,0,0|1,0,1]=4 1252 B7R0.1 CNCCCC=C=C Amb25843272 [2,0,0,0,0,0|1,0,1]=4 1253 B7R0.1 CNCCCCC=C Amb19886674 [2,0,0,0,0,0|1,0,1]=4 1254 B7R0.1 CNCCCCC=C Amb22495849 [2,0,0,0,0,0|1,0,1]=4 1255 B7R0.1 CNCCCOC=O Amb24505269 [2,0,0,0,0,0|2,0,0]=4 1256 B7R0.1 CNCC\C=C\C=C Amb18641669 [2,0,0,0,0,0|1,0,1]=4 1257 B7R0.1 COCC\C=C\CO Amb25084911 [2,0,0,0,0,0|1,0,1]=4 1258 B7R0.1 CSCCCCC=O Amb25760866 [2,0,0,0,0,0|1,0,1]=4 1259 B7R0.1 CSCCCNC=O Amb24407269 [2,0,0,0,0,0|2,0,0]=4 1260 B7R0.1 CSCC\C=C\C=O Amb25093794 [2,0,0,0,0,0|1,0,0]=3 1261 B7R0.1 C\C=C/CCCNC Amb18641753 [2,0,0,0,0,0|1,0,1]=4 1262 B7R0.1 C\C=C\CCCCBr Amb25053891 [2,0,0,0,0,0|1,0,1]=4 1263 B7R0.1 C\C=C\CCCCO Amb24634714 [2,0,0,0,0,0|1,0,1]=4 1264 B7R0.1 C\C=C\CCCNC Amb24514320 [2,0,0,0,0,0|1,0,1]=4 1265 B7R0.1 C\C=C\CCNCC Amb18312572 [2,0,0,0,0,0|1,0,1]=4 1266 B7R0.1 C\C=C\C\C=C\C=O Amb24722156 [2,0,0,0,0,0|0,0,2]=4 1267 B7R0.1 C\C=C\NCCCC Amb25259223 [2,0,0,0,0,0|1,0,1]=4 1268 B7R0.1 ClCCCCCC=O Amb16185781 [2,0,0,0,0,0|1,0,1]=4 1269 B7R0.1 ClCCCC\C=C\Br Amb25173197 [2,0,0,0,0,0|2,0,0]=4 1270 B7R0.1 F\C=C\CCCCBr Amb25101586 [2,0,0,0,0,0|2,0,0]=4 1271 B7R0.1 NCCCCCC=O Amb25680164 [2,0,0,0,0,0|1,0,1]=4 1272 B7R0.1 NCCCCNC=O Amb18641902 [2,0,0,0,0,0|2,0,0]=4 1273 B7R0.1 NCCC\C=C\CO Amb24117506 [2,0,0,0,0,0|1,0,1]=4 1274 B7R0.1 O=CCCCCCBr Amb18127461 [2,0,0,0,0,0|1,0,1]=4 1275 B7R0.1 O=CCCCCCF Amb24533888 [2,0,0,0,0,0|1,0,1]=4 1276 B7R0.1 O=CCC\C=C/C=O Amb24453308 [2,0,0,0,0,0|1,0,1]=4 1277 B7R0.1 O=CCC\C=C\C=O Amb18124241 [2,0,0,0,0,0|1,0,1]=4 1278 B7R0.1 O=CNCCCCBr Amb25300317 [2,0,0,0,0,0|2,0,0]=4 1279 B7R0.1 O=COCCCCCl Amb24599108 [2,0,0,0,0,0|2,0,0]=4 1280 B7R0.1 O=C\C=C\CCCBr Amb24358710 [2,0,0,0,0,0|1,0,0]=3 1281 B7R0.1 OCCCCC=C=C Amb17593159 [2,0,0,0,0,0|1,0,1]=4 1282 B7R0.1 OCCCCC=NO Amb22229987 [2,0,0,0,0,0|2,0,0]=4 1283 B7R0.1 OCCCCCC=O Amb18641885 [2,0,0,0,0,0|1,0,1]=4 1284 B7R0.1 OCCCCOC=O Amb25244169 [2,0,0,0,0,0|2,0,0]=4 1285 B7R0.1 OCCCC\C=C\Cl Amb25725026 [2,0,0,0,0,0|2,0,0]=4 1286 B7R0.1 OCCCC\C=N\O Amb22336271 [2,0,0,0,0,0|2,0,0]=4 1287 B7R0.1 OCCC\C=C\C=C Amb10605295 [2,0,0,0,0,0|1,0,1]=4 1288 B7R0.1 OCCC\C=C\C=O Amb25734444 [2,0,0,0,0,0|1,0,0]=3 1289 B7R0.1 OC\C=C\CCCCl Amb25174931 [2,0,0,0,0,0|1,0,1]=4 1290 B7R0.4 BrCCCCC(=O)C Amb16234126 [2,0,0,0,0,0|2,0,0]=4 1291 B7R0.4 C=CC\C=C\C(O)=O Amb18641681 [2,0,0,0,0,0|0,0,2]=4 1292 B7R0.4 CC#C\C=C\C(O)=O Amb25188432 [2,0,0,0,0,0|0,0,2]=4 1293 B7R0.4 CC(=O)\C=C\CCCl Amb25806173 [2,0,0,0,0,0|2,0,0]=4 1294 B7R0.4 CCCC=NC(N)=O Amb24411468 [2,0,0,0,0,0|2,0,0]=4 1295 B7R0.4 CCCCC=C(C)C Amb22228888 [2,0,0,0,0,0|2,0,0]=4 1296 B7R0.4 CCCCC=C(F)F Amb10840485 [2,0,0,0,0,0|2,0,0]=4 1297 B7R0.4 CCCCCB(O)O Amb2447470 [2,0,0,0,0,0|1,0,1]=4 1298 B7R0.4 CCCCCC(N)=N Amb19890171 [2,0,0,0,0,0|2,0,0]=4 1299 B7R0.4 CCCCCC(N)O Amb24673933 [2,0,0,0,0,0|1,0,1]=4 1300 B7R0.4 CCCCCC([O-])=O Amb22337624 [2,0,0,0,0,0|0,0,1]=3 1301 B7R0.4 CCCCCC([O-])=O Amb22525161 [2,0,0,0,0,0|0,0,1]=3 1302 B7R0.4 CCCCCC([O-])=O Amb22730527 [2,0,0,0,0,0|0,0,1]=3 1303 B7R0.4 CCCCCC([O-])=O Amb22731343 [2,0,0,0,0,0|0,0,1]=3 1304 B7R0.4 CCCCC[13C](O)=O Amb22353417 [2,0,0,0,0,0|0,0,0]=2 1305 B7R0.4 CCCCC[C@@H](C)O Amb20242420 [2,0,0,0,0,0|1,0,1]=4 1306 B7R0.4 CCCCC[N+]([O-])=O Amb22227991 [2,0,0,0,0,0|1,0,1]=4 1307 B7R0.4 CCCCNC(=O)Cl Amb24574309 [2,0,0,0,0,0|2,0,0]=4 1308 B7R0.4 CCCCOC(=O)F Amb24710483 [2,0,0,0,0,0|2,0,0]=4 1309 B7R0.4 CCCCSC(=O)C Amb10552685 [2,0,0,0,0,0|2,0,0]=4 1310 B7R0.4 CCCCSC(=O)Cl Amb22352826 [2,0,0,0,0,0|2,0,0]=4 1311 B7R0.4 CCCCSC(N)=O Amb24533653 [2,0,0,0,0,0|2,0,0]=4 1312 B7R0.4 CCCC[13CH2][13C](O)=O Amb22367381 [2,0,0,0,0,0|0,0,0]=2 1313 B7R0.4 CCCNCC(=O)N Amb1124632 [2,0,0,0,0,0|2,0,0]=4 1314 B7R0.4 CCCNCC(=O)O Amb10609640 [2,0,0,0,0,0|1,0,0]=3 1315 B7R0.4 CCCNCC(=O)O Amb1110628 [2,0,0,0,0,0|1,0,0]=3 1316 B7R0.4 CCCSCC(=O)O Amb1137113 [2,0,0,0,0,0|1,0,0]=3 1317 B7R0.4 CCC\C=C/C(=O)C Amb17593161 [2,0,0,0,0,0|1,0,0]=3 1318 B7R0.4 CCC\C=C\C(=C)O Amb24332587 [2,0,0,0,0,0|1,0,0]=3 1319 B7R0.4 CCC\C=C\C(C)=O Amb20240563 [2,0,0,0,0,0|1,0,0]=3 1320 B7R0.4 CCC\C=C\C(C)O Amb25083446 [2,0,0,0,0,0|1,0,1]=4 1321 B7R0.4 CCC\C=C\C(N)=N Amb24549908 [2,0,0,0,0,0|2,0,0]=4 1322 B7R0.4 CCC\C=C\[N+]([O-])=O Amb24558342 [2,0,0,0,0,0|1,0,1]=4 1323 B7R0.4 CCNCCC(C)=O Amb18641851 [2,0,0,0,0,0|2,0,0]=4 1324 B7R0.4 CCN\C=C\C(C)=O Amb24761435 [2,0,0,0,0,0|2,0,0]=4 1325 B7R0.4 CCOCCC(=O)Cl Amb20672027 [2,0,0,0,0,0|2,0,0]=4 1326 B7R0.4 CCO\C=C/C(C)=O Amb24379536 [2,0,0,0,0,0|2,0,0]=4 1327 B7R0.4 CCO\C=C\C(C)=O Amb25330041 [2,0,0,0,0,0|2,0,0]=4 1328 B7R0.4 CCSSCC(O)=O Amb25233433 [2,0,0,0,0,0|2,0,0]=4 1329 B7R0.4 CCS\C=C/C(O)=O Amb25200140 [2,0,0,0,0,0|1,0,0]=3 1330 B7R0.4 CCS\C=C\C(C)=O Amb25328935 [2,0,0,0,0,0|2,0,0]=4 1331 B7R0.4 CCS\C=C\C(O)=O Amb18642902 [2,0,0,0,0,0|1,0,0]=3 1332 B7R0.4 CNCCCC(=O)O Amb1153115 [2,0,0,0,0,0|1,0,0]=3 1333 B7R0.4 CNCCCC(N)=O Amb18303611 [2,0,0,0,0,0|2,0,0]=4 1334 B7R0.4 CNCCCS(O)=O Amb24656214 [2,0,0,0,0,0|2,0,0]=4 1335 B7R0.4 CNC\C=C\C(O)=O Amb25368293 [2,0,0,0,0,0|1,0,0]=3 1336 B7R0.4 COCCCC(=O)Cl Amb24481572 [2,0,0,0,0,0|2,0,0]=4 1337 B7R0.4 COCCCC(N)=O Amb24670109 [2,0,0,0,0,0|2,0,0]=4 1338 B7R0.4 COC\C=C\C(C)=O Amb25066961 [2,0,0,0,0,0|2,0,0]=4 1339 B7R0.4 COC\C=C\C(O)=O Amb18296423 [2,0,0,0,0,0|1,0,0]=3 1340 B7R0.4 CONCCC(O)=O Amb24441275 [2,0,0,0,0,0|2,0,0]=4 1341 B7R0.4 CON\C=C\C(O)=O Amb24333349 [2,0,0,0,0,0|2,0,0]=4 1342 B7R0.4 CSCCCC(=O)O Amb17503622 [2,0,0,0,0,0|1,0,0]=3 1343 B7R0.4 CSCCCC(C)=O Amb25122381 [2,0,0,0,0,0|2,0,0]=4 1344 B7R0.4 CSCCCC(N)=O Amb19129736 [2,0,0,0,0,0|2,0,0]=4 1345 B7R0.4 CSC\C=C/C(C)=O Amb25713058 [2,0,0,0,0,0|2,0,0]=4 1346 B7R0.4 CSC\C=C\C(C)=O Amb24515276 [2,0,0,0,0,0|2,0,0]=4 1347 B7R0.4 CSC\C=C\C(O)=O Amb18291627 [2,0,0,0,0,0|1,0,0]=3 1348 B7R0.4 C[Se]CCCC(O)=O Amb22347334 [2,0,0,0,0,0|1,0,0]=3 1349 B7R0.4 C\C=C\C=C\C(=O)O Amb17784698 [2,0,0,0,0,0|0,0,2]=4 1350 B7R0.4 C\C=C\CCC(=O)O Amb10071500 [2,0,0,0,0,0|0,0,2]=4 1351 B7R0.4 N#CCCCC(O)=O Amb18560874 [2,0,0,0,0,0|1,0,1]=4 1352 B7R0.4 N#CC\C=C\C(O)=O Amb18123863 [2,0,0,0,0,0|1,0,1]=4 1353 B7R0.4 NC(=O)CCCCI Amb25788033 [2,0,0,0,0,0|2,0,0]=4 1354 B7R0.4 NCCCCC(N)=O Amb18641897 [2,0,0,0,0,0|2,0,0]=4 1355 B7R0.4 NCCCCC([O-])=O Amb22753853 [2,0,0,0,0,0|1,0,1]=4 1356 B7R0.4 NCCCCP(O)=O Amb24520720 [2,0,0,0,0,0|2,0,0]=4 1357 B7R0.4 NCCCNC(O)=O Amb24093884 [2,0,0,0,0,0|2,0,0]=4 1358 B7R0.4 NCCNCC(=O)O Amb17608063 [2,0,0,0,0,0|2,0,0]=4 1359 B7R0.4 NCCNCC(O)=O Amb19958818 [2,0,0,0,0,0|2,0,0]=4 1360 B7R0.4 NCCOCC(O)=O Amb18630146 [2,0,0,0,0,0|2,0,0]=4 1361 B7R0.4 NCCOCC(O)=O Amb22751540 [2,0,0,0,0,0|2,0,0]=4 1362 B7R0.4 NCCSCC(=O)O Amb17500446 [2,0,0,0,0,0|2,0,0]=4 1363 B7R0.4 NCCSCC(O)=O Amb20622325 [2,0,0,0,0,0|2,0,0]=4 1364 B7R0.4 NCC\C=C\C(O)=O Amb25266868 [2,0,0,0,0,0|1,0,0]=3 1365 B7R0.4 NNCCCC(O)=O Amb24455803 [2,0,0,0,0,0|2,0,0]=4 1366 B7R0.4 NOCCCC(=O)O Amb10975956 [2,0,0,0,0,0|2,0,0]=4 1367 B7R0.4 NOCCCC(O)=O Amb22011795 [2,0,0,0,0,0|2,0,0]=4 1368 B7R0.4 O=C(F)CCCCCl Amb24472276 [2,0,0,0,0,0|2,0,0]=4 1369 B7R0.4 O=CCCCC(=O)O Amb17593198 [2,0,0,0,0,0|1,0,1]=4 1370 B7R0.4 OC(=O)CNCCS Amb18124468 [2,0,0,0,0,0|2,0,0]=4 1371 B7R0.4 OC(=O)COCCBr Amb24057760 [2,0,0,0,0,0|2,0,0]=4 1372 B7R0.4 OC(=O)COCCCl Amb21857870 [2,0,0,0,0,0|2,0,0]=4 1373 B7R0.4 OC(=O)CSCCCl Amb18644703 [2,0,0,0,0,0|2,0,0]=4 1374 B7R0.4 OC(=O)CSCCS Amb24711400 [2,0,0,0,0,0|2,0,0]=4 1375 B7R0.4 OC(=O)\C=C\CCBr Amb25702661 [2,0,0,0,0,0|1,0,0]=3 1376 B7R0.4 OCCCCC(=O)C Amb10603864 [2,0,0,0,0,0|2,0,0]=4 1377 B7R0.4 OCCCCC(=O)[O-] Amb13952763 [2,0,0,0,0,0|1,0,1]=4 1378 B7R0.4 OCCCCC(O)=O Amb22351244 [2,0,0,0,0,0|1,0,0]=3 1379 B7R0.4 OCCSCC(=O)O Amb1110090 [2,0,0,0,0,0|2,0,0]=4 1380 B7R0.4 OCC\C=C\C(O)=O Amb21929352 [2,0,0,0,0,0|1,0,0]=3 1381 B7R0.4 SCCCCC(=O)O Amb17503767 [2,0,0,0,0,0|1,0,0]=3 1382 B7R0.4 [O-]C(=O)CCCCO Amb22749314 [2,0,0,0,0,0|1,0,1]=4 1383 B9R0.5 CCCC(=O)O\C=C\C=O Amb25290324 [1,1,0,0,0,0|1,0,1]=4 1384 B9R0.5 CCCC(C)COCC=O Amb24385363 [1,1,0,0,0,0|1,0,1]=4 1385 B9R0.5 CCCC(O)C\C=C\C=C Amb25045684 [1,1,0,0,0,0|1,0,0]=3 1386 B9R0.5 CCCC(O)C\C=C\C=O Amb24383096 [1,1,0,0,0,0|0,0,0]=2 1387 B9R0.5 CCCCCC(=C)CCO Amb25802346 [1,1,0,0,0,0|0,0,2]=4 1388 B9R0.5 CCCCCC(=O)C=C=O Amb24478254 [1,1,0,0,0,0|0,0,1]=3 1389 B9R0.5 CCCCCC(=O)CC=N Amb25146702 [1,1,0,0,0,0|1,0,1]=4 1390 B9R0.5 CCCCCC(=O)CC=O Amb25365648 [1,1,0,0,0,0|0,0,1]=3 1391 B9R0.5 CCCCCC(=O)N=C=O Amb24392136 [1,1,0,0,0,0|1,0,1]=4 1392 B9R0.5 CCCCCC(=O)NCO Amb24478944 [1,1,0,0,0,0|1,0,1]=4 1393 B9R0.5 CCCCCC(=O)OC=C Amb17938956 [1,1,0,0,0,0|2,0,0]=4 1394 B9R0.5 CCCCCC(=O)\C=C/N Amb24408490 [1,1,0,0,0,0|1,0,0]=3 1395 B9R0.5 CCCCCC(C)=CCN Amb25330387 [1,1,0,0,0,0|1,0,1]=4 1396 B9R0.5 CCCCCC(C)=CCO Amb24704431 [1,1,0,0,0,0|0,0,1]=3 1397 B9R0.5 CCCCCC(C)CC=O Amb21953169 [1,1,0,0,0,0|0,0,2]=4 1398 B9R0.5 CCCCCC(Cl)C=NO Amb25361059 [1,1,0,0,0,0|1,0,1]=4 1399 B9R0.5 CCCCCC(O)=CC=O Amb25224445 [1,1,0,0,0,0|0,0,0]=2 1400 B9R0.5 CCCCCC(O)C=NO Amb24473413 [1,1,0,0,0,0|1,0,1]=4 1401 B9R0.5 CCCCCC(O)\C=C\Cl Amb24512016 [1,1,0,0,0,0|1,0,1]=4 1402 B9R0.5 CCCCCN(C)CC=O Amb24478014 [1,1,0,0,0,0|1,0,1]=4 1403 B9R0.5 CCCCC[C@@H](O)CC=O Amb24680284 [1,1,0,0,0,0|0,0,2]=4 1404 B9R0.5 CCCCC[C@@H](O)\C=C\Cl Amb24482173 [1,1,0,0,0,0|1,0,1]=4 1405 B9R0.5 CCCCC[C@H](O)\C=C\Cl Amb24364745 [1,1,0,0,0,0|1,0,1]=4 1406 B9R0.5 CCCCC[C@H](O)\C=C\I Amb24518537 [1,1,0,0,0,0|1,0,1]=4 1407 B9R0.5 CCCCC\C(\C)=C/CBr Amb25290401 [1,1,0,0,0,0|1,0,1]=4 1408 B9R0.5 CCCCC\C(\C)=C\C#N Amb24428989 [1,1,0,0,0,0|1,0,1]=4 1409 B9R0.5 CCCCC\C(\C)=C\C=O Amb18643627 [1,1,0,0,0,0|0,0,0]=2 1410 B9R0.5 CCCCC\C(\O)=C\C=O Amb25326080 [1,1,0,0,0,0|0,0,0]=2 1411 B9R0.5 CCCCOC(=O)/C=C/C Amb17940289 [1,1,0,0,0,0|2,0,0]=4 1412 B9R0.5 CCCCOC(=O)CC=O Amb24722099 [1,1,0,0,0,0|1,0,1]=4 1413 B9R0.5 CCCCOC(=O)\C=C\N Amb24446980 [1,1,0,0,0,0|2,0,0]=4 1414 B9R0.5 CCC\C=C\C(=O)\C=C/O Amb24523803 [1,1,0,0,0,0|0,0,2]=4 1415 B9R0.5 CCOC(C)C\C=C\CO Amb24620831 [1,1,0,0,0,0|1,0,1]=4 1416 B9R0.5 CCOCCC(=O)\C=C\Cl Amb24383480 [1,1,0,0,0,0|2,0,0]=4 1417 B9R0.5 CCOCCC(C)=CCO Amb25066662 [1,1,0,0,0,0|1,0,1]=4 1418 B9R0.5 C\C(\CCCC=C)=C/C=O Amb25707474 [1,1,0,0,0,0|0,0,2]=4 1419 B9R0.5 C\C(\CCCCO)=C/C=O Amb25262253 [1,1,0,0,0,0|1,0,0]=3 1420 B9R0.5 C\C=C/C(=O)CCCCC Amb25086296 [1,1,0,0,0,0|1,0,0]=3 1421 B9R0.5 C\C=C\C(=O)CCCCBr Amb25381449 [1,1,0,0,0,0|2,0,0]=4 1422 B9R0.5 C\C=C\C(=O)CCCCC Amb25146367 [1,1,0,0,0,0|1,0,0]=3 1423 B9R0.5 C\C=C\C(=O)CCCCCl Amb24548775 [1,1,0,0,0,0|2,0,0]=4 1424 B9R0.5 C\C=C\C(=O)CCOCC Amb24676741 [1,1,0,0,0,0|2,0,0]=4 1425 B9R0.5 C\C=C\C(C)CCCCC Amb24639701 [1,1,0,0,0,0|1,0,1]=4 1426 B9R0.5 C\C=C\CCC(O)CCC Amb24747473 [1,1,0,0,0,0|1,0,1]=4 1427 B9R0.5 C\C=C\CC[C@@H](N)CCC Amb25147359 [1,1,0,0,0,0|1,0,1]=4 1428 B9R0.5 C\C=C\CC\C(\C)=C\C=O Amb18643316 [1,1,0,0,0,0|0,0,2]=4 1429 B9R0.18 CCCCC(=C)\C=C\C=O Amb18124519 [1,1,0,0,0,0|0,0,1]=3 1430 B9R0.18 CCCCC(=O)\C=C/C=O Amb25299416 [1,1,0,0,0,0|0,0,1]=3 1431 B9R0.18 CCCCC(=O)\C=C\C=C Amb25338203 [1,1,0,0,0,0|1,0,1]=4 1432 B9R0.18 CCCCC(=O)\C=C\CO Amb25735097 [1,1,0,0,0,0|0,0,2]=4 1433 B9R0.18 CCCCC(C)CCC=O Amb22270225 [1,1,0,0,0,0|0,0,2]=4 1434 B9R0.18 CCCCC(Cl)COC=O Amb25336582 [1,1,0,0,0,0|1,0,1]=4 1435 B9R0.18 CCCCC(N)\C=C\CO Amb24656547 [1,1,0,0,0,0|0,0,1]=3 1436 B9R0.18 CCCCC(O)\C=C\C#C Amb25105899 [1,1,0,0,0,0|1,0,1]=4 1437 B9R0.18 CCCCC(O)\C=C\C#N Amb18643437 [1,1,0,0,0,0|1,0,1]=4 1438 B9R0.18 CCCCC(O)\C=C\C=C Amb24671823 [1,1,0,0,0,0|1,0,0]=3 1439 B9R0.18 CCCCC(O)\C=C\C=O Amb18643941 [1,1,0,0,0,0|0,0,0]=2 1440 B9R0.18 CCCCC(O)\C=C\CC Amb25332314 [1,1,0,0,0,0|1,0,1]=4 1441 B9R0.18 CCCC[C@H](C)CCC=O Amb24389359 [1,1,0,0,0,0|0,0,2]=4 1442 B9R0.18 CCCOC(=O)\C=C\C=O Amb24478353 [1,1,0,0,0,0|1,0,1]=4 1443 B9R0.18 CCCOC(C)\C=C\CO Amb25320645 [1,1,0,0,0,0|1,0,1]=4 1444 B9R0.18 CCCO[C@@H](C)\C=C\CO Amb25823115 [1,1,0,0,0,0|1,0,1]=4 1445 B9R0.18 COCCC(=O)\C=C/C=O Amb25103311 [1,1,0,0,0,0|1,0,1]=4 1446 B9R0.18 COCCC(C)\C=C\CO Amb24658332 [1,1,0,0,0,0|1,0,1]=4 1447 B9R0.18 COCC[C@@H](C)\C=C\CO Amb24481130 [1,1,0,0,0,0|1,0,1]=4 1448 B9R0.18 C\C=C\C[C@@H](O)CCCC Amb25129758 [1,1,0,0,0,0|1,0,1]=4 1449 B9R0.18 OCCCC(O)\C=C\CO Amb25056371 [1,1,0,0,0,0|1,0,1]=4 1450 B9R0.45 C#CCCCC\C=C\CO Amb25042928 [1,1,0,0,0,0|0,0,2]=4 1451 B9R0.45 C=CCCCC\C=C\C=O Amb17593510 [1,1,0,0,0,0|0,0,1]=3 1452 B9R0.45 C=C\C=C\CCCCC=O Amb24678814 [1,1,0,0,0,0|1,0,1]=4 1453 B9R0.45 CC#CCCC\C=C\C=O Amb24418091 [1,1,0,0,0,0|0,0,1]=3 1454 B9R0.45 CC=CC=CCCCCO Amb22231339 [1,1,0,0,0,0|1,0,1]=4 1455 B9R0.45 CCCC=C=C\C=C\CO Amb25792259 [1,1,0,0,0,0|0,0,2]=4 1456 B9R0.45 CCCCC#C\C=C/C=O Amb24399714 [1,1,0,0,0,0|0,0,1]=3 1457 B9R0.45 CCCCC#C\C=C\C=O Amb24564368 [1,1,0,0,0,0|0,0,1]=3 1458 B9R0.45 CCCCC=CC=CCO Amb22228348 [1,1,0,0,0,0|0,0,1]=3 1459 B9R0.45 CCCCCC#C\C=C\Cl Amb24585175 [1,1,0,0,0,0|1,0,1]=4 1460 B9R0.45 CCCCCC=C=CCN Amb25680152 [1,1,0,0,0,0|1,0,1]=4 1461 B9R0.45 CCCCCC=C=CCO Amb25357386 [1,1,0,0,0,0|0,0,1]=3 1462 B9R0.45 CCCCCC=NCCO Amb25769358 [1,1,0,0,0,0|0,0,2]=4 1463 B9R0.45 CCCCCCC#CC=O Amb25227346 [1,1,0,0,0,0|0,0,2]=4 1464 B9R0.45 CCCCCCC=CC=O Amb24061310 [1,1,0,0,0,0|0,0,0]=2 1465 B9R0.45 CCCCCCCC=NO Amb25207893 [1,1,0,0,0,0|0,0,2]=4 1466 B9R0.45 CCCCCCC\C=C\Cl Amb25322197 [1,1,0,0,0,0|1,0,1]=4 1467 B9R0.45 CCCCCCC\C=C\I Amb24708038 [1,1,0,0,0,0|1,0,1]=4 1468 B9R0.45 CCCCCCNC=NO Amb25123252 [1,1,0,0,0,0|1,0,1]=4 1469 B9R0.45 CCCCCC\C=C/C=C Amb22641680 [1,1,0,0,0,0|1,0,0]=3 1470 B9R0.45 CCCCCC\C=C/CO Amb10807383 [1,1,0,0,0,0|0,0,1]=3 1471 B9R0.45 CCCCCC\C=C\CBr Amb25046739 [1,1,0,0,0,0|1,0,1]=4 1472 B9R0.45 CCCCCC\C=C\CCl Amb25728404 [1,1,0,0,0,0|1,0,1]=4 1473 B9R0.45 CCCCCC\C=C\CO Amb22168300 [1,1,0,0,0,0|0,0,1]=3 1474 B9R0.45 CCCCCN\C=C\C#N Amb24386038 [1,1,0,0,0,0|1,0,1]=4 1475 B9R0.45 CCCCCSC\C=C\Cl Amb24457647 [1,1,0,0,0,0|1,0,1]=4 1476 B9R0.45 CCCCCS\C=C\CN Amb24482088 [1,1,0,0,0,0|1,0,1]=4 1477 B9R0.45 CCCCCS\C=C\CO Amb24414212 [1,1,0,0,0,0|0,0,1]=3 1478 B9R0.45 CCCCC\C=C/CC=O Amb22731181 [1,1,0,0,0,0|0,0,0]=2 1479 B9R0.45 CCCCC\C=C\C=CCl Amb24561711 [1,1,0,0,0,0|1,0,0]=3 1480 B9R0.45 CCCCC\C=C\C=CN Amb25224315 [1,1,0,0,0,0|1,0,0]=3 1481 B9R0.45 CCCCC\C=C\CCN Amb25123460 [1,1,0,0,0,0|1,0,1]=4 1482 B9R0.45 CCCCC\C=C\N=[N+]=[N-] Amb24564006 [1,1,0,0,0,0|2,0,0]=4 1483 B9R0.45 CCCCNC\C=C\C=C Amb24621855 [1,1,0,0,0,0|1,0,0]=3 1484 B9R0.45 CCCCSC\C=C\C=O Amb25041125 [1,1,0,0,0,0|0,0,0]=2 1485 B9R0.45 CCCCSC\C=C\CCl Amb25858141 [1,1,0,0,0,0|1,0,1]=4 1486 B9R0.45 CCCCS\C=C\CCO Amb24379996 [1,1,0,0,0,0|1,0,1]=4 1487 B9R0.45 CCCC\C=C/C=C/C=O Amb25770096 [1,1,0,0,0,0|0,0,1]=3 1488 B9R0.45 CCCC\C=C/CCC=O Amb24477003 [1,1,0,0,0,0|0,0,2]=4 1489 B9R0.45 CCCC\C=C\C=C\CO Amb22732540 [1,1,0,0,0,0|0,0,1]=3 1490 B9R0.45 CCC\C=C/CCCCC Amb22230436 [1,1,0,0,0,0|1,0,1]=4 1491 B9R0.45 CCC\C=C/C\C=C\C=O Amb25325046 [1,1,0,0,0,0|0,0,1]=3 1492 B9R0.45 CCC\C=C\CCCCC Amb22231673 [1,1,0,0,0,0|1,0,1]=4 1493 B9R0.45 CCC\C=C\C\C=C\C=O Amb18643331 [1,1,0,0,0,0|0,0,1]=3 1494 B9R0.45 CCNCC\C=C\CC=C Amb25313982 [1,1,0,0,0,0|2,0,0]=4 1495 B9R0.45 CCNCC\C=C\COC Amb25771490 [1,1,0,0,0,0|1,0,1]=4 1496 B9R0.45 CCOC=CCCCCC Amb22227936 [1,1,0,0,0,0|1,0,1]=4 1497 B9R0.45 CCOCCCCCC=O Amb25724799 [1,1,0,0,0,0|0,0,2]=4 1498 B9R0.45 CCSCCCCCC=O Amb25205442 [1,1,0,0,0,0|0,0,2]=4 1499 B9R0.45 CC\C=C/CCCCCC Amb22230427 [1,1,0,0,0,0|1,0,1]=4 1500 B9R0.45 CC\C=C/C\C=C/CC=O Amb18643319 [1,1,0,0,0,0|0,0,2]=4 1501 B9R0.45 CC\C=C/C\C=C\CC=O Amb25366207 [1,1,0,0,0,0|0,0,2]=4 1502 B9R0.45 CC\C=C\CC=CCC=O Amb25242084 [1,1,0,0,0,0|0,0,2]=4 1503 B9R0.45 CC\C=C\CCCCCBr Amb25224953 [1,1,0,0,0,0|1,0,1]=4 1504 B9R0.45 CC\C=C\CCCCCC Amb22231672 [1,1,0,0,0,0|1,0,1]=4 1505 B9R0.45 CC\C=C\CCNCCC Amb25066619 [1,1,0,0,0,0|1,0,1]=4 1506 B9R0.45 CC\C=C\CC\C=C\C=O Amb18124509 [1,1,0,0,0,0|0,0,1]=3 1507 B9R0.45 CC\C=C\CC\C=C\CO Amb10807373 [1,1,0,0,0,0|0,0,2]=4 1508 B9R0.45 COCCCCCNC=O Amb24688397 [1,1,0,0,0,0|1,0,1]=4 1509 B9R0.45 COCOCC\C=C\C=O Amb25679546 [1,1,0,0,0,0|1,0,0]=3 1510 B9R0.45 COCOCC\C=C\CO Amb25677675 [1,1,0,0,0,0|1,0,1]=4 1511 B9R0.45 COC\C=C\CCCCO Amb25125960 [1,1,0,0,0,0|1,0,1]=4 1512 B9R0.45 CO\C=C\CCCCCBr Amb24477215 [1,1,0,0,0,0|1,0,1]=4 1513 B9R0.45 C\C=C/C=C\CCCCC Amb22641684 [1,1,0,0,0,0|1,0,0]=3 1514 B9R0.45 C\C=C\C=CCCCCBr Amb25206214 [1,1,0,0,0,0|1,0,1]=4 1515 B9R0.45 C\C=C\C=CCCCCO Amb25238019 [1,1,0,0,0,0|1,0,1]=4 1516 B9R0.45 C\C=C\CCCCCCC Amb22730483 [1,1,0,0,0,0|1,0,1]=4 1517 B9R0.45 C\C=C\CCCNCCC Amb24359820 [1,1,0,0,0,0|1,0,1]=4 1518 B9R0.45 C\C=C\CCC\C=C\C=O Amb24381698 [1,1,0,0,0,0|0,0,1]=3 1519 B9R0.45 C\C=C\CCOCCCC Amb25695148 [1,1,0,0,0,0|1,0,1]=4 1520 B9R0.45 ClC\C=C\CCCCCCl Amb24652487 [1,1,0,0,0,0|1,0,1]=4 1521 B9R0.45 FC\C=C\CCCCCBr Amb25808973 [1,1,0,0,0,0|1,0,1]=4 1522 B9R0.45 O=CC#CCCCCCCl Amb24480407 [1,1,0,0,0,0|0,0,2]=4 1523 B9R0.45 O=CCCCCCCCF Amb25075653 [1,1,0,0,0,0|0,0,2]=4 1524 B9R0.45 O=COCCCCCCBr Amb25074988 [1,1,0,0,0,0|1,0,1]=4 1525 B9R0.45 O=C\C=C\CCCC=C=O Amb24418469 [1,1,0,0,0,0|0,0,2]=4 1526 B9R0.45 OCCCCCCCC=O Amb25765567 [1,1,0,0,0,0|0,0,2]=4 1527 B9R0.45 OCCCCCCNC=O Amb24452880 [1,1,0,0,0,0|1,0,1]=4 1528 B9R0.45 OCCCCC\C=C/CC Amb10807384 [1,1,0,0,0,0|1,0,1]=4 1529 B9R0.45 OCCCCC\C=C\CCl Amb24573026 [1,1,0,0,0,0|1,0,1]=4 1530 B9R0.45 OCCCCC\C=C\CF Amb24748585 [1,1,0,0,0,0|1,0,1]=4 1531 B9R0.45 OC\C=C\CCCCCBr Amb24666213 [1,1,0,0,0,0|0,0,1]=3 1532 B9R0.45 OC\C=C\CCCCCCl Amb24604808 [1,1,0,0,0,0|0,0,1]=3 1533 B9R0.46 C=C(C=O)OCCCCBr Amb25685896 [1,1,0,0,0,0|2,0,0]=4 1534 B9R0.46 CC(C=O)=CCCCC#C Amb24582020 [1,1,0,0,0,0|0,0,2]=4 1535 B9R0.46 CC(CO)=CCCCCO Amb24719754 [1,1,0,0,0,0|1,0,1]=4 1536 B9R0.46 CCC(=O)OC\C=C\C=O Amb18643835 [1,1,0,0,0,0|1,0,1]=4 1537 B9R0.46 CCC(C)\C=C\C=C/C=O Amb18643327 [1,1,0,0,0,0|0,0,2]=4 1538 B9R0.46 CCC(N)CC\C=C\CC Amb24542855 [1,1,0,0,0,0|1,0,1]=4 1539 B9R0.46 CCCCC#CC(=C)C=O Amb25319160 [1,1,0,0,0,0|0,0,2]=4 1540 B9R0.46 CCCCCCC(=C)CO Amb25145395 [1,1,0,0,0,0|0,0,2]=4 1541 B9R0.46 CCCCCCC(=N)NO Amb22733338 [1,1,0,0,0,0|1,0,1]=4 1542 B9R0.46 CCCCCCC(=O)NO Amb25146254 [1,1,0,0,0,0|1,0,1]=4 1543 B9R0.46 CCCCCCC(C)=NO Amb24476810 [1,1,0,0,0,0|1,0,1]=4 1544 B9R0.46 CCCCCCC(C=O)C Amb10603627 [1,1,0,0,0,0|0,0,2]=4 1545 B9R0.46 CCCCCCC(F)C=O Amb25069121 [1,1,0,0,0,0|0,0,2]=4 1546 B9R0.46 CCCCCCC(O)C=O Amb25820734 [1,1,0,0,0,0|0,0,2]=4 1547 B9R0.46 CCCCCC[C@H](C)C=O Amb24374798 [1,1,0,0,0,0|0,0,2]=4 1548 B9R0.46 CCCCCC[C@H](Cl)C=O Amb25109926 [1,1,0,0,0,0|0,0,2]=4 1549 B9R0.46 CCCCCC[C@H](F)C=O Amb24424433 [1,1,0,0,0,0|0,0,2]=4 1550 B9R0.46 CCCCCC[C@H](O)C=O Amb25285757 [1,1,0,0,0,0|0,0,2]=4 1551 B9R0.46 CCCCCNC(=O)CO Amb17334236 [1,1,0,0,0,0|1,0,1]=4 1552 B9R0.46 CCCCCNC(N)=NO Amb25041541 [1,1,0,0,0,0|2,0,0]=4 1553 B9R0.46 CCCCCOC(=O)C=C Amb17933944 [1,1,0,0,0,0|2,0,0]=4 1554 B9R0.46 CCCCCSC(=C)CO Amb25854022 [1,1,0,0,0,0|1,0,1]=4 1555 B9R0.46 CCCCC\C=C(/C)\C=O Amb18643629 [1,1,0,0,0,0|0,0,0]=2 1556 B9R0.46 CCCCC\C=C(/C)\CBr Amb24597156 [1,1,0,0,0,0|1,0,1]=4 1557 B9R0.46 CCCCC\C=C(\C)/CBr Amb24583665 [1,1,0,0,0,0|1,0,1]=4 1558 B9R0.46 CCCCC\C=C(\F)/CCl Amb24480542 [1,1,0,0,0,0|1,0,1]=4 1559 B9R0.46 CCCCO\C=C(\C)/C=O Amb24744737 [1,1,0,0,0,0|1,0,0]=3 1560 B9R0.46 CCCC\C=C\C(C)C=O Amb24478317 [1,1,0,0,0,0|0,0,2]=4 1561 B9R0.46 CCCNC\C=C(\C)/CO Amb18644033 [1,1,0,0,0,0|1,0,1]=4 1562 B9R0.46 CCOCCOC(=C)C=O Amb25770095 [1,1,0,0,0,0|2,0,0]=4 1563 B9R0.46 CC[C@H](C)CCCCC=O Amb25691434 [1,1,0,0,0,0|0,0,2]=4 1564 B9R0.46 COC(=O)CC\C=C/C=O Amb24536495 [1,1,0,0,0,0|1,0,1]=4 1565 B9R0.46 COC(=O)CC\C=C\C=O Amb18643849 [1,1,0,0,0,0|1,0,1]=4 1566 B9R0.46 COCCC\C=C(\C)/C=O Amb25308818 [1,1,0,0,0,0|1,0,0]=3 1567 B9R0.46 COCCC\C=C(\C)/CO Amb24513532 [1,1,0,0,0,0|1,0,1]=4 1568 B9R0.46 C\C(\C=O)=C/CCCC#C Amb24478336 [1,1,0,0,0,0|0,0,2]=4 1569 B9R0.46 C\C(\CO)=C/CCCCN Amb25314967 [1,1,0,0,0,0|1,0,1]=4 1570 B9R0.46 OCCCCCC(=O)C=O Amb24478225 [1,1,0,0,0,0|1,0,1]=4 1571 B9R0.1 CC(CCCC(O)=O)CO Amb25068017 [1,1,0,0,0,0|1,0,1]=4 1572 B9R0.1 CC(CCl)CCCC(O)=O Amb18646189 [1,1,0,0,0,0|1,0,1]=4 1573 B9R0.1 CC(C\C=C\C(O)=O)C#N Amb24670837 [1,1,0,0,0,0|1,0,1]=4 1574 B9R0.1 CC(C\C=C\C(O)=O)C=C Amb24598302 [1,1,0,0,0,0|0,0,2]=4 1575 B9R0.1 CCC(Br)CCNC(C)=O Amb24388776 [1,1,0,0,0,0|2,0,0]=4 1576 B9R0.1 CCC(C)CC#CC(O)=O Amb24661749 [1,1,0,0,0,0|0,0,2]=4 1577 B9R0.1 CCC(C)CCC=C(C)C Amb25076343 [1,1,0,0,0,0|2,0,0]=4 1578 B9R0.1 CCC(C)CCCC(C)=O Amb24424926 [1,1,0,0,0,0|1,0,1]=4 1579 B9R0.1 CCC(C)CCCC(N)=O Amb24350177 [1,1,0,0,0,0|1,0,1]=4 1580 B9R0.1 CCC(C)CCCC(O)=O Amb18124682 [1,1,0,0,0,0|0,0,1]=3 1581 B9R0.1 CCC(C)CCOC(C)=O Amb24325171 [1,1,0,0,0,0|2,0,0]=4 1582 B9R0.1 CCC(C)CCOC(N)=O Amb24478211 [1,1,0,0,0,0|2,0,0]=4 1583 B9R0.1 CCC(C)CSCC(O)=O Amb18800668 [1,1,0,0,0,0|1,0,1]=4 1584 B9R0.1 CCC(C)O\C=C\C(C)=O Amb24690824 [1,1,0,0,0,0|2,0,0]=4 1585 B9R0.1 CCC(C)S\C=C\C(O)=O Amb24431541 [1,1,0,0,0,0|1,0,0]=3 1586 B9R0.1 CCC(Cl)CCCC(=O)Cl Amb25088358 [1,1,0,0,0,0|1,0,1]=4 1587 B9R0.1 CCC(Cl)CCNC(C)=O Amb24407934 [1,1,0,0,0,0|2,0,0]=4 1588 B9R0.1 CCC(F)CCCC(C)=O Amb25320248 [1,1,0,0,0,0|1,0,1]=4 1589 B9R0.1 CCC(N)CCNC(C)=O Amb25369840 [1,1,0,0,0,0|2,0,0]=4 1590 B9R0.1 CCC(N)COCC(O)=O Amb18630610 [1,1,0,0,0,0|1,0,1]=4 1591 B9R0.1 CCC(O)CCCC(C)=O Amb25146602 [1,1,0,0,0,0|1,0,1]=4 1592 B9R0.1 CCC(O)CCCC(O)=O Amb18644263 [1,1,0,0,0,0|0,0,1]=3 1593 B9R0.1 CCC(O)CCOC(C)=O Amb25345386 [1,1,0,0,0,0|2,0,0]=4 1594 B9R0.1 CCC(O)CCSC(C)=O Amb24379978 [1,1,0,0,0,0|2,0,0]=4 1595 B9R0.1 CCC(O)COCC(O)=O Amb25805810 [1,1,0,0,0,0|1,0,1]=4 1596 B9R0.1 CCC(O)CSCC(O)=O Amb18792573 [1,1,0,0,0,0|1,0,1]=4 1597 B9R0.1 CCN(C)C\C=C\C(O)=O Amb19020698 [1,1,0,0,0,0|1,0,0]=3 1598 B9R0.1 CCS(=O)CCCC(O)=O Amb18788302 [1,1,0,0,0,0|1,0,1]=4 1599 B9R0.1 CC[C@H](C)CCCC(C)=O Amb25128211 [1,1,0,0,0,0|1,0,1]=4 1600 B9R0.1 COC(=O)C\C=C\C(O)=O Amb25132100 [1,1,0,0,0,0|1,0,1]=4 1601 B9R0.1 COC(C)CCCC(O)=O Amb25728362 [1,1,0,0,0,0|1,0,1]=4 1602 B9R0.1 CSC(C)CCCC(O)=O Amb25265803 [1,1,0,0,0,0|1,0,1]=4 1603 B9R0.1 NC(CS)CCCC(O)=O Amb25706315 [1,1,0,0,0,0|1,0,1]=4 1604 B9R0.1 NCC(N)CCCC(O)=O Amb24375177 [1,1,0,0,0,0|1,0,1]=4 1605 B9R0.1 NC[C@@H](N)CCCC(O)=O Amb25147297 [1,1,0,0,0,0|1,0,1]=4 1606 B9R0.1 N[C@@H](CS)CCCC(O)=O Amb25288626 [1,1,0,0,0,0|1,0,1]=4 1607 B9R0.1 N[C@H](CS)CCCC(O)=O Amb24482180 [1,1,0,0,0,0|1,0,1]=4 1608 B9R0.1 OC(=O)CCCC(Cl)CCl Amb18649051 [1,1,0,0,0,0|1,0,1]=4 1609 B9R0.4 CC(=CC(N)=O)SCCC Amb25257909 [1,1,0,0,0,0|2,0,0]=4 1610 B9R0.4 CC(=CC(O)=O)OCCC Amb24629232 [1,1,0,0,0,0|1,0,0]=3 1611 B9R0.4 CC(=CC(O)=O)SCCC Amb25362094 [1,1,0,0,0,0|1,0,0]=3 1612 B9R0.4 CC(=O)C=C(N)COCC Amb24759167 [1,1,0,0,0,0|2,0,0]=4 1613 B9R0.4 CC(=O)CC(=O)CCCC Amb22347234 [1,1,0,0,0,0|1,0,1]=4 1614 B9R0.4 CC(=O)\C=C(/Cl)\CCCC Amb25712728 [1,1,0,0,0,0|1,0,0]=3 1615 B9R0.4 CC(=O)\C=C(/N)\CCCC Amb25317904 [1,1,0,0,0,0|1,0,0]=3 1616 B9R0.4 CC(=O)\C=C(/N)\COCC Amb25793057 [1,1,0,0,0,0|2,0,0]=4 1617 B9R0.4 CC(=O)\C=C(/N)\SCCC Amb24415410 [1,1,0,0,0,0|2,0,0]=4 1618 B9R0.4 CC(CCCBr)=CC(O)=O Amb24654967 [1,1,0,0,0,0|1,0,0]=3 1619 B9R0.4 CC(CCCC)=CC(N)=O Amb25840047 [1,1,0,0,0,0|1,0,0]=3 1620 B9R0.4 CC(CCCC)=NC(N)=O Amb24695360 [1,1,0,0,0,0|2,0,0]=4 1621 B9R0.4 CC(CCCCl)CC(O)=O Amb18646190 [1,1,0,0,0,0|1,0,1]=4 1622 B9R0.4 CC(CCCN)CC(O)=O Amb24761313 [1,1,0,0,0,0|1,0,1]=4 1623 B9R0.4 CC(CCOC)=CC(C)=O Amb24479504 [1,1,0,0,0,0|2,0,0]=4 1624 B9R0.4 CC(CCOC)=CC(O)=O Amb25309097 [1,1,0,0,0,0|1,0,0]=3 1625 B9R0.4 CC(CNCC)=CC(O)=O Amb24643336 [1,1,0,0,0,0|1,0,0]=3 1626 B9R0.4 CC(COCC)=CC(O)=O Amb25348858 [1,1,0,0,0,0|1,0,0]=3 1627 B9R0.4 CCCCC(=C)CC(O)=O Amb18643896 [1,1,0,0,0,0|0,0,1]=3 1628 B9R0.4 CCCCC(C)CC(C)=O Amb25051695 [1,1,0,0,0,0|1,0,1]=4 1629 B9R0.4 CCCCC(C)CC(N)=O Amb24761512 [1,1,0,0,0,0|1,0,1]=4 1630 B9R0.4 CCCCC(CC(=O)O)N Amb1993866 [1,1,0,0,0,0|0,0,1]=3 1631 B9R0.4 CCCCC(Cl)=CC(O)=O Amb25179107 [1,1,0,0,0,0|0,0,0]=2 1632 B9R0.4 CCCCC(Cl)C=C(Cl)Cl Amb25770583 [1,1,0,0,0,0|2,0,0]=4 1633 B9R0.4 CCCCC(Cl)CC(=O)Cl Amb24563246 [1,1,0,0,0,0|1,0,1]=4 1634 B9R0.4 CCCCC(Cl)OC(=O)Cl Amb24571701 [1,1,0,0,0,0|2,0,0]=4 1635 B9R0.4 CCCCC(Cl)OC(C)=O Amb24724411 [1,1,0,0,0,0|2,0,0]=4 1636 B9R0.4 CCCCC(F)=CC(O)=O Amb24568324 [1,1,0,0,0,0|0,0,0]=2 1637 B9R0.4 CCCCC(N)CC(N)=O Amb24638916 [1,1,0,0,0,0|1,0,1]=4 1638 B9R0.4 CCCCC(O)CC(N)=O Amb24563459 [1,1,0,0,0,0|1,0,1]=4 1639 B9R0.4 CCCCC(O)CC(O)=O Amb22388888 [1,1,0,0,0,0|0,0,1]=3 1640 B9R0.4 CCCCS(=O)CC(O)=O Amb18792577 [1,1,0,0,0,0|1,0,1]=4 1641 B9R0.4 CCCC[C@@H](C)NC(C)=O Amb24681561 [1,1,0,0,0,0|2,0,0]=4 1642 B9R0.4 CCCC[C@@H](O)CC(N)=O Amb24549040 [1,1,0,0,0,0|1,0,1]=4 1643 B9R0.4 CCCC[C@@H](O)CC(O)=O Amb24350627 [1,1,0,0,0,0|0,0,1]=3 1644 B9R0.4 CCCC[C@H](N)CC(N)=O Amb25147366 [1,1,0,0,0,0|1,0,1]=4 1645 B9R0.4 CCCC[C@H](O)CC(C)=O Amb25245692 [1,1,0,0,0,0|1,0,1]=4 1646 B9R0.4 CCCC\C(\C)=C\C(C)=O Amb24698890 [1,1,0,0,0,0|1,0,0]=3 1647 B9R0.4 CCCC\C(\Cl)=C/C(O)=O Amb25279577 [1,1,0,0,0,0|0,0,0]=2 1648 B9R0.4 CCCC\C(\F)=C/C(O)=O Amb18124779 [1,1,0,0,0,0|0,0,0]=2 1649 B9R0.4 CCCNC(=O)CC(=O)O Amb17399888 [1,1,0,0,0,0|1,0,1]=4 1650 B9R0.4 CCCN\C(\C)=C\C(C)=O Amb24467024 [1,1,0,0,0,0|2,0,0]=4 1651 B9R0.4 CCCO[C@H](C)CC(O)=O Amb24450437 [1,1,0,0,0,0|1,0,1]=4 1652 B9R0.4 CCOCC(C)CC(O)=O Amb18202330 [1,1,0,0,0,0|1,0,1]=4 1653 B9R0.4 CCOCC(Cl)CC(O)=O Amb24426131 [1,1,0,0,0,0|1,0,1]=4 1654 B9R0.4 CNCCC(C)CC(O)=O Amb24694269 [1,1,0,0,0,0|1,0,1]=4 1655 B9R0.4 CNCC[C@@H](N)CC(O)=O Amb24117036 [1,1,0,0,0,0|1,0,1]=4 1656 B9R0.4 CNCC[C@H](N)CC(O)=O Amb25789535 [1,1,0,0,0,0|1,0,1]=4 1657 B9R0.4 CSCCC(N)CC(O)=O Amb22353181 [1,1,0,0,0,0|1,0,1]=4 1658 B9R0.4 CSCCC(O)CC(O)=O Amb18798349 [1,1,0,0,0,0|1,0,1]=4 1659 B9R0.4 CSCC[C@@H](CC(=O)O)N Amb16184019 [1,1,0,0,0,0|1,0,1]=4 1660 B9R0.4 CSCC[C@H](N)CC(O)=O Amb22352993 [1,1,0,0,0,0|1,0,1]=4 1661 B9R0.4 C[C@@H](CCCN)CC(O)=O Amb24744945 [1,1,0,0,0,0|1,0,1]=4 1662 B9R0.4 C[C@H](CCCN)CC(O)=O Amb24715301 [1,1,0,0,0,0|1,0,1]=4 1663 B9R0.4 C[C@H](CCCS)CC(O)=O Amb24358051 [1,1,0,0,0,0|1,0,1]=4 1664 B9R0.4 C\C(=C/C(O)=O)\OCOC Amb24505156 [1,1,0,0,0,0|2,0,0]=4 1665 B9R0.4 C\C(=C/C(O)=O)\SCCC Amb25032478 [1,1,0,0,0,0|1,0,0]=3 1666 B9R0.4 C\C(\CCC=C)=C/C(O)=O Amb18643565 [1,1,0,0,0,0|0,0,2]=4 1667 B9R0.4 C\C(\CCC=C)=C\C(O)=O Amb25242614 [1,1,0,0,0,0|0,0,2]=4 1668 B9R0.4 C\C(\CCCCl)=C\C(O)=O Amb18126354 [1,1,0,0,0,0|1,0,0]=3 1669 B9R0.4 C\C(\N)=C\C(=O)CCCC Amb24608603 [1,1,0,0,0,0|2,0,0]=4 1670 B9R0.4 C\C(\O)=C/C(=O)CCCC Amb25146869 [1,1,0,0,0,0|1,0,0]=3 1671 B9R0.4 C\C(\O)=C\C(=O)CCCC Amb25729180 [1,1,0,0,0,0|1,0,0]=3 1672 B9R0.4 C\C(\O)=C\C(=O)OCCC Amb24595160 [1,1,0,0,0,0|2,0,0]=4 1673 B9R0.4 NC(CCCS)CC(O)=O Amb24524306 [1,1,0,0,0,0|1,0,1]=4 1674 B9R0.4 NCCCC(N)CC(O)=O Amb18644278 [1,1,0,0,0,0|1,0,1]=4 1675 B9R0.4 NCCC[C@@H](N)CC(O)=O Amb24117039 [1,1,0,0,0,0|1,0,1]=4 1676 B9R0.4 NCCC[C@@H](N)CC(O)=O Amb24117927 [1,1,0,0,0,0|1,0,1]=4 1677 B9R0.4 NCCC[C@H](N)CC(O)=O Amb25757485 [1,1,0,0,0,0|1,0,1]=4 1678 B9R0.4 O[C@@H](CCCBr)CC(O)=O Amb24605609 [1,1,0,0,0,0|1,0,1]=4 1679 B9R0.38 CCCCCCS(O)(=O)=O Amb25138206 [1,1,0,0,0,0|1,0,1]=4 1680 B9R0.38 CCCCCNS(O)(=O)=O Amb24535979 [1,1,0,0,0,0|2,0,0]=4 1681 B9R0.38 CCCCCOP(O)(O)=O Amb22168445 [1,1,0,0,0,0|2,0,0]=4 1682 B9R0.38 CCCC\C=C\S(=O)(=O)Cl Amb24443682 [1,1,0,0,0,0|1,0,1]=4 1683 B9R0.47 C#CCCCC(=O)C(O)=O Amb24592957 [1,1,0,0,0,0|0,0,2]=4 1684 B9R0.47 C=C(CCCC#C)C(O)=O Amb25118890 [1,1,0,0,0,0|0,0,2]=4 1685 B9R0.47 C=C(CCCC=C)C(O)=O Amb24585641 [1,1,0,0,0,0|0,0,2]=4 1686 B9R0.47 C=C(CCCCO)C(O)=O Amb24479220 [1,1,0,0,0,0|1,0,0]=3 1687 B9R0.47 C=C(CNCCO)C(O)=O Amb25091316 [1,1,0,0,0,0|2,0,0]=4 1688 B9R0.47 C=C(CSCCN)C(O)=O Amb24411908 [1,1,0,0,0,0|2,0,0]=4 1689 B9R0.47 C=CCCCC(=O)C(O)=O Amb24459619 [1,1,0,0,0,0|0,0,2]=4 1690 B9R0.47 CC(=C)C(=O)CCCCC Amb25146665 [1,1,0,0,0,0|2,0,0]=4 1691 B9R0.47 CC(=C=CCCC)C(O)=O Amb24409524 [1,1,0,0,0,0|0,0,2]=4 1692 B9R0.47 CC(=CCCC#C)C(O)=O Amb25230847 [1,1,0,0,0,0|0,0,2]=4 1693 B9R0.47 CC(=CCCCCl)C(=O)Cl Amb25263393 [1,1,0,0,0,0|2,0,0]=4 1694 B9R0.47 CC(=NOCCC)C(O)=O Amb24757594 [1,1,0,0,0,0|2,0,0]=4 1695 B9R0.47 CC(=O)C(=C)CCCCC Amb24708779 [1,1,0,0,0,0|1,0,0]=3 1696 B9R0.47 CC(=O)C(=C)COCCC Amb25226745 [1,1,0,0,0,0|2,0,0]=4 1697 B9R0.47 CC(=O)C(=O)CCCCCl Amb24480576 [1,1,0,0,0,0|2,0,0]=4 1698 B9R0.47 CC(=O)C(=O)CCCCO Amb24524628 [1,1,0,0,0,0|2,0,0]=4 1699 B9R0.47 CC(=O)C(=O)\C=C\CCC Amb25255453 [1,1,0,0,0,0|1,0,1]=4 1700 B9R0.47 CC(=O)C(Cl)=NCCCC Amb24512403 [1,1,0,0,0,0|2,0,0]=4 1701 B9R0.47 CC(=O)\C(\Cl)=C/CCCC Amb24598892 [1,1,0,0,0,0|1,0,0]=3 1702 B9R0.47 CC(=O)\C(\O)=C/NCCC Amb24670646 [1,1,0,0,0,0|2,0,0]=4 1703 B9R0.47 CC(C)=C(C)CCCCC Amb22228299 [1,1,0,0,0,0|2,0,0]=4 1704 B9R0.47 CC(CCCCF)C(O)=O Amb24370978 [1,1,0,0,0,0|1,0,1]=4 1705 B9R0.47 CC(CCCCN)C(O)=O Amb18644200 [1,1,0,0,0,0|1,0,1]=4 1706 B9R0.47 CCCCCC(=C)C(C)O Amb25828956 [1,1,0,0,0,0|1,0,1]=4 1707 B9R0.47 CCCCCC(=C)C(N)=O Amb25774332 [1,1,0,0,0,0|1,0,0]=3 1708 B9R0.47 CCCCCC(=C)C(O)=O Amb18643927 [1,1,0,0,0,0|0,0,0]=2 1709 B9R0.47 CCCCCC(=C)[C@@H](C)O Amb24625124 [1,1,0,0,0,0|1,0,1]=4 1710 B9R0.47 CCCCCC(=O)C(=C)F Amb24736420 [1,1,0,0,0,0|2,0,0]=4 1711 B9R0.47 CCCCCC(=O)C(=O)C Amb15693393 [1,1,0,0,0,0|1,0,0]=3 1712 B9R0.47 CCCCCC(=O)C(=O)Cl Amb24647840 [1,1,0,0,0,0|1,0,0]=3 1713 B9R0.47 CCCCCC(=O)C(C)O Amb25146485 [1,1,0,0,0,0|1,0,1]=4 1714 B9R0.47 CCCCCC(=O)C(O)=O Amb18644122 [1,1,0,0,0,0|0,0,0]=2 1715 B9R0.47 CCCCCC(=O)[C@@H](C)O Amb25729179 [1,1,0,0,0,0|1,0,1]=4 1716 B9R0.47 CCCCCC(Br)C(N)=O Amb25857400 [1,1,0,0,0,0|1,0,1]=4 1717 B9R0.47 CCCCCC(Br)C(O)=O Amb18130346 [1,1,0,0,0,0|0,0,1]=3 1718 B9R0.47 CCCCCC(C(=O)O)F Amb17593693 [1,1,0,0,0,0|0,0,1]=3 1719 B9R0.47 CCCCCC(C)C(=O)Cl Amb25127828 [1,1,0,0,0,0|1,0,1]=4 1720 B9R0.47 CCCCCC(C)C(N)=O Amb24568260 [1,1,0,0,0,0|1,0,1]=4 1721 B9R0.47 CCCCCC(C)P(O)=O Amb25287382 [1,1,0,0,0,0|1,0,1]=4 1722 B9R0.47 CCCCCC(Cl)C(N)=O Amb18800736 [1,1,0,0,0,0|1,0,1]=4 1723 B9R0.47 CCCCCC(Cl)C(O)=O Amb18646187 [1,1,0,0,0,0|0,0,1]=3 1724 B9R0.47 CCCCCC(F)C(C)=O Amb25763258 [1,1,0,0,0,0|1,0,1]=4 1725 B9R0.47 CCCCCC(F)C(N)=O Amb25147451 [1,1,0,0,0,0|1,0,1]=4 1726 B9R0.47 CCCCCC(N)C(C)=O Amb24446263 [1,1,0,0,0,0|1,0,1]=4 1727 B9R0.47 CCCCCC(N)C(N)=O Amb25843277 [1,1,0,0,0,0|1,0,1]=4 1728 B9R0.47 CCCCCC(O)C(N)=O Amb24478096 [1,1,0,0,0,0|1,0,1]=4 1729 B9R0.47 CCCCCC(O)C(O)=O Amb17778103 [1,1,0,0,0,0|0,0,1]=3 1730 B9R0.47 CCCCCN(C)C(=O)Cl Amb25032287 [1,1,0,0,0,0|2,0,0]=4 1731 B9R0.47 CCCCCN(C)C(C)=O Amb24621351 [1,1,0,0,0,0|2,0,0]=4 1732 B9R0.47 CCCCC[C@@H](C(=O)O)C Amb10844510 [1,1,0,0,0,0|0,0,1]=3 1733 B9R0.47 CCCCC[C@@H](N)C(O)=O Amb22745982 [1,1,0,0,0,0|0,0,1]=3 1734 B9R0.47 CCCCC[C@@H](O)C(C)=O Amb24480618 [1,1,0,0,0,0|1,0,1]=4 1735 B9R0.47 CCCCC[C@H](Br)C(C)=O Amb25187962 [1,1,0,0,0,0|1,0,1]=4 1736 B9R0.47 CCCCC[C@H](C(=O)O)C Amb10844515 [1,1,0,0,0,0|0,0,1]=3 1737 B9R0.47 CCCCC[C@H](C)C(C)=O Amb25134138 [1,1,0,0,0,0|1,0,1]=4 1738 B9R0.47 CCCCC[C@H](N)C(N)=O Amb24502148 [1,1,0,0,0,0|1,0,1]=4 1739 B9R0.47 CCCCC[C@H](N)C(O)=O Amb17943098 [1,1,0,0,0,0|0,0,1]=3 1740 B9R0.47 CCCCC[C@H](O)C(O)=O Amb25728353 [1,1,0,0,0,0|0,0,1]=3 1741 B9R0.47 CCCCNC(=N)C(O)=O Amb24746786 [1,1,0,0,0,0|1,0,0]=3 1742 B9R0.47 CCCCNC(=O)C(=O)C Amb17399878 [1,1,0,0,0,0|2,0,0]=4 1743 B9R0.47 CCCCOC(=N)C(N)=O Amb24470659 [1,1,0,0,0,0|2,0,0]=4 1744 B9R0.47 CCCCOC(=O)C(=O)C Amb15692541 [1,1,0,0,0,0|2,0,0]=4 1745 B9R0.47 CCCCOC(=O)C(=O)Cl Amb25316230 [1,1,0,0,0,0|2,0,0]=4 1746 B9R0.47 CCCCOC(=O)C(N)=O Amb22734019 [1,1,0,0,0,0|2,0,0]=4 1747 B9R0.47 CCCCO[C@H](C)C(O)=O Amb24480807 [1,1,0,0,0,0|1,0,1]=4 1748 B9R0.47 CCCCS[C@H](C)C(O)=O Amb24725214 [1,1,0,0,0,0|1,0,1]=4 1749 B9R0.47 CCCC\C=C(/C)\C(C)=O Amb24378444 [1,1,0,0,0,0|1,0,0]=3 1750 B9R0.47 CCCC\C=C(/C)\[N+]([O-])=O Amb25824021 [1,1,0,0,0,0|1,0,1]=4 1751 B9R0.47 CCCC\C=C(/N)\C(N)=O Amb24640945 [1,1,0,0,0,0|1,0,0]=3 1752 B9R0.47 CCCC\C=C(\Br)/B(O)O Amb25105897 [1,1,0,0,0,0|1,0,1]=4 1753 B9R0.47 CCCC\C=C(\C)/B(O)O Amb24558321 [1,1,0,0,0,0|1,0,1]=4 1754 B9R0.47 CCCC\C=C(\C)/C(C)O Amb25769451 [1,1,0,0,0,0|1,0,1]=4 1755 B9R0.47 CCCC\C=C(\C)/[N+]([O-])=O Amb25247778 [1,1,0,0,0,0|1,0,1]=4 1756 B9R0.47 CCCC\C=C(\Cl)/C(O)=O Amb25299436 [1,1,0,0,0,0|0,0,0]=2 1757 B9R0.47 CCCC\N=C(/C)\C(C)=O Amb25073215 [1,1,0,0,0,0|2,0,0]=4 1758 B9R0.47 CCCNCC(=C)C(O)=O Amb24479657 [1,1,0,0,0,0|1,0,0]=3 1759 B9R0.47 CCCNCC(O)C(O)=O Amb24734975 [1,1,0,0,0,0|1,0,1]=4 1760 B9R0.47 CCCN\C=C(/C)\C(C)=O Amb25146791 [1,1,0,0,0,0|2,0,0]=4 1761 B9R0.47 CCCN\C=C(\C)/C(C)=O Amb25244710 [1,1,0,0,0,0|2,0,0]=4 1762 B9R0.47 CCCOCC(=C)C(N)=O Amb25836866 [1,1,0,0,0,0|2,0,0]=4 1763 B9R0.47 CCCOCC(Cl)C(O)=O Amb25713951 [1,1,0,0,0,0|1,0,1]=4 1764 B9R0.47 CCCOCC(N)C(O)=O Amb24621740 [1,1,0,0,0,0|1,0,1]=4 1765 B9R0.47 CCCOCC(O)C(O)=O Amb25098725 [1,1,0,0,0,0|1,0,1]=4 1766 B9R0.47 CCCSC[C@@H](N)C(O)=O Amb18792511 [1,1,0,0,0,0|1,0,1]=4 1767 B9R0.47 CCCSC[C@H](O)C(O)=O Amb24482234 [1,1,0,0,0,0|1,0,1]=4 1768 B9R0.47 CCC\C=C\C(=O)C(O)=O Amb25270853 [1,1,0,0,0,0|0,0,1]=3 1769 B9R0.47 CCC\C=C\C(C)C(O)=O Amb25687429 [1,1,0,0,0,0|0,0,2]=4 1770 B9R0.47 CCC\C=C\C(N)C(O)=O Amb24656860 [1,1,0,0,0,0|0,0,2]=4 1771 B9R0.47 CCC\C=C\C(O)C(O)=O Amb25113481 [1,1,0,0,0,0|0,0,2]=4 1772 B9R0.47 CCC\C=C\[C@H](N)C(O)=O Amb24547580 [1,1,0,0,0,0|0,0,2]=4 1773 B9R0.47 CCOCCC(=O)C(=O)Cl Amb24649864 [1,1,0,0,0,0|2,0,0]=4 1774 B9R0.47 CCOCC[C@H](C)C(O)=O Amb25791629 [1,1,0,0,0,0|1,0,1]=4 1775 B9R0.47 CCONCC(=C)C(O)=O Amb25238507 [1,1,0,0,0,0|2,0,0]=4 1776 B9R0.47 CCO\C=C\C(=O)C(O)=O Amb25367891 [1,1,0,0,0,0|1,0,1]=4 1777 B9R0.47 CCSCCC(C(=O)O)C Amb10844082 [1,1,0,0,0,0|1,0,1]=4 1778 B9R0.47 CCSCCC(C(=O)O)N Amb2137050 [1,1,0,0,0,0|1,0,1]=4 1779 B9R0.47 CCSCCC(N)C(O)=O Amb22904200 [1,1,0,0,0,0|1,0,1]=4 1780 B9R0.47 CCSCCC(O)C(O)=O Amb24482157 [1,1,0,0,0,0|1,0,1]=4 1781 B9R0.47 CCSCC[C@@H](C(=O)O)N Amb17613844 [1,1,0,0,0,0|1,0,1]=4 1782 B9R0.47 CCSCC[C@H](C(=O)O)N Amb17613843 [1,1,0,0,0,0|1,0,1]=4 1783 B9R0.47 CCSC\C=C(/C)\C(C)=O Amb25689133 [1,1,0,0,0,0|2,0,0]=4 1784 B9R0.47 CC[Se]CCC(C(=O)O)N Amb17620056 [1,1,0,0,0,0|1,0,1]=4 1785 B9R0.47 CNCCCC(C)C(O)=O Amb25313872 [1,1,0,0,0,0|1,0,1]=4 1786 B9R0.47 CNCCCC(N)C(O)=O Amb18644279 [1,1,0,0,0,0|1,0,1]=4 1787 B9R0.47 CNCCC[C@H](N)C(O)=O Amb24377155 [1,1,0,0,0,0|1,0,1]=4 1788 B9R0.47 CNCCNC(=O)C(O)=O Amb18644254 [1,1,0,0,0,0|2,0,0]=4 1789 B9R0.47 COCCCC(N)C(O)=O Amb20628315 [1,1,0,0,0,0|1,0,1]=4 1790 B9R0.47 COCCCC(N)C(O)=O Amb22058809 [1,1,0,0,0,0|1,0,1]=4 1791 B9R0.47 COCCC[C@@H](N)C(O)=O Amb25081508 [1,1,0,0,0,0|1,0,1]=4 1792 B9R0.47 COCCC[C@H](N)C(O)=O Amb25378737 [1,1,0,0,0,0|1,0,1]=4 1793 B9R0.47 COCCOC(=O)C(O)=O Amb24376746 [1,1,0,0,0,0|2,0,0]=4 1794 B9R0.47 CSCCCC(C(=O)O)N Amb17594057 [1,1,0,0,0,0|1,0,1]=4 1795 B9R0.47 CSCCCC(O)C(O)=O Amb25169340 [1,1,0,0,0,0|1,0,1]=4 1796 B9R0.47 C\C(=C/CCC#C)\C(O)=O Amb24746703 [1,1,0,0,0,0|0,0,2]=4 1797 B9R0.47 C\C(=C/CCC#N)\C(O)=O Amb25339471 [1,1,0,0,0,0|1,0,1]=4 1798 B9R0.47 C\C(=C/CCC=C)\C(O)=O Amb18124587 [1,1,0,0,0,0|0,0,2]=4 1799 B9R0.47 C\C(=C/CCCC)\C(O)=O Amb18643947 [1,1,0,0,0,0|0,0,0]=2 1800 B9R0.47 C\C(=C/CCCCl)\C(O)=O Amb24462748 [1,1,0,0,0,0|1,0,0]=3 1801 B9R0.47 C\C(=C\CCC=C)\C(O)=O Amb24585718 [1,1,0,0,0,0|0,0,2]=4 1802 B9R0.47 C\C(=C\CCCC)\C(N)=O Amb25174960 [1,1,0,0,0,0|1,0,0]=3 1803 B9R0.47 NC(CCCCCl)C(O)=O Amb25141944 [1,1,0,0,0,0|1,0,1]=4 1804 B9R0.47 NC(CCCCS)C(O)=O Amb25363159 [1,1,0,0,0,0|1,0,1]=4 1805 B9R0.47 NC(CCC[13CH2][15NH2])C(O)=O Amb22351283 [1,1,0,0,0,0|1,0,1]=4 1806 B9R0.47 NCCCCC(=O)C(O)=O Amb25703573 [1,1,0,0,0,0|1,0,0]=3 1807 B9R0.47 NCCCCC(Cl)C(O)=O Amb24540314 [1,1,0,0,0,0|1,0,1]=4 1808 B9R0.47 NCCCCC(F)C(O)=O Amb25147460 [1,1,0,0,0,0|1,0,1]=4 1809 B9R0.47 NCCCCC(N)C(O)=O Amb22349470 [1,1,0,0,0,0|1,0,1]=4 1810 B9R0.47 NCCCCC(N)C(O)=O Amb22489521 [1,1,0,0,0,0|1,0,1]=4 1811 B9R0.47 NCCCCC(N)[13C](O)=O Amb22338743 [1,1,0,0,0,0|1,0,1]=4 1812 B9R0.47 NCCCCC(O)C(O)=O Amb18644320 [1,1,0,0,0,0|1,0,1]=4 1813 B9R0.47 NCCCCC(S)C(O)=O Amb24652524 [1,1,0,0,0,0|1,0,1]=4 1814 B9R0.47 NCCCCC([15NH2])C(O)=O Amb22351358 [1,1,0,0,0,0|1,0,1]=4 1815 B9R0.47 NCCCC[13CH](N)C(O)=O Amb22351886 [1,1,0,0,0,0|1,0,1]=4 1816 B9R0.47 NCCCC[13CH](N)[13C](O)=O Amb22336528 [1,1,0,0,0,0|1,0,1]=4 1817 B9R0.47 NCCCC[C@@H](C(=O)O)C Amb10844513 [1,1,0,0,0,0|1,0,1]=4 1818 B9R0.47 NCCCC[C@@H](N)C(O)=O Amb22744766 [1,1,0,0,0,0|1,0,1]=4 1819 B9R0.47 NCCCC[C@@H](N)C(O)=O Amb22746247 [1,1,0,0,0,0|1,0,1]=4 1820 B9R0.47 NCCCC[C@@H](N)C(O)=O Amb22750565 [1,1,0,0,0,0|1,0,1]=4 1821 B9R0.47 NCCCC[C@H](C(=O)O)N Amb10072417 [1,1,0,0,0,0|1,0,1]=4 1822 B9R0.47 NCCCC[C@H](O)C(O)=O Amb25303562 [1,1,0,0,0,0|1,0,1]=4 1823 B9R0.47 NCCCC[C@H]([15NH2])C(O)=O Amb22354049 [1,1,0,0,0,0|1,0,1]=4 1824 B9R0.47 NCCC\C=C(\O)/C(O)=O Amb25077106 [1,1,0,0,0,0|1,0,0]=3 1825 B9R0.47 N[13CH2]CCCC(N)C(O)=O Amb22367560 [1,1,0,0,0,0|1,0,1]=4 1826 B9R0.47 N[13CH2][13CH2][13CH2][13CH2][13C@H](N)[13C](O)=O Amb22337497 [1,1,0,0,0,0|1,0,1]=4 1827 B9R0.47 N[14CH2][14CH2][14CH2][14CH2][14CH](N)[14C](O)=O Amb22349598 [1,1,0,0,0,0|1,0,1]=4 1828 B9R0.47 N[C@@H](CCCCO)C(O)=O Amb22900800 [1,1,0,0,0,0|1,0,1]=4 1829 B9R0.47 N[C@@H](CCCCS)C(O)=O Amb25729289 [1,1,0,0,0,0|1,0,1]=4 1830 B9R0.47 N[C@@H](CCCC[NH3+])C(O)=O Amb22801419 [1,1,0,0,0,0|1,0,1]=4 1831 B9R0.47 OC(=O)C(=O)CCCC=O Amb25789953 [1,1,0,0,0,0|1,0,1]=4 1832 B9R0.47 OC(=O)C(=O)CCCCF Amb25259949 [1,1,0,0,0,0|1,0,0]=3 1833 B9R0.47 OC(=O)C(=O)NCCCO Amb24371547 [1,1,0,0,0,0|2,0,0]=4 1834 B9R0.47 OC(=O)C(Br)CCCCBr Amb21964537 [1,1,0,0,0,0|1,0,1]=4 1835 B9R0.47 OC(=O)C(Cl)CCCCCl Amb24442431 [1,1,0,0,0,0|1,0,1]=4 1836 B9R0.47 OC(=O)C(F)CCCCF Amb24482414 [1,1,0,0,0,0|1,0,1]=4 1837 B9R0.47 OC(=O)\C(\Cl)=C\SCCO Amb25256124 [1,1,0,0,0,0|2,0,0]=4 1838 B9R0.47 OCCCCC(O)C(O)=O Amb18644356 [1,1,0,0,0,0|1,0,1]=4 1839 B9R0.47 OCCCC[C@H](O)C(O)=O Amb24480682 [1,1,0,0,0,0|1,0,1]=4 1840 B9R0.47 [15NH2]CCCCC([15NH2])C(O)=O Amb22363194 [1,1,0,0,0,0|1,0,1]=4 1841 B9R0.47 [15NH2]CCCC[C@H]([15NH2])C(O)=O Amb22353587 [1,1,0,0,0,0|1,0,1]=4 1842 B9R0.48 CC(=O)\C=C\C(=O)CCC Amb24512208 [1,1,0,0,0,0|1,0,1]=4 1843 B9R0.48 CC(CCN)CCC(O)=O Amb18124749 [1,1,0,0,0,0|1,0,1]=4 1844 B9R0.48 CCCC(=O)\C=C\C(O)=O Amb18643821 [1,1,0,0,0,0|0,0,1]=3 1845 B9R0.48 CCCC(Br)CCC(O)=O Amb24469305 [1,1,0,0,0,0|0,0,1]=3 1846 B9R0.48 CCCC(C)COC(=O)Cl Amb25783542 [1,1,0,0,0,0|2,0,0]=4 1847 B9R0.48 CCCC(C)COC(C)=O Amb22735194 [1,1,0,0,0,0|2,0,0]=4 1848 B9R0.48 CCCC(C)OCC(O)=O Amb18124782 [1,1,0,0,0,0|1,0,1]=4 1849 B9R0.48 CCCC(C)\C=C\B(O)O Amb24558340 [1,1,0,0,0,0|1,0,1]=4 1850 B9R0.48 CCCC(C)\C=C\C(C)=O Amb24686480 [1,1,0,0,0,0|1,0,0]=3 1851 B9R0.48 CCCC(CCC(=O)C)C Amb10807385 [1,1,0,0,0,0|1,0,1]=4 1852 B9R0.48 CCCC(CCC(=O)N)O Amb17593642 [1,1,0,0,0,0|1,0,1]=4 1853 B9R0.48 CCCC(CCC(=O)O)N Amb1014101 [1,1,0,0,0,0|0,0,1]=3 1854 B9R0.48 CCCC(CCC(=O)[O-])O Amb2386295 [1,1,0,0,0,0|0,0,2]=4 1855 B9R0.48 CCCC(Cl)CCC(O)=O Amb23590328 [1,1,0,0,0,0|0,0,1]=3 1856 B9R0.48 CCCC(Cl)COC(C)=O Amb25088458 [1,1,0,0,0,0|2,0,0]=4 1857 B9R0.48 CCCC(F)CCC(C)=O Amb25723377 [1,1,0,0,0,0|1,0,1]=4 1858 B9R0.48 CCCC(N)CNC(N)=O Amb24443520 [1,1,0,0,0,0|2,0,0]=4 1859 B9R0.48 CCCC(O)C#CC(O)=O Amb25823661 [1,1,0,0,0,0|0,0,2]=4 1860 B9R0.48 CCCC(O)CCC(O)=O Amb17689110 [1,1,0,0,0,0|0,0,1]=3 1861 B9R0.48 CCCC(O)CCC([O-])=O Amb17778117 [1,1,0,0,0,0|0,0,2]=4 1862 B9R0.48 CCCC(O)CNC(C)=O Amb24333057 [1,1,0,0,0,0|2,0,0]=4 1863 B9R0.48 CCCC(O)\C=C\C(C)=O Amb25293157 [1,1,0,0,0,0|1,0,0]=3 1864 B9R0.48 CCCC(O)\C=C\S(C)=O Amb24471430 [1,1,0,0,0,0|2,0,0]=4 1865 B9R0.48 CCCN(C)CCC(O)=O Amb19280988 [1,1,0,0,0,0|1,0,1]=4 1866 B9R0.48 CCCS(=O)CCC(O)=O Amb18792575 [1,1,0,0,0,0|1,0,1]=4 1867 B9R0.48 CCCS(=O)\C=C\C(O)=O Amb25825020 [1,1,0,0,0,0|1,0,0]=3 1868 B9R0.48 CCC[C@@H](Br)COC(C)=O Amb25733071 [1,1,0,0,0,0|2,0,0]=4 1869 B9R0.48 CCC[C@@H](C)CCC(O)=O Amb24548514 [1,1,0,0,0,0|0,0,1]=3 1870 B9R0.48 CCC[C@H](C)CCC(O)=O Amb24446759 [1,1,0,0,0,0|0,0,1]=3 1871 B9R0.48 CCC[C@H](N)CCC(O)=O Amb25211817 [1,1,0,0,0,0|0,0,1]=3 1872 B9R0.48 CCNC(=O)\C=C/C(=O)O Amb1235096 [1,1,0,0,0,0|1,0,1]=4 1873 B9R0.48 CCNC(C)CCC(O)=O Amb24394614 [1,1,0,0,0,0|1,0,1]=4 1874 B9R0.48 CCOC(=O)\C=C/C(O)=O Amb24462678 [1,1,0,0,0,0|1,0,1]=4 1875 B9R0.48 CCOC(=O)\C=C\C(=O)O Amb2189151 [1,1,0,0,0,0|1,0,1]=4 1876 B9R0.48 CCOC(=O)\C=C\C(O)=O Amb22351272 [1,1,0,0,0,0|1,0,1]=4 1877 B9R0.48 CCOC(C)CCC(O)=O Amb24690847 [1,1,0,0,0,0|1,0,1]=4 1878 B9R0.48 CCSC(C)CCC(O)=O Amb18800669 [1,1,0,0,0,0|1,0,1]=4 1879 B9R0.48 CNCC(O)CCC(O)=O Amb24745159 [1,1,0,0,0,0|1,0,1]=4 1880 B9R0.48 COCC(=O)\C=C\C(O)=O Amb25835230 [1,1,0,0,0,0|1,0,1]=4 1881 B9R0.48 COCC(C)CCC(O)=O Amb25340432 [1,1,0,0,0,0|1,0,1]=4 1882 B9R0.48 C[C@@H](CCS)CCC(O)=O Amb24693959 [1,1,0,0,0,0|1,0,1]=4 1883 B9R0.48 C[C@H](CCBr)CCC(O)=O Amb24585993 [1,1,0,0,0,0|1,0,1]=4 1884 B9R0.48 C\C(\C=CC(O)=O)=C\CC Amb24562528 [1,1,0,0,0,0|0,0,2]=4 1885 B9R0.48 C\C(\C=C\C(O)=O)=C/CC Amb18643546 [1,1,0,0,0,0|0,0,2]=4 1886 B9R0.48 C\C=C\C(C)C=CC(O)=O Amb25340463 [1,1,0,0,0,0|0,0,2]=4 1887 B9R0.48 NC(CCS)CCC(O)=O Amb24453471 [1,1,0,0,0,0|1,0,1]=4 1888 B9R0.48 N[C@@H](CCO)CCC(O)=O Amb25756968 [1,1,0,0,0,0|1,0,1]=4 1889 B9R0.48 OC(CCS)CCC(O)=O Amb25320980 [1,1,0,0,0,0|1,0,1]=4 1890 B9R0.48 OCC[C@H](O)CCC(O)=O Amb25843738 [1,1,0,0,0,0|1,0,1]=4 1891 B9R0.55 CC(=C)CN\C=C\C(O)=O Amb25804662 [1,1,0,0,0,0|1,0,1]=4 1892 B9R0.55 CC(=C)CO\C=C\C(O)=O Amb18643826 [1,1,0,0,0,0|1,0,1]=4 1893 B9R0.55 CC(=O)CCCC=C(C)O Amb24627452 [1,1,0,0,0,0|1,0,1]=4 1894 B9R0.55 CC(=O)CCC\C=C(\C)/O Amb24546380 [1,1,0,0,0,0|1,0,1]=4 1895 B9R0.55 CC(=O)CC\C=C\C(=O)O Amb17593589 [1,1,0,0,0,0|0,0,1]=3 1896 B9R0.55 CC(=O)OC\C=C\C(O)=O Amb24454652 [1,1,0,0,0,0|1,0,1]=4 1897 B9R0.55 CC(Br)CCCCC(O)=O Amb25309392 [1,1,0,0,0,0|0,0,1]=3 1898 B9R0.55 CC(Br)CCCNC(C)=O Amb25784406 [1,1,0,0,0,0|2,0,0]=4 1899 B9R0.55 CC(C)C#C\C=C\C(O)=O Amb24622479 [1,1,0,0,0,0|0,0,2]=4 1900 B9R0.55 CC(C)CC=C=CC(O)=O Amb25063138 [1,1,0,0,0,0|0,0,2]=4 1901 B9R0.55 CC(C)CCCCC(=O)Cl Amb25067489 [1,1,0,0,0,0|1,0,1]=4 1902 B9R0.55 CC(C)CCCCC([O-])=O Amb22732968 [1,1,0,0,0,0|0,0,2]=4 1903 B9R0.55 CC(C)CCCNC(C)=O Amb25756283 [1,1,0,0,0,0|2,0,0]=4 1904 B9R0.55 CC(C)CCCOC(C)=O Amb24401009 [1,1,0,0,0,0|2,0,0]=4 1905 B9R0.55 CC(C)CC\C=C\B(O)O Amb22168996 [1,1,0,0,0,0|1,0,1]=4 1906 B9R0.55 CC(C)CC\C=C\C(C)=O Amb25111718 [1,1,0,0,0,0|1,0,0]=3 1907 B9R0.55 CC(C)CO\C=C\C(C)=O Amb24569665 [1,1,0,0,0,0|2,0,0]=4 1908 B9R0.55 CC(C)CO\C=C\C(O)=O Amb18644129 [1,1,0,0,0,0|1,0,0]=3 1909 B9R0.55 CC(C)C\C=C\CC(O)=O Amb24681011 [1,1,0,0,0,0|0,0,2]=4 1910 B9R0.55 CC(C)OC\C=C\C(O)=O Amb18308396 [1,1,0,0,0,0|1,0,0]=3 1911 B9R0.55 CC(C)SC\C=C\C(O)=O Amb19020662 [1,1,0,0,0,0|1,0,0]=3 1912 B9R0.55 CC(C)\C=C\C=C\C(O)=O Amb25367977 [1,1,0,0,0,0|0,0,2]=4 1913 B9R0.55 CC(CCCCC(=O)O)C Amb10576144 [1,1,0,0,0,0|0,0,1]=3 1914 B9R0.55 CC(CCNCC(=O)O)C Amb1111021 [1,1,0,0,0,0|1,0,1]=4 1915 B9R0.55 CC(CCSCC(=O)O)C Amb1137397 [1,1,0,0,0,0|1,0,1]=4 1916 B9R0.55 CC(CC\C=C\C(=O)O)C Amb17593603 [1,1,0,0,0,0|0,0,0]=2 1917 B9R0.55 CC(CNCCC(=O)O)C Amb10609230 [1,1,0,0,0,0|1,0,1]=4 1918 B9R0.55 CC(CNCCC(=O)O)C Amb2372367 [1,1,0,0,0,0|1,0,1]=4 1919 B9R0.55 CC(Cl)CCCCC(=O)Cl Amb24633993 [1,1,0,0,0,0|1,0,1]=4 1920 B9R0.55 CC(Cl)CCCCC(O)=O Amb18646185 [1,1,0,0,0,0|0,0,1]=3 1921 B9R0.55 CC(Cl)CCCNC(C)=O Amb25275384 [1,1,0,0,0,0|2,0,0]=4 1922 B9R0.55 CC(F)CCCCC(C)=O Amb25145595 [1,1,0,0,0,0|1,0,1]=4 1923 B9R0.55 CC(F)COCCC(O)=O Amb25268355 [1,1,0,0,0,0|1,0,1]=4 1924 B9R0.55 CC(N)CCCCC(N)=O Amb19515544 [1,1,0,0,0,0|1,0,1]=4 1925 B9R0.55 CC(N)CCCCC(O)=O Amb18644199 [1,1,0,0,0,0|0,0,1]=3 1926 B9R0.55 CC(N)CCCCC(O)=O Amb19515386 [1,1,0,0,0,0|0,0,1]=3 1927 B9R0.55 CC(N)CCCNC(C)=O Amb24481145 [1,1,0,0,0,0|2,0,0]=4 1928 B9R0.55 CC(N)CCCNC(N)=O Amb25136886 [1,1,0,0,0,0|2,0,0]=4 1929 B9R0.55 CC(N)CSCCC(O)=O Amb24435179 [1,1,0,0,0,0|1,0,1]=4 1930 B9R0.55 CC(NCCCC(=O)O)C Amb1111231 [1,1,0,0,0,0|1,0,1]=4 1931 B9R0.55 CC(O)C#C\C=C/C(O)=O Amb24745668 [1,1,0,0,0,0|0,0,2]=4 1932 B9R0.55 CC(O)CCCCC(O)=O Amb18644264 [1,1,0,0,0,0|0,0,1]=3 1933 B9R0.55 CC(O)CCNCC(O)=O Amb25369892 [1,1,0,0,0,0|1,0,1]=4 1934 B9R0.55 CC(O)CC\C=C\C(O)=O Amb24680771 [1,1,0,0,0,0|0,0,0]=2 1935 B9R0.55 CC(O)CN\C=C\C(O)=O Amb24479663 [1,1,0,0,0,0|1,0,0]=3 1936 B9R0.55 CC(O)COCCC(O)=O Amb24746704 [1,1,0,0,0,0|1,0,1]=4 1937 B9R0.55 CC(O)CSCCC(O)=O Amb18792572 [1,1,0,0,0,0|1,0,1]=4 1938 B9R0.55 CN(C)CCCCC(O)=O Amb19275569 [1,1,0,0,0,0|1,0,1]=4 1939 B9R0.55 CN(C)NC\C=C\C(O)=O Amb24391795 [1,1,0,0,0,0|2,0,0]=4 1940 B9R0.55 CP(=O)CCCCC(O)=O Amb25765822 [1,1,0,0,0,0|1,0,1]=4 1941 B9R0.55 CS(=O)CCCCC(O)=O Amb18788305 [1,1,0,0,0,0|1,0,1]=4 1942 B9R0.55 C[C@@H](O)CCCCC(C)=O Amb25114746 [1,1,0,0,0,0|1,0,1]=4 1943 B9R0.55 C[C@@H](O)CCCCC(O)=O Amb24427549 [1,1,0,0,0,0|0,0,1]=3 1944 B9R0.55 C[C@H](N)CCCCC(O)=O Amb25229790 [1,1,0,0,0,0|0,0,1]=3 1945 B9R0.55 C[C@H](O)CCCCC(O)=O Amb24671333 [1,1,0,0,0,0|0,0,1]=3 1946 B9R0.55 OC(=O)CCC=CC(O)=O Amb20622952 [1,1,0,0,0,0|1,0,1]=4 1947 B9R0.55 OC(=O)CCCCC(Cl)Cl Amb24482330 [1,1,0,0,0,0|1,0,1]=4 1948 B9R0.55 OC(=O)CCCSC(C)C Amb17503621 [1,1,0,0,0,0|1,0,1]=4 1949 B9R0.55 OC(=O)CC\C=C\C(O)=O Amb24117843 [1,1,0,0,0,0|1,0,1]=4 1950 B9R0.55 OC(=O)\C=C\NCC(F)F Amb24479655 [1,1,0,0,0,0|2,0,0]=4 1951 B11R0.6 CC(C)CC(N)COCC(O)=O Amb24089546 [0,2,0,0,0,0|1,0,1]=4 1952 B11R0.147 CCCNC(=O)N\C=C\C(O)=O Amb22960483 [0,2,0,0,0,0|1,0,1]=4 1953 B11R0.2 CC(=O)CC(=O)OCCCCC Amb22734938 [0,2,0,0,0,0|1,0,1]=4 1954 B11R0.2 CCCCCCC(CC(=O)O)N Amb2229636 [0,2,0,0,0,0|0,0,2]=4 1955 B11R0.2 CCCCCCC(O)CC(O)=O Amb18803982 [0,2,0,0,0,0|0,0,2]=4 1956 B11R0.2 CCCCCCN(C)CC(O)=O Amb19373387 [0,2,0,0,0,0|0,0,2]=4 1957 B11R0.2 CCCC\C=C\C(O)CC(O)=O Amb22831931 [0,2,0,0,0,0|0,0,2]=4 1958 B11R0.30 CC(C)CCNCCCC(O)=O Amb24271192 [0,2,0,0,0,0|0,0,2]=4 1959 B11R0.40 CCCCC\C=C\CC(=O)OC Amb10807478 [0,2,0,0,0,0|0,0,0]=2 1960 B11R0.40 COC(=O)CCCCCCCBr Amb24063235 [0,2,0,0,0,0|0,0,2]=4 1961 B11R0.40 COC(=O)CCCCCCCN Amb20669115 [0,2,0,0,0,0|0,0,2]=4 1962 B11R0.40 COC(=O)CCCCCCCN Amb24331924 [0,2,0,0,0,0|0,0,2]=4 1963 B11R0.40 COC(=O)NCCCCCCO Amb24095886 [0,2,0,0,0,0|1,0,1]=4 1964 B11R0.42 CCCCC#C\C=C(\Cl)/C(O)=O Amb25221210 [0,2,0,0,0,0|0,0,1]=3 1965 B11R0.42 CCCCCCCC(=O)C(O)=O Amb22904309 [0,2,0,0,0,0|0,0,1]=3 1966 B11R0.42 CCCCCCCC(Br)C(O)=O Amb21520353 [0,2,0,0,0,0|0,0,2]=4 1967 B11R0.42 CCCCCCCC(C(=O)O)N Amb2229635 [0,2,0,0,0,0|0,0,2]=4 1968 B11R0.42 CCCCCCCC(C)C(O)=O Amb18794410 [0,2,0,0,0,0|0,0,2]=4 1969 B11R0.42 CCCCCCCC(O)C(O)=O Amb18790307 [0,2,0,0,0,0|0,0,2]=4 1970 B11R0.42 CCCCCCC[C@@H](N)C(O)=O Amb22747720 [0,2,0,0,0,0|0,0,2]=4 1971 B11R0.42 CCCCCC\C=C(/C)\C(C)O Amb22546750 [0,2,0,0,0,0|1,0,1]=4 1972 B11R0.42 CCCCCSC[C@H](N)C(O)=O Amb22451173 [0,2,0,0,0,0|0,0,2]=4 1973 B11R0.42 CCCCSCC[C@H](C(=O)O)N Amb17610162 [0,2,0,0,0,0|0,0,2]=4 1974 B11R0.42 CCNCCCCC(C(=O)O)N Amb17614099 [0,2,0,0,0,0|0,0,2]=4 1975 B11R0.42 C\C(=C\CCCCCC)\C(O)=O Amb22359372 [0,2,0,0,0,0|0,0,0]=2 1976 B11R0.42 NCCCCCNC(=O)C(O)=O Amb24068947 [0,2,0,0,0,0|1,0,0]=3 1977 B11R0.46 CCCCCC(CCC(=O)O)C Amb10807482 [0,2,0,0,0,0|0,0,2]=4 1978 B11R0.46 CCCCCC(\C=C\C(=O)O)O Amb10549834 [0,2,0,0,0,0|0,0,0]=2 1979 B11R0.46 CCCCNC(=O)CCC(=O)O Amb1785994 [0,2,0,0,0,0|1,0,1]=4 1980 B11R0.46 CCCCNC(=O)NCC(=O)O Amb1138541 [0,2,0,0,0,0|1,0,1]=4 1981 B11R0.46 CCCCNC(=O)\C=C\C(=O)O Amb1234975 [0,2,0,0,0,0|0,0,1]=3 1982 B11R0.46 CCCCOC(=O)CCC(O)=O Amb19888684 [0,2,0,0,0,0|1,0,1]=4 1983 B11R0.46 CCCCOC(=O)\C=C\C(O)=O Amb22351343 [0,2,0,0,0,0|0,0,1]=3 1984 B11R0.46 COCCNC(=O)\C=C/C(=O)O Amb2580803 [0,2,0,0,0,0|1,0,1]=4 1985 B11R0.46 COCCNC(=O)\C=C\C(=O)O Amb1159739 [0,2,0,0,0,0|1,0,1]=4 1986 B11R0.111 CCC(C)CCCCCC(O)=O Amb22232340 [0,2,0,0,0,0|0,0,2]=4 1987 B11R0.111 COC(=O)CCCCCC(C)C Amb22503803 [0,2,0,0,0,0|0,0,2]=4 1988 B11R0.111 OC(=O)CCCCCC(F)CBr Amb22547633 [0,2,0,0,0,0|0,0,2]=4 1989 B11R0.148 C#CCCCCCCCC(O)=O Amb22388895 [0,2,0,0,0,0|0,0,2]=4 1990 B11R0.148 CCCC=CCCCCC(O)=O Amb24063196 [0,2,0,0,0,0|0,0,2]=4 1991 B11R0.148 CCCCC=CCCCC(O)=O Amb24062906 [0,2,0,0,0,0|0,0,2]=4 1992 B11R0.148 CCCCCC=CCCC(O)=O Amb24079160 [0,2,0,0,0,0|0,0,0]=2 1993 B11R0.148 CCCCCCCCC[13C](O)=O Amb22353426 [0,2,0,0,0,0|0,0,2]=4 1994 B11R0.148 CCCCCCCC[13CH2][13C](O)=O Amb22054843 [0,2,0,0,0,0|0,0,2]=4 1995 B11R0.148 CCCCCCCNCC(O)=O Amb19373457 [0,2,0,0,0,0|0,0,2]=4 1996 B11R0.148 CCCCCCC\C=C\B(O)O Amb2456042 [0,2,0,0,0,0|1,0,1]=4 1997 B11R0.148 CCCCCC\C=C/C=C(C)C Amb22546455 [0,2,0,0,0,0|2,0,0]=4 1998 B11R0.148 CCCCCC\C=C\CC(=O)O Amb10807476 [0,2,0,0,0,0|0,0,0]=2 1999 B11R0.148 CCCCC\C=C\CCC(=O)O Amb17594266 [0,2,0,0,0,0|0,0,0]=2 2000 B11R0.148 CCCCSCCCCC(=O)O Amb1032990 [0,2,0,0,0,0|0,0,2]=4 2001 B11R0.148 CCC\C=C\CCCCC(O)=O Amb22411539 [0,2,0,0,0,0|0,0,2]=4 2002 B11R0.148 CCNCCOCCCC(O)=O Amb18110845 [0,2,0,0,0,0|0,0,2]=4 2003 B11R0.148 NCCCCSCCCC(=O)O Amb17500972 [0,2,0,0,0,0|0,0,2]=4 2004 B11R0.148 OC(=O)CCCCCCCC=O Amb17939414 [0,2,0,0,0,0|0,0,2]=4 2005 B11R0.148 [13CH3]CCCCCCCCC(O)=O Amb22367552 [0,2,0,0,0,0|0,0,2]=4 2006 B11R0.176 CCCC(=O)C#C\C=C\C(O)=O Amb24571683 [0,2,0,0,0,0|0,0,2]=4 2007 B11R0.176 OC(=O)CCCC[C@@H](S)CCS Amb24099064 [0,2,0,0,0,0|0,0,2]=4 2008 B11R0.176 SCCC(CCCCC(=O)O)S Amb17595596 [0,2,0,0,0,0|0,0,2]=4 2009 B11R0.107 CCC(C)CCC(C)CC(O)=O Amb22229103 [0,2,0,0,0,0|0,0,2]=4 2010 B11R0.139 CCCCCC(=O)C(C(=O)C)C Amb17594265 [0,2,0,0,0,0|1,0,1]=4 2011 B11R0.154 CCCCCC(=O)CC(=O)OC Amb19515873 [0,2,0,0,0,0|0,0,1]=3 2012 B11R0.154 CCCCCC(O)CC(=O)OC Amb21928835 [0,2,0,0,0,0|0,0,2]=4 2013 B11R0.154 CCCCNC(=O)CC(=O)OC Amb17400389 [0,2,0,0,0,0|1,0,1]=4 2014 B11R0.324 CCCCCC(C)(C)CC(O)=O Amb22229020 [0,2,0,0,0,0|0,0,2]=4 2015 B11R0.106 CCC(C)CCCCC(=O)OC Amb22489983 [0,2,0,0,0,0|0,0,2]=4 2016 B11R0.4 CCCCCCCC(=O)OC=C Amb17672562 [0,2,0,0,0,0|0,0,2]=4 2017 B11R0.4 CCC\C=C/C=C/C(=O)OCC Amb10067180 [0,2,0,0,0,0|0,0,2]=4 2018 B11R0.142 CCCCCCC(Br)C(=O)OC Amb22002102 [0,2,0,0,0,0|0,0,2]=4 2019 B11R0.142 CCCCCCC(O)C(=O)OC Amb18808375 [0,2,0,0,0,0|0,0,2]=4 2020 B11R0.76 CCCCCCC(CC)C(O)=O Amb18794406 [0,2,0,0,0,0|0,0,2]=4 2021 B11R0.76 CCCCCCC(O[NH3+])C(O)=O Amb22434188 [0,2,0,0,0,0|0,0,2]=4 2022 B11R0.125 [2H]C([2H])(CCCCCC)C(O)=O Amb21928955 [0,2,0,0,0,0|0,0,2]=4 2023 B11R0.85 CC(CNC(=O)\C=C/C(=O)O)C Amb1235089 [0,2,0,0,0,0|1,0,1]=4 2024 B11R0.85 NC(CCC(=O)O)CCC(C)C Amb2229637 [0,2,0,0,0,0|0,0,2]=4 2025 B11R0.164 CCCCC(CC)C=CC(O)=O Amb22229760 [0,2,0,0,0,0|0,0,0]=2 2026 B11R0.164 CCCCC(CCC(=O)O)CC Amb10807481 [0,2,0,0,0,0|0,0,2]=4 2027 B9R1.5 CC1=CCCC=CC1=O Amb25807535 [1,0,0,1,0,0|0,0,2]=4 2028 B9R1.5 CC1CCCC=CC1Cl Amb24480199 [1,0,0,1,0,0|1,0,1]=4 2029 B9R1.5 CN1CCNC=CC1=O Amb24070477 [1,0,0,1,0,0|2,0,0]=4 2030 B9R1.5 C[C@@H]1CCCC=C[C@@H]1Cl Amb25322043 [1,0,0,1,0,0|1,0,1]=4 2031 B9R1.5 C[C@@H]1CCCCCC1=O Amb25032177 [1,0,0,1,0,0|0,0,2]=4 2032 B9R1.5 C[C@H]1CCCCCC1=O Amb24475484 [1,0,0,1,0,0|0,0,2]=4 2033 B9R1.5 OC1CCCC=CC1O Amb25069753 [1,0,0,1,0,0|1,0,1]=4 2034 B9R1.8 Br\C=C/N1CCCCC1 Amb25111136 [1,0,0,1,0,0|2,0,0]=4 2035 B9R1.8 Br\C=C\C=1CCCCC1 Amb25088121 [1,0,0,1,0,0|1,0,1]=4 2036 B9R1.8 CC=C=C1CCCCC1 Amb25842132 [1,0,0,1,0,0|1,0,1]=4 2037 B9R1.8 CCCC1CCC=CN1 Amb24426782 [1,0,0,1,0,0|1,0,1]=4 2038 B9R1.8 CCC[C@@H]1CC=CCN1 Amb24625706 [1,0,0,1,0,0|1,0,1]=4 2039 B9R1.8 CNCC1CCC=CO1 Amb18958296 [1,0,0,1,0,0|1,0,1]=4 2040 B9R1.8 COC=C1CCCCC1 Amb17674336 [1,0,0,1,0,0|2,0,0]=4 2041 B9R1.8 C\C=C\C1CCCCC1 Amb24641527 [1,0,0,1,0,0|1,0,1]=4 2042 B9R1.8 C\C=C\C=1CCCCC1 Amb24514568 [1,0,0,1,0,0|1,0,1]=4 2043 B9R1.8 Cl\C=C/C1CCCCC1 Amb24355898 [1,0,0,1,0,0|1,0,1]=4 2044 B9R1.8 Cl\C=C\C=1CCCCC1 Amb24415403 [1,0,0,1,0,0|1,0,1]=4 2045 B9R1.8 I\C=C\C1CCCCC1 Amb25232850 [1,0,0,1,0,0|1,0,1]=4 2046 B9R1.8 N#CC=C1CCCCC1 Amb16233597 [1,0,0,1,0,0|1,0,1]=4 2047 B9R1.8 NCC=C1CCCCC1 Amb17605580 [1,0,0,1,0,0|1,0,1]=4 2048 B9R1.8 NCCC1CCC=CO1 Amb25743698 [1,0,0,1,0,0|1,0,1]=4 2049 B9R1.8 O=CC=C1CCCCC1 Amb17593282 [1,0,0,1,0,0|0,0,0]=2 2050 B9R1.8 O=CC=C1CCOCC1 Amb24559555 [1,0,0,1,0,0|1,0,0]=3 2051 B9R1.8 O=CC=C1SCCCS1 Amb25042217 [1,0,0,1,0,0|2,0,0]=4 2052 B9R1.8 O=CCC1=CCCCC1 Amb17593283 [1,0,0,1,0,0|0,0,2]=4 2053 B9R1.8 O=CCC1CCCCC1 Amb10070777 [1,0,0,1,0,0|0,0,2]=4 2054 B9R1.8 O=CCN1CCCCC1 Amb20248700 [1,0,0,1,0,0|1,0,1]=4 2055 B9R1.8 O=CNC1=CCCCC1 Amb16192555 [1,0,0,1,0,0|1,0,1]=4 2056 B9R1.8 O=COC1CCCCC1 Amb17939405 [1,0,0,1,0,0|1,0,1]=4 2057 B9R1.8 O=C\C=C/1\CC=CCC1 Amb18642056 [1,0,0,1,0,0|0,0,2]=4 2058 B9R1.8 O=C\C=C/1\CCCC=C1 Amb24654989 [1,0,0,1,0,0|0,0,2]=4 2059 B9R1.8 O=C\C=C\1/CC=CCC1 Amb24513021 [1,0,0,1,0,0|0,0,2]=4 2060 B9R1.8 O=C\C=C\1/CCCC=C1 Amb18642057 [1,0,0,1,0,0|0,0,2]=4 2061 B9R1.8 OCC=C1CCCCC1 Amb25783847 [1,0,0,1,0,0|0,0,1]=3 2062 B9R1.8 OCCC1CCC=CO1 Amb24481996 [1,0,0,1,0,0|1,0,1]=4 2063 B9R1.12 BrCCCc1ccco1 Amb17104550 [1,0,0,1,0,0|1,0,1]=4 2064 B9R1.12 C=C\C=C\C1CCCC1 Amb25262791 [1,0,0,1,0,0|1,0,0]=3 2065 B9R1.12 CCC=CC1CCCC1 Amb22227912 [1,0,0,1,0,0|1,0,1]=4 2066 B9R1.12 CCCCC1C=CC=C1 Amb21962871 [1,0,0,1,0,0|1,0,0]=3 2067 B9R1.12 CCCCC1C=CCN1 Amb22587190 [1,0,0,1,0,0|1,0,1]=4 2068 B9R1.12 CCCCC1CCC=C1 Amb17674167 [1,0,0,1,0,0|1,0,1]=4 2069 B9R1.12 CCCCC1NCC=C1 Amb10608225 [1,0,0,1,0,0|1,0,1]=4 2070 B9R1.12 CCCCc1ccco1 Amb10070290 [1,0,0,1,0,0|0,0,1]=3 2071 B9R1.12 CCCSc1ccco1 Amb25249856 [1,0,0,1,0,0|1,0,1]=4 2072 B9R1.12 CCNCc1ccco1 Amb1137312 [1,0,0,1,0,0|1,0,1]=4 2073 B9R1.12 CCOCc1ccco1 Amb22234292 [1,0,0,1,0,0|1,0,1]=4 2074 B9R1.12 CNCCc1ccco1 Amb17399803 [1,0,0,1,0,0|1,0,1]=4 2075 B9R1.12 COCCc1ccco1 Amb25147016 [1,0,0,1,0,0|1,0,1]=4 2076 B9R1.12 N#C\C=C\C1CCCC1 Amb13890295 [1,0,0,1,0,0|1,0,1]=4 2077 B9R1.12 O=CCC=C1CCCC1 Amb24669022 [1,0,0,1,0,0|0,0,2]=4 2078 B9R1.12 O=CCSC1CCCC1 Amb25213895 [1,0,0,1,0,0|1,0,1]=4 2079 B9R1.12 O=CNCC1CCCC1 Amb24405331 [1,0,0,1,0,0|1,0,1]=4 2080 B9R1.12 O=C\C=C\C1CCCC1 Amb18642236 [1,0,0,1,0,0|0,0,0]=2 2081 B9R1.12 O=C\C=C\C=1CCCC1 Amb25302373 [1,0,0,1,0,0|0,0,2]=4 2082 B9R1.12 O=C\C=C\N1CCCC1 Amb24362953 [1,0,0,1,0,0|1,0,0]=3 2083 B9R1.12 OC\C=C\C1CCCN1 Amb25702213 [1,0,0,1,0,0|1,0,1]=4 2084 B9R1.12 OC\C=C\C1COCC1 Amb24413589 [1,0,0,1,0,0|1,0,1]=4 2085 B9R1.12 OC\C=C\[C@@H]1CCCN1 Amb24455785 [1,0,0,1,0,0|1,0,1]=4 2086 B9R1.12 SCCCc1ccco1 Amb17399874 [1,0,0,1,0,0|1,0,1]=4 2087 B9R1.14 CCC1CCCC1C=O Amb25227553 [1,0,0,1,0,0|0,0,2]=4 2088 B9R1.14 CCC1CCCN1C=O Amb25146930 [1,0,0,1,0,0|1,0,1]=4 2089 B9R1.14 CCN1CCN=C1C=O Amb20248622 [1,0,0,1,0,0|2,0,0]=4 2090 B9R1.15 C=CC1=CCCCC1O Amb25722968 [1,0,0,1,0,0|2,0,0]=4 2091 B9R1.15 C=CC1CCC=CC1=O Amb24621081 [1,0,0,1,0,0|0,0,2]=4 2092 B9R1.15 CC/1CCCC\C1=C\Cl Amb25701202 [1,0,0,1,0,0|1,0,1]=4 2093 B9R1.15 CC/1CCCC\C1=N/O Amb20619925 [1,0,0,1,0,0|1,0,1]=4 2094 B9R1.15 CC/1CCCC\C1=N\O Amb19650930 [1,0,0,1,0,0|1,0,1]=4 2095 B9R1.15 CC1CCCC=C1C#N Amb18642013 [1,0,0,1,0,0|1,0,1]=4 2096 B9R1.15 CC1CCCC=C1C=C Amb25720169 [1,0,0,1,0,0|1,0,0]=3 2097 B9R1.15 CC1CCCC=C1C=O Amb18642217 [1,0,0,1,0,0|0,0,0]=2 2098 B9R1.15 CC1CCCC=C1CBr Amb25685308 [1,0,0,1,0,0|1,0,1]=4 2099 B9R1.15 CC1CCCC=C1CO Amb25048354 [1,0,0,1,0,0|0,0,1]=3 2100 B9R1.15 CC1CCCCC1=CBr Amb24711430 [1,0,0,1,0,0|1,0,1]=4 2101 B9R1.15 CC1CCCCC1=NO Amb25355481 [1,0,0,1,0,0|1,0,1]=4 2102 B9R1.15 CC1CCCCC1C=O Amb18642449 [1,0,0,1,0,0|0,0,2]=4 2103 B9R1.15 CC1SCCC=C1C=O Amb18124605 [1,0,0,1,0,0|1,0,0]=3 2104 B9R1.15 CC=1CCCCC1C=O Amb18642216 [1,0,0,1,0,0|0,0,2]=4 2105 B9R1.15 CCC1CCCCC1=O Amb22002104 [1,0,0,1,0,0|0,0,2]=4 2106 B9R1.15 CCC1CCCNC1=O Amb22276357 [1,0,0,1,0,0|1,0,1]=4 2107 B9R1.15 CCN1CCC=CC1=S Amb25700784 [1,0,0,1,0,0|1,1,0]=4 2108 B9R1.15 CC[C@@H]1CCCCC1=O Amb25706912 [1,0,0,1,0,0|0,0,2]=4 2109 B9R1.15 CC[C@H]1CCCCC1=O Amb25093777 [1,0,0,1,0,0|0,0,2]=4 2110 B9R1.15 CC[C@H]1CCCOC1=O Amb24477860 [1,0,0,1,0,0|1,0,1]=4 2111 B9R1.15 COC1CCC=CC1=O Amb25707777 [1,0,0,1,0,0|1,0,0]=3 2112 B9R1.15 COC1COC=CC1=O Amb25286719 [1,0,0,1,0,0|2,0,0]=4 2113 B9R1.15 COC1OCC=CC1=O Amb24388970 [1,0,0,1,0,0|2,0,0]=4 2114 B9R1.15 C[C@H]1CCCC[C@@H]1C=O Amb25209797 [1,0,0,1,0,0|0,0,2]=4 2115 B9R1.15 C[C@H]1CCCO[C@@H]1C=O Amb24513078 [1,0,0,1,0,0|1,0,1]=4 2116 B9R1.15 C\C=C/1\CCCCC1C Amb25233583 [1,0,0,1,0,0|1,0,1]=4 2117 B9R1.15 C\C=C\1/CCC=CC1=O Amb25718019 [1,0,0,1,0,0|0,0,2]=4 2118 B9R1.15 O=C1CCCC=C1C=O Amb18642171 [1,0,0,1,0,0|1,0,1]=4 2119 B9R1.15 O=CC1CCC=CC1=O Amb25835701 [1,0,0,1,0,0|1,0,1]=4 2120 B9R1.15 OC1CCCC=C1C=O Amb25373355 [1,0,0,1,0,0|1,0,0]=3 2121 B9R1.15 OCC1=CCCCC1O Amb25083485 [1,0,0,1,0,0|1,0,1]=4 2122 B9R1.15 OCC1CCC=CC1=O Amb25086884 [1,0,0,1,0,0|1,0,0]=3 2123 B9R1.15 O[C@@H]1CCCC=C1C=O Amb24582523 [1,0,0,1,0,0|1,0,0]=3 2124 B9R1.16 CCCCCC1=CC1=O Amb24553590 [1,0,0,1,0,0|0,0,0]=2 2125 B9R1.20 C=CC1CC1\C=C\C=O Amb25371821 [1,0,0,1,0,0|0,0,2]=4 2126 B9R1.20 C=C[C@@H]1C[C@@H]1\C=C/C=O Amb25698411 [1,0,0,1,0,0|0,0,2]=4 2127 B9R1.20 C=C[C@@H]1C[C@@H]1\C=C\C=O Amb24395032 [1,0,0,1,0,0|0,0,2]=4 2128 B9R1.20 C=C[C@H]1C[C@@H]1\C=C/C=O Amb25207034 [1,0,0,1,0,0|0,0,2]=4 2129 B9R1.20 C=C[C@H]1C[C@H]1\C=C\C=O Amb24395023 [1,0,0,1,0,0|0,0,2]=4 2130 B9R1.20 CCC1OC1\C=C\C=O Amb24750192 [1,0,0,1,0,0|1,0,0]=3 2131 B9R1.20 CCCC[C@@H]1O[C@H]1C=O Amb24562977 [1,0,0,1,0,0|1,0,1]=4 2132 B9R1.33 C=CCC1CC=CC1=O Amb25834342 [1,0,0,1,0,0|0,0,2]=4 2133 B9R1.33 CC/1CCC\C1=C/C=O Amb24677898 [1,0,0,1,0,0|0,0,0]=2 2134 B9R1.33 CC1=CCCC1=CC=O Amb24696185 [1,0,0,1,0,0|0,0,2]=4 2135 B9R1.33 CC1CCCC1=CC=O Amb25249728 [1,0,0,1,0,0|0,0,0]=2 2136 B9R1.33 CC1CCCC1=CCO Amb25855774 [1,0,0,1,0,0|0,0,1]=3 2137 B9R1.33 CCCC1C=CCC1=O Amb24722811 [1,0,0,1,0,0|0,0,2]=4 2138 B9R1.33 CCCC1CCNC1=O Amb24548217 [1,0,0,1,0,0|1,0,1]=4 2139 B9R1.33 CCCC1CCOC1=O Amb25032145 [1,0,0,1,0,0|1,0,1]=4 2140 B9R1.33 CCCC1CSCC1=O Amb25777255 [1,0,0,1,0,0|1,0,1]=4 2141 B9R1.33 CCCN1OC=CC1=O Amb25681048 [1,0,0,1,0,0|2,0,0]=4 2142 B9R1.33 CCCN1SC=CC1=O Amb24546623 [1,0,0,1,0,0|2,0,0]=4 2143 B9R1.33 CCC[C@@H]1CC=C[C@H]1O Amb25343780 [1,0,0,1,0,0|0,0,1]=3 2144 B9R1.33 CCC[n]1[n]ccc1O Amb24644797 [1,0,0,1,0,0|2,0,0]=4 2145 B9R1.33 CN/1CCC\C1=C/C=O Amb24100275 [1,0,0,1,0,0|1,0,0]=3 2146 B9R1.33 CN/1CCS\C1=C\C=O Amb25758365 [1,0,0,1,0,0|2,0,0]=4 2147 B9R1.33 COCC1CC=CC1=O Amb24620076 [1,0,0,1,0,0|1,0,0]=3 2148 B9R1.33 O=CCC1CC=CC1=O Amb24567093 [1,0,0,1,0,0|1,0,1]=4 2149 B9R1.33 OC1C=CCC1CCO Amb25282917 [1,0,0,1,0,0|1,0,1]=4 2150 B9R1.33 OCCC1OC=CC1=O Amb25101057 [1,0,0,1,0,0|2,0,0]=4 2151 B9R1.33 O[C@H]1C=CC[C@H]1CCO Amb25252869 [1,0,0,1,0,0|1,0,1]=4 2152 B9R1.50 BrC1CCCC=CC=C1 Amb24739198 [1,0,0,1,0,0|2,0,0]=4 2153 B9R1.50 BrC1CCCCCC=C1 Amb24480205 [1,0,0,1,0,0|1,0,1]=4 2154 B9R1.50 BrC=1C=CCCCCC1 Amb24481625 [1,0,0,1,0,0|1,0,1]=4 2155 B9R1.50 BrC=1CCCCCCC1 Amb23590920 [1,0,0,1,0,0|1,0,1]=4 2156 B9R1.50 CC1CCCCCC=C1 Amb22229355 [1,0,0,1,0,0|1,0,1]=4 2157 B9R1.50 CC=1CCCCCCC1 Amb22227979 [1,0,0,1,0,0|1,0,1]=4 2158 B9R1.50 NC1CCCCCC=C1 Amb22410845 [1,0,0,1,0,0|1,0,1]=4 2159 B9R1.50 O=C1C=CCCCC=C1 Amb22364780 [1,0,0,1,0,0|0,0,2]=4 2160 B9R1.50 O=C1C=CCCCCN1 Amb24469221 [1,0,0,1,0,0|1,0,0]=3 2161 B9R1.50 O=C1CC=CCCC=C1 Amb22365234 [1,0,0,1,0,0|0,0,2]=4 2162 B9R1.50 O=C1CC=CCCCC1 Amb25767841 [1,0,0,1,0,0|0,0,2]=4 2163 B9R1.50 O=C1CCCCC=CN1 Amb24477747 [1,0,0,1,0,0|1,0,1]=4 2164 B9R1.50 O=C1CCCCCC#C1 Amb25741527 [1,0,0,1,0,0|0,0,2]=4 2165 B9R1.50 O=C1CCCCNC=C1 Amb24745434 [1,0,0,1,0,0|1,0,0]=3 2166 B9R1.50 O=C1CNCCCCC1 Amb25254886 [1,0,0,1,0,0|1,0,1]=4 2167 B9R1.50 O=C1COCCCC=C1 Amb24595828 [1,0,0,1,0,0|1,0,0]=3 2168 B9R1.50 OC1CCCCCC=C1 Amb22364937 [1,0,0,1,0,0|0,0,1]=3 2169 B9R1.50 OC1CCOCCC=C1 Amb24582073 [1,0,0,1,0,0|1,0,1]=4 2170 B9R1.50 O[C@@H]1CCCCCC=C1 Amb25781852 [1,0,0,1,0,0|0,0,1]=3 2171 B9R1.83 N#C\C=C\CCC1CC1 Amb24651662 [1,0,0,1,0,0|1,0,1]=4 2172 B9R1.83 O=CNCCCC1CC1 Amb24685574 [1,0,0,1,0,0|1,0,1]=4 2173 B9R1.89 C#CC1=CCCCCC1 Amb17689256 [1,0,0,1,0,0|1,0,1]=4 2174 B9R1.89 CC=C1CCCCCC1 Amb22230656 [1,0,0,1,0,0|1,0,1]=4 2175 B9R1.89 ClCC1CCC=CC=C1 Amb25132007 [1,0,0,1,0,0|2,0,0]=4 2176 B9R1.89 O=C=C1CCCCCC1 Amb24412602 [1,0,0,1,0,0|0,0,2]=4 2177 B9R1.89 O=CC1CCCCCN1 Amb24461226 [1,0,0,1,0,0|1,0,1]=4 2178 B9R1.89 O=CC=1C=CCCCC1 Amb25827154 [1,0,0,1,0,0|0,0,2]=4 2179 B9R1.89 O\N=C/1\CCCCCN1 Amb1107240 [1,0,0,1,0,0|2,0,0]=4 2180 B9R1.89 O\N=C\1/CCCCCN1 Amb19664764 [1,0,0,1,0,0|2,0,0]=4 2181 B9R1.103 C1CC=CC=CCCN1 Amb24683046 [1,0,0,1,0,0|2,0,0]=4 2182 B9R1.103 C1CCCCCCC=C1 Amb22365157 [1,0,0,1,0,0|1,0,1]=4 2183 B9R1.2 CCC1CC(=O)C=CS1 Amb25373158 [1,0,0,1,0,0|2,0,0]=4 2184 B9R1.2 CCC1CC(=O)CCC1 Amb19335038 [1,0,0,1,0,0|1,0,1]=4 2185 B9R1.2 CCC1CC(=O)NCC1 Amb25791122 [1,0,0,1,0,0|2,0,0]=4 2186 B9R1.2 CCC1CC(=O)OCC1 Amb24707973 [1,0,0,1,0,0|2,0,0]=4 2187 B9R1.2 CCC1CCCC(=O)N1 Amb13883424 [1,0,0,1,0,0|1,0,1]=4 2188 B9R1.2 CCC1CCNC(O)=N1 Amb24481964 [1,0,0,1,0,0|2,0,0]=4 2189 B9R1.2 CC[C@@H]1CC(=O)CCC1 Amb25373198 [1,0,0,1,0,0|1,0,1]=4 2190 B9R1.2 CC[C@@H]1CCCC(=O)N1 Amb22746831 [1,0,0,1,0,0|1,0,1]=4 2191 B9R1.2 COC1CC=CC(=O)C1 Amb24636360 [1,0,0,1,0,0|2,0,0]=4 2192 B9R1.2 O=C1C=CCC(CCl)O1 Amb24432531 [1,0,0,1,0,0|1,0,0]=3 2193 B9R1.2 O=C1C=CC[C@@H](CCl)O1 Amb22226720 [1,0,0,1,0,0|1,0,0]=3 2194 B9R1.2 O=C1CCCC(CI)O1 Amb24675480 [1,0,0,1,0,0|1,0,1]=4 2195 B9R1.2 O=C1CCC[C@@H](CCl)O1 Amb24408738 [1,0,0,1,0,0|1,0,1]=4 2196 B9R1.2 O=CC1CC=CC(=O)O1 Amb18642367 [1,0,0,1,0,0|1,0,1]=4 2197 B9R1.2 O=C[C@H]1CC=CC(=O)O1 Amb25309566 [1,0,0,1,0,0|1,0,1]=4 2198 B9R1.2 OC[C@@H]1CC=CC(=O)C1 Amb24658579 [1,0,0,1,0,0|2,0,0]=4 2199 B9R1.2 OC[C@@H]1CC=CC(=O)N1 Amb24581594 [1,0,0,1,0,0|2,0,0]=4 2200 B9R1.2 OC[C@@H]1CCCC(=O)O1 Amb25045754 [1,0,0,1,0,0|1,0,1]=4 2201 B9R1.6 CC(=O)C1=CNCCC1 Amb1162825 [1,0,0,1,0,0|2,0,0]=4 2202 B9R1.6 CC(=O)C1=NCCCC1 Amb17607660 [1,0,0,1,0,0|2,0,0]=4 2203 B9R1.6 CC(=O)C=1CCCCN1 Amb22054236 [1,0,0,1,0,0|2,0,0]=4 2204 B9R1.6 CC(=O)C=1CNCCC1 Amb24461681 [1,0,0,1,0,0|2,0,0]=4 2205 B9R1.6 CC(=O)C=1CSCCC1 Amb25177639 [1,0,0,1,0,0|2,0,0]=4 2206 B9R1.6 CC(O)C=1CCCCC1 Amb25747240 [1,0,0,1,0,0|1,0,1]=4 2207 B9R1.6 C[C@@H](O)C=1CCCCC1 Amb25822621 [1,0,0,1,0,0|1,0,1]=4 2208 B9R1.6 ClC(=O)N1CCCCC1 Amb17563099 [1,0,0,1,0,0|2,0,0]=4 2209 B9R1.6 NC(=O)C1=CCCCO1 Amb23585657 [1,0,0,1,0,0|2,0,0]=4 2210 B9R1.6 NC(=O)C=1CCCOC1 Amb20665861 [1,0,0,1,0,0|2,0,0]=4 2211 B9R1.6 NC(=O)C=1CNCCC1 Amb25772238 [1,0,0,1,0,0|2,0,0]=4 2212 B9R1.6 NC(=O)N1CCCCC1 Amb1151731 [1,0,0,1,0,0|2,0,0]=4 2213 B9R1.6 O=C(Br)N1CCCCC1 Amb24089221 [1,0,0,1,0,0|2,0,0]=4 2214 B9R1.6 O=C(Cl)C=1CCCCC1 Amb21961756 [1,0,0,1,0,0|1,0,0]=3 2215 B9R1.6 O=C(Cl)C=1CCOCC1 Amb25714177 [1,0,0,1,0,0|2,0,0]=4 2216 B9R1.6 O=C(S)N1CCCCC1 Amb24744645 [1,0,0,1,0,0|1,1,0]=4 2217 B9R1.6 OB(C1=CCCCC1)O Amb2455978 [1,0,0,1,0,0|1,0,1]=4 2218 B9R1.6 OC(=O)C1=CCCCN1 Amb23585365 [1,0,0,1,0,0|1,0,0]=3 2219 B9R1.6 OC(=O)C1=CCCNC1 Amb10608557 [1,0,0,1,0,0|1,0,0]=3 2220 B9R1.6 OC(=O)C1=CCNCC1 Amb10843904 [1,0,0,1,0,0|1,0,0]=3 2221 B9R1.6 OC(=O)C1=COCCO1 Amb1106470 [1,0,0,1,0,0|2,0,0]=4 2222 B9R1.6 OC(=O)C1=CSCCN1 Amb24691283 [1,0,0,1,0,0|2,0,0]=4 2223 B9R1.6 OC(=O)C1=CSCCO1 Amb20455323 [1,0,0,1,0,0|2,0,0]=4 2224 B9R1.6 OC(=O)C1=CSCCS1 Amb24355897 [1,0,0,1,0,0|2,0,0]=4 2225 B9R1.6 OC(=O)C1CCCC=C1 Amb18642396 [1,0,0,1,0,0|0,0,2]=4 2226 B9R1.6 OC(=O)C1CCCCS1 Amb18202314 [1,0,0,1,0,0|1,0,1]=4 2227 B9R1.6 OC(=O)C1CCCNC1 Amb1151304 [1,0,0,1,0,0|1,0,1]=4 2228 B9R1.6 OC(=O)C1CCCOC1 Amb1102367 [1,0,0,1,0,0|1,0,1]=4 2229 B9R1.6 OC(=O)C1CSCCC1 Amb18202321 [1,0,0,1,0,0|1,0,1]=4 2230 B9R1.6 OC(=O)C=1CCCCN1 Amb24597785 [1,0,0,1,0,0|1,0,0]=3 2231 B9R1.6 OC(=O)C=1CCCNC1 Amb25328967 [1,0,0,1,0,0|1,0,0]=3 2232 B9R1.6 OC(=O)C=1CCCNN1 Amb18642590 [1,0,0,1,0,0|2,0,0]=4 2233 B9R1.6 OC(=O)C=1CCCOC1 Amb18642576 [1,0,0,1,0,0|1,0,0]=3 2234 B9R1.6 OC(=O)C=1CCOCC1 Amb18642574 [1,0,0,1,0,0|1,0,0]=3 2235 B9R1.6 OC(=O)C=1COCCC1 Amb19958529 [1,0,0,1,0,0|1,0,0]=3 2236 B9R1.6 OC(=O)C=1CSCCC1 Amb19515066 [1,0,0,1,0,0|1,0,0]=3 2237 B9R1.6 OC(=O)C=1CSCCN1 Amb25324089 [1,0,0,1,0,0|2,0,0]=4 2238 B9R1.6 OC(=O)C=1NCCCN1 Amb25379456 [1,0,0,1,0,0|2,0,0]=4 2239 B9R1.6 OC(=O)N1CCCCC1 Amb20242677 [1,0,0,1,0,0|1,0,0]=3 2240 B9R1.6 OC(=O)N1CCNCC1 Amb20621990 [1,0,0,1,0,0|2,0,0]=4 2241 B9R1.6 OC(=O)N1CCOCC1 Amb22491154 [1,0,0,1,0,0|2,0,0]=4 2242 B9R1.6 OC(=O)N1CCSCC1 Amb24099831 [1,0,0,1,0,0|2,0,0]=4 2243 B9R1.6 OC(=O)[C@@H]1CCCCO1 Amb22746821 [1,0,0,1,0,0|1,0,1]=4 2244 B9R1.6 OC(=O)[C@@H]1CCCNC1 Amb16232354 [1,0,0,1,0,0|1,0,1]=4 2245 B9R1.6 OC(=O)[C@@H]1COCCC1 Amb24118033 [1,0,0,1,0,0|1,0,1]=4 2246 B9R1.6 OP(=O)C1CCCCC1 Amb25327219 [1,0,0,1,0,0|1,0,1]=4 2247 B9R1.6 OS(=O)C1CCCCC1 Amb24603074 [1,0,0,1,0,0|1,0,1]=4 2248 B9R1.6 O[13C](=O)C1CCCCN1 Amb22363349 [1,0,0,1,0,0|1,0,1]=4 2249 B9R1.6 [13CH3][13C](=O)C=1CCCCN1 Amb22054237 [1,0,0,1,0,0|2,0,0]=4 2250 B9R1.6 [O-][N+](=O)C=1CCCCC1 Amb22347895 [1,0,0,1,0,0|1,0,1]=4 2251 B9R1.7 CCCC1C=CC(=O)O1 Amb25793308 [1,0,0,1,0,0|0,0,0]=2 2252 B9R1.7 CCCC1C=CC(=O)S1 Amb25274697 [1,0,0,1,0,0|0,1,0]=3 2253 B9R1.7 CCCC1CC(=O)C=C1 Amb25768578 [1,0,0,1,0,0|1,0,0]=3 2254 B9R1.7 CCCC1CC(=O)CC1 Amb24087435 [1,0,0,1,0,0|1,0,1]=4 2255 B9R1.7 CCCC1CCC(=O)N1 Amb17940083 [1,0,0,1,0,0|1,0,1]=4 2256 B9R1.7 CCCC1CNC(=O)C1 Amb16186658 [1,0,0,1,0,0|2,0,0]=4 2257 B9R1.7 CCC[C@@H]1CC(=O)CC1 Amb25802135 [1,0,0,1,0,0|1,0,1]=4 2258 B9R1.7 CCC[C@@H]1CCC(=O)N1 Amb25824143 [1,0,0,1,0,0|1,0,1]=4 2259 B9R1.7 CCC[C@H]1CC(=O)C=C1 Amb24620152 [1,0,0,1,0,0|1,0,0]=3 2260 B9R1.7 CCC[C@H]1CC(=O)CC1 Amb25298534 [1,0,0,1,0,0|1,0,1]=4 2261 B9R1.7 CCC[C@H]1CCC(=O)N1 Amb24477475 [1,0,0,1,0,0|1,0,1]=4 2262 B9R1.7 CCC[C@H]1CNC(=O)C1 Amb25146172 [1,0,0,1,0,0|2,0,0]=4 2263 B9R1.7 CCC[C@H]1CNC(=O)S1 Amb25698617 [1,0,0,1,0,0|1,1,0]=4 2264 B9R1.7 CCCc1ccc(Br)o1 Amb24318772 [1,0,0,1,0,0|1,0,1]=4 2265 B9R1.7 CCCc1ccc(S)o1 Amb24541239 [1,0,0,1,0,0|0,1,1]=4 2266 B9R1.7 CCOC1C=CC(=O)N1 Amb25809445 [1,0,0,1,0,0|2,0,0]=4 2267 B9R1.7 CCOC1CCC(=O)O1 Amb24117269 [1,0,0,1,0,0|1,0,1]=4 2268 B9R1.7 CCO[C@@H]1C=CC(=O)O1 Amb25060479 [1,0,0,1,0,0|1,0,0]=3 2269 B9R1.7 CC\C=C/1\C=CC(=O)O1 Amb25359381 [1,0,0,1,0,0|0,0,2]=4 2270 B9R1.7 CC\N=C\1/C=CC(=O)O1 Amb25274141 [1,0,0,1,0,0|1,0,1]=4 2271 B9R1.7 CNCC1CNC(=O)O1 Amb17506101 [1,0,0,1,0,0|2,0,0]=4 2272 B9R1.7 CNC[C@H]1CNC(=O)O1 Amb25199568 [1,0,0,1,0,0|2,0,0]=4 2273 B9R1.7 COC[C@@H]1C=CC(=O)O1 Amb24726034 [1,0,0,1,0,0|1,0,0]=3 2274 B9R1.7 COC[C@@H]1CNC(=O)O1 Amb22746095 [1,0,0,1,0,0|2,0,0]=4 2275 B9R1.7 COC[C@@H]1COC(=O)O1 Amb22366849 [1,0,0,1,0,0|2,0,0]=4 2276 B9R1.7 COC[C@H]1CNC(=O)O1 Amb22225377 [1,0,0,1,0,0|2,0,0]=4 2277 B9R1.7 COC[C@H]1COC(=O)O1 Amb22226690 [1,0,0,1,0,0|2,0,0]=4 2278 B9R1.7 C\C=C\C1C=CC(=O)O1 Amb25238033 [1,0,0,1,0,0|0,0,2]=4 2279 B9R1.7 C\C=C\[C@H]1C=CC(=O)O1 Amb24415319 [1,0,0,1,0,0|0,0,2]=4 2280 B9R1.7 Cc1ccc(CCC)o1 Amb22339463 [1,0,0,1,0,0|1,0,1]=4 2281 B9R1.7 N#CCC1C=CC(=O)O1 Amb18124291 [1,0,0,1,0,0|1,0,1]=4 2282 B9R1.7 NCCC1CCC(=O)O1 Amb25146052 [1,0,0,1,0,0|1,0,1]=4 2283 B9R1.7 NCCC1COC(=O)O1 Amb24746673 [1,0,0,1,0,0|2,0,0]=4 2284 B9R1.7 O=C1CCC(CCCl)O1 Amb24459566 [1,0,0,1,0,0|1,0,1]=4 2285 B9R1.7 O=C1NCC(CCCl)O1 Amb25145966 [1,0,0,1,0,0|2,0,0]=4 2286 B9R1.7 OCCC1C=CC(=O)O1 Amb18832646 [1,0,0,1,0,0|1,0,0]=3 2287 B9R1.7 OCCC1CCC(=O)O1 Amb25188957 [1,0,0,1,0,0|1,0,1]=4 2288 B9R1.7 OCCC1CNC(=O)O1 Amb24604919 [1,0,0,1,0,0|2,0,0]=4 2289 B9R1.7 OCC[C@@H]1CNC(=O)O1 Amb25340109 [1,0,0,1,0,0|2,0,0]=4 2290 B9R1.7 OCC[C@H]1CCC(=O)O1 Amb24397212 [1,0,0,1,0,0|1,0,1]=4 2291 B9R1.9 CCCCC1CC(=O)O1 Amb25202242 [1,0,0,1,0,0|0,0,1]=3 2292 B9R1.9 CCCCC=1CC(O)C1 Amb25204732 [1,0,0,1,0,0|1,0,1]=4 2293 B9R1.13 CC(=O)SC1CCCC1 Amb22337902 [1,0,0,1,0,0|2,0,0]=4 2294 B9R1.13 CC(=O)\C=C/1\CCCN1 Amb17593301 [1,0,0,1,0,0|2,0,0]=4 2295 B9R1.13 CC(=O)\C=C/1\CCCO1 Amb25241353 [1,0,0,1,0,0|2,0,0]=4 2296 B9R1.13 ClC(=O)OC1CCCC1 Amb10070029 [1,0,0,1,0,0|2,0,0]=4 2297 B9R1.13 NC(=O)C=C1CCCC1 Amb20622621 [1,0,0,1,0,0|1,0,0]=3 2298 B9R1.13 NC(=O)NC1CCCC1 Amb1151267 [1,0,0,1,0,0|2,0,0]=4 2299 B9R1.13 O=C(F)NC1CCCC1 Amb25711539 [1,0,0,1,0,0|2,0,0]=4 2300 B9R1.13 OC(=O)C=C1NCCN1 Amb18832637 [1,0,0,1,0,0|2,0,0]=4 2301 B9R1.13 OC(=O)C=C1SCCS1 Amb25803443 [1,0,0,1,0,0|2,0,0]=4 2302 B9R1.13 OC(=O)CC1CCCC1 Amb16192937 [1,0,0,1,0,0|0,0,1]=3 2303 B9R1.13 OC(=O)CC1CCCN1 Amb20668514 [1,0,0,1,0,0|1,0,1]=4 2304 B9R1.13 OC(=O)CC1CCCO1 Amb1088908 [1,0,0,1,0,0|1,0,1]=4 2305 B9R1.13 OC(=O)CC1CCCS1 Amb18644290 [1,0,0,1,0,0|1,0,1]=4 2306 B9R1.13 OC(=O)CC1CSCC1 Amb18202318 [1,0,0,1,0,0|1,0,1]=4 2307 B9R1.13 OC(=O)CC=1CCCC1 Amb18642404 [1,0,0,1,0,0|0,0,2]=4 2308 B9R1.13 OC(=O)C[C@@H]1CCCN1 Amb13891876 [1,0,0,1,0,0|1,0,1]=4 2309 B9R1.13 OC(=O)C[C@@H]1CCCO1 Amb24271115 [1,0,0,1,0,0|1,0,1]=4 2310 B9R1.13 OC(=O)C[C@@H]1COCC1 Amb23401495 [1,0,0,1,0,0|1,0,1]=4 2311 B9R1.13 OC(=O)C[C@H]1CCCN1 Amb16184011 [1,0,0,1,0,0|1,0,1]=4 2312 B9R1.13 OC(=O)C[C@H]1CCCO1 Amb24271109 [1,0,0,1,0,0|1,0,1]=4 2313 B9R1.13 OC(=O)C[C@H]1CNCC1 Amb10067024 [1,0,0,1,0,0|1,0,1]=4 2314 B9R1.13 OC(=O)NN1CCCC1 Amb24082039 [1,0,0,1,0,0|2,0,0]=4 2315 B9R1.13 OC(=O)\C=C/1\CCNC1 Amb21953701 [1,0,0,1,0,0|1,0,0]=3 2316 B9R1.13 OC(=O)\C=C\1/CCNC1 Amb24538554 [1,0,0,1,0,0|1,0,0]=3 2317 B9R1.41 CC(=O)C1=CCC[C@H]1C Amb25724215 [1,0,0,1,0,0|1,0,0]=3 2318 B9R1.41 CC1CCCC1C(=O)C Amb17593321 [1,0,0,1,0,0|1,0,1]=4 2319 B9R1.41 CC1CCCC1C(N)=O Amb24680775 [1,0,0,1,0,0|1,0,1]=4 2320 B9R1.41 CC1CCCN1C(=O)Cl Amb25131803 [1,0,0,1,0,0|2,0,0]=4 2321 B9R1.41 CC1CCNC1C(O)=O Amb22496299 [1,0,0,1,0,0|1,0,1]=4 2322 B9R1.41 CC1CCN[C@@H]1C(O)=O Amb25786199 [1,0,0,1,0,0|1,0,1]=4 2323 B9R1.41 CC1CCOC1C(O)=O Amb20668280 [1,0,0,1,0,0|1,0,1]=4 2324 B9R1.41 CC1COCC1C(O)=O Amb25326733 [1,0,0,1,0,0|1,0,1]=4 2325 B9R1.41 CC1NCCC1C(O)=O Amb18118138 [1,0,0,1,0,0|1,0,1]=4 2326 B9R1.41 CC1OCCC1C(O)=O Amb22059743 [1,0,0,1,0,0|1,0,1]=4 2327 B9R1.41 CC=1CC=CC1C(O)=O Amb25145525 [1,0,0,1,0,0|0,0,2]=4 2328 B9R1.41 CC=1SCCC1C(O)=O Amb24750254 [1,0,0,1,0,0|1,0,1]=4 2329 B9R1.41 CN1CCC[C@@H]1C(O)=O Amb17935722 [1,0,0,1,0,0|1,0,1]=4 2330 B9R1.41 CN1CCC[C@@H]1C(O)=O Amb18559228 [1,0,0,1,0,0|1,0,1]=4 2331 B9R1.41 CN1CCC[C@@H]1C(O)=O Amb22748316 [1,0,0,1,0,0|1,0,1]=4 2332 B9R1.41 CN1CCC[C@H]1C(=O)O Amb10604041 [1,0,0,1,0,0|1,0,1]=4 2333 B9R1.41 CN1CCC[C@H]1C(O)=O Amb22587172 [1,0,0,1,0,0|1,0,1]=4 2334 B9R1.41 CN1CCN=C1C(O)=O Amb25352083 [1,0,0,1,0,0|2,0,0]=4 2335 B9R1.41 C[C@@H]1CCC[C@@H]1C(=O)O Amb10843957 [1,0,0,1,0,0|0,0,1]=3 2336 B9R1.41 C[C@@H]1CCC[C@H]1C(=O)O Amb10843949 [1,0,0,1,0,0|0,0,1]=3 2337 B9R1.41 C[C@@H]1CCC[C@H]1C(C)=O Amb24692616 [1,0,0,1,0,0|1,0,1]=4 2338 B9R1.41 C[C@@H]1CCC[C@H]1C(N)=O Amb24598612 [1,0,0,1,0,0|1,0,1]=4 2339 B9R1.41 C[C@@H]1CCN[C@H]1C(O)=O Amb22747259 [1,0,0,1,0,0|1,0,1]=4 2340 B9R1.41 C[C@@H]1CCO[C@@H]1C(O)=O Amb25251332 [1,0,0,1,0,0|1,0,1]=4 2341 B9R1.41 C[C@@H]1COC[C@@H]1C(O)=O Amb24649146 [1,0,0,1,0,0|1,0,1]=4 2342 B9R1.41 C[C@@H]1NCC[C@H]1C(O)=O Amb18832568 [1,0,0,1,0,0|1,0,1]=4 2343 B9R1.41 C[C@@H]1OCC[C@@H]1C(O)=O Amb22886528 [1,0,0,1,0,0|1,0,1]=4 2344 B9R1.41 C[C@H]1CCC[C@@H]1C(=O)O Amb10843959 [1,0,0,1,0,0|0,0,1]=3 2345 B9R1.41 C[C@H]1CCC[C@H]1C(=O)O Amb10843950 [1,0,0,1,0,0|0,0,1]=3 2346 B9R1.41 C[C@H]1CCN[C@H]1C(O)=O Amb24715733 [1,0,0,1,0,0|1,0,1]=4 2347 B9R1.41 C[C@H]1CNCC1C(O)=O Amb24546979 [1,0,0,1,0,0|1,0,1]=4 2348 B9R1.41 C[C@H]1NCC[C@@H]1C(O)=O Amb24539923 [1,0,0,1,0,0|1,0,1]=4 2349 B9R1.41 C[C@H]1OCC[C@H]1C(O)=O Amb25253338 [1,0,0,1,0,0|1,0,1]=4 2350 B9R1.41 C[S+]1CCCC1C(O)=O Amb24634112 [1,0,0,1,0,0|1,0,1]=4 2351 B9R1.41 NC=1CCCC1C(O)=O Amb20240586 [1,0,0,1,0,0|1,0,1]=4 2352 B9R1.41 N[C@@H]1CCC[C@H]1C(O)=O Amb20241297 [1,0,0,1,0,0|1,0,1]=4 2353 B9R1.41 N[C@@H]1CCC[C@H]1C(O)=O Amb22224830 [1,0,0,1,0,0|1,0,1]=4 2354 B9R1.41 N[C@H]1CCC[C@@H]1C(O)=O Amb20241298 [1,0,0,1,0,0|1,0,1]=4 2355 B9R1.41 N[C@H]1CCC[C@@H]1C(O)=O Amb22224860 [1,0,0,1,0,0|1,0,1]=4 2356 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993719 [1,0,0,1,0,0|1,0,1]=4 2357 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993764 [1,0,0,1,0,0|1,0,1]=4 2358 B9R1.41 OC(=O)C1=CCC[C@H]1O Amb25795408 [1,0,0,1,0,0|1,0,0]=3 2359 B9R1.41 OC(=O)C1CCCC1Br Amb24480063 [1,0,0,1,0,0|1,0,1]=4 2360 B9R1.41 OC(=O)C1CCCC1S Amb18280971 [1,0,0,1,0,0|1,0,1]=4 2361 B9R1.41 OC(=O)C=1CCCC1Br Amb24424181 [1,0,0,1,0,0|1,0,1]=4 2362 B9R1.41 OC(=O)[C@H]1CCC[C@@H]1Br Amb25251282 [1,0,0,1,0,0|1,0,1]=4 2363 B9R1.41 OC(=O)[C@H]1CCC[C@H]1Br Amb24693868 [1,0,0,1,0,0|1,0,1]=4 2364 B9R1.41 OC1CCCC1C(O)=O Amb19148040 [1,0,0,1,0,0|1,0,1]=4 2365 B9R1.41 OC=1CCCC1C(O)=O Amb25697344 [1,0,0,1,0,0|1,0,1]=4 2366 B9R1.41 O[C@@H]1CCC[C@@H]1C(O)=O Amb22747315 [1,0,0,1,0,0|1,0,1]=4 2367 B9R1.41 O[C@@H]1CCC[C@H]1C(O)=O Amb24120349 [1,0,0,1,0,0|1,0,1]=4 2368 B9R1.41 O[C@H]1CCC[C@H]1C(=O)O Amb10844853 [1,0,0,1,0,0|1,0,1]=4 2369 B9R1.46 CC1CC1C#CC(O)=O Amb24390173 [1,0,0,1,0,0|0,0,2]=4 2370 B9R1.46 CC1CC1CNC(C)=O Amb25851867 [1,0,0,1,0,0|2,0,0]=4 2371 B9R1.46 CC1CC1CNC(N)=O Amb25185082 [1,0,0,1,0,0|2,0,0]=4 2372 B9R1.46 CC1CC1NCC(O)=O Amb18993215 [1,0,0,1,0,0|1,0,1]=4 2373 B9R1.46 CC1OC1\C=C\C(C)=O Amb25116313 [1,0,0,1,0,0|2,0,0]=4 2374 B9R1.46 CC1OC1\C=C\C(O)=O Amb24475226 [1,0,0,1,0,0|1,0,0]=3 2375 B9R1.46 C[C@@H]1C[C@@H]1CCC(C)=O Amb25834668 [1,0,0,1,0,0|1,0,1]=4 2376 B9R1.46 C[C@@H]1C[C@H]1CCC(C)=O Amb25163844 [1,0,0,1,0,0|1,0,1]=4 2377 B9R1.46 C[C@@H]1O[C@@H]1\C=C\C(C)=O Amb24576022 [1,0,0,1,0,0|2,0,0]=4 2378 B9R1.46 NC1CC1\C=C\C(N)=O Amb23590839 [1,0,0,1,0,0|2,0,0]=4 2379 B9R1.48 CC1CCCCC(=O)C1 Amb17593325 [1,0,0,1,0,0|1,0,1]=4 2380 B9R1.48 CC1CCCCC(=O)N1 Amb22434912 [1,0,0,1,0,0|1,0,1]=4 2381 B9R1.48 CC1CNC=CC(=O)C1 Amb24546980 [1,0,0,1,0,0|2,0,0]=4 2382 B9R1.48 C[C@@H]1CC(=O)C=CCC1 Amb25353106 [1,0,0,1,0,0|1,0,0]=3 2383 B9R1.48 C[C@@H]1CC(=O)CCCC1 Amb25044345 [1,0,0,1,0,0|1,0,1]=4 2384 B9R1.48 C[C@H]1CC(=O)C=CCC1 Amb24384662 [1,0,0,1,0,0|1,0,0]=3 2385 B9R1.48 C[C@H]1C[C@@H](O)C=CCC1 Amb24620795 [1,0,0,1,0,0|1,0,1]=4 2386 B9R1.48 O[C@@H]1CCCCC(=O)O1 Amb25296333 [1,0,0,1,0,0|1,0,1]=4 2387 B9R1.48 O[C@H]1CCCCC(=O)O1 Amb24529319 [1,0,0,1,0,0|1,0,1]=4 2388 B9R1.59 CCCC1=CC1C(O)=O Amb24701359 [1,0,0,1,0,0|0,0,2]=4 2389 B9R1.59 CCCC1CC1C(N)=O Amb24473639 [1,0,0,1,0,0|1,0,1]=4 2390 B9R1.59 CCCC1CC1C(O)=O Amb19001459 [1,0,0,1,0,0|0,0,1]=3 2391 B9R1.59 CCCC1OC1C(O)=O Amb24561183 [1,0,0,1,0,0|1,0,1]=4 2392 B9R1.59 CCC[C@@H]1C[C@H]1C(O)=O Amb25368727 [1,0,0,1,0,0|0,0,1]=3 2393 B9R1.59 CNC[C@@H]1C[C@H]1C(O)=O Amb24744378 [1,0,0,1,0,0|1,0,1]=4 2394 B9R1.59 OC(=O)[C@@H]1C[C@H]1CCBr Amb24519204 [1,0,0,1,0,0|1,0,1]=4 2395 B9R1.67 CC(=O)\C=C/1\CCC1F Amb24352112 [1,0,0,1,0,0|2,0,0]=4 2396 B9R1.67 CC1CCC1CC(O)=O Amb24466547 [1,0,0,1,0,0|0,0,1]=3 2397 B9R1.67 N[C@H]1CC[C@@H]1CC(O)=O Amb24700074 [1,0,0,1,0,0|1,0,1]=4 2398 B9R1.84 CC(=O)CCC1CCC1 Amb24534447 [1,0,0,1,0,0|1,0,1]=4 2399 B9R1.84 CC(=O)\C=C\C1CCC1 Amb22494067 [1,0,0,1,0,0|1,0,0]=3 2400 B9R1.84 NC(=O)OCC1CCC1 Amb24642121 [1,0,0,1,0,0|2,0,0]=4 2401 B9R1.84 O=C(Cl)OCC1CCC1 Amb24551352 [1,0,0,1,0,0|2,0,0]=4 2402 B9R1.84 OC(=O)C=CC1CCC1 Amb20624021 [1,0,0,1,0,0|0,0,0]=2 2403 B9R1.84 OC(=O)CCN1CCC1 Amb22292346 [1,0,0,1,0,0|1,0,1]=4 2404 B9R1.84 OC(=O)CNC1CCC1 Amb18982434 [1,0,0,1,0,0|1,0,1]=4 2405 B9R1.84 OC(=O)COC1CCC1 Amb18295877 [1,0,0,1,0,0|1,0,1]=4 2406 B9R1.84 OC(=O)CSC1CCC1 Amb24439698 [1,0,0,1,0,0|1,0,1]=4 2407 B9R1.84 [O-][N+](=O)\C=C\C1CCC1 Amb21858185 [1,0,0,1,0,0|1,0,1]=4 2408 B9R1.85 CC(=O)CCCC1CC1 Amb25303589 [1,0,0,1,0,0|1,0,1]=4 2409 B9R1.85 CC(=O)NCCC1CC1 Amb25749460 [1,0,0,1,0,0|2,0,0]=4 2410 B9R1.85 CC(=O)OCCC1CC1 Amb25091905 [1,0,0,1,0,0|2,0,0]=4 2411 B9R1.85 NC(=O)NCCC1CC1 Amb24478666 [1,0,0,1,0,0|2,0,0]=4 2412 B9R1.85 OC(=O)C#CCC1CC1 Amb25147203 [1,0,0,1,0,0|0,0,2]=4 2413 B9R1.85 OC(=O)CCCC1CC1 Amb18832629 [1,0,0,1,0,0|0,0,1]=3 2414 B9R1.85 OC(=O)CCC[C@H]1CO1 Amb24427275 [1,0,0,1,0,0|1,0,1]=4 2415 B9R1.85 OC(=O)CCNC1CC1 Amb1106410 [1,0,0,1,0,0|1,0,1]=4 2416 B9R1.85 OC(=O)CCSC1CC1 Amb25221891 [1,0,0,1,0,0|1,0,1]=4 2417 B9R1.85 OC(=O)\C=C\NC1CC1 Amb22363623 [1,0,0,1,0,0|1,0,0]=3 2418 B9R1.86 CCC1CC1NC(C)=O Amb25208251 [1,0,0,1,0,0|2,0,0]=4 2419 B9R1.86 CCC1CC1NC(N)=O Amb25208250 [1,0,0,1,0,0|2,0,0]=4 2420 B9R1.86 OC(=O)CC1CC1CBr Amb25269489 [1,0,0,1,0,0|1,0,1]=4 2421 B9R1.96 CCC1CCC1C(O)=O Amb25727014 [1,0,0,1,0,0|0,0,1]=3 2422 B9R1.96 CCN1CCC1C(O)=O Amb22011877 [1,0,0,1,0,0|1,0,1]=4 2423 B9R1.96 CCN1CC[C@@H]1C(O)=O Amb24634744 [1,0,0,1,0,0|1,0,1]=4 2424 B9R1.96 CCN1CC[C@H]1C(O)=O Amb25347394 [1,0,0,1,0,0|1,0,1]=4 2425 B9R1.96 CNC1CCC1C(O)=O Amb25340658 [1,0,0,1,0,0|1,0,1]=4 2426 B9R1.96 CSC1CCC1C(O)=O Amb25118114 [1,0,0,1,0,0|1,0,1]=4 2427 B9R1.96 NCC1CCC1C(O)=O Amb25269589 [1,0,0,1,0,0|1,0,1]=4 2428 B9R1.96 NC[C@H]1CC[C@H]1C(O)=O Amb24579352 [1,0,0,1,0,0|1,0,1]=4 2429 B9R1.96 OC(=O)C1CCC1CF Amb20667674 [1,0,0,1,0,0|1,0,1]=4 2430 B9R1.96 OCC1CCC1C(O)=O Amb24340315 [1,0,0,1,0,0|1,0,1]=4 2431 B9R1.96 OCC1CCN1C(O)=O Amb22756926 [1,0,0,1,0,0|2,0,0]=4 2432 B11R1.15 CC(CC=O)C1C=CC(=O)O1 Amb25150233 [0,1,0,1,0,0|1,0,1]=4 2433 B11R1.15 CC(OCC)C1CC(=O)C=C1 Amb25151489 [0,1,0,1,0,0|2,0,0]=4 2434 B11R1.15 CCCC(O)C1CCC(=O)O1 Amb24371260 [0,1,0,1,0,0|0,0,2]=4 2435 B11R1.15 CCCC(O)c1ccc(Br)o1 Amb25694234 [0,1,0,1,0,0|1,0,1]=4 2436 B11R1.15 CCC[C@@H](N)c1ccc(Cl)o1 Amb25757883 [0,1,0,1,0,0|1,0,1]=4 2437 B11R1.15 CCC[C@@H](O)[C@@H]1C=CC(=O)O1 Amb25204712 [0,1,0,1,0,0|0,0,0]=2 2438 B11R1.15 CCC[C@H](N)c1ccc(Br)o1 Amb25095864 [0,1,0,1,0,0|1,0,1]=4 2439 B11R1.15 CCC[C@H](O)[C@H]1C=CC(=O)O1 Amb25324569 [0,1,0,1,0,0|0,0,0]=2 2440 B11R1.15 C\C=C\[C@@H](O)[C@H]1C=CC(=O)O1 Amb25306640 [0,1,0,1,0,0|0,0,2]=4 2441 B11R1.15 C\C=C\[C@H](O)[C@@H]1C=CC(=O)O1 Amb24515319 [0,1,0,1,0,0|0,0,2]=4 2442 B11R1.15 Cc1ccc(o1)C(N)CCC Amb18293648 [0,1,0,1,0,0|1,0,1]=4 2443 B11R1.90 CC(=O)\C=C\C1CCCC1=C Amb24620047 [0,1,0,1,0,0|1,0,1]=4 2444 B11R1.90 CC(=O)\C=C\C1CCCC1=O Amb25205843 [0,1,0,1,0,0|1,0,1]=4 2445 B11R1.90 CC1=CCCC1\C=C\C(C)=O Amb24584482 [0,1,0,1,0,0|1,0,1]=4 2446 B11R1.90 CC1CCCC1C#CC(O)=O Amb25779879 [0,1,0,1,0,0|0,0,2]=4 2447 B11R1.90 CC1CCCC1CCC(O)=O Amb18644848 [0,1,0,1,0,0|0,0,2]=4 2448 B11R1.90 CC1CCCC1NCC(O)=O Amb25713954 [0,1,0,1,0,0|0,0,2]=4 2449 B11R1.90 CC1CCCN1CCC(O)=O Amb18290255 [0,1,0,1,0,0|0,0,2]=4 2450 B11R1.90 CC1CCN=C1C=CC(N)=O Amb24462799 [0,1,0,1,0,0|1,0,1]=4 2451 B11R1.90 CC1CCOC1C#CC(O)=O Amb24660589 [0,1,0,1,0,0|0,0,2]=4 2452 B11R1.90 CC=1CCCC1CCC(O)=O Amb24373821 [0,1,0,1,0,0|0,0,2]=4 2453 B11R1.90 CC=1CCCC1\C=C\C(C)=O Amb25205824 [0,1,0,1,0,0|1,0,1]=4 2454 B11R1.90 OC(=O)CCC1CCCN1C Amb17504569 [0,1,0,1,0,0|0,0,2]=4 2455 B11R1.90 OC(=O)CNC1CCCC1F Amb25275634 [0,1,0,1,0,0|1,0,1]=4 2456 B11R1.90 OC1CCCC1CCC(O)=O Amb25828867 [0,1,0,1,0,0|0,0,2]=4 2457 B11R1.90 OC1CCCC1NCC(O)=O Amb18289477 [0,1,0,1,0,0|1,0,1]=4 2458 B11R1.90 OC1CCCC1SCC(O)=O Amb18292041 [0,1,0,1,0,0|1,0,1]=4 2459 B11R1.90 OC1CCNC1\C=C\C(O)=O Amb25351484 [0,1,0,1,0,0|1,0,0]=3 2460 B11R1.120 CCCC1CC(CC(O)=O)C1 Amb25384948 [0,1,0,1,0,0|0,0,2]=4 2461 B11R1.120 CCCC1CN(C1)CC(O)=O Amb24761786 [0,1,0,1,0,0|1,0,1]=4 2462 B11R1.124 CCCC1CC(CC1)C(O)=O Amb24650608 [0,1,0,1,0,0|0,0,2]=4 2463 B11R1.124 CCCC1CC(NC1)C(O)=O Amb18126070 [0,1,0,1,0,0|1,0,1]=4 2464 B11R1.124 CCCC1CCC(N1)C(O)=O Amb24423990 [0,1,0,1,0,0|0,0,2]=4 2465 B11R1.124 CCCC1C[C@H](NC1)C(O)=O Amb24487717 [0,1,0,1,0,0|1,0,1]=4 2466 B11R1.124 CCCC=1CC(=CN1)C(O)=O Amb25279917 [0,1,0,1,0,0|1,0,1]=4 2467 B11R1.124 CCC[C@H]1CC[C@@H](N1)C(O)=O Amb25338321 [0,1,0,1,0,0|0,0,2]=4 2468 B11R1.124 CCC[C@H]1C[C@H](NC1)C(O)=O Amb24692815 [0,1,0,1,0,0|1,0,1]=4 2469 B11R1.124 CCC[n]1cc(cc1)C(O)=O Amb23555738 [0,1,0,1,0,0|1,0,1]=4 2470 B11R1.124 CCCc1[nH]c(c[n]1)C(O)=O Amb18200807 [0,1,0,1,0,0|1,0,1]=4 2471 B11R1.124 CCCc1[n]c(co1)C(O)=O Amb18296164 [0,1,0,1,0,0|1,0,1]=4 2472 B11R1.124 CCCc1cc(cs1)C(=O)O Amb2154727 [0,1,0,1,0,0|1,0,1]=4 2473 B11R1.124 CCCc1ccc([nH]1)C(O)=O Amb23153977 [0,1,0,1,0,0|0,0,2]=4 2474 B11R1.124 CCCc1ccc(o1)C(=O)O Amb1074343 [0,1,0,1,0,0|0,0,2]=4 2475 B11R1.145 OC1CCCC(=O)OCCC1 Amb25149645 [0,1,0,1,0,0|0,0,2]=4 2476 B11R1.154 CC(=O)CCCC=1CC(=O)C1 Amb24766882 [0,1,0,1,0,0|1,0,1]=4 2477 B11R1.154 CN1CC(C1)N\C=C\C(O)=O Amb25100052 [0,1,0,1,0,0|2,0,0]=4 2478 B11R1.157 CC(=O)C=C1CN(C)CCC1 Amb25308398 [0,1,0,1,0,0|2,0,0]=4 2479 B11R1.157 CC(=O)\C=C\1/CC(C)CCC1 Amb24509592 [0,1,0,1,0,0|1,0,0]=3 2480 B11R1.157 CC(C)CC1CC(=O)C=CO1 Amb24669636 [0,1,0,1,0,0|2,0,0]=4 2481 B11R1.157 CC(C)C[C@@H]1CC(=O)C=CN1 Amb25731241 [0,1,0,1,0,0|2,0,0]=4 2482 B11R1.157 CC(O)CC1C=CCC(=O)O1 Amb25152202 [0,1,0,1,0,0|0,0,2]=4 2483 B11R1.157 CC(O)CC1CC=CC(=O)O1 Amb24354347 [0,1,0,1,0,0|0,0,0]=2 2484 B11R1.157 CC1CC(CCC1)=CC(N)=O Amb25360869 [0,1,0,1,0,0|1,0,0]=3 2485 B11R1.157 CC1CC(CCO1)=CC(O)=O Amb25145777 [0,1,0,1,0,0|1,0,0]=3 2486 B11R1.157 CC1CCCC(CC(O)=O)=C1 Amb25217002 [0,1,0,1,0,0|0,0,1]=3 2487 B11R1.157 CC1CCCC(CC(O)=O)O1 Amb18126127 [0,1,0,1,0,0|0,0,2]=4 2488 B11R1.157 CC1CCC\C(\C1)=C\C(C)O Amb24487003 [0,1,0,1,0,0|1,0,1]=4 2489 B11R1.157 CC1CN(CC(O)=O)CCC1 Amb21955265 [0,1,0,1,0,0|1,0,1]=4 2490 B11R1.157 CC=1CCCC(C1)=CC(N)=O Amb24527804 [0,1,0,1,0,0|1,0,1]=4 2491 B11R1.157 CC=1CCC\C(\C1)=C\C(O)=O Amb24627151 [0,1,0,1,0,0|0,0,1]=3 2492 B11R1.157 CN1CC(CCC1)=CC(O)=O Amb25777437 [0,1,0,1,0,0|1,0,0]=3 2493 B11R1.157 CN1C\C(\CCC1)=C/C(O)=O Amb24447002 [0,1,0,1,0,0|1,0,0]=3 2494 B11R1.157 C[C@@H](O)C[C@H]1C=CCC(=O)O1 Amb25211741 [0,1,0,1,0,0|0,0,2]=4 2495 B11R1.157 C[C@@H]1CCCC(CC(O)=O)=C1 Amb24440181 [0,1,0,1,0,0|0,0,1]=3 2496 B11R1.157 C[C@@H]1CCC[C@@H](CC(O)=O)O1 Amb24609908 [0,1,0,1,0,0|0,0,2]=4 2497 B11R1.157 C[C@@H]1CN(CC(O)=O)CCC1 Amb24722257 [0,1,0,1,0,0|1,0,1]=4 2498 B11R1.157 C[C@@H]1CN(CC(O)=O)CCC1 Amb25712697 [0,1,0,1,0,0|1,0,1]=4 2499 B11R1.157 C[C@H](O)C[C@@H]1C=CCC(=O)O1 Amb25254522 [0,1,0,1,0,0|0,0,2]=4 2500 B11R1.157 C[C@H](O)C[C@H]1CC=CC(=O)O1 Amb25246552 [0,1,0,1,0,0|0,0,0]=2 2501 B11R1.157 C[C@H]1CC(CC(O)=O)CCC1 Amb24677826 [0,1,0,1,0,0|0,0,2]=4 2502 B11R1.157 C[C@H]1CCC[C@@H](CC(O)=O)N1 Amb24669005 [0,1,0,1,0,0|0,0,2]=4 2503 B11R1.157 C[C@H]1CCC[C@@H](CC(O)=O)O1 Amb25201003 [0,1,0,1,0,0|0,0,2]=4 2504 B11R1.157 C[C@H]1C[C@@H](CC(O)=O)CCC1 Amb25179080 [0,1,0,1,0,0|0,0,2]=4 2505 B11R1.157 C[C@H]1C\C(\CCC1)=C/C(O)=O Amb25074643 [0,1,0,1,0,0|0,0,0]=2 2506 B11R1.157 NC(=O)\C=C/1\CC(N)CCC1 Amb24629983 [0,1,0,1,0,0|1,0,0]=3 2507 B11R1.157 NC1CC(CC(O)=O)CCC1 Amb18644926 [0,1,0,1,0,0|0,0,2]=4 2508 B11R1.157 NC1CN(CC(O)=O)CCC1 Amb18955426 [0,1,0,1,0,0|1,0,1]=4 2509 B11R1.157 NC1C\C(\CCC1)=C\C(O)=O Amb24740593 [0,1,0,1,0,0|0,0,0]=2 2510 B11R1.157 N[C@H]1C[C@H](CC(O)=O)CCC1 Amb24627101 [0,1,0,1,0,0|0,0,2]=4 2511 B11R1.157 OC(=O)CC1CCCC(Cl)C1 Amb18648013 [0,1,0,1,0,0|0,0,2]=4 2512 B11R1.157 OC(=O)CC1CCCC(F)C1 Amb24651233 [0,1,0,1,0,0|0,0,2]=4 2513 B11R1.157 OC(=O)CN1CC(Br)CCC1 Amb21860428 [0,1,0,1,0,0|1,0,1]=4 2514 B11R1.157 OC(=O)CN1CC(Cl)CCC1 Amb21860309 [0,1,0,1,0,0|1,0,1]=4 2515 B11R1.157 OC(=O)CN1CC(I)CCC1 Amb21860467 [0,1,0,1,0,0|1,0,1]=4 2516 B11R1.157 OC(=O)\C=C/1\CCCC(=O)N1 Amb24670052 [0,1,0,1,0,0|1,0,1]=4 2517 B11R1.157 OC1CCCC(C1)CC(O)=O Amb18645020 [0,1,0,1,0,0|0,0,2]=4 2518 B11R1.157 OC1CCCN(C1)CC(=O)O Amb15701257 [0,1,0,1,0,0|1,0,1]=4 2519 B11R1.157 O[C@@H]1CCC[C@H](C1)CC(O)=O Amb25257413 [0,1,0,1,0,0|0,0,2]=4 2520 B11R1.157 O[C@@H]1CN(CC(O)=O)CCC1 Amb22224789 [0,1,0,1,0,0|1,0,1]=4 2521 B11R1.157 O[C@H]1CCC[C@H](C1)CC(O)=O Amb24552923 [0,1,0,1,0,0|0,0,2]=4 2522 B11R1.157 O[C@H]1CN(CC(O)=O)CCC1 Amb22224754 [0,1,0,1,0,0|1,0,1]=4 2523 B11R1.166 CC1CC(C)C(=CO1)C(O)=O Amb25053896 [0,1,0,1,0,0|1,0,0]=3 2524 B11R1.166 CC1CC(Cl)CCC1C(O)=O Amb24065967 [0,1,0,1,0,0|0,0,2]=4 2525 B11R1.166 CC1CC(O)C(=CC1)C(O)=O Amb24374704 [0,1,0,1,0,0|1,0,0]=3 2526 B11R1.166 CC1CC(O)CCC1C(O)=O Amb25227872 [0,1,0,1,0,0|0,0,2]=4 2527 B11R1.166 CC1CC=C(C(C)O1)C(=O)Cl Amb25095328 [0,1,0,1,0,0|2,0,0]=4 2528 B11R1.166 CC1CC=C(C(C)O1)C(N)=O Amb25102617 [0,1,0,1,0,0|2,0,0]=4 2529 B11R1.166 CC1CC=C(C(C)O1)C(O)=O Amb24487845 [0,1,0,1,0,0|1,0,0]=3 2530 B11R1.166 C[C@@H]1CC=C([C@H](C)O1)C(=O)Cl Amb24689432 [0,1,0,1,0,0|2,0,0]=4 2531 B11R1.166 C[C@H]1C[C@@H](C)[C@@H](CC1)C(O)=O Amb24565702 [0,1,0,1,0,0|0,0,2]=4 2532 B11R1.172 CC(=O)C=NNC1CCCC1 Amb24693223 [0,1,0,1,0,0|2,0,0]=4 2533 B11R1.172 CC(=O)\C=C\C=C1CCCC1 Amb25768071 [0,1,0,1,0,0|1,0,1]=4 2534 B11R1.172 CC(=O)\C=N\NC1CCCC1 Amb24486299 [0,1,0,1,0,0|2,0,0]=4 2535 B11R1.172 NC(=O)NN=CC1CCCC1 Amb24405108 [0,1,0,1,0,0|2,0,0]=4 2536 B11R1.172 O=C(Cl)\C=C\CN1CCCC1 Amb20247007 [0,1,0,1,0,0|1,0,0]=3 2537 B11R1.172 OB(O)\C=C\CC1CCCC1 Amb22491038 [0,1,0,1,0,0|1,0,1]=4 2538 B11R1.172 OC(=O)C#CCC1CCCO1 Amb25289735 [0,1,0,1,0,0|0,0,2]=4 2539 B11R1.172 OC(=O)C#CCC1COCC1 Amb24643048 [0,1,0,1,0,0|0,0,2]=4 2540 B11R1.172 OC(=O)C#CCN1CCCC1 Amb25765805 [0,1,0,1,0,0|0,0,2]=4 2541 B11R1.172 OC(=O)CCC=C1CCCC1 Amb24658603 [0,1,0,1,0,0|0,0,2]=4 2542 B11R1.172 OC(=O)CCCC1CCCC1 Amb19149142 [0,1,0,1,0,0|0,0,2]=4 2543 B11R1.172 OC(=O)CCCC1CCCN1 Amb18199969 [0,1,0,1,0,0|0,0,2]=4 2544 B11R1.172 OC(=O)CCCC1CNCC1 Amb25384946 [0,1,0,1,0,0|0,0,2]=4 2545 B11R1.172 OC(=O)CCCC1COCC1 Amb24755490 [0,1,0,1,0,0|0,0,2]=4 2546 B11R1.172 OC(=O)CCCN1CCCC1 Amb10609669 [0,1,0,1,0,0|0,0,2]=4 2547 B11R1.172 OC(=O)CCC[C@@H]1CCCN1 Amb25385183 [0,1,0,1,0,0|0,0,2]=4 2548 B11R1.172 OC(=O)CCNC1CCCC1 Amb1109669 [0,1,0,1,0,0|0,0,2]=4 2549 B11R1.172 OC(=O)CCNC1CCCC1 Amb13951292 [0,1,0,1,0,0|0,0,2]=4 2550 B11R1.172 OC(=O)CNCC1CCCS1 Amb24754604 [0,1,0,1,0,0|1,0,1]=4 2551 B11R1.172 OC(=O)CNC[C@@H]1CCCN1 Amb25384319 [0,1,0,1,0,0|1,0,1]=4 2552 B11R1.172 OC(=O)COCC1CCCC1 Amb21963936 [0,1,0,1,0,0|0,0,2]=4 2553 B11R1.172 OC(=O)COCC1CCCN1 Amb19516849 [0,1,0,1,0,0|1,0,1]=4 2554 B11R1.172 OC(=O)COCC1CCCN1 Amb22587360 [0,1,0,1,0,0|1,0,1]=4 2555 B11R1.172 OC(=O)COCC1CCCO1 Amb1090896 [0,1,0,1,0,0|1,0,1]=4 2556 B11R1.172 OC(=O)COCC1CNCC1 Amb25385516 [0,1,0,1,0,0|1,0,1]=4 2557 B11R1.172 OC(=O)COCC1COCC1 Amb18307774 [0,1,0,1,0,0|1,0,1]=4 2558 B11R1.172 OC(=O)CSCC1CCCC1 Amb18790439 [0,1,0,1,0,0|0,0,2]=4 2559 B11R1.172 OC(=O)CSCC1CCCO1 Amb1130528 [0,1,0,1,0,0|1,0,1]=4 2560 B11R1.172 OC(=O)CSCC1COCC1 Amb18305811 [0,1,0,1,0,0|1,0,1]=4 2561 B11R1.172 OC(=O)C\C=C\C1CCCC1 Amb24473377 [0,1,0,1,0,0|0,0,0]=2 2562 B11R1.172 OC(=O)\C=C/C=C1CCCC1 Amb25831109 [0,1,0,1,0,0|0,0,1]=3 2563 B11R1.172 OC(=O)\C=C\C=C1CCOC1 Amb24357485 [0,1,0,1,0,0|0,0,2]=4 2564 B11R1.172 OC(=O)\C=C\C=C1CCSC1 Amb24452557 [0,1,0,1,0,0|0,0,2]=4 2565 B11R1.172 OC(=O)\C=C\CN1CC=CC1 Amb24501810 [0,1,0,1,0,0|0,0,2]=4 2566 B11R1.172 OC(=O)\C=C\CN1CCCC1 Amb18296129 [0,1,0,1,0,0|0,0,0]=2 2567 B11R1.172 OC(=O)\C=C\NC1CCCC1 Amb25149498 [0,1,0,1,0,0|0,0,0]=2 2568 B11R1.172 OC(=O)\C=C\NC1CSCC1 Amb25342816 [0,1,0,1,0,0|1,0,0]=3 2569 B11R1.172 OC(=O)\C=C\SC1CCCC1 Amb25063967 [0,1,0,1,0,0|0,0,0]=2 2570 B11R1.241 CC[C@@H]1O[C@@H]1C\C=C/C(C)=O Amb24766810 [0,1,0,1,0,0|1,0,0]=3 2571 B11R1.241 CC[C@@H]1O[C@H]1C\C=C/C(C)=O Amb24766811 [0,1,0,1,0,0|1,0,0]=3 2572 B11R1.241 CC[C@H]1O[C@H]1C\C=C/C(C)=O Amb24766812 [0,1,0,1,0,0|1,0,0]=3 2573 B11R1.565 CC(=O)C=1CCC(=O)CCC1 Amb24357309 [0,1,0,1,0,0|1,0,1]=4 2574 B11R1.565 CC1CCCC(CC1)C(O)=O Amb24487583 [0,1,0,1,0,0|0,0,2]=4 2575 B11R1.645 CC(=O)C=C1CC(C)OC1C Amb25024926 [0,1,0,1,0,0|2,0,0]=4 2576 B11R1.645 CC1CC(C)N(C1)CC(O)=O Amb24593598 [0,1,0,1,0,0|1,0,1]=4 2577 B11R1.720 CN(C\C=C\C(O)=O)C1CC1 Amb18308435 [0,1,0,1,0,0|1,0,0]=3 2578 B11R1.924 NC1(C\C=C\C(O)=O)CCC1 Amb24651054 [0,1,0,1,0,0|0,0,0]=2 2579 B11R1.1251 CC1(CCCl)CC=CC(=O)O1 Amb24509112 [0,1,0,1,0,0|1,0,0]=3 2580 B11R1.1251 CCCC1(C)CC(=O)C=CO1 Amb24433194 [0,1,0,1,0,0|2,0,0]=4 2581 B11R1.24 CCCCC1C=C(C)C=CN1 Amb24104097 [0,1,0,1,0,0|2,0,0]=4 2582 B11R1.24 CCCCC1C=CC=C(C)N1 Amb24104099 [0,1,0,1,0,0|2,0,0]=4 2583 B11R1.24 CCCCC1C=CCC(=O)N1 Amb24484938 [0,1,0,1,0,0|1,0,0]=3 2584 B11R1.24 CCCCC1C=CCC(=S)N1 Amb25732440 [0,1,0,1,0,0|1,1,0]=4 2585 B11R1.24 CCCCC1C=CN=C(Cl)N1 Amb25104918 [0,1,0,1,0,0|2,0,0]=4 2586 B11R1.24 CCCCC1CC(=O)C=CN1 Amb24590147 [0,1,0,1,0,0|1,0,0]=3 2587 B11R1.24 CCCCC1CC(=O)C=CO1 Amb25145787 [0,1,0,1,0,0|1,0,0]=3 2588 B11R1.24 CCCCC1CC(=O)C=CS1 Amb24416719 [0,1,0,1,0,0|1,0,0]=3 2589 B11R1.24 CCCCC1CC=CC(=O)C1 Amb24621497 [0,1,0,1,0,0|1,0,0]=3 2590 B11R1.24 CCCCC1CCCC(=O)O1 Amb10807434 [0,1,0,1,0,0|0,0,2]=4 2591 B11R1.24 CCCCc1cc(O)cc[n]1 Amb25109626 [0,1,0,1,0,0|1,0,1]=4 2592 B11R1.24 CCCCc1cc[n]c(O)c1 Amb22749775 [0,1,0,1,0,0|1,0,1]=4 2593 B11R1.24 COCOC1CC(=O)C=CC1 Amb25735808 [0,1,0,1,0,0|2,0,0]=4 2594 B11R1.24 O=C1C=CC=C(CCCCl)O1 Amb25279515 [0,1,0,1,0,0|0,0,2]=4 2595 B11R1.24 OCCCC1CC=CC(=O)O1 Amb25204203 [0,1,0,1,0,0|0,0,0]=2 2596 B11R1.24 OCCC[C@@H]1CC=CC(=O)O1 Amb24340466 [0,1,0,1,0,0|0,0,0]=2 2597 B11R1.27 Brc1cc(CCCCBr)co1 Amb25380577 [0,1,0,1,0,0|2,0,0]=4 2598 B11R1.27 Brc1ccc(CCCCBr)o1 Amb25380579 [0,1,0,1,0,0|1,0,1]=4 2599 B11R1.27 C=CCCCC1CC(=O)C=C1 Amb24764940 [0,1,0,1,0,0|1,0,1]=4 2600 B11R1.27 CCCCCC1=CC(=O)CS1 Amb24765347 [0,1,0,1,0,0|0,1,0]=3 2601 B11R1.27 CCCCCC1=CCC(=O)N1 Amb25384805 [0,1,0,1,0,0|1,0,0]=3 2602 B11R1.27 CCCCCC1=CNC(=O)N1 Amb25383578 [0,1,0,1,0,0|1,0,0]=3 2603 B11R1.27 CCCCCC1=CNC(=S)N1 Amb25386155 [0,1,0,1,0,0|1,1,0]=4 2604 B11R1.27 CCCCCC1=CSC(=S)N1 Amb25385721 [0,1,0,1,0,0|1,1,0]=4 2605 B11R1.27 CCCCCC1=NNC(=O)O1 Amb24755475 [0,1,0,1,0,0|1,0,0]=3 2606 B11R1.27 CCCCCC1C=CC(=O)O1 Amb24766300 [0,1,0,1,0,0|0,0,0]=2 2607 B11R1.27 CCCCCC1CC(=O)CO1 Amb24766911 [0,1,0,1,0,0|0,0,2]=4 2608 B11R1.27 CCCCCC=1CC(=O)CC1 Amb24765342 [0,1,0,1,0,0|1,0,0]=3 2609 B11R1.27 CCCCCC=1CC(=O)NN1 Amb24061982 [0,1,0,1,0,0|1,0,1]=4 2610 B11R1.27 CCCCCC=1NC(=O)NN1 Amb25385778 [0,1,0,1,0,0|2,0,0]=4 2611 B11R1.27 CCCCC[C@@H]1COC(=O)N1 Amb24765069 [0,1,0,1,0,0|1,0,1]=4 2612 B11R1.27 CCCCC[C@H]1CCC(=O)O1 Amb22348365 [0,1,0,1,0,0|0,0,2]=4 2613 B11R1.27 CCCCC[n]1cc(O)c[n]1 Amb25381711 [0,1,0,1,0,0|2,0,0]=4 2614 B11R1.27 CCCCC[n]1ccc(C)[n]1 Amb25382476 [0,1,0,1,0,0|2,0,0]=4 2615 B11R1.27 CCCCC[n]1ccc(N)[n]1 Amb18791553 [0,1,0,1,0,0|2,0,0]=4 2616 B11R1.27 CCCCCc1[n]c(Cl)[n]o1 Amb24762751 [0,1,0,1,0,0|2,0,0]=4 2617 B11R1.27 CCCCCc1[n]c(N)[n]o1 Amb25380455 [0,1,0,1,0,0|2,0,0]=4 2618 B11R1.27 CCCCCc1c[nH]c(Br)[n]1 Amb24766347 [0,1,0,1,0,0|2,0,0]=4 2619 B11R1.27 CCCCCc1c[nH]c(Cl)[n]1 Amb24766345 [0,1,0,1,0,0|2,0,0]=4 2620 B11R1.27 CCCCCc1c[s]c(N)[n]1 Amb18126726 [0,1,0,1,0,0|2,0,0]=4 2621 B11R1.27 CCCCCc1cc(Br)o[n]1 Amb22584327 [0,1,0,1,0,0|1,0,0]=3 2622 B11R1.27 CCCCCc1cc(Cl)o[n]1 Amb25380021 [0,1,0,1,0,0|1,0,0]=3 2623 B11R1.27 CCCCCc1cc(N)[n]o1 Amb25383063 [0,1,0,1,0,0|1,0,0]=3 2624 B11R1.27 CCCCNC=1CCC(=O)C1 Amb24486855 [0,1,0,1,0,0|2,0,0]=4 2625 B11R1.27 CCCCNC=1COC(=O)C1 Amb24488012 [0,1,0,1,0,0|1,0,0]=3 2626 B11R1.27 CCCCOC1C=CC(=O)O1 Amb24750668 [0,1,0,1,0,0|0,0,0]=2 2627 B11R1.27 CCCCOC=1CNC(=O)C1 Amb25384752 [0,1,0,1,0,0|2,0,0]=4 2628 B11R1.27 CCCCOC=1NC(=O)ON1 Amb25384637 [0,1,0,1,0,0|2,0,0]=4 2629 B11R1.27 CCCCOc1cc(N)[n]o1 Amb25383062 [0,1,0,1,0,0|2,0,0]=4 2630 B11R1.27 CCCCSc1[n]cc(Br)o1 Amb25385374 [0,1,0,1,0,0|2,0,0]=4 2631 B11R1.27 CCCC\N=C\1/C=CC(=O)O1 Amb24709107 [0,1,0,1,0,0|0,0,1]=3 2632 B11R1.27 CCCNCC1=CSC(=O)N1 Amb24755686 [0,1,0,1,0,0|2,0,0]=4 2633 B11R1.27 CCCNCc1ccc(Cl)o1 Amb18303796 [0,1,0,1,0,0|1,0,1]=4 2634 B11R1.27 CCCNCc1ccc(N)o1 Amb18625737 [0,1,0,1,0,0|1,0,1]=4 2635 B11R1.27 CCCOCC=1NC(=O)ON1 Amb18797324 [0,1,0,1,0,0|2,0,0]=4 2636 B11R1.27 CCCOCc1ccc(Br)o1 Amb25380557 [0,1,0,1,0,0|1,0,1]=4 2637 B11R1.27 CCCOCc1coc(Br)c1 Amb25380558 [0,1,0,1,0,0|2,0,0]=4 2638 B11R1.27 CCCSCc1ccc(Br)o1 Amb25380581 [0,1,0,1,0,0|1,0,1]=4 2639 B11R1.27 CCCSCc1coc(Br)c1 Amb25380580 [0,1,0,1,0,0|2,0,0]=4 2640 B11R1.27 CCNCCc1c[n]c(O)[s]1 Amb24755433 [0,1,0,1,0,0|1,1,0]=4 2641 B11R1.27 CCNCCc1coc(Br)c1 Amb25380550 [0,1,0,1,0,0|2,0,0]=4 2642 B11R1.27 CCOCCC1=NNC(=O)O1 Amb24755477 [0,1,0,1,0,0|2,0,0]=4 2643 B11R1.27 CNCCCc1c[s]c(O)[n]1 Amb24762773 [0,1,0,1,0,0|2,0,0]=4 2644 B11R1.27 COCCCC=1NC(=O)ON1 Amb24764879 [0,1,0,1,0,0|2,0,0]=4 2645 B11R1.27 COCCSC1C=CC(=O)O1 Amb24751008 [0,1,0,1,0,0|1,0,0]=3 2646 B11R1.27 Cc1[n]cc(CCCCCl)o1 Amb25386282 [0,1,0,1,0,0|2,0,0]=4 2647 B11R1.27 Cc1[n]cc(CNCCC)o1 Amb24766024 [0,1,0,1,0,0|2,0,0]=4 2648 B11R1.27 Cc1c[nH]c(CCCCC)[n]1 Amb25386143 [0,1,0,1,0,0|2,0,0]=4 2649 B11R1.27 Cc1c[n]c(CCCCN)o1 Amb18830994 [0,1,0,1,0,0|2,0,0]=4 2650 B11R1.27 Cc1c[n]c(CNCCC)o1 Amb24761736 [0,1,0,1,0,0|2,0,0]=4 2651 B11R1.27 Cc1cc(CCCCC)c[nH]1 Amb24755210 [0,1,0,1,0,0|2,0,0]=4 2652 B11R1.27 Cc1cc(CCCCCl)o[n]1 Amb24767116 [0,1,0,1,0,0|2,0,0]=4 2653 B11R1.27 Cc1cc(CCCCN)[n]o1 Amb18200713 [0,1,0,1,0,0|2,0,0]=4 2654 B11R1.27 Cc1cc(CCCCN)oc1 Amb18200981 [0,1,0,1,0,0|2,0,0]=4 2655 B11R1.27 Cc1cc(CCCCO)o[n]1 Amb25383000 [0,1,0,1,0,0|2,0,0]=4 2656 B11R1.27 Cc1cc(CNCCC)[n]o1 Amb18182914 [0,1,0,1,0,0|2,0,0]=4 2657 B11R1.27 Cc1cc(CNCCC)co1 Amb24766194 [0,1,0,1,0,0|2,0,0]=4 2658 B11R1.27 Cc1cc(CNCCC)o[n]1 Amb18306235 [0,1,0,1,0,0|2,0,0]=4 2659 B11R1.27 Cc1cc(NCCCC)[n]o1 Amb25305377 [0,1,0,1,0,0|2,0,0]=4 2660 B11R1.27 Cc1ccc(CCCCN)o1 Amb18831090 [0,1,0,1,0,0|1,0,1]=4 2661 B11R1.27 Cc1ccc(CCCNC)o1 Amb18125591 [0,1,0,1,0,0|1,0,1]=4 2662 B11R1.27 Cc1ccc(CNCCC)o1 Amb20673507 [0,1,0,1,0,0|1,0,1]=4 2663 B11R1.27 ClCCCCc1ccc(Br)o1 Amb25380578 [0,1,0,1,0,0|1,0,1]=4 2664 B11R1.27 ClCCCCc1coc(Br)c1 Amb25380576 [0,1,0,1,0,0|2,0,0]=4 2665 B11R1.27 NCCCCc1ccc(Cl)o1 Amb18197810 [0,1,0,1,0,0|1,0,1]=4 2666 B11R1.27 OCCCCC=1CCC(=O)C1 Amb24766942 [0,1,0,1,0,0|2,0,0]=4 2667 B11R1.27 OCCC\C=C\1/C=CC(=O)O1 Amb25296386 [0,1,0,1,0,0|0,0,2]=4 2668 B11R1.53 CCC1CC=CCC1C(O)=O Amb25700917 [0,1,0,1,0,0|0,0,2]=4 2669 B11R1.53 CCC1CCNCC1C(O)=O Amb18199964 [0,1,0,1,0,0|0,0,2]=4 2670 B11R1.53 CCC1NCCOC1C(O)=O Amb22496550 [0,1,0,1,0,0|1,0,1]=4 2671 B11R1.53 CCC1SCCSC1C(O)=O Amb25282389 [0,1,0,1,0,0|1,0,1]=4 2672 B11R1.53 CCC=1CCCCC1C(O)=O Amb18644662 [0,1,0,1,0,0|0,0,1]=3 2673 B11R1.53 CCC=1OCCCC1C(O)=O Amb24528967 [0,1,0,1,0,0|0,0,2]=4 2674 B11R1.53 CCC=1OCCSC1C(O)=O Amb25053451 [0,1,0,1,0,0|1,0,1]=4 2675 B11R1.53 CCN1CCCC=C1C(O)=O Amb23585374 [0,1,0,1,0,0|0,0,0]=2 2676 B11R1.53 CCN1CCCCC1C(=O)O Amb10603421 [0,1,0,1,0,0|0,0,2]=4 2677 B11R1.53 CC[C@@H]1NCCC[C@H]1C(O)=O Amb18199984 [0,1,0,1,0,0|0,0,2]=4 2678 B11R1.53 CC[C@H]1CCCC[C@@H]1C(O)=O Amb25258056 [0,1,0,1,0,0|0,0,2]=4 2679 B11R1.53 CN[C@@H]1CCCC[C@@H]1C(O)=O Amb24519490 [0,1,0,1,0,0|0,0,2]=4 2680 B11R1.53 COC1CCCCC1C(O)=O Amb18967398 [0,1,0,1,0,0|0,0,2]=4 2681 B11R1.53 CO[C@@H]1CCCC[C@@H]1C(O)=O Amb24652410 [0,1,0,1,0,0|0,0,2]=4 2682 B11R1.53 CSC1CCCCC1C(O)=O Amb18288578 [0,1,0,1,0,0|0,0,2]=4 2683 B11R1.53 NCC1CCCCC1C(O)=O Amb18126060 [0,1,0,1,0,0|0,0,2]=4 2684 B11R1.53 NC[C@@H]1CCCC[C@@H]1C(O)=O Amb22901093 [0,1,0,1,0,0|0,0,2]=4 2685 B11R1.53 NC[C@@H]1CCCC[C@@H]1C(O)=O Amb24602383 [0,1,0,1,0,0|0,0,2]=4 2686 B11R1.53 NC[C@@H]1CCCC[C@H]1C(O)=O Amb24740766 [0,1,0,1,0,0|0,0,2]=4 2687 B11R1.53 OC(=O)C1CCCCC1CBr Amb18658502 [0,1,0,1,0,0|0,0,2]=4 2688 B11R1.53 OC(=O)C1CCCCC1CF Amb20668097 [0,1,0,1,0,0|0,0,2]=4 2689 B11R1.53 OCC1CCCCC1C(O)=O Amb24484407 [0,1,0,1,0,0|0,0,2]=4 2690 B11R1.53 OC[C@@H]1CCCC[C@@H]1C(O)=O Amb24615220 [0,1,0,1,0,0|0,0,2]=4 2691 B11R1.53 OC[C@H]1CCCC[C@@H]1C(O)=O Amb25326727 [0,1,0,1,0,0|0,0,2]=4 2692 B11R1.53 OC[C@H]1CCCC[C@H]1C(O)=O Amb24554835 [0,1,0,1,0,0|0,0,2]=4 2693 B11R1.57 CC(=O)C=C1CCCC1CC Amb25300095 [0,1,0,1,0,0|1,0,0]=3 2694 B11R1.57 CCC1CCCC1=CC(O)=O Amb25296695 [0,1,0,1,0,0|0,0,0]=2 2695 B11R1.57 CCC1CCCC1CC(O)=O Amb18125992 [0,1,0,1,0,0|0,0,2]=4 2696 B11R1.57 CCC1CCCN1CC(O)=O Amb18971987 [0,1,0,1,0,0|0,0,2]=4 2697 B11R1.57 CCC1NCCC1CC(O)=O Amb24390544 [0,1,0,1,0,0|0,0,2]=4 2698 B11R1.57 CCN1CCCC1CC(=O)O Amb17504530 [0,1,0,1,0,0|0,0,2]=4 2699 B11R1.57 CCN1CCCC1CC(O)=O Amb20622924 [0,1,0,1,0,0|0,0,2]=4 2700 B11R1.57 CC[C@@H]1CCC[C@@H]1CC(O)=O Amb24603943 [0,1,0,1,0,0|0,0,2]=4 2701 B11R1.57 CC[C@@H]1NCC[C@H]1CC(O)=O Amb18199980 [0,1,0,1,0,0|0,0,2]=4 2702 B11R1.57 COC1CCCC1CC(O)=O Amb18199909 [0,1,0,1,0,0|0,0,2]=4 2703 B11R1.57 NCC1CCCC1CC(O)=O Amb25311074 [0,1,0,1,0,0|0,0,2]=4 2704 B11R1.57 NC[C@@H]1CCCN1CC(O)=O Amb24737565 [0,1,0,1,0,0|1,0,1]=4 2705 B11R1.57 NC[C@H]1CCCN1CC(O)=O Amb25314232 [0,1,0,1,0,0|1,0,1]=4 2706 B11R1.57 NC[C@H]1CCC[C@H]1CC(O)=O Amb25267777 [0,1,0,1,0,0|0,0,2]=4 2707 B11R1.57 OC(=O)CN1CCCC1CBr Amb21861250 [0,1,0,1,0,0|1,0,1]=4 2708 B11R1.57 OC(=O)CN1CCCC1CCl Amb21861115 [0,1,0,1,0,0|1,0,1]=4 2709 B11R1.57 OC(=O)CN1CCCC1CI Amb21861275 [0,1,0,1,0,0|1,0,1]=4 2710 B11R1.57 OCC1CCCC1CC(O)=O Amb25694766 [0,1,0,1,0,0|0,0,2]=4 2711 B11R1.57 OCC1CCCN1CC(O)=O Amb18984550 [0,1,0,1,0,0|1,0,1]=4 2712 B11R1.57 OC[C@@H]1CCCN1CC(=O)O Amb10067045 [0,1,0,1,0,0|1,0,1]=4 2713 B11R1.57 OC[C@H]1CCCN1CC(=O)O Amb10067044 [0,1,0,1,0,0|1,0,1]=4 2714 B11R1.86 C=C/1CCCC\C1=C\C(O)=O Amb18125426 [0,1,0,1,0,0|0,0,1]=3 2715 B11R1.86 CC(=C)C=C1CCCNC1C Amb24540201 [0,1,0,1,0,0|2,0,0]=4 2716 B11R1.86 CC(=O)C=C1CCCCN1C Amb24551457 [0,1,0,1,0,0|1,0,0]=3 2717 B11R1.86 CC(=O)C=C1CCCSC1C Amb24447155 [0,1,0,1,0,0|1,0,0]=3 2718 B11R1.86 CC(=O)CC1=C(C)CCCC1 Amb17593809 [0,1,0,1,0,0|1,0,1]=4 2719 B11R1.86 CC(=O)CC1=CCCCC1C Amb24625377 [0,1,0,1,0,0|1,0,0]=3 2720 B11R1.86 CC(=O)NC1=C(C)CCCC1 Amb17845068 [0,1,0,1,0,0|2,0,0]=4 2721 B11R1.86 CC(=O)NC1=CCCCC1C Amb25270018 [0,1,0,1,0,0|1,0,0]=3 2722 B11R1.86 CC(=O)OC1=CCCCC1Br Amb24390350 [0,1,0,1,0,0|2,0,0]=4 2723 B11R1.86 CC(=O)\C=C/1\CCCCC1=O Amb24416702 [0,1,0,1,0,0|1,0,1]=4 2724 B11R1.86 CC(=O)\C=C\1/CCCCC1C Amb25709867 [0,1,0,1,0,0|1,0,0]=3 2725 B11R1.86 CC(=O)\C=C\1/CCCCN1C Amb25735132 [0,1,0,1,0,0|1,0,0]=3 2726 B11R1.86 CC/1CCCC\C1=C/C(O)=O Amb22339342 [0,1,0,1,0,0|0,0,0]=2 2727 B11R1.86 CC/1CCCC\C1=C\C(C)O Amb25730355 [0,1,0,1,0,0|1,0,1]=4 2728 B11R1.86 CC/1CCCC\C1=C\C(N)=O Amb24487986 [0,1,0,1,0,0|1,0,0]=3 2729 B11R1.86 CC/1COCC\C1=C\C(C)O Amb24440477 [0,1,0,1,0,0|1,0,1]=4 2730 B11R1.86 CC/1SCCC\C1=C\C(C)O Amb25057875 [0,1,0,1,0,0|1,0,1]=4 2731 B11R1.86 CC1CCCCC1CC(O)=O Amb22339306 [0,1,0,1,0,0|0,0,2]=4 2732 B11R1.86 CC1CCCCN1CC(O)=O Amb21955230 [0,1,0,1,0,0|0,0,2]=4 2733 B11R1.86 CC1COCCC1=CC(O)=O Amb24398264 [0,1,0,1,0,0|0,0,0]=2 2734 B11R1.86 CC1COCCC1CC(O)=O Amb24484704 [0,1,0,1,0,0|0,0,2]=4 2735 B11R1.86 CN1CCCC[C@H]1CC(O)=O Amb25723356 [0,1,0,1,0,0|0,0,2]=4 2736 B11R1.86 CN1CCCN=C1CC(O)=O Amb24652867 [0,1,0,1,0,0|1,0,1]=4 2737 B11R1.86 C[C@H]1CCCC[C@H]1CC(O)=O Amb25241512 [0,1,0,1,0,0|0,0,2]=4 2738 B11R1.86 C[C@H]1CNCCN1CC(O)=O Amb25843322 [0,1,0,1,0,0|1,0,1]=4 2739 B11R1.86 NC1CCCC=C1CC(O)=O Amb25074597 [0,1,0,1,0,0|1,0,0]=3 2740 B11R1.86 NC1CCCCC1CC(O)=O Amb24509773 [0,1,0,1,0,0|0,0,2]=4 2741 B11R1.86 NC1CCCCN1CC(O)=O Amb25152865 [0,1,0,1,0,0|1,0,1]=4 2742 B11R1.86 NC1CCCC[C@@H]1CC(O)=O Amb24426265 [0,1,0,1,0,0|0,0,2]=4 2743 B11R1.86 N[C@H]1CCCC[C@H]1CC(O)=O Amb24561031 [0,1,0,1,0,0|0,0,2]=4 2744 B11R1.86 OC(=O)CC1=CCCCC1=O Amb18125686 [0,1,0,1,0,0|1,0,1]=4 2745 B11R1.86 OC(=O)CC1CCCCC1F Amb24697602 [0,1,0,1,0,0|0,0,2]=4 2746 B11R1.86 OC(=O)CC1CCCCN1C Amb1076959 [0,1,0,1,0,0|0,0,2]=4 2747 B11R1.86 OC(=O)CC1CCCCN1C Amb13885783 [0,1,0,1,0,0|0,0,2]=4 2748 B11R1.86 OC(=O)CC=1CCCCC1Br Amb24668990 [0,1,0,1,0,0|0,0,2]=4 2749 B11R1.86 OC(=O)CC=1CCCCC1Cl Amb25108663 [0,1,0,1,0,0|0,0,2]=4 2750 B11R1.86 OC(=O)C[C@@H]1CCCC[C@H]1F Amb25168843 [0,1,0,1,0,0|0,0,2]=4 2751 B11R1.86 OC(=O)\C=C/1\CCCCC1Br Amb25366048 [0,1,0,1,0,0|0,0,0]=2 2752 B11R1.86 OC(=O)\C=C/1\COCCC1=O Amb24509316 [0,1,0,1,0,0|1,0,1]=4 2753 B11R1.86 OC(=O)\C=C\1/CCCCC1=O Amb25701737 [0,1,0,1,0,0|0,0,1]=3 2754 B11R1.86 OC(=O)\C=C\1/COCCC1=O Amb25143478 [0,1,0,1,0,0|1,0,1]=4 2755 B11R1.86 OC1CCCC[C@@H]1CC(O)=O Amb25233444 [0,1,0,1,0,0|0,0,2]=4 2756 B11R1.86 O[C@@H]1CCCCC1CC(O)=O Amb25792260 [0,1,0,1,0,0|0,0,2]=4 2757 B11R1.86 O[C@H]1CCCC[C@@H]1CC(O)=O Amb25274080 [0,1,0,1,0,0|0,0,2]=4 2758 B11R1.86 O[C@H]1CCCC[C@H]1CC(O)=O Amb25210705 [0,1,0,1,0,0|0,0,2]=4 2759 B11R1.91 CC(=O)C=CN1CCCCC1 Amb24066208 [0,1,0,1,0,0|1,0,0]=3 2760 B11R1.91 CC(=O)O\C=C/1\CCCCN1 Amb25189142 [0,1,0,1,0,0|2,0,0]=4 2761 B11R1.91 CC(=O)\C=C\C1CCCC=C1 Amb25735805 [0,1,0,1,0,0|1,0,1]=4 2762 B11R1.91 CC(=O)\C=C\C1CCCCC1 Amb24625780 [0,1,0,1,0,0|1,0,0]=3 2763 B11R1.91 CC(=O)\C=C\C1CCCCO1 Amb24736349 [0,1,0,1,0,0|1,0,0]=3 2764 B11R1.91 CC(=O)\C=C\C1CSCCC1 Amb22264590 [0,1,0,1,0,0|1,0,0]=3 2765 B11R1.91 CC(=O)\C=C\C=1CCCCC1 Amb25052277 [0,1,0,1,0,0|1,0,1]=4 2766 B11R1.91 CC(=O)\C=C\N1CCCCC1 Amb10565535 [0,1,0,1,0,0|1,0,0]=3 2767 B11R1.91 CC(=O)\C=C\N1CCOCC1 Amb10565266 [0,1,0,1,0,0|2,0,0]=4 2768 B11R1.91 CC(O)C=C=C1CCCCC1 Amb24739168 [0,1,0,1,0,0|1,0,1]=4 2769 B11R1.91 CC(O)\C=C\C1CCCCO1 Amb24474154 [0,1,0,1,0,0|1,0,1]=4 2770 B11R1.91 CC(O)\C=C\C1COCCC1 Amb25222045 [0,1,0,1,0,0|1,0,1]=4 2771 B11R1.91 C[C@@H](O)\C=C\C1CCCCC1 Amb24370035 [0,1,0,1,0,0|1,0,1]=4 2772 B11R1.91 NC(=O)N=CN1CCCCC1 Amb24487999 [0,1,0,1,0,0|2,0,0]=4 2773 B11R1.91 NC(=O)ON=C1CCCCC1 Amb25237571 [0,1,0,1,0,0|2,0,0]=4 2774 B11R1.91 NC(=O)\C=C\C1CCCCC1 Amb24619124 [0,1,0,1,0,0|1,0,0]=3 2775 B11R1.91 NC(=O)\C=C\N1CCCCC1 Amb24426051 [0,1,0,1,0,0|1,0,0]=3 2776 B11R1.91 NC(=S)\C=C\N1CCCCC1 Amb17477775 [0,1,0,1,0,0|1,1,0]=4 2777 B11R1.91 O=C(Cl)\C=C\C1CCCCC1 Amb24447782 [0,1,0,1,0,0|1,0,0]=3 2778 B11R1.91 O=C(Cl)\C=C\C1CCNCC1 Amb24392093 [0,1,0,1,0,0|1,0,0]=3 2779 B11R1.91 OB(O)CC=C1CCCCC1 Amb24352168 [0,1,0,1,0,0|1,0,1]=4 2780 B11R1.91 OB(O)\C=C\C1CCCCC1 Amb19959879 [0,1,0,1,0,0|1,0,1]=4 2781 B11R1.91 OC(=O)C#CC1CCCCC1 Amb21963916 [0,1,0,1,0,0|0,0,2]=4 2782 B11R1.91 OC(=O)C#CC1CCCCO1 Amb25266171 [0,1,0,1,0,0|0,0,2]=4 2783 B11R1.91 OC(=O)C#CC1CCOCC1 Amb25127292 [0,1,0,1,0,0|0,0,2]=4 2784 B11R1.91 OC(=O)C#CC1COCCC1 Amb25151250 [0,1,0,1,0,0|0,0,2]=4 2785 B11R1.91 OC(=O)C=CC1CCC=CO1 Amb19330465 [0,1,0,1,0,0|0,0,2]=4 2786 B11R1.91 OC(=O)C=CC1CCOCC1 Amb17605506 [0,1,0,1,0,0|0,0,0]=2 2787 B11R1.91 OC(=O)C=NN1CCOCC1 Amb24650917 [0,1,0,1,0,0|2,0,0]=4 2788 B11R1.91 OC(=O)CC=C1CCCCC1 Amb18644654 [0,1,0,1,0,0|0,0,0]=2 2789 B11R1.91 OC(=O)CC=C1CCSCC1 Amb23441815 [0,1,0,1,0,0|1,0,0]=3 2790 B11R1.91 OC(=O)CCC1CCCCN1 Amb1102729 [0,1,0,1,0,0|0,0,2]=4 2791 B11R1.91 OC(=O)CCC1CCCCO1 Amb17506864 [0,1,0,1,0,0|0,0,2]=4 2792 B11R1.91 OC(=O)CCC1CCCNC1 Amb10576190 [0,1,0,1,0,0|0,0,2]=4 2793 B11R1.91 OC(=O)CCC1CCCNC1 Amb1101056 [0,1,0,1,0,0|0,0,2]=4 2794 B11R1.91 OC(=O)CCC1CCNCC1 Amb10609864 [0,1,0,1,0,0|0,0,2]=4 2795 B11R1.91 OC(=O)CCC1CCNCC1 Amb10609915 [0,1,0,1,0,0|0,0,2]=4 2796 B11R1.91 OC(=O)CCC1CCOCC1 Amb18990337 [0,1,0,1,0,0|0,0,2]=4 2797 B11R1.91 OC(=O)CCC1CCSCC1 Amb18197511 [0,1,0,1,0,0|0,0,2]=4 2798 B11R1.91 OC(=O)CCC1COCCC1 Amb18199907 [0,1,0,1,0,0|0,0,2]=4 2799 B11R1.91 OC(=O)CCC1CSCCC1 Amb18825218 [0,1,0,1,0,0|0,0,2]=4 2800 B11R1.91 OC(=O)CCC=1CCCCC1 Amb25775024 [0,1,0,1,0,0|0,0,2]=4 2801 B11R1.91 OC(=O)CCN1CCCCC1 Amb10609748 [0,1,0,1,0,0|0,0,2]=4 2802 B11R1.91 OC(=O)CC[S+]1CCCCC1 Amb25706418 [0,1,0,1,0,0|0,0,2]=4 2803 B11R1.91 OC(=O)CN=C1CCCCC1 Amb25258353 [0,1,0,1,0,0|0,0,1]=3 2804 B11R1.91 OC(=O)CNC1=NCCCC1 Amb10976583 [0,1,0,1,0,0|1,0,1]=4 2805 B11R1.91 OC(=O)CNC1CCCCC1 Amb19263851 [0,1,0,1,0,0|0,0,2]=4 2806 B11R1.91 OC(=O)CNC1CCNCC1 Amb18289709 [0,1,0,1,0,0|1,0,1]=4 2807 B11R1.91 OC(=O)CNC1CCNCC1 Amb24271155 [0,1,0,1,0,0|1,0,1]=4 2808 B11R1.91 OC(=O)CNC1CNCCC1 Amb18293207 [0,1,0,1,0,0|1,0,1]=4 2809 B11R1.91 OC(=O)CNC1COCCC1 Amb25827250 [0,1,0,1,0,0|1,0,1]=4 2810 B11R1.91 OC(=O)CNC1CSCCC1 Amb18301750 [0,1,0,1,0,0|1,0,1]=4 2811 B11R1.91 OC(=O)CNN1CCCCC1 Amb24451443 [0,1,0,1,0,0|1,0,1]=4 2812 B11R1.91 OC(=O)COC1CCCNC1 Amb13783632 [0,1,0,1,0,0|1,0,1]=4 2813 B11R1.91 OC(=O)COC1CCNCC1 Amb10603194 [0,1,0,1,0,0|1,0,1]=4 2814 B11R1.91 OC(=O)COC1CCNCC1 Amb21960053 [0,1,0,1,0,0|1,0,1]=4 2815 B11R1.91 OC(=O)COC1CCOCC1 Amb18975304 [0,1,0,1,0,0|1,0,1]=4 2816 B11R1.91 OC(=O)COC1CSCCC1 Amb25117929 [0,1,0,1,0,0|1,0,1]=4 2817 B11R1.91 OC(=O)CSC1CCNCC1 Amb17502143 [0,1,0,1,0,0|1,0,1]=4 2818 B11R1.91 OC(=O)CSC1CCOCC1 Amb18302590 [0,1,0,1,0,0|1,0,1]=4 2819 B11R1.91 OC(=O)CSC1COCCC1 Amb25150533 [0,1,0,1,0,0|1,0,1]=4 2820 B11R1.91 OC(=O)CSN1CCCCC1 Amb25134616 [0,1,0,1,0,0|1,0,1]=4 2821 B11R1.91 OC(=O)C\C=C/1\CCCC=C1 Amb25216929 [0,1,0,1,0,0|0,0,2]=4 2822 B11R1.91 OC(=O)C\C=C\1/CCCC=C1 Amb24398614 [0,1,0,1,0,0|0,0,2]=4 2823 B11R1.91 OC(=O)\C=C/C1CCCC=C1 Amb25258354 [0,1,0,1,0,0|0,0,1]=3 2824 B11R1.91 OC(=O)\C=C/C1CCCCO1 Amb24552900 [0,1,0,1,0,0|0,0,0]=2 2825 B11R1.91 OC(=O)\C=C/C1SCCCS1 Amb25189151 [0,1,0,1,0,0|1,0,0]=3 2826 B11R1.91 OC(=O)\C=C\C1CCC=CO1 Amb25145804 [0,1,0,1,0,0|0,0,2]=4 2827 B11R1.91 OC(=O)\C=C\C1CCCCC1 Amb18960079 [0,1,0,1,0,0|0,0,0]=2 2828 B11R1.91 OC(=O)\C=C\C1CCCCN1 Amb24622863 [0,1,0,1,0,0|0,0,0]=2 2829 B11R1.91 OC(=O)\C=C\C1CCCCO1 Amb24677693 [0,1,0,1,0,0|0,0,0]=2 2830 B11R1.91 OC(=O)\C=C\C1CCNCC1 Amb24580436 [0,1,0,1,0,0|0,0,0]=2 2831 B11R1.91 OC(=O)\C=C\C1CCOCC1 Amb18961299 [0,1,0,1,0,0|0,0,0]=2 2832 B11R1.91 OC(=O)\C=C\C1COCCC1 Amb24716636 [0,1,0,1,0,0|0,0,0]=2 2833 B11R1.91 OC(=O)\C=C\C1CSCCC1 Amb24614944 [0,1,0,1,0,0|0,0,0]=2 2834 B11R1.91 OC(=O)\C=C\C1SCCCS1 Amb24738958 [0,1,0,1,0,0|1,0,0]=3 2835 B11R1.91 OC(=O)\C=C\C=1CCCCC1 Amb24670201 [0,1,0,1,0,0|0,0,1]=3 2836 B11R1.91 OC(=O)\C=C\C=1CCCSC1 Amb24733611 [0,1,0,1,0,0|0,0,2]=4 2837 B11R1.91 OC(=O)\C=C\C=1COCCC1 Amb24649970 [0,1,0,1,0,0|0,0,2]=4 2838 B11R1.91 OC(=O)\C=C\[C@@H]1CC=CCC1 Amb24623648 [0,1,0,1,0,0|0,0,1]=3 2839 B11R1.91 [O-][N+](=O)C=CC1CCCCC1 Amb18181954 [0,1,0,1,0,0|1,0,1]=4 2840 B11R1.91 [O-][N+](=O)\C=C\C1CCOCC1 Amb25684458 [0,1,0,1,0,0|1,0,1]=4 2841 B11R1.101 O=C1CCC=CCCCC=C1 Amb24645378 [0,1,0,1,0,0|1,0,1]=4 2842 B11R1.101 O=C1NCCCCCCCO1 Amb24443710 [0,1,0,1,0,0|0,0,2]=4 2843 B11R1.101 OC1CC=CCCCCCC1 Amb24473368 [0,1,0,1,0,0|1,0,1]=4 2844 B11R1.102 CC1CC1CN\C=C\C(O)=O Amb25805760 [0,1,0,1,0,0|0,0,0]=2 2845 B11R1.102 CC1OC1CC\C=C\C(C)=O Amb24764992 [0,1,0,1,0,0|1,0,0]=3 2846 B11R1.102 C[C@@H]1O[C@H]1CC\C=C\C(C)=O Amb24766806 [0,1,0,1,0,0|1,0,0]=3 2847 B11R1.107 C=C1CC(=O)CCCCCC1 Amb24646699 [0,1,0,1,0,0|1,0,1]=4 2848 B11R1.107 CC=1CCCCCCC(=O)C1 Amb25188731 [0,1,0,1,0,0|1,0,0]=3 2849 B11R1.107 O=C1CC(=O)NCCCCC1 Amb25207080 [0,1,0,1,0,0|1,0,1]=4 2850 B11R1.107 O=C1CCCCCCC(=O)C1 Amb17593852 [0,1,0,1,0,0|1,0,1]=4 2851 B11R1.107 OC1CCCCCCC(Cl)=C1 Amb24502093 [0,1,0,1,0,0|1,0,1]=4 2852 B11R1.143 CC(=C)C1=CCCCCC1O Amb24575558 [0,1,0,1,0,0|2,0,0]=4 2853 B11R1.143 CC(=O)C1=CCCCCC1=O Amb25244207 [0,1,0,1,0,0|1,0,1]=4 2854 B11R1.143 CC(=O)C1CCCCCC1=C Amb25767027 [0,1,0,1,0,0|1,0,1]=4 2855 B11R1.143 CC(=O)C1CCCCCC1=O Amb18796759 [0,1,0,1,0,0|1,0,1]=4 2856 B11R1.143 CC(=O)C=1SCCCCC1O Amb24551540 [0,1,0,1,0,0|2,0,0]=4 2857 B11R1.143 CC(Cl)=C1CCCCCC1=O Amb24582921 [0,1,0,1,0,0|2,0,0]=4 2858 B11R1.143 CC1CCCCCC1C(O)=O Amb25361762 [0,1,0,1,0,0|0,0,2]=4 2859 B11R1.143 C[C@@H]1NCCCC[C@H]1C(O)=O Amb18199981 [0,1,0,1,0,0|0,0,2]=4 2860 B11R1.143 NC(=O)C1CCCCCC1=O Amb10553082 [0,1,0,1,0,0|1,0,1]=4 2861 B11R1.143 NC(=O)C=1CCCCCC1Br Amb25113983 [0,1,0,1,0,0|1,0,0]=3 2862 B11R1.143 NC=1CCCCCC1C(O)=O Amb24620224 [0,1,0,1,0,0|0,0,0]=2 2863 B11R1.143 OC(=O)C1CCCCCC1S Amb18949212 [0,1,0,1,0,0|0,0,2]=4 2864 B11R1.143 OC(=O)C=1CCCCCC1Br Amb25790609 [0,1,0,1,0,0|0,0,0]=2 2865 B11R1.143 OC(=O)[C@@H]1CCCCC[C@@H]1N Amb1993850 [0,1,0,1,0,0|0,0,2]=4 2866 B11R1.143 OC(=O)[C@@H]1CCCCC[C@@H]1N Amb1994003 [0,1,0,1,0,0|0,0,2]=4 2867 B11R1.143 OC(=O)[C@H]1CCCCC[C@H]1N Amb1993851 [0,1,0,1,0,0|0,0,2]=4 2868 B11R1.143 OC(=O)[C@H]1CCCCC[C@H]1N Amb1994004 [0,1,0,1,0,0|0,0,2]=4 2869 B11R1.143 OC1CCCCCC1C(O)=O Amb18280963 [0,1,0,1,0,0|0,0,2]=4 2870 B11R1.161 CC/1CC\C1=C/C=CC(O)=O Amb25345392 [0,1,0,1,0,0|0,0,1]=3 2871 B11R1.161 CC1CCC1N\C=C\C(O)=O Amb24725806 [0,1,0,1,0,0|0,0,0]=2 2872 B11R1.161 CC1CCC1\C=N\NC(N)=O Amb24626126 [0,1,0,1,0,0|2,0,0]=4 2873 B11R1.161 CC1CCN1CCCC(O)=O Amb24761790 [0,1,0,1,0,0|0,0,2]=4 2874 B11R1.161 CN1CCC1CCCC(O)=O Amb25385623 [0,1,0,1,0,0|0,0,2]=4 2875 B11R1.161 CN1CCC1COCC(O)=O Amb25385512 [0,1,0,1,0,0|1,0,1]=4 2876 B11R1.174 OC(=O)\C=C\C=CC1CCC1 Amb25338820 [0,1,0,1,0,0|0,0,1]=3 2877 B11R1.174 OC(=O)\C=C\COC1CCC1 Amb19020651 [0,1,0,1,0,0|0,0,0]=2 2878 B11R1.176 CC(=O)NN=CCCC1CC1 Amb24756078 [0,1,0,1,0,0|2,0,0]=4 2879 B11R1.193 CC(=O)C1=CCCC1CC=O Amb24690846 [0,1,0,1,0,0|1,0,1]=4 2880 B11R1.193 CC(=O)C1=CCCC1CCC Amb24356901 [0,1,0,1,0,0|1,0,0]=3 2881 B11R1.193 CC(=O)C1=CCCC1\C=C\C Amb24408196 [0,1,0,1,0,0|1,0,1]=4 2882 B11R1.193 CCCC1CCCC1C(O)=O Amb18644850 [0,1,0,1,0,0|0,0,2]=4 2883 B11R1.193 CCCC1CCNC1C(O)=O Amb25241187 [0,1,0,1,0,0|0,0,2]=4 2884 B11R1.193 CCCC1NCCC1C(O)=O Amb18118098 [0,1,0,1,0,0|0,0,2]=4 2885 B11R1.193 CCCC1OC=NC1C(O)=O Amb25126139 [0,1,0,1,0,0|1,0,1]=4 2886 B11R1.193 CCCC1OCCC1C(O)=O Amb25073122 [0,1,0,1,0,0|0,0,2]=4 2887 B11R1.193 CCCN1CCCC1C(=O)O Amb1110656 [0,1,0,1,0,0|0,0,2]=4 2888 B11R1.193 CCC[C@@H]1CCC[C@H]1C(O)=O Amb24726338 [0,1,0,1,0,0|0,0,2]=4 2889 B11R1.193 CCC[C@@H]1CCN[C@@H]1C(O)=O Amb24670482 [0,1,0,1,0,0|0,0,2]=4 2890 B11R1.193 CCC[C@H]1CCN[C@@H]1C(O)=O Amb25198748 [0,1,0,1,0,0|0,0,2]=4 2891 B11R1.193 CCC[n]1[n]c[n]c1C(O)=O Amb25185086 [0,1,0,1,0,0|2,0,0]=4 2892 B11R1.193 CCC[n]1c[n]cc1C(O)=O Amb18679873 [0,1,0,1,0,0|1,0,1]=4 2893 B11R1.193 CCC[n]1cc[n]c1C(O)=O Amb23443764 [0,1,0,1,0,0|1,0,1]=4 2894 B11R1.193 CCCc1[nH]c[n]c1C(O)=O Amb25138053 [0,1,0,1,0,0|1,0,1]=4 2895 B11R1.193 CCCc1[n]coc1C(O)=O Amb24423448 [0,1,0,1,0,0|1,0,1]=4 2896 B11R1.193 CCCc1c[nH]cc1C(O)=O Amb25722053 [0,1,0,1,0,0|0,0,2]=4 2897 B11R1.193 CCCc1cc[nH]c1C(O)=O Amb25087273 [0,1,0,1,0,0|0,0,2]=4 2898 B11R1.193 CCCc1ncsc1C(=O)O Amb17219818 [0,1,0,1,0,0|1,0,1]=4 2899 B11R1.193 CCCc1occc1C(O)=O Amb24549237 [0,1,0,1,0,0|0,0,2]=4 2900 B11R1.193 CCCn1nncc1C(=O)O Amb17534541 [0,1,0,1,0,0|2,0,0]=4 2901 B11R1.193 CCNC1CCCC1C(O)=O Amb24509259 [0,1,0,1,0,0|0,0,2]=4 2902 B11R1.193 CCOC=1CCCC1C(O)=O Amb24487805 [0,1,0,1,0,0|0,0,2]=4 2903 B11R1.193 CCO[C@@H]1CCC[C@H]1C(O)=O Amb25322175 [0,1,0,1,0,0|0,0,2]=4 2904 B11R1.193 CCSC1CCCC1C(O)=O Amb18303074 [0,1,0,1,0,0|0,0,2]=4 2905 B11R1.193 CCSC=1CCCC1C(O)=O Amb24634149 [0,1,0,1,0,0|0,0,2]=4 2906 B11R1.193 CNC[C@@H]1CCC[C@@H]1C(O)=O Amb24591293 [0,1,0,1,0,0|0,0,2]=4 2907 B11R1.193 COCC1CCCC1C(O)=O Amb25200900 [0,1,0,1,0,0|0,0,2]=4 2908 B11R1.193 COCC=1CCCC1C(O)=O Amb18125946 [0,1,0,1,0,0|0,0,2]=4 2909 B11R1.193 COC[C@@H]1CCC[C@H]1C(O)=O Amb25061611 [0,1,0,1,0,0|0,0,2]=4 2910 B11R1.193 COC[C@H]1CCC[C@H]1C(O)=O Amb25295380 [0,1,0,1,0,0|0,0,2]=4 2911 B11R1.204 CCCCC1CCC1C(O)=O Amb24762099 [0,1,0,1,0,0|0,0,2]=4 2912 B11R1.204 CCCCC1CNC1C(O)=O Amb25385838 [0,1,0,1,0,0|0,0,2]=4 2913 B11R1.204 CCCCN1CCC1C(O)=O Amb25385844 [0,1,0,1,0,0|0,0,2]=4 2914 B11R1.204 CCCCN1CC[C@@H]1C(O)=O Amb25383066 [0,1,0,1,0,0|0,0,2]=4 2915 B11R1.204 CCCCN1CC[C@H]1C(O)=O Amb25383032 [0,1,0,1,0,0|0,0,2]=4 2916 B11R1.204 CCCNC1CCC1C(O)=O Amb25381540 [0,1,0,1,0,0|0,0,2]=4 2917 B11R1.204 CCOCC1CCC1C(O)=O Amb24762100 [0,1,0,1,0,0|0,0,2]=4 2918 B11R1.245 COC1CC(=O)C=CCCC1 Amb24486280 [0,1,0,1,0,0|1,0,0]=3 2919 B11R1.245 COC1CC(=O)CC=CCC1 Amb25319932 [0,1,0,1,0,0|2,0,0]=4 2920 B11R1.706 CC(=O)C1CCCCCC=C1 Amb22011813 [0,1,0,1,0,0|1,0,0]=3 2921 B11R1.706 CC(=O)C=1CCCC=CCC1 Amb25713503 [0,1,0,1,0,0|1,0,1]=4 2922 B11R1.706 CC(=O)C=1CCCCC=CC1 Amb24584297 [0,1,0,1,0,0|1,0,1]=4 2923 B11R1.706 CC(O)C1CCCCCC=C1 Amb25333601 [0,1,0,1,0,0|1,0,1]=4 2924 B11R1.706 CC(O)C=1CCCCCCC1 Amb24705027 [0,1,0,1,0,0|1,0,1]=4 2925 B11R1.706 C[C@H](O)[C@H]1CCCCCC=C1 Amb25175195 [0,1,0,1,0,0|1,0,1]=4 2926 B11R1.706 NC(=O)C=1CCCCCCC1 Amb25258002 [0,1,0,1,0,0|1,0,0]=3 2927 B11R1.706 OC(=O)C1CC=CCCCC1 Amb25774993 [0,1,0,1,0,0|0,0,2]=4 2928 B11R1.706 OC(=O)C1CCCCCCC1 Amb18278612 [0,1,0,1,0,0|0,0,2]=4 2929 B11R1.706 OC(=O)C1CCCCCNN1 Amb25827524 [0,1,0,1,0,0|1,0,1]=4 2930 B11R1.706 OC(=O)C=1CCCCCCC1 Amb25760819 [0,1,0,1,0,0|0,0,0]=2 2931 B11R1.742 CC(O)C=C1CCCCCC1 Amb24487002 [0,1,0,1,0,0|1,0,1]=4 2932 B11R1.742 CC(O)\C=C/1\CCCOCC1 Amb25121381 [0,1,0,1,0,0|1,0,1]=4 2933 B11R1.742 NC(=O)C=C1CCCCCC1 Amb25733352 [0,1,0,1,0,0|1,0,0]=3 2934 B11R1.742 NC(=O)N=C1CCCCCN1 Amb24607781 [0,1,0,1,0,0|2,0,0]=4 2935 B11R1.742 OC(=O)CC1CCCCCN1 Amb18199972 [0,1,0,1,0,0|0,0,2]=4 2936 B11R1.742 OC(=O)CC1CCCNCC1 Amb18199994 [0,1,0,1,0,0|0,0,2]=4 2937 B11R1.742 OC(=O)CC1CCCOCC1 Amb18199912 [0,1,0,1,0,0|0,0,2]=4 2938 B11R1.742 OC(=O)CC1CCCSCC1 Amb18197457 [0,1,0,1,0,0|0,0,2]=4 2939 B11R1.742 OC(=O)CC1CNCCCC1 Amb18199974 [0,1,0,1,0,0|0,0,2]=4 2940 B11R1.742 OC(=O)CC=1CCCCCC1 Amb24487852 [0,1,0,1,0,0|0,0,0]=2 2941 B11R1.742 OC(=O)CN1CCCCCC1 Amb2536986 [0,1,0,1,0,0|0,0,2]=4 2942 B11R1.742 OC(=O)CN1CCCOCC1 Amb18288769 [0,1,0,1,0,0|1,0,1]=4 2943 B11R1.742 OC(=O)CN1CCCSCC1 Amb18957006 [0,1,0,1,0,0|1,0,1]=4 2944 B11R1.742 OC(=O)CN1CCNCCC1 Amb13952776 [0,1,0,1,0,0|1,0,1]=4 2945 B11R1.742 OC(=O)C[C@H]1CCCCC=C1 Amb25798948 [0,1,0,1,0,0|0,0,2]=4 2946 B11R1.742 [O-]N(=O)\C=C/1\CCCCCN1 Amb22302815 [0,1,0,1,0,0|1,0,1]=4 2947 B11R1.742 [O-][N+](=O)CC=1CCCCCC1 Amb24600149 [0,1,0,1,0,0|1,0,1]=4 2948 B11R1.742 [O-][N+](=O)\C=C\1/CCCCCN1 Amb21922604 [0,1,0,1,0,0|1,0,1]=4 2949 B11R1.34 CC=1CC(CCC)CC(=O)C1 Amb20621716 [0,1,0,1,0,0|1,0,0]=3 2950 B11R1.34 CC=1CC(CCC)NC(=N)C1 Amb24673806 [0,1,0,1,0,0|2,0,0]=4 2951 B11R1.34 CC=1CC(CCC)NC(=O)C1 Amb24565802 [0,1,0,1,0,0|1,0,0]=3 2952 B11R1.34 CCCC1=CC(O)=CC(=O)O1 Amb22753964 [0,1,0,1,0,0|0,0,2]=4 2953 B11R1.34 CCCC1CC(=O)CC(=O)C1 Amb1153836 [0,1,0,1,0,0|1,0,1]=4 2954 B11R1.34 CCCC1CC(=O)CC(=O)O1 Amb24486422 [0,1,0,1,0,0|0,0,1]=3 2955 B11R1.34 CCCC1CC(=O)NC(=O)C1 Amb25169440 [0,1,0,1,0,0|2,0,0]=4 2956 B11R1.34 CCCC1CC(O)=CC(=O)N1 Amb25044269 [0,1,0,1,0,0|1,0,0]=3 2957 B11R1.34 CCC[C@@H]1CC(O)=CC(=O)N1 Amb25081070 [0,1,0,1,0,0|1,0,0]=3 2958 B11R1.34 CCCc1cc(O)cc(=O)o1 Amb22229791 [0,1,0,1,0,0|0,0,2]=4 2959 B11R1.34 NCCC1CC(=O)C=C(O)C1 Amb24567874 [0,1,0,1,0,0|2,0,0]=4 2960 B11R1.43 CC(=O)C=C1CC(CC1)CC Amb24487001 [0,1,0,1,0,0|1,0,0]=3 2961 B11R1.43 CC(=O)\C=C\1/CC(CO1)CC Amb24653002 [0,1,0,1,0,0|2,0,0]=4 2962 B11R1.43 CC(=O)\C=C\1/CCC(CBr)O1 Amb25194648 [0,1,0,1,0,0|2,0,0]=4 2963 B11R1.43 CC(=O)\C=C\1/CCC(CO)O1 Amb25729233 [0,1,0,1,0,0|2,0,0]=4 2964 B11R1.43 CCC1CC(CC1)CC(O)=O Amb25715115 [0,1,0,1,0,0|0,0,2]=4 2965 B11R1.43 CCN1CC(CC1)=CC(O)=O Amb24452457 [0,1,0,1,0,0|1,0,0]=3 2966 B11R1.77 CC(=CC(O)=O)C1COCC1 Amb25789155 [0,1,0,1,0,0|1,0,0]=3 2967 B11R1.77 CC(=O)CC(=O)C1CCCC1 Amb18791570 [0,1,0,1,0,0|1,0,1]=4 2968 B11R1.77 CC(=O)NC(=O)C1CCCC1 Amb25695373 [0,1,0,1,0,0|2,0,0]=4 2969 B11R1.77 CC(=O)NC(=S)C1CCCC1 Amb24597686 [0,1,0,1,0,0|2,0,0]=4 2970 B11R1.77 CC(=O)\C=C(\Cl)/N1CCCC1 Amb24697917 [0,1,0,1,0,0|2,0,0]=4 2971 B11R1.77 CC(=O)\C=C(\N)/N1CCCC1 Amb25695546 [0,1,0,1,0,0|2,0,0]=4 2972 B11R1.77 CC(C1CCCC1)CC(=O)O Amb17506860 [0,1,0,1,0,0|0,0,2]=4 2973 B11R1.77 C\C(=C/C(=O)C)\N1CCCC1 Amb10070618 [0,1,0,1,0,0|2,0,0]=4 2974 B11R1.77 C\C(=C/C(=O)O)\C1CCCC1 Amb17506859 [0,1,0,1,0,0|0,0,0]=2 2975 B11R1.77 C\C(=C/C(O)=O)\N1CCCC1 Amb24109437 [0,1,0,1,0,0|1,0,0]=3 2976 B11R1.77 C\C(=C\C(C)=O)\C1COCC1 Amb25309567 [0,1,0,1,0,0|2,0,0]=4 2977 B11R1.77 N[C@@H](CC(O)=O)C1CCCC1 Amb22748847 [0,1,0,1,0,0|0,0,2]=4 2978 B11R1.77 N[C@@H](CC(O)=O)C1CCCC1 Amb24670269 [0,1,0,1,0,0|0,0,2]=4 2979 B11R1.77 O=C(N1CCCC1)CC(=O)O Amb17400018 [0,1,0,1,0,0|1,0,1]=4 2980 B11R1.77 OC(=O)CS(=O)C1CCCC1 Amb18289838 [0,1,0,1,0,0|1,0,1]=4 2981 B11R1.77 OC(=O)\C=C(\Cl)/C1CCCC1 Amb25201939 [0,1,0,1,0,0|0,0,0]=2 2982 B11R1.77 OC(=O)\C=C(\Cl)/C1COCC1 Amb25853572 [0,1,0,1,0,0|1,0,0]=3 2983 B11R1.77 OC(CC(O)=O)C1CCCC1 Amb18990583 [0,1,0,1,0,0|0,0,2]=4 2984 B11R1.106 CC1CC1NC(=O)CC(O)=O Amb18298251 [0,1,0,1,0,0|1,0,1]=4 2985 B11R1.156 CC(=O)C1C(C)CCCC1=O Amb25848681 [0,1,0,1,0,0|1,0,1]=4 2986 B11R1.156 CC(=O)C=1C(=O)CCCC1C Amb24486039 [0,1,0,1,0,0|1,0,1]=4 2987 B11R1.156 CC(=O)C=1C(C)CCCC1O Amb25355109 [0,1,0,1,0,0|1,0,0]=3 2988 B11R1.156 CC(=O)N1C(C)CCCC1=O Amb25361534 [0,1,0,1,0,0|2,0,0]=4 2989 B11R1.156 CC(=O)[C@H]1[C@@H](C)CCCC1=O Amb24582476 [0,1,0,1,0,0|1,0,1]=4 2990 B11R1.156 CC(C)=C1[C@H](C)CCCC1=O Amb24662344 [0,1,0,1,0,0|2,0,0]=4 2991 B11R1.156 CC(O)=C1C(C)CCCC1=O Amb25327766 [0,1,0,1,0,0|1,0,0]=3 2992 B11R1.156 CC1=CCCC(C)C1C(O)=O Amb24351203 [0,1,0,1,0,0|0,0,2]=4 2993 B11R1.156 CC1CCNC(=O)C1C(O)=O Amb24470307 [0,1,0,1,0,0|1,0,1]=4 2994 B11R1.156 CC=1CCCC(C)C1B(O)O Amb25244776 [0,1,0,1,0,0|1,0,1]=4 2995 B11R1.156 CC=1CCCC(C)C1C(O)=O Amb25701700 [0,1,0,1,0,0|0,0,0]=2 2996 B11R1.156 C[C@@H]1CCC[C@@H](C)C1C(O)=O Amb25202408 [0,1,0,1,0,0|0,0,2]=4 2997 B11R1.156 C[C@@H]1CCC[C@H](N)[C@@H]1C(O)=O Amb24612184 [0,1,0,1,0,0|0,0,2]=4 2998 B11R1.156 C[C@@H]1CCNC(=O)[C@H]1C(O)=O Amb24567805 [0,1,0,1,0,0|1,0,1]=4 2999 B11R1.156 C[C@H]1CCCN(C)[C@@H]1C(O)=O Amb24568933 [0,1,0,1,0,0|1,0,1]=4 3000 B11R1.156 C[C@H]1CCC[C@@H](C)[C@@H]1C(O)=O Amb24711507 [0,1,0,1,0,0|0,0,2]=4 3001 B11R1.230 C=CCCC1OC(=O)C=C1O Amb24738417 [0,1,0,1,0,0|0,0,2]=4 3002 B11R1.230 CC1=CC(=O)CC1CCCC Amb25735217 [0,1,0,1,0,0|1,0,0]=3 3003 B11R1.230 CC1=CC(=O)OC1CCCCl Amb24737310 [0,1,0,1,0,0|1,0,0]=3 3004 B11R1.230 CC1CC(=O)OC1CCCC Amb15692528 [0,1,0,1,0,0|0,0,2]=4 3005 B11R1.230 CCCCC1CC(=O)CC1=O Amb25294421 [0,1,0,1,0,0|1,0,1]=4 3006 B11R1.230 CCCCC1CC(=O)OC1=O Amb22230364 [0,1,0,1,0,0|2,0,0]=4 3007 B11R1.230 CCCCC1OC(=O)N=C1N Amb24693411 [0,1,0,1,0,0|1,0,0]=3 3008 B11R1.230 CCCCC1OC(=O)NC1=O Amb22495610 [0,1,0,1,0,0|1,0,0]=3 3009 B11R1.230 CCCC[C@H]1OC(=O)CC1=O Amb25300900 [0,1,0,1,0,0|0,0,1]=3 3010 B11R1.230 CCCC[C@H]1OC(=O)C[C@@H]1O Amb25369404 [0,1,0,1,0,0|0,0,2]=4 3011 B11R1.230 CCCC[n]1[n]c(O)cc1N Amb18291009 [0,1,0,1,0,0|2,0,0]=4 3012 B11R1.230 CSCCC1OC(=O)N=C1N Amb25701263 [0,1,0,1,0,0|2,0,0]=4 3013 B11R1.230 C[C@@H]1CC(=O)O[C@H]1CCCC Amb24674272 [0,1,0,1,0,0|0,0,2]=4 3014 B11R1.471 CC(=O)C1C(CCC1=O)CC Amb25718300 [0,1,0,1,0,0|1,0,1]=4 3015 B11R1.471 CC(=O)C=1C(CCC1N)CC Amb24367283 [0,1,0,1,0,0|1,0,0]=3 3016 B11R1.471 CC1CCC(CC)C1C(O)=O Amb25779324 [0,1,0,1,0,0|0,0,2]=4 3017 B11R1.471 CCC1CCC(N)C1C(O)=O Amb25222054 [0,1,0,1,0,0|0,0,2]=4 3018 B11R1.471 CC[C@H]1CCN(C)[C@@H]1C(O)=O Amb24548891 [0,1,0,1,0,0|1,0,1]=4 3019 B11R1.484 CC(C)=CC(=O)CC1CCC1 Amb25766273 [0,1,0,1,0,0|2,0,0]=4 3020 B11R1.484 CC(CC1CCC1)CC(O)=O Amb25382090 [0,1,0,1,0,0|0,0,2]=4 3021 B11R1.484 CC(CN1CCC1)=CC(O)=O Amb24418169 [0,1,0,1,0,0|1,0,0]=3 3022 B11R1.484 CN(CC1CCC1)CC(O)=O Amb18523858 [0,1,0,1,0,0|1,0,1]=4 3023 B11R1.484 C\C(\N)=C\C(=O)CC1CCC1 Amb24586329 [0,1,0,1,0,0|2,0,0]=4 3024 B11R1.484 NC(CC1CCC1)CC(O)=O Amb25383680 [0,1,0,1,0,0|0,0,2]=4 3025 B11R1.484 OC(=O)CC(=O)NC1CCC1 Amb18298121 [0,1,0,1,0,0|1,0,1]=4 3026 B11R1.485 CC(C)=CC(=O)CCC1CC1 Amb25380189 [0,1,0,1,0,0|2,0,0]=4 3027 B11R1.485 CC(CNC1CC1)=CC(O)=O Amb25381547 [0,1,0,1,0,0|1,0,0]=3 3028 B11R1.485 OC(=O)CC(=O)NCC1CC1 Amb18183139 [0,1,0,1,0,0|1,0,1]=4 3029 B11R1.928 C[N+]1(CC(O)=O)CCCCC1 Amb25751186 [0,1,0,1,0,0|1,0,1]=4 3030 B11R1.928 OC(=O)CC1(C)CCCCC1 Amb17194149 [0,1,0,1,0,0|0,0,2]=4 3031 B11R1.928 OC(=O)CC1(N)CCCCC1 Amb10602480 [0,1,0,1,0,0|0,0,2]=4 3032 B11R1.1121 CC(C)(O)C=1CCCCCC1 Amb25680821 [0,1,0,1,0,0|1,0,1]=4 3033 B11R1.20 CC(=O)C=C1CCC(O)CC1 Amb25718921 [0,1,0,1,0,0|1,0,0]=3 3034 B11R1.20 CC1CCN(CC1)CC(=O)O Amb2236300 [0,1,0,1,0,0|1,0,1]=4 3035 B11R1.20 CC1CCN(CC1)CC(=O)O Amb2583054 [0,1,0,1,0,0|1,0,1]=4 3036 B11R1.20 C[C@@H]1CC[C@@H](CC1)CC(=O)O Amb10843976 [0,1,0,1,0,0|0,0,2]=4 3037 B11R1.20 NC1CCC(CC1)=CC(O)=O Amb24677619 [0,1,0,1,0,0|0,0,0]=2 3038 B11R1.20 NC1CCN(CC(O)=O)CC1 Amb22284092 [0,1,0,1,0,0|1,0,1]=4 3039 B11R1.20 NC1CCN(CC1)CC(=O)O Amb1099363 [0,1,0,1,0,0|1,0,1]=4 3040 B11R1.20 N[C@@H]1CC[C@@H](CC(O)=O)CC1 Amb22387640 [0,1,0,1,0,0|0,0,2]=4 3041 B11R1.20 N[C@@H]1CC[C@@H](CC(O)=O)CC1 Amb22746078 [0,1,0,1,0,0|0,0,2]=4 3042 B11R1.20 OC(=O)CN1CCC(Br)CC1 Amb21860450 [0,1,0,1,0,0|1,0,1]=4 3043 B11R1.20 OC(=O)CN1CCC(Cl)CC1 Amb21860297 [0,1,0,1,0,0|1,0,1]=4 3044 B11R1.20 OC(=O)CN1CCC(F)CC1 Amb22491200 [0,1,0,1,0,0|1,0,1]=4 3045 B11R1.20 OC(=O)CN1CCC(I)CC1 Amb21860436 [0,1,0,1,0,0|1,0,1]=4 3046 B11R1.20 OC1CCC(CC(O)=O)CC1 Amb18126157 [0,1,0,1,0,0|0,0,2]=4 3047 B11R1.20 OC1CCN(CC1)CC(=O)O Amb10609681 [0,1,0,1,0,0|1,0,1]=4 3048 B11R1.20 O[C@@H]1CC[C@@H](CC(O)=O)CC1 Amb24076397 [0,1,0,1,0,0|0,0,2]=4 3049 B11R1.20 O[C@@H]1CC[C@H](CC(O)=O)CC1 Amb24093224 [0,1,0,1,0,0|0,0,2]=4 3050 B11R1.23 CC(CO)C1CC=CC(=O)O1 Amb25150802 [0,1,0,1,0,0|1,0,0]=3 3051 B11R1.23 CC[C@H](O)[C@H]1CCCC(=O)O1 Amb24674493 [0,1,0,1,0,0|0,0,2]=4 3052 B11R1.23 C[C@@H](CO)C1CC=CC(=O)O1 Amb25296294 [0,1,0,1,0,0|1,0,0]=3 3053 B11R1.39 CC(CC)\N=C\1/C=CC(=O)O1 Amb24557999 [0,1,0,1,0,0|1,0,1]=4 3054 B11R1.39 CC(CC1CNC(=O)O1)CC Amb24595061 [0,1,0,1,0,0|1,0,1]=4 3055 B11R1.39 CC(CO)SC1C=CC(=O)O1 Amb24404296 [0,1,0,1,0,0|2,0,0]=4 3056 B11R1.39 CC(C[C@H]1C=CC(=O)O1)CO Amb25681440 [0,1,0,1,0,0|1,0,0]=3 3057 B11R1.39 CCC(=O)OC1C=CC(=O)O1 Amb25344559 [0,1,0,1,0,0|1,0,1]=4 3058 B11R1.39 CCC(N)Cc1ccc(Cl)o1 Amb18300827 [0,1,0,1,0,0|1,0,1]=4 3059 B11R1.39 CCC(N)Cc1ccc(I)o1 Amb25105439 [0,1,0,1,0,0|1,0,1]=4 3060 B11R1.39 COC(=O)CC1C=CC(=O)O1 Amb24066588 [0,1,0,1,0,0|1,0,1]=4 3061 B11R1.75 CC(=O)CCC1C=CC(=O)O1 Amb25143549 [0,1,0,1,0,0|0,0,1]=3 3062 B11R1.75 CC(=O)OCC1C=CC(=O)O1 Amb24424037 [0,1,0,1,0,0|1,0,1]=4 3063 B11R1.75 CC(=O)OC[C@@H]1C=CC(=O)O1 Amb24709308 [0,1,0,1,0,0|1,0,1]=4 3064 B11R1.75 CC(Br)CCc1ccc(Br)o1 Amb24690255 [0,1,0,1,0,0|1,0,1]=4 3065 B11R1.75 CC(C)CCC1CNC(=O)O1 Amb24532323 [0,1,0,1,0,0|1,0,1]=4 3066 B11R1.75 CC(Cl)CCc1ccc(Br)o1 Amb24523185 [0,1,0,1,0,0|1,0,1]=4 3067 B11R1.75 CC(N)CCc1ccc(Br)o1 Amb24619887 [0,1,0,1,0,0|1,0,1]=4 3068 B11R1.75 CC(O)CCc1ccc(Br)o1 Amb25094102 [0,1,0,1,0,0|1,0,1]=4 3069 B11R1.75 CC1CC(CC1)CCC(O)=O Amb25798904 [0,1,0,1,0,0|0,0,2]=4 3070 B11R1.75 CC1CC(CC1)NCC(O)=O Amb25274568 [0,1,0,1,0,0|1,0,1]=4 3071 B11R1.75 CC1CCC(C=CC(N)=O)=N1 Amb24610166 [0,1,0,1,0,0|1,0,1]=4 3072 B11R1.75 CC1CCC(CCC(O)=O)O1 Amb20623187 [0,1,0,1,0,0|0,0,2]=4 3073 B11R1.75 CC1CCC(N1)CCC(=O)O Amb17593932 [0,1,0,1,0,0|0,0,2]=4 3074 B11R1.75 CC1CCC(O1)\C=C\C(=O)O Amb17593894 [0,1,0,1,0,0|0,0,0]=2 3075 B11R1.75 CC1CCC(\C=C\C(C)=O)O1 Amb24532485 [0,1,0,1,0,0|1,0,0]=3 3076 B11R1.75 CC1CCC(\C=C\C(N)=O)=N1 Amb25132601 [0,1,0,1,0,0|1,0,1]=4 3077 B11R1.75 CC1COC(C1)\C=C\C(C)=O Amb25202718 [0,1,0,1,0,0|2,0,0]=4 3078 B11R1.75 C[C@@H]1CC[C@@H](CCC(O)=O)O1 Amb25299457 [0,1,0,1,0,0|0,0,2]=4 3079 B11R1.75 Cc1ccc(CCC(C)N)o1 Amb18644581 [0,1,0,1,0,0|1,0,1]=4 3080 B11R1.75 NC1CN(CC1)\C=C\C(O)=O Amb25771326 [0,1,0,1,0,0|1,0,0]=3 3081 B11R1.75 OC1CCC(C1)CCC(O)=O Amb24666025 [0,1,0,1,0,0|0,0,2]=4 3082 B11R1.159 CC1C(CCCC1O)C(O)=O Amb25072619 [0,1,0,1,0,0|0,0,2]=4 3083 B11R1.159 CC1C(Cl)CCCC1C(O)=O Amb25780658 [0,1,0,1,0,0|0,0,2]=4 3084 B11R1.159 CC1CCCC(C1C)C(O)=O Amb25189114 [0,1,0,1,0,0|0,0,2]=4 3085 B11R1.159 CC1[C@H](CCC[C@@H]1O)C(O)=O Amb24512159 [0,1,0,1,0,0|0,0,2]=4 3086 B11R1.159 C[C@H]1[C@H](CCC[C@H]1O)C(O)=O Amb24634320 [0,1,0,1,0,0|0,0,2]=4 3087 B11R1.159 C[C@H]1[C@H](NCC[C@H]1O)C(O)=O Amb24580494 [0,1,0,1,0,0|1,0,1]=4 3088 B11R1.159 OC(=O)C1=CCCC(O)C1O Amb25350593 [0,1,0,1,0,0|1,0,0]=3 3089 B11R1.159 OC(=O)C1=CCC[C@H](O)[C@@H]1O Amb25232550 [0,1,0,1,0,0|1,0,0]=3 3090 B11R1.235 CC1CC1N\C=C\C(=O)OC Amb24471765 [0,1,0,1,0,0|1,0,0]=3 3091 B11R1.237 COC(=O)C#CCCC1CC1 Amb25291613 [0,1,0,1,0,0|0,0,2]=4 3092 B11R1.237 COC(=O)\C=C\NCC1CC1 Amb25381548 [0,1,0,1,0,0|1,0,0]=3 3093 B11R1.262 CCC1CC(CCC(O)=O)C1 Amb25385585 [0,1,0,1,0,0|0,0,2]=4 3094 B11R1.262 COC1CN(C1)\C=C\C(O)=O Amb24572555 [0,1,0,1,0,0|2,0,0]=4 3095 B11R1.266 CCC1CC(CCC1)C(O)=O Amb24486034 [0,1,0,1,0,0|0,0,2]=4 3096 B11R1.266 CCC1CC(NCC1)C(O)=O Amb18830613 [0,1,0,1,0,0|1,0,1]=4 3097 B11R1.266 CCC1CCCC(N1)C(O)=O Amb25110486 [0,1,0,1,0,0|0,0,2]=4 3098 B11R1.266 CCC1CCNC(N1)C(O)=O Amb24484693 [0,1,0,1,0,0|1,0,1]=4 3099 B11R1.266 CCN1CC(=CCC1)C(O)=O Amb18117359 [0,1,0,1,0,0|1,0,0]=3 3100 B11R1.266 CC[C@@H]1C[C@@H](CCC1)C(O)=O Amb25179101 [0,1,0,1,0,0|0,0,2]=4 3101 B11R1.266 CC[C@H]1CCN[C@H](N1)C(O)=O Amb25179308 [0,1,0,1,0,0|1,0,1]=4 3102 B11R1.266 COC1CC(=CCC1)C(O)=O Amb25109290 [0,1,0,1,0,0|1,0,0]=3 3103 B11R1.313 CC1CCN(CC(O)=O)C1C Amb25845989 [0,1,0,1,0,0|1,0,1]=4 3104 B11R1.560 CC=1CCCC=C(C)C(=O)C1 Amb25718360 [0,1,0,1,0,0|1,0,1]=4 3105 B11R1.717 CC(=O)\C=C\CCC1(C)CO1 Amb24765118 [0,1,0,1,0,0|2,0,0]=4 3106 B11R1.717 CC1(CC1)NC\C=C\C(O)=O Amb25381526 [0,1,0,1,0,0|1,0,0]=3 3107 B11R1.717 CC1(CN\C=C\C(O)=O)CC1 Amb25089627 [0,1,0,1,0,0|1,0,0]=3 3108 B11R1.849 COC(=O)C/1C\C1=C\C(O)=O Amb25362160 [0,1,0,1,0,0|1,0,1]=4 3109 B11R1.849 COC(=O)C1CC1=CC(O)=O Amb25261373 [0,1,0,1,0,0|1,0,1]=4 3110 B11R1.1 CCCCC1C=CC(Br)CO1 Amb24484898 [0,1,0,1,0,0|1,0,1]=4 3111 B11R1.1 CCCCC1CNC(=O)CO1 Amb24662583 [0,1,0,1,0,0|1,0,1]=4 3112 B11R1.1 CCCCC=1C=CC(=O)NN1 Amb25791568 [0,1,0,1,0,0|1,0,1]=4 3113 B11R1.1 CCCC[C@H]1C=C[C@H](O)CN1 Amb24688327 [0,1,0,1,0,0|1,0,1]=4 3114 B11R1.1 CCCC[C@H]1C=C[C@H](O)CO1 Amb24728245 [0,1,0,1,0,0|0,0,2]=4 3115 B11R1.1 CCCCc1ccc(O)c[n]1 Amb25831110 [0,1,0,1,0,0|1,0,1]=4 3116 B11R1.1 O=C1CCC(CCCCl)C=C1 Amb25250570 [0,1,0,1,0,0|2,0,0]=4 3117 B11R1.13 CC1C(CCC)OC=CC1=O Amb25264017 [0,1,0,1,0,0|2,0,0]=4 3118 B11R1.13 CCCc1occc(=O)c1O Amb11032523 [0,1,0,1,0,0|1,0,1]=4 3119 B11R1.25 C#CC(=O)\C=C/C1CCCC1 Amb25718324 [0,1,0,1,0,0|1,0,0]=3 3120 B11R1.25 C#CC(O)\C=C\C1CCCC1 Amb25188828 [0,1,0,1,0,0|1,0,1]=4 3121 B11R1.25 CCC(=O)\C=C/N1CCCC1 Amb25347529 [0,1,0,1,0,0|2,0,0]=4 3122 B11R1.25 COC(=O)C#CC1CCCC1 Amb25756477 [0,1,0,1,0,0|0,0,2]=4 3123 B11R1.25 COC(=O)CNC1CCCC1 Amb19958344 [0,1,0,1,0,0|1,0,1]=4 3124 B11R1.25 COC(=O)CSC1CCCC1 Amb24750765 [0,1,0,1,0,0|1,0,1]=4 3125 B11R1.25 COC(=O)NCC1CCCC1 Amb25853291 [0,1,0,1,0,0|1,0,1]=4 3126 B11R1.25 COC(=O)\C=C\C1CCCN1 Amb25137257 [0,1,0,1,0,0|1,0,0]=3 3127 B11R1.25 COC(=O)\C=C\C1CCCO1 Amb10067185 [0,1,0,1,0,0|1,0,0]=3 3128 B11R1.25 COC(=O)\C=C\C1CSCC1 Amb25150467 [0,1,0,1,0,0|1,0,0]=3 3129 B11R1.25 COC(=O)\C=C\C1OCCO1 Amb25258482 [0,1,0,1,0,0|2,0,0]=4 3130 B11R1.25 COC(=O)\C=C\C=1CCCC1 Amb24392864 [0,1,0,1,0,0|0,0,2]=4 3131 B11R1.25 COC(=O)\C=C\N1CCCC1 Amb2384232 [0,1,0,1,0,0|1,0,0]=3 3132 B11R1.25 O=C(CCl)\C=C\C1COCC1 Amb24373116 [0,1,0,1,0,0|2,0,0]=4 3133 B11R1.25 OCC(=O)OCC1CCCC1 Amb25382633 [0,1,0,1,0,0|1,0,1]=4 3134 B11R1.25 OCC(=O)\C=C\C=1CCCC1 Amb24486442 [0,1,0,1,0,0|0,0,2]=4 3135 B11R1.25 ONC(=O)CNC1CCCC1 Amb25145836 [0,1,0,1,0,0|1,0,1]=4 3136 B11R1.25 ONC(=O)CSC1CCCC1 Amb25043430 [0,1,0,1,0,0|1,0,1]=4 3137 B11R1.40 CC(CO)=CC1CCCCC1 Amb24431251 [0,1,0,1,0,0|1,0,1]=4 3138 B11R1.40 CNC(=O)C=C1CCCCC1 Amb25752019 [0,1,0,1,0,0|1,0,0]=3 3139 B11R1.40 CNC(=O)C=C1CCOCC1 Amb24485258 [0,1,0,1,0,0|2,0,0]=4 3140 B11R1.40 COC(=O)C=C1CCCCC1 Amb22365303 [0,1,0,1,0,0|0,0,0]=2 3141 B11R1.40 COC(=O)C=C1CCOCC1 Amb19337770 [0,1,0,1,0,0|1,0,0]=3 3142 B11R1.40 COC(=O)C=C1CCSCC1 Amb24727308 [0,1,0,1,0,0|1,0,0]=3 3143 B11R1.40 COC(=O)CN1CCCCC1 Amb2583056 [0,1,0,1,0,0|1,0,1]=4 3144 B11R1.40 COC(=O)NC=1CCCCC1 Amb24484970 [0,1,0,1,0,0|1,0,1]=4 3145 B11R1.40 COC(=O)NN1CCCCC1 Amb2125354 [0,1,0,1,0,0|2,0,0]=4 3146 B11R1.40 COC(=O)\C=C/1\CCCCN1 Amb23570717 [0,1,0,1,0,0|1,0,0]=3 3147 B11R1.40 COC(=O)\C=C/1\CCCNC1 Amb24331938 [0,1,0,1,0,0|1,0,0]=3 3148 B11R1.40 C\C(\C=C1CCCCC1)=C\C Amb24526880 [0,1,0,1,0,0|2,0,0]=4 3149 B11R1.40 C\C(\C=O)=C/C1CCCCC1 Amb18125472 [0,1,0,1,0,0|1,0,1]=4 3150 B11R1.40 NNC(=O)C=C1CCCCC1 Amb25086285 [0,1,0,1,0,0|1,0,0]=3 3151 B11R1.40 NNC(=O)C=C1CCOCC1 Amb25318401 [0,1,0,1,0,0|2,0,0]=4 3152 B11R1.40 NOC(=O)CC1CCCCC1 Amb22168867 [0,1,0,1,0,0|0,0,2]=4 3153 B11R1.40 NOC(=O)NC1CCCCC1 Amb24642623 [0,1,0,1,0,0|1,0,1]=4 3154 B11R1.40 O=C(CBr)C=C1CCCCC1 Amb25823876 [0,1,0,1,0,0|1,0,0]=3 3155 B11R1.40 OCC(=O)CC=1CCCCC1 Amb24486365 [0,1,0,1,0,0|0,0,2]=4 3156 B11R1.40 OCC(=O)NC1CCCCC1 Amb1109698 [0,1,0,1,0,0|1,0,1]=4 3157 B11R1.40 OCC(=O)OC1CCCCC1 Amb25284517 [0,1,0,1,0,0|1,0,1]=4 3158 B11R1.40 OCC(Br)=CC1CCCCC1 Amb25287334 [0,1,0,1,0,0|1,0,1]=4 3159 B11R1.40 OCC(Cl)=CC1CCCCC1 Amb25792228 [0,1,0,1,0,0|1,0,1]=4 3160 B11R1.40 OCC(O)C=C1CCCCC1 Amb25769334 [0,1,0,1,0,0|0,0,2]=4 3161 B11R1.40 OC[C@@H](O)C=C1CCCCC1 Amb25149710 [0,1,0,1,0,0|0,0,2]=4 3162 B11R1.40 OC\C(=C\C1CCCCC1)\Br Amb10605436 [0,1,0,1,0,0|1,0,1]=4 3163 B11R1.40 ONC(=O)C=C1CCOCC1 Amb25033071 [0,1,0,1,0,0|1,0,0]=3 3164 B11R1.59 CCC1CCCN1C(=O)OC Amb16981720 [0,1,0,1,0,0|1,0,1]=4 3165 B11R1.59 CCC1CCNC1C(=O)OC Amb18126064 [0,1,0,1,0,0|1,0,1]=4 3166 B11R1.59 CC[C@@H]1CCN[C@H]1C(=O)OC Amb24554485 [0,1,0,1,0,0|1,0,1]=4 3167 B11R1.59 CC[C@H]1CCN[C@@H]1C(=O)OC Amb24562884 [0,1,0,1,0,0|1,0,1]=4 3168 B11R1.59 COC(=O)C1=CCCC1C#N Amb25172764 [0,1,0,1,0,0|1,0,1]=4 3169 B11R1.85 C=C1CCCCCCCC1=O Amb25092923 [0,1,0,1,0,0|1,0,1]=4 3170 B11R1.85 CC1=CCCCCCCC1=O Amb24722806 [0,1,0,1,0,0|1,0,0]=3 3171 B11R1.85 O=C1NCCCCCC=C1Br Amb25237624 [0,1,0,1,0,0|1,0,0]=3 3172 B11R1.85 OC1CCCCCCC=C1Br Amb17595969 [0,1,0,1,0,0|1,0,1]=4 3173 B11R1.144 O=C1CCCCCC(=O)C=C1 Amb25282753 [0,1,0,1,0,0|1,0,1]=4 3174 B11R1.190 CCCCC\C=C/1\CCC1=O Amb24765435 [0,1,0,1,0,0|1,0,0]=3 3175 B11R1.212 CC1=CC=C(CCCC)C1=O Amb24646676 [0,1,0,1,0,0|1,0,1]=4 3176 B11R1.212 CCCCC1COC(=O)C1O Amb25680553 [0,1,0,1,0,0|1,0,1]=4 3177 B11R1.212 CCCC[C@@H]1COC(=O)[C@H]1O Amb24733418 [0,1,0,1,0,0|1,0,1]=4 3178 B11R1.212 CCCC[C@H]1COC(=O)[C@@H]1O Amb24741786 [0,1,0,1,0,0|1,0,1]=4 3179 B11R1.212 CN1C(CCCO)C=CC1=O Amb25043800 [0,1,0,1,0,0|2,0,0]=4 3180 B11R1.212 CN1[C@@H](CCCO)C=CC1=O Amb24613518 [0,1,0,1,0,0|2,0,0]=4 3181 B11R1.214 CCCC[n]1cc(C=O)cc1 Amb25381639 [0,1,0,1,0,0|2,0,0]=4 3182 B11R1.214 CCCC[n]1ccc(C=O)[n]1 Amb23568552 [0,1,0,1,0,0|2,0,0]=4 3183 B11R1.214 CCCC[n]1ccc(CO)[n]1 Amb23568560 [0,1,0,1,0,0|2,0,0]=4 3184 B11R1.214 CCCCc1ccc(C=O)[nH]1 Amb18125308 [0,1,0,1,0,0|1,0,1]=4 3185 B11R1.214 CCCCc1ccc(C=O)o1 Amb18125410 [0,1,0,1,0,0|0,0,1]=3 3186 B11R1.214 CCCCc1ccc(CO)[nH]1 Amb23154083 [0,1,0,1,0,0|1,0,1]=4 3187 B11R1.214 CCCOc1ccc(C=O)o1 Amb25379982 [0,1,0,1,0,0|1,0,1]=4 3188 B11R1.214 CCOCc1ccc(C=O)o1 Amb18125681 [0,1,0,1,0,0|1,0,1]=4 3189 B11R1.214 CCSCc1ccc(C=O)o1 Amb25384437 [0,1,0,1,0,0|1,0,1]=4 3190 B11R1.218 CCCCC1CC1C(=O)OC Amb24061167 [0,1,0,1,0,0|0,0,2]=4 3191 B11R1.222 CC(=NO)C1=CCCCC1Br Amb25070454 [0,1,0,1,0,0|2,0,0]=4 3192 B11R1.222 CC1CCCCN1C(=O)NO Amb24631869 [0,1,0,1,0,0|1,0,1]=4 3193 B11R1.222 CC1CCCNC1C(=O)OC Amb23590118 [0,1,0,1,0,0|1,0,1]=4 3194 B11R1.222 CC=1CCCCC1C(=O)OC Amb24593167 [0,1,0,1,0,0|0,0,2]=4 3195 B11R1.222 CN1CCCC=C1C(=O)OC Amb23585371 [0,1,0,1,0,0|1,0,0]=3 3196 B11R1.222 COC(=O)N1C=CCC[C@@H]1C Amb24060023 [0,1,0,1,0,0|1,0,1]=4 3197 B11R1.222 C[C@H]1CCCN[C@H]1C(=O)OC Amb24716098 [0,1,0,1,0,0|1,0,1]=4 3198 B11R1.228 CC1CCCC1NC(=O)CO Amb25189432 [0,1,0,1,0,0|1,0,1]=4 3199 B11R1.228 CC1CCCC1NC(=O)OC Amb25306459 [0,1,0,1,0,0|1,0,1]=4 3200 B11R1.228 CC1OCCC1=CC(=O)NO Amb24592326 [0,1,0,1,0,0|1,0,0]=3 3201 B11R1.228 CCC(=O)\C=C/1\CCCN1C Amb24646542 [0,1,0,1,0,0|2,0,0]=4 3202 B11R1.228 CN/1CCC\C1=C/C(=O)C=C Amb25150317 [0,1,0,1,0,0|2,0,0]=4 3203 B11R1.228 CN/1CCC\C1=C\C(=O)OC Amb25310230 [0,1,0,1,0,0|1,0,0]=3 3204 B11R1.228 CNC(=O)\C=C/1\CCOC1C Amb24577604 [0,1,0,1,0,0|2,0,0]=4 3205 B11R1.228 COC(=O)CN1CCCC1C Amb18179726 [0,1,0,1,0,0|1,0,1]=4 3206 B11R1.228 COC(=O)\C=C/1\CCCC1C Amb24712218 [0,1,0,1,0,0|0,0,0]=2 3207 B11R1.228 COC(=O)\C=C/1\CCOC1C Amb25748969 [0,1,0,1,0,0|1,0,0]=3 3208 B11R1.228 COC(=O)\C=C/1\NCCC1C Amb24711643 [0,1,0,1,0,0|1,0,0]=3 3209 B11R1.228 COC(=O)\C=C/1\NCCC1O Amb24580471 [0,1,0,1,0,0|2,0,0]=4 3210 B11R1.228 COC(=O)\C=C/1\OCCC1C Amb24437401 [0,1,0,1,0,0|1,0,0]=3 3211 B11R1.228 COC(=O)\C=C\1/NCC[C@@H]1O Amb25097205 [0,1,0,1,0,0|2,0,0]=4 3212 B11R1.236 COC(=O)C#CCC1CCC1 Amb24610465 [0,1,0,1,0,0|0,0,2]=4 3213 B11R1.236 COC(=O)\C=C\NC1CCC1 Amb24410479 [0,1,0,1,0,0|1,0,0]=3 3214 B11R1.236 COC(=O)\C=C\NC1COC1 Amb25340594 [0,1,0,1,0,0|2,0,0]=4 3215 B11R1.248 O=CC=1CCCCCCCC1 Amb25172766 [0,1,0,1,0,0|1,0,1]=4 3216 B11R1.255 COC(=O)\C=C/C1CC1C=O Amb24762932 [0,1,0,1,0,0|1,0,1]=4 3217 B11R1.255 COC(=O)\C=C\C1CC1C=O Amb25384113 [0,1,0,1,0,0|1,0,1]=4 3218 B11R1.558 CC1CCCCC=C(F)C1=O Amb24485837 [0,1,0,1,0,0|1,0,1]=4 3219 B11R1.757 CCCCCC1NC(=O)C1O Amb24767006 [0,1,0,1,0,0|1,0,1]=4 3220 B11R1.757 CCCCNC1=CC(=O)C1=O Amb24741583 [0,1,0,1,0,0|1,0,1]=4 3221 B11R1.757 CCCCOC1=CC(=O)C1=O Amb25383141 [0,1,0,1,0,0|1,0,1]=4 3222 B11R1.757 CCCCSC1=CC(=O)C1=O Amb24766635 [0,1,0,1,0,0|1,0,1]=4 3223 B11R1.852 C#CC(=O)C=1CCCCCC1 Amb25149436 [0,1,0,1,0,0|1,0,0]=3 3224 B11R1.852 C=CC(=O)C=1CCCCCC1 Amb25142707 [0,1,0,1,0,0|1,0,0]=3 3225 B11R1.852 CC(CO)C=1CCCCCC1 Amb25152033 [0,1,0,1,0,0|1,0,1]=4 3226 B11R1.852 CCC(=O)C=1CCCCCC1 Amb18182813 [0,1,0,1,0,0|1,0,0]=3 3227 B11R1.852 CCC(O)C=1CCCCCC1 Amb18182952 [0,1,0,1,0,0|1,0,1]=4 3228 B11R1.852 COC(=O)C1CCCCCC1 Amb18182101 [0,1,0,1,0,0|0,0,2]=4 3229 B11R1.852 COC(=O)C1CCCCCN1 Amb21963566 [0,1,0,1,0,0|1,0,1]=4 3230 B11R1.852 COC(=O)C1CCCCCN1 Amb21964454 [0,1,0,1,0,0|1,0,1]=4 3231 B11R1.852 COC(=O)N1CCCCCC1 Amb17789384 [0,1,0,1,0,0|1,0,1]=4 3232 B11R1.852 NCC(O)C=1CCCCCC1 Amb24684767 [0,1,0,1,0,0|1,0,1]=4 3233 B11R1.852 OCC(=O)N1CCCCCC1 Amb1111379 [0,1,0,1,0,0|1,0,1]=4 3234 B11R1.852 OCC(=O)N1CCCCCO1 Amb25050987 [0,1,0,1,0,0|2,0,0]=4 3235 B11R1.852 ONC(=O)C1CCCCCC1 Amb18182216 [0,1,0,1,0,0|0,0,2]=4 3236 B11R1.852 ONC(=O)C1CCCCCN1 Amb25151281 [0,1,0,1,0,0|1,0,1]=4 3237 B11R1.852 ONC(=O)C=1CCCCCC1 Amb25355359 [0,1,0,1,0,0|0,0,0]=2 3238 B11R1.35 C=C(CC1CCCC1)C(O)=O Amb24470140 [0,1,0,1,0,0|0,0,1]=3 3239 B11R1.35 C=C(CN1CCCC1)C(O)=O Amb22265840 [0,1,0,1,0,0|1,0,1]=4 3240 B11R1.35 CC(=CC1CCCC1)C(C)=O Amb24383606 [0,1,0,1,0,0|1,0,0]=3 3241 B11R1.35 CC(=CC1CCCC1)C(O)=O Amb24417264 [0,1,0,1,0,0|0,0,0]=2 3242 B11R1.35 CC(=CC1CCCC1)[N+]([O-])=O Amb18796842 [0,1,0,1,0,0|1,0,1]=4 3243 B11R1.35 CC(=CC1CCCO1)C(O)=O Amb25780020 [0,1,0,1,0,0|1,0,0]=3 3244 B11R1.35 CC(=CC1COCC1)C(C)=O Amb24678397 [0,1,0,1,0,0|2,0,0]=4 3245 B11R1.35 CC(=CC1COCC1)C(O)=O Amb25286866 [0,1,0,1,0,0|1,0,0]=3 3246 B11R1.35 CC(=O)C(=O)CC1CCCC1 Amb24593200 [0,1,0,1,0,0|1,0,1]=4 3247 B11R1.35 CC(=O)C(=O)OC1CCCC1 Amb25151525 [0,1,0,1,0,0|2,0,0]=4 3248 B11R1.35 CC(=O)C(O)=CN1CCCC1 Amb25263624 [0,1,0,1,0,0|2,0,0]=4 3249 B11R1.35 CC(C(=O)O)CC1CCCC1 Amb10844013 [0,1,0,1,0,0|0,0,2]=4 3250 B11R1.35 C[C@@H](NC1CCCC1)C(O)=O Amb25151812 [0,1,0,1,0,0|1,0,1]=4 3251 B11R1.35 C[C@@H](OC1CCCC1)C(O)=O Amb24385410 [0,1,0,1,0,0|1,0,1]=4 3252 B11R1.35 C[C@H](NC1CCCC1)C(O)=O Amb17772284 [0,1,0,1,0,0|1,0,1]=4 3253 B11R1.35 C[C@H](OC1CCCC1)C(O)=O Amb25841911 [0,1,0,1,0,0|1,0,1]=4 3254 B11R1.35 C\C(=C/C=1CCCC1)\C(O)=O Amb25109916 [0,1,0,1,0,0|0,0,2]=4 3255 B11R1.35 O=C(C(=O)C)NC1CCCC1 Amb17399994 [0,1,0,1,0,0|2,0,0]=4 3256 B11R1.35 OC(=O)C(=O)CC1CCCC1 Amb18296288 [0,1,0,1,0,0|0,0,1]=3 3257 B11R1.35 OC(=O)C(=O)CC1COCC1 Amb18987708 [0,1,0,1,0,0|1,0,1]=4 3258 B11R1.35 OC(=O)C(=O)NC1CNCC1 Amb25072154 [0,1,0,1,0,0|2,0,0]=4 3259 B11R1.35 OC(=O)C(F)=CC1CCCO1 Amb24751658 [0,1,0,1,0,0|1,0,0]=3 3260 B11R1.35 OC(=O)C(F)CC1CCCC1 Amb25706351 [0,1,0,1,0,0|0,0,2]=4 3261 B11R1.35 OC(=O)C(F)OC1CCCC1 Amb25045342 [0,1,0,1,0,0|1,0,1]=4 3262 B11R1.35 OC(=O)C(F)SC1CCCC1 Amb25828149 [0,1,0,1,0,0|1,0,1]=4 3263 B11R1.35 OC(=O)C(S)CC1CCCC1 Amb18296291 [0,1,0,1,0,0|0,0,2]=4 3264 B11R1.35 O[C@@H](CC1CCCC1)C(O)=O Amb25700901 [0,1,0,1,0,0|0,0,2]=4 3265 B11R1.36 C=C(C(O)=O)C=1CCCCC1 Amb25216978 [0,1,0,1,0,0|0,0,1]=3 3266 B11R1.36 C=C(C(O)=O)N1CCOCC1 Amb25281878 [0,1,0,1,0,0|2,0,0]=4 3267 B11R1.36 C=C(C1CCCCC1)C(N)=O Amb24681095 [0,1,0,1,0,0|1,0,1]=4 3268 B11R1.36 CC(=C1CCCCC1)C(C)=O Amb24676878 [0,1,0,1,0,0|1,0,0]=3 3269 B11R1.36 CC(=O)C(=C)C=1CCCCC1 Amb25151448 [0,1,0,1,0,0|1,0,1]=4 3270 B11R1.36 CC(=O)C(=C)N1CCCCC1 Amb25735264 [0,1,0,1,0,0|2,0,0]=4 3271 B11R1.36 CC(=O)C(=O)C=1CCCCC1 Amb25272523 [0,1,0,1,0,0|1,0,1]=4 3272 B11R1.36 CC(=O)C(Cl)=C1CCCCC1 Amb25370669 [0,1,0,1,0,0|1,0,0]=3 3273 B11R1.36 CC(=O)C(F)=C1CCCCC1 Amb25797341 [0,1,0,1,0,0|1,0,0]=3 3274 B11R1.36 CC(C(N)=O)=C1CCCCC1 Amb25251658 [0,1,0,1,0,0|1,0,0]=3 3275 B11R1.36 CC(C(O)=O)=C1CCOCC1 Amb25323210 [0,1,0,1,0,0|1,0,0]=3 3276 B11R1.36 CC(C(O)=O)C=1CCCCC1 Amb18125728 [0,1,0,1,0,0|0,0,2]=4 3277 B11R1.36 C[C@@H](C(=O)O)C1CCCCC1 Amb10844024 [0,1,0,1,0,0|0,0,2]=4 3278 B11R1.36 C[C@@H](C(O)=O)N1CCCCC1 Amb24360124 [0,1,0,1,0,0|1,0,1]=4 3279 B11R1.36 C[C@H](C(=O)O)C1CCCCC1 Amb10844035 [0,1,0,1,0,0|0,0,2]=4 3280 B11R1.36 N=C(C(O)=O)N1CCOCC1 Amb18126113 [0,1,0,1,0,0|2,0,0]=4 3281 B11R1.36 NC(C(O)=O)C=1CCCCC1 Amb18125858 [0,1,0,1,0,0|0,0,2]=4 3282 B11R1.36 N[C@@H](C1CCCCC1)C(O)=O Amb20240588 [0,1,0,1,0,0|0,0,2]=4 3283 B11R1.36 N[C@H](C(O)=O)C=1CCCCC1 Amb25699117 [0,1,0,1,0,0|0,0,2]=4 3284 B11R1.36 N[C@H](C1CCCCC1)C(O)=O Amb20242426 [0,1,0,1,0,0|0,0,2]=4 3285 B11R1.36 O=C(C(=O)C)N1CCCCC1 Amb17399995 [0,1,0,1,0,0|2,0,0]=4 3286 B11R1.36 OC(=O)C(=O)C1=CCCCO1 Amb24587805 [0,1,0,1,0,0|1,0,1]=4 3287 B11R1.36 OC(=O)C(=O)C1CCCCC1 Amb18125967 [0,1,0,1,0,0|0,0,1]=3 3288 B11R1.36 OC(=O)C(=O)C=1CCCOC1 Amb24677009 [0,1,0,1,0,0|1,0,1]=4 3289 B11R1.36 OC(=O)C(Br)=C1CCCCC1 Amb25123900 [0,1,0,1,0,0|0,0,0]=2 3290 B11R1.36 OC(=O)C(C1=CCCCC1)O Amb17593900 [0,1,0,1,0,0|0,0,2]=4 3291 B11R1.36 OC(=O)C(Cl)=C1CCCCC1 Amb18647874 [0,1,0,1,0,0|0,0,0]=2 3292 B11R1.36 OC(=O)C(Cl)C1CCCCC1 Amb18127804 [0,1,0,1,0,0|0,0,2]=4 3293 B11R1.36 OC(=O)C(F)=C1CCCCC1 Amb18126121 [0,1,0,1,0,0|0,0,0]=2 3294 B11R1.36 OC(=O)C(F)=C1CCOCC1 Amb24355921 [0,1,0,1,0,0|1,0,0]=3 3295 B11R1.36 OC(=O)C(F)=C1CCSCC1 Amb25055253 [0,1,0,1,0,0|1,0,0]=3 3296 B11R1.36 O[C@H](C1CCCCC1)C(O)=O Amb22361246 [0,1,0,1,0,0|0,0,2]=4 3297 B11R1.89 CC(C(O)=O)=C1CCOC1C Amb25043200 [0,1,0,1,0,0|1,0,0]=3 3298 B11R1.89 CC1CCCC1=C(F)C(O)=O Amb25053233 [0,1,0,1,0,0|0,0,0]=2 3299 B11R1.89 CC1CCCC1C(C)C(O)=O Amb24645562 [0,1,0,1,0,0|0,0,2]=4 3300 B11R1.89 CC1CCCC1C(F)C(O)=O Amb25823406 [0,1,0,1,0,0|0,0,2]=4 3301 B11R1.89 CC1CCCC1C(O)C(O)=O Amb25217460 [0,1,0,1,0,0|0,0,2]=4 3302 B11R1.89 CC1CCCN1C(=O)C(O)=O Amb18944324 [0,1,0,1,0,0|1,0,0]=3 3303 B11R1.89 CC1CCCN1C(C)C(O)=O Amb18284138 [0,1,0,1,0,0|1,0,1]=4 3304 B11R1.89 CC1CSCC1=C(F)C(O)=O Amb25150494 [0,1,0,1,0,0|1,0,0]=3 3305 B11R1.89 CC1SCCC1=C(F)C(O)=O Amb25736511 [0,1,0,1,0,0|1,0,0]=3 3306 B11R1.89 C[C@@H]1CCCN1C(=O)C(O)=O Amb24391529 [0,1,0,1,0,0|1,0,0]=3 3307 B11R1.89 OC(=O)C(O)=C1CCCC1=O Amb25362193 [0,1,0,1,0,0|1,0,1]=4 3308 B11R1.89 OC(=O)\C(\O)=C/1\CCCC1=O Amb24650916 [0,1,0,1,0,0|1,0,1]=4 3309 B11R1.104 CC1CC1CNC(=O)C(O)=O Amb24660141 [0,1,0,1,0,0|1,0,0]=3 3310 B11R1.142 CC1CCC1NC(C)C(O)=O Amb25283466 [0,1,0,1,0,0|1,0,1]=4 3311 B11R1.142 CC1CCC1N[C@@H](C)C(O)=O Amb24735541 [0,1,0,1,0,0|1,0,1]=4 3312 B11R1.142 OC(=O)C(=O)N[C@@H]1CC[C@H]1O Amb24526393 [0,1,0,1,0,0|2,0,0]=4 3313 B11R1.192 CC1=CO[C@@H](CCC)CC1=O Amb25143334 [0,1,0,1,0,0|2,0,0]=4 3314 B11R1.192 CCCC1CC(=O)C(=O)CC1 Amb25150181 [0,1,0,1,0,0|1,0,1]=4 3315 B11R1.211 CCCCC1CC(C1)C(O)=O Amb23537588 [0,1,0,1,0,0|0,0,2]=4 3316 B11R1.231 CC1=C[C@@H](CCCO)OC1=O Amb24420804 [0,1,0,1,0,0|1,0,0]=3 3317 B11R1.231 CCCCC1CC(=C)C(=O)O1 Amb24640131 [0,1,0,1,0,0|0,0,1]=3 3318 B11R1.231 CCCC[C@@H]1CC(=O)C(=O)O1 Amb24619605 [0,1,0,1,0,0|0,0,1]=3 3319 B11R1.231 CCCC[C@@H]1C[C@@H](Cl)C(=O)O1 Amb25262544 [0,1,0,1,0,0|0,0,2]=4 3320 B11R1.231 CCCC[C@@H]1C[C@H](Cl)C(=O)O1 Amb24557198 [0,1,0,1,0,0|0,0,2]=4 3321 B11R1.231 CCCC[C@@H]1C[C@H](N)C(=O)O1 Amb25263992 [0,1,0,1,0,0|0,0,2]=4 3322 B11R1.231 CCCC[C@H]1C[C@H](N)C(=O)O1 Amb25179026 [0,1,0,1,0,0|0,0,2]=4 3323 B11R1.231 CCCCc1cc(C)c(C)o1 Amb25311321 [0,1,0,1,0,0|1,0,1]=4 3324 B11R1.231 O=C1OC(CCC=O)C=C1F Amb24380785 [0,1,0,1,0,0|1,0,1]=4 3325 B11R1.332 CC(=CCN1CCC1)C(O)=O Amb25185249 [0,1,0,1,0,0|1,0,0]=3 3326 B11R1.332 CC(CCC1CCC1)C(O)=O Amb24765911 [0,1,0,1,0,0|0,0,2]=4 3327 B11R1.332 CC(NCC1CCC1)C(O)=O Amb18182199 [0,1,0,1,0,0|1,0,1]=4 3328 B11R1.332 CC(OCC1CCC1)C(O)=O Amb24762012 [0,1,0,1,0,0|1,0,1]=4 3329 B11R1.332 C[C@@H](NCC1CCC1)C(O)=O Amb25383670 [0,1,0,1,0,0|1,0,1]=4 3330 B11R1.332 C[C@H](NCC1CCC1)C(O)=O Amb25383664 [0,1,0,1,0,0|1,0,1]=4 3331 B11R1.332 NC(CCC1CCC1)C(O)=O Amb24765840 [0,1,0,1,0,0|0,0,2]=4 3332 B11R1.332 N[C@@H](CCC1CCC1)C(O)=O Amb24765842 [0,1,0,1,0,0|0,0,2]=4 3333 B11R1.332 N[C@H](CCC1CCC1)C(O)=O Amb24765843 [0,1,0,1,0,0|0,0,2]=4 3334 B11R1.332 OC(=O)C(=O)CCC1CCC1 Amb24765895 [0,1,0,1,0,0|0,0,1]=3 3335 B11R1.332 OC(=O)C(=O)NCC1CNC1 Amb25072127 [0,1,0,1,0,0|2,0,0]=4 3336 B11R1.332 OC(=O)C(=O)\C=C\C1CCC1 Amb25692000 [0,1,0,1,0,0|0,0,1]=3 3337 B11R1.332 OC(CCC1CCC1)C(O)=O Amb24765884 [0,1,0,1,0,0|0,0,2]=4 3338 B11R1.333 CC(=CCNC1CC1)C(O)=O Amb25381546 [0,1,0,1,0,0|1,0,0]=3 3339 B11R1.333 OC(=O)C(=O)NCCC1CC1 Amb25379849 [0,1,0,1,0,0|1,0,0]=3 3340 B11R1.421 CC[C@@H]1CCC[C@@]1(N)C(O)=O Amb25227403 [0,1,0,1,0,0|0,0,2]=4 3341 B11R1.421 CC[C@@H]1CCC[C@]1(N)C(O)=O Amb25295379 [0,1,0,1,0,0|0,0,2]=4 3342 B11R1.421 CC[C@H]1CCC[C@@]1(N)C(O)=O Amb24557381 [0,1,0,1,0,0|0,0,2]=4 3343 B11R1.421 CC[C@H]1CCC[C@]1(N)C(O)=O Amb24571144 [0,1,0,1,0,0|0,0,2]=4 3344 B11R1.421 CC[C@H]1CCN[C@]1(C)C(O)=O Amb25294337 [0,1,0,1,0,0|1,0,1]=4 3345 B11R1.468 CCC1CC1NC(=O)C(O)=O Amb25362972 [0,1,0,1,0,0|1,0,0]=3 3346 B11R1.468 CC[C@@H]1C[C@H]1NC(=O)C(O)=O Amb25295901 [0,1,0,1,0,0|1,0,0]=3 3347 B11R1.497 CC(=C)C1CC(=O)C=CCC1 Amb25718323 [0,1,0,1,0,0|1,0,1]=4 3348 B11R1.497 CC(C)C1CCCCC(=O)O1 Amb24366072 [0,1,0,1,0,0|0,0,2]=4 3349 B11R1.497 CC(C)C=1CCC=CC(=O)C1 Amb24485850 [0,1,0,1,0,0|1,0,1]=4 3350 B11R1.497 CC1CCCC[C@H](N1)C(O)=O Amb25119161 [0,1,0,1,0,0|0,0,2]=4 3351 B11R1.497 OC(=O)C=1CC(=O)CCCC1 Amb24650908 [0,1,0,1,0,0|0,0,1]=3 3352 B11R1.520 CC1CCCCC1(C)C(O)=O Amb24635732 [0,1,0,1,0,0|0,0,2]=4 3353 B11R1.520 CC1CCCCC1(O)C(O)=O Amb18278639 [0,1,0,1,0,0|0,0,2]=4 3354 B11R1.520 C[C@@H]1CCCC[C@]1(N)C(O)=O Amb25263952 [0,1,0,1,0,0|0,0,2]=4 3355 B11R1.520 C[C@@H]1CCCC[C@]1(O)C(O)=O Amb25361084 [0,1,0,1,0,0|0,0,2]=4 3356 B11R1.520 C[C@H]1CCCC[C@@]1(N)C(O)=O Amb24607337 [0,1,0,1,0,0|0,0,2]=4 3357 B11R1.520 C[C@H]1CCCC[C@]1(C)C(O)=O Amb24735955 [0,1,0,1,0,0|0,0,2]=4 3358 B11R1.737 CC1(CCCCC=C1)C(O)=O Amb25310941 [0,1,0,1,0,0|0,0,2]=4 3359 B11R1.737 CC1(CCCCCC1)C(O)=O Amb25152741 [0,1,0,1,0,0|0,0,2]=4 3360 B11R1.737 OC(=O)C1(Br)CCCCCC1 Amb24603087 [0,1,0,1,0,0|0,0,2]=4 3361 B11R1.737 OC(=O)C1(F)CCCCCC1 Amb25151314 [0,1,0,1,0,0|0,0,2]=4 3362 B11R1.737 OC(=O)C1(N)CCCCCC1 Amb1841034 [0,1,0,1,0,0|0,0,2]=4 3363 B11R1.167 CC1CCC(Cl)CC1C(O)=O Amb25260877 [0,1,0,1,0,0|0,0,2]=4 3364 B11R1.167 CC1CCC(O)CC1C(O)=O Amb24392245 [0,1,0,1,0,0|0,0,2]=4 3365 B11R1.167 CC1CC[C@@H](O)C[C@H]1C(O)=O Amb25233392 [0,1,0,1,0,0|0,0,2]=4 3366 B11R1.167 CC=1CCC(C)C(C1)C(O)=O Amb24634155 [0,1,0,1,0,0|0,0,2]=4 3367 B11R1.167 C[C@@H]1C[C@H]([C@H](C)CC1)C(O)=O Amb24595391 [0,1,0,1,0,0|0,0,2]=4 3368 B11R1.167 C[C@H]1C[C@H]([C@@H](C)CC1)C(O)=O Amb24511944 [0,1,0,1,0,0|0,0,2]=4 3369 B11R1.182 C=CCC1OC(=O)C=CC1O Amb20246603 [0,1,0,1,0,0|0,0,2]=4 3370 B11R1.182 CCCC1CC(=O)C=CC1O Amb25714472 [0,1,0,1,0,0|1,0,0]=3 3371 B11R1.182 C\C=C\C1OC(=O)C=CC1O Amb24504762 [0,1,0,1,0,0|0,0,2]=4 3372 B11R1.182 C\C=C\[C@@H]1OC(=O)C=C[C@@H]1O Amb16184147 [0,1,0,1,0,0|0,0,2]=4 3373 B11R1.182 C\C=C\[C@@H]1OC(=O)C=C[C@H]1O Amb24519682 [0,1,0,1,0,0|0,0,2]=4 3374 B11R1.346 CC(NCC(O)=O)C1CCC1 Amb24755089 [0,1,0,1,0,0|1,0,1]=4 3375 B11R1.346 N[C@H](CCC(O)=O)C1CCC1 Amb25383072 [0,1,0,1,0,0|0,0,2]=4 3376 B11R1.346 OC(=O)CCC(Cl)C1CCC1 Amb25382317 [0,1,0,1,0,0|0,0,2]=4 3377 B11R1.348 CN(CC1CC1)\C=C\C(O)=O Amb24755183 [0,1,0,1,0,0|1,0,0]=3 3378 B11R1.348 OC(=O)\C=C/C(=O)NC1CC1 Amb20622197 [0,1,0,1,0,0|1,0,1]=4 3379 B11R1.495 CC1CCC(C)N1CC(O)=O Amb24723428 [0,1,0,1,0,0|1,0,1]=4 3380 B11R1.495 CC1CCC(N1CC(=O)O)C Amb10609615 [0,1,0,1,0,0|1,0,1]=4 3381 B11R1.495 CN1CCN(C)C1=CC(O)=O Amb18200192 [0,1,0,1,0,0|2,0,0]=4 3382 B11R1.650 CC1CCC(O)C=CC(=O)O1 Amb24340468 [0,1,0,1,0,0|0,0,0]=2 3383 B11R1.713 CC(=O)\C=C\C1(C)CCCC1 Amb25210597 [0,1,0,1,0,0|1,0,0]=3 3384 B11R1.713 CC1(CCC(O)=O)CCCC1 Amb24641201 [0,1,0,1,0,0|0,0,2]=4 3385 B11R1.713 CC1(CCCC1)C#CC(O)=O Amb25749054 [0,1,0,1,0,0|0,0,2]=4 3386 B11R1.713 CC1(CCCC1)NCC(O)=O Amb18979316 [0,1,0,1,0,0|1,0,1]=4 3387 B11R1.713 CC1(CCCC1)OCC(O)=O Amb24538298 [0,1,0,1,0,0|1,0,1]=4 3388 B11R1.713 CC1(CCCC1)\C=C\C(N)=O Amb24512879 [0,1,0,1,0,0|1,0,0]=3 3389 B11R1.713 CC1(CCCS1)\C=C\C(O)=O Amb25187067 [0,1,0,1,0,0|1,0,0]=3 3390 B11R1.713 NC1(CCC(O)=O)CCCC1 Amb18199966 [0,1,0,1,0,0|0,0,2]=4 3391 B11R1.914 CC1(CCCCl)C=CC(=O)O1 Amb25101525 [0,1,0,1,0,0|1,0,0]=3 3392 B11R1.914 CC1(CCCO)C=CC(=O)O1 Amb24672578 [0,1,0,1,0,0|1,0,0]=3 3393 B11R1.914 CCCCC1(C)CC(=O)C=C1 Amb25271003 [0,1,0,1,0,0|1,0,0]=3 3394 B11R1.914 CCCC[C@@]1(C)CC(=O)C=C1 Amb24631117 [0,1,0,1,0,0|1,0,0]=3 3395 B11R1.914 COCCC1(C)CC(=O)C=C1 Amb24486328 [0,1,0,1,0,0|2,0,0]=4 3396 B11R1.914 C[C@]1(CCC=O)C=CC(=O)O1 Amb24422436 [0,1,0,1,0,0|1,0,1]=4 3397 B11R1.914 C[C@]1(CCCO)C=CC(=O)O1 Amb25847779 [0,1,0,1,0,0|1,0,0]=3 3398 B11R1.177 CC(=O)C1=CCCCC1(C)O Amb25282720 [0,1,0,1,0,0|1,0,0]=3 3399 B11R1.177 CC1(C)CCCC=C1B(O)O Amb25306163 [0,1,0,1,0,0|1,0,1]=4 3400 B11R1.177 CC1(C)CCCNC1C(O)=O Amb23589293 [0,1,0,1,0,0|1,0,1]=4 3401 B11R1.177 CC1(N)CCCCC1C(O)=O Amb25803877 [0,1,0,1,0,0|0,0,2]=4 3402 B11R1.177 CC1(O)CCCCC1C(O)=O Amb24511332 [0,1,0,1,0,0|0,0,2]=4 3403 B11R1.177 OC(=O)[C@H]1CCCC[C@@]1(C)N Amb1993789 [0,1,0,1,0,0|0,0,2]=4 3404 B11R1.177 OC(=O)[C@H]1CCCC[C@@]1(C)N Amb1993896 [0,1,0,1,0,0|0,0,2]=4 3405 B11R1.178 CC(C)C1CCNC1C(O)=O Amb25291280 [0,1,0,1,0,0|1,0,1]=4 3406 B11R1.178 CC(C)C1CCOC1C(O)=O Amb24370040 [0,1,0,1,0,0|1,0,1]=4 3407 B11R1.178 CC(C)[C@@H]1CCO[C@@H]1C(O)=O Amb25249400 [0,1,0,1,0,0|1,0,1]=4 3408 B11R1.178 CC(C)[C@H]1CCC[C@H]1C(O)=O Amb24513094 [0,1,0,1,0,0|0,0,2]=4 3409 B11R1.178 CC(C)[C@H]1CCO[C@H]1C(O)=O Amb24636009 [0,1,0,1,0,0|1,0,1]=4 3410 B11R1.178 OC(=O)C1=CCCC1C(O)=O Amb24358007 [0,1,0,1,0,0|1,0,1]=4 3411 B11R1.234 CC(=O)\C=C/1\COCC1(C)C Amb24373265 [0,1,0,1,0,0|2,0,0]=4 3412 B11R1.234 CC(O)\C=C/1\CCCC1(C)C Amb25352571 [0,1,0,1,0,0|1,0,1]=4 3413 B11R1.234 CC1(C)CCCC1=CC(O)=O Amb25781976 [0,1,0,1,0,0|0,0,0]=2 3414 B11R1.234 CC1(C)OCCC1=CC(O)=O Amb25175998 [0,1,0,1,0,0|1,0,0]=3 3415 B11R1.234 CC1(F)CCCC1CC(O)=O Amb24754402 [0,1,0,1,0,0|0,0,2]=4 3416 B11R1.711 CC(C)C1CC1CCC(O)=O Amb25385586 [0,1,0,1,0,0|0,0,2]=4 3417 B11R1.711 CC(C)CC[C@@H]1O[C@H]1C(O)=O Amb25386408 [0,1,0,1,0,0|1,0,1]=4 3418 B11R1.740 CC(C)CC1CC1CC(O)=O Amb24767051 [0,1,0,1,0,0|0,0,2]=4 3419 B11R1.922 CC(=O)\C=C\[C@@H]1CCC1(C)C Amb24722992 [0,1,0,1,0,0|1,0,0]=3 3420 B11R2.35 O=C1CC(OC=C1)C2CC2 Amb25055019 [0,0,0,2,0,0|2,0,0]=4 3421 B11R2.36 O=C1C=CC=2CCCC2O1 Amb24433400 [0,0,0,2,0,0|0,0,2]=4 3422 B11R2.36 O=C1CC2CCCN2C=C1 Amb25698683 [0,0,0,2,0,0|2,0,0]=4 3423 B11R2.36 O=C1CCC2CCNC2=C1 Amb24505252 [0,0,0,2,0,0|2,0,0]=4 3424 B11R2.36 O=C1CCN2CCCC2=C1 Amb25039857 [0,0,0,2,0,0|2,0,0]=4 3425 B11R2.36 O=C1CNC2CCCC2O1 Amb23536461 [0,0,0,2,0,0|1,0,1]=4 3426 B11R2.36 O=C1C[C@H]2CCCN2C=C1 Amb24554688 [0,0,0,2,0,0|2,0,0]=4 3427 B11R2.36 O=C1NC2CCCC2CO1 Amb25054713 [0,0,0,2,0,0|1,0,1]=4 3428 B11R2.36 OC1CCC2CCCC2=C1 Amb24457805 [0,0,0,2,0,0|1,0,1]=4 3429 B11R2.36 OC1C[C@H]2CCC[C@@H]2C=C1 Amb25271532 [0,0,0,2,0,0|1,0,1]=4 3430 B11R2.106 O=C1C=CC[C@@H]2CCCN12 Amb24093686 [0,0,0,2,0,0|1,0,0]=3 3431 B11R2.106 O=C1C=CC[C@@H]2CCC[C@H]12 Amb24584151 [0,0,0,2,0,0|1,0,0]=3 3432 B11R2.106 O=C1CCCC2CCC=C12 Amb25340773 [0,0,0,2,0,0|1,0,0]=3 3433 B11R2.106 O=C1CCC[C@H]2CCC=C12 Amb25145580 [0,0,0,2,0,0|1,0,0]=3 3434 B11R2.106 O=C1OCCC2CC=CN12 Amb25138060 [0,0,0,2,0,0|1,0,1]=4 3435 B11R2.106 O[C@H]1C=CC[C@H]2CCC[C@@H]21 Amb24583264 [0,0,0,2,0,0|1,0,1]=4 3436 B11R2.106 O[C@H]1CCC[C@H]2CCC=C21 Amb25176856 [0,0,0,2,0,0|1,0,1]=4 3437 B11R2.1478 O=C1CC2(CCC2)OC=C1 Amb25299532 [0,0,0,2,0,0|2,0,0]=4 3438 B11R2.1 O=C1C=CC2CCCCC12 Amb25146595 [0,0,0,2,0,0|1,0,0]=3 3439 B11R2.1 O=C1C=CC2CCCCN12 Amb25100870 [0,0,0,2,0,0|1,0,0]=3 3440 B11R2.1 O=C1C=CC2OCCCC12 Amb25145622 [0,0,0,2,0,0|2,0,0]=4 3441 B11R2.1 O=C1C=C[C@@H]2CCCCN12 Amb25053407 [0,0,0,2,0,0|1,0,0]=3 3442 B11R2.1 O=C1COC2CCCC=C12 Amb24422091 [0,0,0,2,0,0|2,0,0]=4 3443 B11R2.1 O=C1OCC2CCCC=C12 Amb24698793 [0,0,0,2,0,0|0,0,0]=2 3444 B11R2.1 O=C1OCC2CCCCC12 Amb22551108 [0,0,0,2,0,0|0,0,2]=4 3445 B11R2.1 O=C1OC[C@H]2CCCCN12 Amb24364788 [0,0,0,2,0,0|1,0,1]=4 3446 B11R2.10 O=C1C=C2C(S1)CCNC2 Amb15692582 [0,0,0,2,0,0|1,1,0]=4 3447 B11R2.10 O=C1C=C2CCCC=C2O1 Amb24086550 [0,0,0,2,0,0|0,0,2]=4 3448 B11R2.10 O=C1C=C2CCCCC2N1 Amb24670349 [0,0,0,2,0,0|1,0,0]=3 3449 B11R2.10 O=C1C=C2CNCCC2S1 Amb22497522 [0,0,0,2,0,0|1,1,0]=4 3450 B11R2.10 O=C1CN2CCCCC2=C1 Amb25337495 [0,0,0,2,0,0|2,0,0]=4 3451 B11R2.10 O=C1C[C@H]2CCCCC2=C1 Amb25050275 [0,0,0,2,0,0|1,0,0]=3 3452 B11R2.10 O=C1N[C@@H]2CCCC[C@@H]2O1 Amb25304504 [0,0,0,2,0,0|1,0,1]=4 3453 B11R2.10 O=C1N[C@H]2CCCC[C@H]2O1 Amb25174868 [0,0,0,2,0,0|1,0,1]=4 3454 B11R2.10 O=C1OC2C(O1)CCCC2 Amb1031385 [0,0,0,2,0,0|1,0,1]=4 3455 B11R2.66 CC1CCC2OC(=O)NC21 Amb25243436 [0,0,0,2,0,0|1,0,1]=4 3456 B11R2.66 CC1OCC2CC(=O)C=C21 Amb25320169 [0,0,0,2,0,0|2,0,0]=4 3457 B11R2.66 CC1SCC2CC(=O)C=C21 Amb25730979 [0,0,0,2,0,0|2,0,0]=4 3458 B11R2.67 O[C@@H]1CC[C@@H]2C=CC(=O)[C@@H]21 Amb24570127 [0,0,0,2,0,0|2,0,0]=4 3459 B11R2.352 Brc1ccc(o1)C2CCC2 Amb10600912 [0,0,0,2,0,0|1,0,1]=4 3460 B11R2.359 O=C1C=CC2CC(CC2)N1 Amb24423967 [0,0,0,2,0,0|1,0,0]=3 3461 B11R2.359 O=C1C[C@@H]2C[C@@H](CC2)C=C1 Amb25262770 [0,0,0,2,0,0|1,0,0]=3 3462 B11R2.359 OC1CC2CC(CC2)C=C1 Amb25105890 [0,0,0,2,0,0|1,0,1]=4 3463 B11R2.359 O[C@@H]1C[C@H]2C[C@H](CC2)C=C1 Amb24515511 [0,0,0,2,0,0|1,0,1]=4 3464 B11R2.743 CC1CCC12CNC(=O)O2 Amb25733319 [0,0,0,2,0,0|1,0,1]=4 3465 B11R2.748 O=C1CC2(CCCC2)C=C1 Amb25767081 [0,0,0,2,0,0|1,0,0]=3 3466 B11R2.748 O=C1CC2(CCCN2)C=C1 Amb24629698 [0,0,0,2,0,0|2,0,0]=4 3467 B11R2.748 O=C1CSC2(CCCC2)O1 Amb24349546 [0,0,0,2,0,0|1,0,1]=4 3468 B11R2.748 O=C1NCC2(O1)CCCC2 Amb17506328 [0,0,0,2,0,0|1,0,1]=4 3469 B11R2.4 O=C1C=C1C2CCCCC2 Amb25050235 [0,0,0,2,0,0|1,0,1]=4 3470 B11R2.4 O=C1C=C1C=2CCCCC2 Amb25285972 [0,0,0,2,0,0|1,0,1]=4 3471 B11R2.59 O=S1(=O)C=C2CCCCC12 Amb22364563 [0,0,0,2,0,0|1,0,1]=4 3472 B11R2.433 O=C1NC2CCC(CC2)O1 Amb25147515 [0,0,0,2,0,0|1,0,1]=4 3473 B11R2.703 O=C1CC2(CCCCC2)O1 Amb25275407 [0,0,0,2,0,0|0,0,2]=4 3474 B11R2.824 OC(=O)C1C2CCC1CC2 Amb18643538 [0,0,0,2,0,0|0,0,2]=4 3475 B11R2.824 OC(=O)C1C2CCN1CC2 Amb24074708 [0,0,0,2,0,0|1,0,1]=4 3476 B11R2.824 OC(=O)C1C2CCN1CC2 Amb24078266 [0,0,0,2,0,0|1,0,1]=4 3477 B11R2.853 OC(=O)CC12CC1CCC2 Amb25259799 [0,0,0,2,0,0|0,0,2]=4 3478 B11R2.860 OC(=O)C[C@@H]1[C@H]2CCC[C@H]21 Amb25703165 [0,0,0,2,0,0|0,0,2]=4 3479 B11R2.932 OC(=O)CC1CCC2CC21 Amb25766461 [0,0,0,2,0,0|0,0,2]=4 3480 B11R2.934 OC(=O)CN1CC2CC2C1 Amb25257563 [0,0,0,2,0,0|1,0,1]=4 3481 B11R2.1824 OC(=O)C1C2CC1CCC2 Amb24724748 [0,0,0,2,0,0|0,0,2]=4 3482 B11R2.1824 OC(=O)[C@@H]1[C@@H]2C[C@H]1CCC2 Amb24389040 [0,0,0,2,0,0|0,0,2]=4 3483 B11R2.1852 OC(=O)C1C2C1CCCC2 Amb2235084 [0,0,0,2,0,0|0,0,2]=4 3484 B11R2.1852 OC(=O)C1[C@@H]2[C@H]1CCCC2 Amb13777307 [0,0,0,2,0,0|0,0,2]=4 3485 B11R2.11 O=C1CC(=C1)N2CCCC2 Amb25059226 [0,0,0,2,0,0|2,0,0]=4 3486 B11R2.711 O=C1NC2CCCCC=C12 Amb24505013 [0,0,0,2,0,0|1,0,0]=3 3487 B11R2.391 CC1(O)C=CC2CC1CC2 Amb22356370 [0,0,0,2,0,0|1,0,1]=4 3488 B11R2.142 OC(=O)C1NCCC12CC2 Amb25315640 [0,0,0,2,0,0|1,0,1]=4 3489 B11R2.819 OC(=O)C12CCC1CCN2 Amb24399669 [0,0,0,2,0,0|1,0,1]=4 3490 B11R2.822 OC(=O)C1=CCC2CCN12 Amb25113849 [0,0,0,2,0,0|1,0,0]=3 3491 B11R2.822 OC(=O)C1OCC2CCC21 Amb24523153 [0,0,0,2,0,0|1,0,1]=4 3492 B11R2.822 OC(=O)[C@@H]1OC[C@H]2CC[C@H]21 Amb25209300 [0,0,0,2,0,0|1,0,1]=4 3493 B11R2.845 CC(=O)C1=CC2CCC1C2 Amb24078352 [0,0,0,2,0,0|1,0,0]=3 3494 B11R2.845 NC(=O)C1=CC2CCC1C2 Amb24505178 [0,0,0,2,0,0|1,0,0]=3 3495 B11R2.845 OB(C1=CC2CC1CC2)O Amb10072045 [0,0,0,2,0,0|1,0,1]=4 3496 B11R2.845 OB(O)C1=C[C@@H]2C[C@H]1CC2 Amb24052976 [0,0,0,2,0,0|1,0,1]=4 3497 B11R2.845 OC(=O)C1=CC2CC1CC2 Amb17593494 [0,0,0,2,0,0|0,0,0]=2 3498 B11R2.845 OC(=O)C1C[C@@H]2C[C@H]1CC2 Amb24598959 [0,0,0,2,0,0|0,0,2]=4 3499 B11R2.845 OC(=O)[C@@H]1CC2CC1CC2 Amb24745677 [0,0,0,2,0,0|0,0,2]=4 3500 B11R2.845 OC(=O)[C@@H]1C[C@@H]2C[C@@H]1CC2 Amb24599985 [0,0,0,2,0,0|0,0,2]=4 3501 B11R2.845 OC(=O)[C@@H]1C[C@@H]2C[C@H]1CC2 Amb24630346 [0,0,0,2,0,0|0,0,2]=4 3502 B11R2.845 OC(=O)[C@@H]1C[C@H]2CC1CC2 Amb24615765 [0,0,0,2,0,0|0,0,2]=4 3503 B11R2.845 OC(=O)[C@@H]1C[C@H]2C[C@H]1CC2 Amb25175105 [0,0,0,2,0,0|0,0,2]=4 3504 B11R2.845 OC(=O)[C@@H]1N[C@@H]2C[C@@H]1CC2 Amb22745380 [0,0,0,2,0,0|1,0,1]=4 3505 B11R2.845 OC(=O)[C@@H]1N[C@@H]2C[C@H]1CC2 Amb18180724 [0,0,0,2,0,0|1,0,1]=4 3506 B11R2.845 OC(=O)[C@@H]1N[C@@H]2C[C@H]1CC2 Amb22748360 [0,0,0,2,0,0|1,0,1]=4 3507 B11R2.845 OC(=O)[C@@H]1N[C@H]2C[C@@H]1CC2 Amb24560741 [0,0,0,2,0,0|1,0,1]=4 3508 B11R2.845 OC(=O)[C@H]1C[C@@H]2C[C@@H]1CC2 Amb24615645 [0,0,0,2,0,0|0,0,2]=4 3509 B11R2.845 OC(=O)[C@H]1C[C@@H]2C[C@H]1CC2 Amb24548859 [0,0,0,2,0,0|0,0,2]=4 3510 B11R2.845 OC(=O)[C@H]1C[C@H]2C[C@H]1CC2 Amb25175104 [0,0,0,2,0,0|0,0,2]=4 3511 B11R2.845 OC(=O)[C@H]1N[C@@H]2CC[C@H]1C2 Amb17913041 [0,0,0,2,0,0|1,0,1]=4 3512 B11R2.845 OC(=O)[C@H]1N[C@H]2C[C@@H]1CC2 Amb2371885 [0,0,0,2,0,0|1,0,1]=4 3513 B11R2.559 O=C1C=2CCCCCCC21 Amb24478306 [0,0,0,2,0,0|1,0,1]=4 3514 B11R2.120 CC1C2NCCC1OC2=O Amb25689437 [0,0,0,2,0,0|1,0,1]=4 3515 B11R2.120 C[C@H]1[C@@H]2NCC[C@H]1OC2=O Amb24597664 [0,0,0,2,0,0|1,0,1]=4 3516 B11R2.813 OC(=O)C12CC1CCCC2 Amb25709012 [0,0,0,2,0,0|0,0,2]=4 3517 B11R2.813 OC(=O)C12CC1CCCN2 Amb24112951 [0,0,0,2,0,0|1,0,1]=4 3518 B11R2.813 OC(=O)[C@]12C[C@H]1CCCN2 Amb24609781 [0,0,0,2,0,0|1,0,1]=4 3519 B11R2.821 OC(=O)C1CC[C@H]2C[C@@H]1C2 Amb24482502 [0,0,0,2,0,0|0,0,2]=4 3520 B11R2.1837 OC(=O)C1NCCC2CC21 Amb24758905 [0,0,0,2,0,0|1,0,1]=4 3521 B11R2.1837 OC(=O)[C@@H]1CCC[C@@H]2C[C@@H]21 Amb24580476 [0,0,0,2,0,0|0,0,2]=4 3522 B11R2.1854 CC12CCCC1C2C(O)=O Amb25757879 [0,0,0,2,0,0|0,0,2]=4 3523 B11R2.1854 C[C@]12CCCC1[C@H]2C(O)=O Amb25189728 [0,0,0,2,0,0|0,0,2]=4 3524 B11R2.9 CC12CCCC1=CC(=O)C2 Amb25350425 [0,0,0,2,0,0|1,0,0]=3 3525 B11R2.9 CC12COCC1=CC(=O)C2 Amb25128272 [0,0,0,2,0,0|2,0,0]=4 3526 B11R2.9 C[C@@]12CCCC1=CC(=O)C2 Amb25146675 [0,0,0,2,0,0|1,0,0]=3 3527 B11R2.9 C[C@]12CCCC1=CC(=O)C2 Amb22356941 [0,0,0,2,0,0|1,0,0]=3 3528 B11R2.814 CC(=O)C1=CC2CCCC12 Amb24737200 [0,0,0,2,0,0|1,0,0]=3 3529 B11R2.814 OC(=O)C1CC2CCCC21 Amb24524606 [0,0,0,2,0,0|0,0,2]=4 3530 B11R2.141 OC(=O)C1CC12CCCC2 Amb10607312 [0,0,0,2,0,0|0,0,2]=4 3531 B11R2.111 O=C1CCC2CC2CC=C1 Amb22356805 [0,0,0,2,0,0|1,0,0]=3 3532 B11R2.111 OC1CCC2CC2CC=C1 Amb24705784 [0,0,0,2,0,0|1,0,1]=4 3533 B11R2.111 O[C@H]1CCCC2CC2C=C1 Amb22356855 [0,0,0,2,0,0|1,0,1]=4 3534 B11R2.839 OC(=O)C1CCC2CC2N1 Amb25342650 [0,0,0,2,0,0|1,0,1]=4 3535 B11R2.839 OC(=O)[C@@H]1C[C@@H]2C[C@@H]2CC1 Amb25174795 [0,0,0,2,0,0|0,0,2]=4 3536 B11R2.513 O=C1C=CCCCC2CC12 Amb25855375 [0,0,0,2,0,0|1,0,0]=3 3537 B11R2.532 CC12CC(=O)C=CC1CC2 Amb25371816 [0,0,0,2,0,0|1,0,0]=3 3538 B11R2.61 C=C1CCC2CCC2C=C1 Amb24391696 [0,0,0,2,0,0|2,0,0]=4 3539 B11R2.61 C=C1CC[C@H]2CC[C@H]2C=C1 Amb24514940 [0,0,0,2,0,0|2,0,0]=4 3540 B11R2.843 OC(=O)C1CCC1C2CC2 Amb25677861 [0,0,0,2,0,0|0,0,2]=4 3541 B11R2.826 OC(=O)CC1CC1C2CC2 Amb25738014 [0,0,0,2,0,0|0,0,2]=4 3542 B11R2.1886 OC(=O)CC1CC12CCC2 Amb25174514 [0,0,0,2,0,0|0,0,2]=4 3543 B11R2.842 OC(=O)C1CC2CCC2C1 Amb25256091 [0,0,0,2,0,0|0,0,2]=4 3544 B11R2.842 OC(=O)C1C[C@@H]2CC[C@@H]2C1 Amb24460735 [0,0,0,2,0,0|0,0,2]=4 3545 B11R2.842 OC(=O)[C@@H]1C[C@@H]2CC[C@@H]2C1 Amb24446426 [0,0,0,2,0,0|0,0,2]=4 3546 B11R2.842 OC(=O)[C@@H]1C[C@H]2CC[C@H]2C1 Amb24472881 [0,0,0,2,0,0|0,0,2]=4 3547 B11R2.1836 OC(=O)C1CC1C2CCC2 Amb20622343 [0,0,0,2,0,0|0,0,2]=4